A0A096MHE5_POEFO Loading...

RAD54 homolog B

AlphaFold DB , UniProt , Accession A0A096MHE5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 937 aa.

						>A0A096MHE5_POEFO|A0A096MHE5
MRRSGAPSQLLGNAVKKPRFVPLGGSASCPVAESKPLAPKLGLGNALDKVQRSLSAVVVNKSTCSVQGQTGQAASGLSKVLARVLTATESKENEDETKNEVCAEDMNVSAGGVDGGLQWTHASPQTPQPLADSPRVSGAAGPDGVRYFSVVWCKASKKKHKRWEGDAVLVARGRTVVLKDMEGKDIGKGSGYKVSELASLSEGETLMIGGKEIEVMGIVSAEDFAKGRCFQEVQTDQEELHAKAAAPLPRRFNPKPFCPPTMLGRAGHPENKPQAEQTSKPRHDPLAPGALVMPRPSSNHQWLHNKSGFPVVDVVVDPHLTTHLRPHQREGILFLYECVMGMRAAGRHGAILADEMGLGKTLQSVALCWTLLKQGPYGGKPVAKRVLVVTPGSLVQNWKAEFTKWLGRERISVFTVDQDHRIEEFLSSPLHSVLVISYEMLLRCLEPIQKVEFGLIICDEGHRLKNSSIKTSSALSSLSCNRRVILTGTPVQNDLQEFYAIIEFVNPGILGSTTAYRKVYEEPILHSRQPSCSEDERVLGEERAAELSRLTGMFILRRTQEIINRYLPPRLDWTLFCTPSPLQQKLYKHLLCHRVFRACLQGFTQGSAHLACITALKKLCNHPGLLHDTVKERKERGSVESSLYEGLADLFPESYCSAGFDAADSGKLLVLSDLLSAIRQLSPSDRVVLVSNYTQTLDLLQDLCARSGYAFCRLDGQTPTSQRQRLVDAFNSPYSQSFLFLLSSKAGGVGLNLIGASHLVLYDIDWNPANDIQAMARVWRDGQKKTVHIYRLLTAGTIEERIFQRQVSKQGLSGTVVDLGKAAEHTSFSSSELRDLFSLTDTPCLTHDLLSCSCSMDGSANDVEVEEAELVPDRPCQLGRQGDRRGAAQKHLSMSELMQWRHFSGDTHTFSDPYLDHARSHITFAFQTTISHTPSEQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.4	Very low	34.1	Very low	240 Å²	240	163.5 Å²	163.5	100%	1.182	90%	0.895	S	S	*	*				0	127.7	0	-90.5	174.3	164.7	0	0	108.9
2	R	30.4	Very low	33.7	Very low	234 Å²	234	156.6 Å²	156.6	88%	0.883	89%	0.889	S	S	*	*			trans	34.2	119.2	151.3	-66.2	-179.4	176.9	-174.3	-1.6	118.7
3	R	34.5	Very low	33.4	Very low	239 Å²	239	157.5 Å²	157.5	90%	0.902	89%	0.891	S	S	*	*				54.5	128.6	86.8	-70.6	-171.4	-179.6	-168.6	0.8	110.9
4	S	33.8	Very low	33.5	Very low	124 Å²	124	152.4 Å²	152.4	87%	0.867	88%	0.877	S	S	*	*			cis	173.6	158.2	46.5	23.6	0	0	0	0	109.3
5	G	28.7	Very low	33.5	Very low	83 Å²	83	150.3 Å²	150.3	86%	0.856	87%	0.868	S	S	*	*			trans	157.1	89.4	160.4	0	0	0	0	0	115.7
6	A	28.8	Very low	33.2	Very low	96 Å²	96	153.6 Å²	153.6	79%	0.793	87%	0.869	S	S	*	*			trans	-100.1	-168.3	162.6	0	0	0	0	0	109
7	P	54.9	Low	33.5	Very low	125 Å²	125	155.9 Å²	155.9	81%	0.812	87%	0.867	S	S	*	*				-125.9	170	-66.3	35.4	-20.1	0	0	0	111.9
8	S	29	Very low	34	Very low	122 Å²	122	153.8 Å²	153.8	85%	0.853	86%	0.861	S	S	*	*			trans	-160.4	119	151.4	67.9	0	0	0	0	113.1
9	Q	35.3	Very low	33.9	Very low	189 Å²	189	157.2 Å²	157.2	88%	0.883	86%	0.859	S	S	*	*			trans	-82.8	145.5	156.8	-71.7	176.4	-23.8	0	0	109.1
10	L	32.9	Very low	33.5	Very low	172 Å²	172	158.4 Å²	158.4	90%	0.901	86%	0.856	S	S	*	*			trans	-160.5	135.3	148.3	-104.1	164.5	0	0	0	110.2
11	L	34	Very low	33.5	Very low	175 Å²	175	156.2 Å²	156.2	92%	0.916	85%	0.848	S	S	*	*			trans	-69.1	162.1	178.8	-71.9	96.4	0	0	0	113.2
12	G	29.6	Very low	34.6	Very low	80 Å²	80	150.1 Å²	150.1	83%	0.825	83%	0.826	S	S	*	*			trans	145.6	118	144.1	0	0	0	0	0	117.1
13	N	30.5	Very low	34.6	Very low	169 Å²	169	147.6 Å²	147.6	90%	0.904	83%	0.829	S	S	*	*			trans	-63.2	159.7	179.7	-76	-35.4	0	0	0	116.4
14	A	34.2	Very low	34.3	Very low	85 Å²	85	139.7 Å²	139.7	70%	0.702	82%	0.823	S	S	*	*				132	120.6	120.8	0	0	0	0	0	117.3
15	V	33.4	Very low	34.1	Very low	122 Å²	122	137.7 Å²	137.7	74%	0.739	82%	0.822	S	S	*	*				66.7	112.3	128.4	179.6	0	0	0	0	119.8
16	K	29.3	Very low	34.1	Very low	202 Å²	202	140 Å²	140	88%	0.878	82%	0.824	S	S	*	*				167.7	142.9	108.1	-111.8	146.9	-171.7	-176.2	0	114.1
17	K	38.2	Very low	34.2	Very low	194 Å²	194	140.2 Å²	140.2	84%	0.843	83%	0.826	S	S	*	*			trans	-66.2	174.1	168.9	-65.3	176	173.9	178	0	113.1
18	P	41.3	Very low	32.8	Very low	118 Å²	118	140 Å²	140	77%	0.766	83%	0.827	S	S	*	*				-135.6	137.1	103.2	13.7	8.8	0	0	0	113.4
19	R	33.1	Very low	32.6	Very low	217 Å²	217	140 Å²	140	82%	0.819	83%	0.826	S	S	*	*				69.5	125.8	88.4	-80.7	-175.3	171.1	172.9	-3.1	113
20	F	25.8	Very low	33.2	Very low	181 Å²	181	136.5 Å²	136.5	79%	0.794	82%	0.82	S	S	*	*				-173.6	128.9	69.4	-145.2	-96.5	0	0	0	107.3
21	V	32.6	Very low	32.9	Very low	114 Å²	114	134.8 Å²	134.8	69%	0.691	82%	0.816	S	S	*	*				90.5	137.3	51.4	174.8	0	0	0	0	114
22	P	56.6	Low	32.6	Very low	112 Å²	112	131.1 Å²	131.1	73%	0.727	81%	0.811	S	S	*	*			trans	-118.6	-158.7	-150.7	43.7	-27.5	0	0	0	113.3
23	L	30.2	Very low	32.6	Very low	180 Å²	180	136.6 Å²	136.6	94%	0.942	82%	0.816	S	S	*	*			trans	-173.1	144.7	151.3	-94.1	155.4	0	0	0	108.3
24	G	27.6	Very low	32.5	Very low	74 Å²	74	134 Å²	134	76%	0.763	81%	0.81	S	S	*	*			cis	173	163.9	-0.1	0	0	0	0	0	112.6
25	G	29.1	Very low	32.2	Very low	82 Å²	82	139 Å²	139	85%	0.845	82%	0.816	S	S	*	*			trans	75.3	145.1	154.4	0	0	0	0	0	118.9
26	S	28.9	Very low	32	Very low	130 Å²	130	139.5 Å²	139.5	91%	0.909	82%	0.822	S	S	*	*			cis	-170.6	163.5	-3.3	46.9	0	0	0	0	108.6
27	A	32	Very low	32	Very low	101 Å²	101	138 Å²	138	84%	0.835	82%	0.823	S	S	*	*			trans	-85.7	155.7	-164	0	0	0	0	0	118.1
28	S	25.2	Very low	31.6	Very low	120 Å²	120	133.1 Å²	133.1	84%	0.839	82%	0.819	S	S	*	*			trans	-173.7	134.8	139.2	57.2	0	0	0	0	112.6
29	C	24.6	Very low	31.2	Very low	123 Å²	123	133.8 Å²	133.8	83%	0.831	82%	0.823	S	S	*	*			trans	-86.5	-174	174.6	-66.3	0	0	0	0	113
30	P	48.3	Very low	31	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	83%	0.827	S	S	*	*			cis	-134.7	-172.8	-40.9	28.2	-5.3	0	0	0	114.6
31	V	27.1	Very low	31.2	Very low	136 Å²	136	133.6 Å²	133.6	82%	0.824	84%	0.835	S	S	*	*			trans	112.9	134.7	149.3	-170.8	0	0	0	0	118.9
32	A	26.9	Very low	30.9	Very low	98 Å²	98	131.4 Å²	131.4	81%	0.81	84%	0.836	S	S	*	*			trans	100.8	128.5	153.5	0	0	0	0	0	120.8
33	E	29.7	Very low	29.6	Very low	196 Å²	196	134.9 Å²	134.9	92%	0.916	85%	0.848	S	S	*	*			trans	-68.4	151	178.8	-61.4	171.5	131.6	0	0	114.4
34	S	27.4	Very low	29.6	Very low	114 Å²	114	129.9 Å²	129.9	80%	0.797	84%	0.84	S	S	*	*			trans	-163.3	127.6	144.5	62.8	0	0	0	0	114
35	K	28.1	Very low	30.2	Very low	190 Å²	190	134.4 Å²	134.4	83%	0.826	85%	0.846	S	S	*	*			trans	2.8	151.4	149.2	-64	173.4	177.6	174.4	0	119.9
36	P	30.4	Very low	30.4	Very low	132 Å²	132	134.7 Å²	134.7	86%	0.857	84%	0.841	S	S	*	*			trans	-104.7	138.6	141.5	9.8	10	0	0	0	112.6
37	L	28.1	Very low	30.6	Very low	172 Å²	172	135.7 Å²	135.7	90%	0.901	84%	0.835	S	S	*	*			trans	-75.2	155.7	170.7	-88.6	110.1	0	0	0	112.7
38	A	30.9	Very low	30.6	Very low	91 Å²	91	137.8 Å²	137.8	75%	0.752	83%	0.832	S	S	*	*			trans	-67.1	172.5	-175.1	0	0	0	0	0	117.2
39	P	32	Very low	30.9	Very low	131 Å²	131	141.1 Å²	141.1	85%	0.851	83%	0.831	S	S	*	*			trans	-113.2	156.9	137.9	30.2	-15.6	0	0	0	112.9
40	K	28.7	Very low	31.4	Very low	209 Å²	209	140.7 Å²	140.7	91%	0.909	83%	0.825	S	S	*	*			trans	-79	157.4	-163.9	-76.2	175.4	173.7	175.9	0	115.8
41	L	30.1	Very low	30.6	Very low	185 Å²	185	143.2 Å²	143.2	97%	0.969	83%	0.827	S	S	*	*			trans	-63.1	157.3	176.8	-73.7	115.3	0	0	0	116.5
42	G	26.9	Very low	30.8	Very low	69 Å²	69	147.4 Å²	147.4	71%	0.711	83%	0.828	S	S	*	*			trans	-177.9	104.5	154.6	0	0	0	0	0	115.5
43	L	29.5	Very low	30.9	Very low	185 Å²	185	147.1 Å²	147.1	97%	0.969	82%	0.82	S	S	*	*			trans	69.7	80.2	157.8	-78.4	90.4	0	0	0	120.4
44	G	30.6	Very low	30.9	Very low	75 Å²	75	146 Å²	146	77%	0.773	82%	0.819	S	S	*	*			trans	-124.3	89.7	148.2	0	0	0	0	0	109
45	N	39.6	Very low	31	Very low	169 Å²	169	145.7 Å²	145.7	90%	0.904	82%	0.817	S	S	*	*			trans	-158.7	81.1	173.1	-97.4	-19.2	0	0	0	108.7
46	A	32.9	Very low	31	Very low	88 Å²	88	141 Å²	141	73%	0.727	81%	0.813	S	S	*	*	S	Bend	trans	-154.6	-8.4	170.5	0	0	0	0	0	116
47	L	33.6	Very low	30.7	Very low	150 Å²	150	141.4 Å²	141.4	79%	0.785	81%	0.813	S	S	*	*	S	Bend	trans	-111.8	-11.3	-172.8	-84.4	156.8	0	0	0	115.9	K49	L47-K49 VanDerWaalsContact C-N 3.34Å; L47-K49 PolarHBondContact O-N 3.39Å
48	D	32.6	Very low	30.7	Very low	146 Å²	146	139.3 Å²	139.3	78%	0.781	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	4.4	178.2	-84.4	-28.2	0	0	0	114.9
49	K	30.9	Very low	30.5	Very low	189 Å²	189	140.6 Å²	140.6	82%	0.822	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-2.3	-176.5	-125.8	178.2	-177.2	-178.7	0	115.5	L47	L47-K49 VanDerWaalsContact C-N 3.34Å; L47-K49 PolarHBondContact O-N 3.39Å
50	V	34.4	Very low	30.1	Very low	114 Å²	114	142 Å²	142	69%	0.691	81%	0.806	S	S	*	*	S	Bend	trans	-103.5	-20.3	178.3	-178.5	0	0	0	0	112.2	R52	V50-R52 VanDerWaalsContact C-N 3.31Å; V50-R52 PolarHBondContact O-N 3.22Å
51	Q	33.2	Very low	30.1	Very low	168 Å²	168	141.2 Å²	141.2	79%	0.785	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	4.1	-175	-153.8	160.3	-25.9	0	0	114.7
52	R	29.6	Very low	29.8	Very low	225 Å²	225	138.2 Å²	138.2	85%	0.849	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	9.9	177.8	-78.3	-173	-174.3	156.4	4.7	115.1	V50	V50-R52 VanDerWaalsContact C-N 3.31Å; V50-R52 PolarHBondContact O-N 3.22Å
53	S	29.6	Very low	29.8	Very low	91 Å²	91	141.6 Å²	141.6	64%	0.636	80%	0.804	S	S	*	*	S	Bend	trans	-108	5.2	-172.6	-40.5	0	0	0	0	115.4
54	L	29.9	Very low	29.5	Very low	173 Å²	173	138.8 Å²	138.8	91%	0.906	80%	0.798	S	S	*	*	S	Bend	trans	-129.7	26.5	-176	-81.3	165.6	0	0	0	114.3
55	S	30.3	Very low	29.1	Very low	107 Å²	107	140.4 Å²	140.4	75%	0.748	80%	0.798	S	S	*	*	S	Bend	trans	-132.1	68.6	172.5	25.6	0	0	0	0	111.3
56	A	26.5	Very low	28.4	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	80%	0.796	S	S	*	*			trans	-177	150.6	152.1	0	0	0	0	0	109.1
57	V	26	Very low	28	Very low	142 Å²	142	143.7 Å²	143.7	86%	0.861	80%	0.802	S	S	*	*			trans	89	113.4	-177	-170.6	0	0	0	0	111.6
58	V	26.2	Very low	27.5	Very low	127 Å²	127	139.9 Å²	139.9	77%	0.77	80%	0.799	S	S	*	*			cis	-157.5	148.3	11.2	131	0	0	0	0	109.3
59	V	28.1	Very low	27.1	Very low	118 Å²	118	142.4 Å²	142.4	72%	0.715	81%	0.806	S	S	*	*			trans	-73.9	134.5	169.6	167.6	0	0	0	0	110.1
60	N	24.1	Very low	26.9	Very low	161 Å²	161	140 Å²	140	86%	0.861	81%	0.808	S	S	*	*			trans	-156.8	135.5	133.2	-108.9	-12.9	0	0	0	114.1
61	K	28.2	Very low	26.4	Very low	193 Å²	193	138.4 Å²	138.4	84%	0.839	81%	0.814	S	S	*	*			trans	-72.9	145.8	179.9	-71.1	171.5	171.4	176.3	0	111.5
62	S	24.3	Very low	26.1	Very low	121 Å²	121	140 Å²	140	85%	0.846	82%	0.822	S	S	*	*			trans	-155.3	128	133	50.5	0	0	0	0	110.8
63	T	25.1	Very low	25.9	Very low	140 Å²	140	134 Å²	134	86%	0.859	82%	0.82	S	S	*	*			trans	-78	138.1	174.6	40.9	0	0	0	0	110.7
64	C	23.2	Very low	25.8	Very low	127 Å²	127	134.5 Å²	134.5	86%	0.858	83%	0.83	S	S	*	*			trans	-156.6	125	142.4	-147.8	0	0	0	0	111.1
65	S	22.5	Very low	25.8	Very low	109 Å²	109	132 Å²	132	76%	0.762	83%	0.827	S	S	*	*			trans	-92.4	134.5	173.8	49.5	0	0	0	0	110.3
66	V	25.3	Very low	26	Very low	142 Å²	142	130.4 Å²	130.4	86%	0.861	83%	0.827	S	S	*	*			trans	-148.3	132.4	150	-179.2	0	0	0	0	110.1
67	Q	24	Very low	26	Very low	183 Å²	183	134.1 Å²	134.1	86%	0.855	83%	0.834	S	S	*	*			trans	-78.3	151.5	174.1	-68.8	166.6	-44.4	0	0	112.4
68	G	23.4	Very low	26.3	Very low	71 Å²	71	132.9 Å²	132.9	73%	0.732	83%	0.831	S	S	*	*			trans	62.9	122.4	135.3	0	0	0	0	0	120.3
69	Q	25.3	Very low	26.4	Very low	198 Å²	198	135.5 Å²	135.5	93%	0.925	83%	0.832	S	S	*	*				175.5	145.7	99.8	-94.3	-177.5	5.8	0	0	112.3
70	T	25.7	Very low	26.4	Very low	139 Å²	139	135.3 Å²	135.3	85%	0.853	83%	0.831	S	S	*	*			trans	-58.9	146.1	166.6	44.9	0	0	0	0	113.3
71	G	24.7	Very low	26.7	Very low	80 Å²	80	136.1 Å²	136.1	83%	0.825	84%	0.835	S	S	*	*			trans	178.5	116.1	164.9	0	0	0	0	0	113.2
72	Q	27.3	Very low	26.8	Very low	201 Å²	201	131 Å²	131	94%	0.939	83%	0.828	S	S	*	*			trans	-57.9	143.3	179.4	-66.1	162.7	-30.7	0	0	113.5
73	A	24.2	Very low	26.9	Very low	100 Å²	100	135.4 Å²	135.4	83%	0.826	83%	0.826	S	S	*	*			trans	-156.3	100.2	144.5	0	0	0	0	0	109.8
74	A	28.3	Very low	27.1	Very low	101 Å²	101	135.3 Å²	135.3	84%	0.835	83%	0.825	S	S	*	*			trans	-71.8	124.7	157.7	0	0	0	0	0	108.5
75	S	29.9	Very low	27.4	Very low	122 Å²	122	137.2 Å²	137.2	85%	0.853	83%	0.826	S	S	*	*			trans	156.5	119.7	143.6	63.3	0	0	0	0	109.2
76	G	33.2	Very low	27.7	Very low	72 Å²	72	137.7 Å²	137.7	74%	0.742	82%	0.824	S	S	*	*			trans	122.1	53.8	162.5	0	0	0	0	0	116.9
77	L	26.7	Very low	27.7	Very low	170 Å²	170	135.5 Å²	135.5	89%	0.89	82%	0.821	S	S	*	*			trans	-119.8	53.5	163.6	-73.8	174.7	0	0	0	111.5
78	S	32.4	Very low	27.8	Very low	116 Å²	116	133.5 Å²	133.5	81%	0.811	82%	0.821	S	S	*	*	S	Bend	trans	-118.6	14.5	172.4	-177.5	0	0	0	0	113.4
79	K	29.3	Very low	27.9	Very low	182 Å²	182	139.2 Å²	139.2	79%	0.791	83%	0.829	S	S	*	*	S	Bend	trans	-138.3	17.2	-175.2	-83.1	-173.8	176.7	175.4	0	116.6
80	V	28.1	Very low	27.9	Very low	113 Å²	113	134.4 Å²	134.4	69%	0.685	82%	0.817	S	S	*	*	S	Bend	trans	-105.8	-10.2	-179.5	-177.8	0	0	0	0	113.7
81	L	29.6	Very low	27.9	Very low	179 Å²	179	136.9 Å²	136.9	94%	0.937	82%	0.816	S	S	*	*	S	Bend	trans	-95.1	-0.5	174.9	-110.3	135.3	0	0	0	114.8
82	A	29.5	Very low	27.9	Very low	84 Å²	84	141.2 Å²	141.2	69%	0.694	82%	0.815	S	S	*	*	S	Bend	trans	-103.2	16.1	178.1	0	0	0	0	0	114
83	R	28.1	Very low	27.8	Very low	214 Å²	214	138.6 Å²	138.6	81%	0.808	81%	0.808	S	S	*	*	S	Bend	trans	-119.1	15.4	-175	-96.7	-176	175.5	173	-1.7	115.6
84	V	29.3	Very low	27.9	Very low	139 Å²	139	142 Å²	142	84%	0.842	81%	0.806	S	S	*	*	S	Bend	trans	-102.5	-1	174.3	-179.5	0	0	0	0	112.8
85	L	29	Very low	27.8	Very low	166 Å²	166	143.5 Å²	143.5	87%	0.869	80%	0.8	S	S	*	*	S	Bend	trans	-111	6.6	-178.4	-83	169.6	0	0	0	116.6
86	T	28.8	Very low	27.6	Very low	120 Å²	120	145.4 Å²	145.4	74%	0.736	80%	0.796	S	S	*	*	S	Bend	trans	-152.8	93.7	176.5	51.7	0	0	0	0	111.6
87	A	25	Very low	27.3	Very low	96 Å²	96	147.3 Å²	147.3	79%	0.793	79%	0.793	S	S	*	*			trans	176.9	94.4	151	0	0	0	0	0	111.1
88	T	26.2	Very low	27.3	Very low	140 Å²	140	148.1 Å²	148.1	86%	0.859	79%	0.79	S	S	*	*			trans	-146.5	96.4	149.2	48.1	0	0	0	0	108.9
89	E	25.7	Very low	27.1	Very low	191 Å²	191	149.4 Å²	149.4	89%	0.893	79%	0.787	S	S	*	*			trans	174.1	129	151.5	-101	176.9	-158.2	0	0	104.4
90	S	25.6	Very low	26.9	Very low	97 Å²	97	148.8 Å²	148.8	68%	0.678	79%	0.787	S	S	*	*			cis	-166.8	175.9	27.6	-35.4	0	0	0	0	110.4
91	K	24.8	Very low	26.8	Very low	192 Å²	192	149.5 Å²	149.5	84%	0.835	79%	0.792	S	S	*	*			trans	86.1	133.2	155.5	-73.4	178.9	177.5	-176.4	0	117.3
92	E	25	Very low	26.6	Very low	170 Å²	170	146.5 Å²	146.5	79%	0.794	78%	0.784	S	S	*	*			cis	-145.2	138.3	34.7	-101.7	143.9	-160.8	0	0	111
93	N	25.1	Very low	26.5	Very low	147 Å²	147	146.7 Å²	146.7	79%	0.786	79%	0.785	S	S	*	*				66.4	125.2	85	-94.5	18.3	0	0	0	112.5
94	E	26.5	Very low	26.3	Very low	171 Å²	171	144.9 Å²	144.9	80%	0.799	79%	0.786	S	S	*	*				-164.1	165.1	54.6	-83.7	165.5	168.2	0	0	107.8
95	D	25.8	Very low	26.2	Very low	133 Å²	133	144.8 Å²	144.8	71%	0.711	78%	0.781	S	S	*	*			cis	-168.6	169	24.8	-141.2	-17.9	0	0	0	113.3
96	E	26.8	Very low	26.1	Very low	161 Å²	161	143.8 Å²	143.8	75%	0.752	77%	0.774	S	S	*	*			trans	90.8	80	153.7	-70.8	-168.7	156	0	0	123.9
97	T	26.7	Very low	26	Very low	112 Å²	112	144.2 Å²	144.2	69%	0.687	77%	0.772	S	S	*	*				45.8	125.1	113.5	60.3	0	0	0	0	123.7
98	K	26.2	Very low	26.1	Very low	188 Å²	188	144.8 Å²	144.8	82%	0.817	77%	0.765	S	S	*	*				173.9	123.8	97.9	-92.1	-177.8	-178.1	173.8	0	114.3
99	N	27	Very low	26.1	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	76%	0.759	S	S	*	*			trans	37	143.1	139.2	-69.9	11	0	0	0	121.6
100	E	25.1	Very low	26.2	Very low	168 Å²	168	138.7 Å²	138.7	79%	0.785	76%	0.755	S	S	*	*			cis	-168.8	129	33.2	-122.1	159	-166.9	0	0	106.4
101	V	27.6	Very low	26.2	Very low	129 Å²	129	138.1 Å²	138.1	78%	0.782	77%	0.765	S	S	*	*				51.7	125.1	74.9	-162.4	0	0	0	0	113.4
102	C	24.5	Very low	26.2	Very low	116 Å²	116	132.3 Å²	132.3	78%	0.784	76%	0.759	S	S	*	*				-145.8	138.6	56.4	-70.6	0	0	0	0	111.6
103	A	27.8	Very low	26.3	Very low	87 Å²	87	130.8 Å²	130.8	72%	0.719	76%	0.761	S	S	*	*				63.6	132	75.7	0	0	0	0	0	112.7
104	E	24.5	Very low	26.4	Very low	177 Å²	177	131.4 Å²	131.4	83%	0.827	76%	0.764	S	S	*	*				-155.9	134.7	57.5	-74.9	175.7	155.7	0	0	112.8
105	D	26.3	Very low	26.4	Very low	137 Å²	137	126.9 Å²	126.9	73%	0.733	76%	0.764	S	S	*	*				37.3	145.5	115	-69.6	-13.4	0	0	0	120.1
106	M	27.7	Very low	26.2	Very low	144 Å²	144	123.9 Å²	123.9	71%	0.709	76%	0.764	S	S	*	*			cis	-172.8	154.1	14.5	-125.9	-175.6	-164.1	0	0	110.9
107	N	25.9	Very low	26.1	Very low	130 Å²	130	124.1 Å²	124.1	70%	0.695	77%	0.77	S	S	*	*			trans	79.3	119.4	135.1	-88.8	-0.7	0	0	0	125.6
108	V	28.3	Very low	26	Very low	108 Å²	108	127.3 Å²	127.3	66%	0.655	78%	0.777	S	S	*	*				89.5	89.4	118.1	175	0	0	0	0	118.2
109	S	26.1	Very low	25.9	Very low	104 Å²	104	128.4 Å²	128.4	73%	0.727	78%	0.776	S	S	*	*				35.8	126.1	116.1	72.2	0	0	0	0	120.3
110	A	27.3	Very low	25.8	Very low	99 Å²	99	126.2 Å²	126.2	82%	0.818	77%	0.768	S	S	*	*				145.7	138.1	92.7	0	0	0	0	0	113.1
111	G	25.3	Very low	25.9	Very low	85 Å²	85	126.6 Å²	126.6	88%	0.876	77%	0.769	S	S	*	*			trans	88.3	129.6	160.1	0	0	0	0	0	114.4
112	G	24.7	Very low	25.7	Very low	69 Å²	69	124.1 Å²	124.1	71%	0.711	76%	0.763	S	S	*	*			cis	143.2	142.6	10.3	0	0	0	0	0	108.7
113	V	27.7	Very low	25.7	Very low	138 Å²	138	124.2 Å²	124.2	84%	0.836	76%	0.764	S	S	*	*			trans	90.4	110.8	158.3	-164.9	0	0	0	0	118.9
114	D	27.1	Very low	25.9	Very low	161 Å²	161	125.6 Å²	125.6	86%	0.861	77%	0.766	S	S	*	*			trans	33.8	134.5	140.7	-76.3	-33	0	0	0	123.3
115	G	25	Very low	25.9	Very low	76 Å²	76	125.6 Å²	125.6	78%	0.784	77%	0.766	S	S	*	*				121.3	107.1	113.1	0	0	0	0	0	117.2
116	G	22.9	Very low	25.8	Very low	70 Å²	70	125.1 Å²	125.1	72%	0.722	77%	0.768	S	S	*	*				97.1	124.4	122.9	0	0	0	0	0	120.1
117	L	24.5	Very low	26.1	Very low	166 Å²	166	123.8 Å²	123.8	87%	0.869	77%	0.77	S	S	*	*			trans	82.5	118.4	141.5	-80.9	92.1	0	0	0	122.1
118	Q	24.1	Very low	26.1	Very low	179 Å²	179	126 Å²	126	84%	0.836	78%	0.776	S	S	*	*			trans	-40.2	178.4	153.6	-97.5	166.6	-7.3	0	0	118.4
119	W	24.5	Very low	26.3	Very low	210 Å²	210	126.3 Å²	126.3	80%	0.795	78%	0.781	S	S	*	*			trans	122.1	88.1	159.9	-68.9	91.6	0	0	0	111.5
120	T	25.2	Very low	26.2	Very low	97 Å²	97	128.7 Å²	128.7	60%	0.595	79%	0.785	S	S	*	*				73.6	124.6	90.4	57.2	0	0	0	0	115.7
121	H	26.3	Very low	26.2	Very low	176 Å²	176	128 Å²	128	82%	0.815	78%	0.779	S	S	*	*				159.5	111.4	126.4	-91	-72.4	0	0	0	110.3
122	A	24.1	Very low	26.3	Very low	78 Å²	78	131.7 Å²	131.7	65%	0.645	78%	0.779	S	S	*	*				78.1	99	96.6	0	0	0	0	0	113.5
123	S	24.3	Very low	26.4	Very low	118 Å²	118	133.3 Å²	133.3	83%	0.825	78%	0.779	S	S	*	*				71.6	142.8	102.4	-62	0	0	0	0	114.7
124	P	32.1	Very low	26.5	Very low	115 Å²	115	132.7 Å²	132.7	75%	0.747	78%	0.778	S	S	*	*			cis	-151.2	153.8	45.4	39	-16.1	0	0	0	120
125	Q	24.8	Very low	26.5	Very low	177 Å²	177	136.6 Å²	136.6	83%	0.827	78%	0.781	S	S	*	*			trans	53.2	111.1	133	-66.7	-173.2	-7.1	0	0	125.3
126	T	23.5	Very low	26.8	Very low	127 Å²	127	139.8 Å²	139.8	78%	0.779	78%	0.784	S	S	*	*			trans	58.2	155.8	130.5	27.9	0	0	0	0	123.2
127	P	33.6	Very low	27.3	Very low	116 Å²	116	141.7 Å²	141.7	75%	0.753	79%	0.787	S	S	*	*			cis	-134.7	153.5	4.4	35.4	-14.2	0	0	0	119
128	Q	26.3	Very low	27.9	Very low	176 Å²	176	135.7 Å²	135.7	82%	0.822	77%	0.765	S	S	*	*			trans	11.1	151.4	146.6	-87.4	-170.4	-3	0	0	124.1
129	P	32	Very low	28.6	Very low	116 Å²	116	132 Å²	132	75%	0.753	77%	0.765	S	S	*	*				-148.1	149.9	66.4	37.8	-16.4	0	0	0	121
130	L	25.7	Very low	29.6	Very low	154 Å²	154	125.1 Å²	125.1	81%	0.806	75%	0.753	S	S	*	*			trans	50.9	116.3	140.2	-73	151.7	0	0	0	124.7
131	A	26.3	Very low	30.7	Very low	85 Å²	85	121.1 Å²	121.1	70%	0.702	73%	0.731	S	S	*	*			trans	73.1	113.3	130.9	0	0	0	0	0	121.8
132	D	27.9	Very low	31.6	Very low	162 Å²	162	119.1 Å²	119.1	87%	0.866	73%	0.733	S	S	*	*				-163.6	155.1	116.8	-115	-25.4	0	0	0	113.8
133	S	26.5	Very low	33	Very low	102 Å²	102	120 Å²	120	71%	0.713	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-68.6	151	-161.2	-44.3	0	0	0	0	116.8
134	P	29.8	Very low	34.9	Very low	126 Å²	126	116.4 Å²	116.4	82%	0.818	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-84.7	125.7	-179.2	32.4	-29.9	0	0	0	112.6
135	R	27.7	Very low	37.1	Very low	243 Å²	243	111.6 Å²	111.6	92%	0.917	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-68.7	127.2	165.8	-75.6	178.1	173.4	-178.4	-3.7	109.8	S137	R135-S137 PolarHBondContact O-N 3.27Å
136	V	30	Very low	39.8	Very low	142 Å²	142	107.3 Å²	107.3	86%	0.861	65%	0.654	S	S	*	*			trans	-76	104.2	172.8	179.7	0	0	0	0	108.8
137	S	33.1	Very low	42.8	Very low	111 Å²	111	103 Å²	103	78%	0.776	62%	0.624	S	S	*	*			trans	-84.7	109	168.3	55.1	0	0	0	0	109.5	R135	R135-S137 PolarHBondContact O-N 3.27Å
138	G	38.3	Very low	45.3	Very low	40 Å²	40	97.6 Å²	97.6	41%	0.412	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-61.3	132.9	173.5	0	0	0	0	0	111.7	A140	G138-A140 PolarHBondContact O-N 3.23Å
139	A	38.5	Very low	48.2	Very low	102 Å²	102	91.4 Å²	91.4	84%	0.843	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-62.7	130.8	-179	0	0	0	0	0	111.4
140	A	44.5	Very low	50.9	Low	64 Å²	64	86 Å²	86	53%	0.529	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-67.7	138.6	172.1	0	0	0	0	0	110	G138	G138-A140 PolarHBondContact O-N 3.23Å
141	G	49.2	Very low	53.9	Low	13 Å²	13	79.3 Å²	79.3	13%	0.134	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-64.7	167.2	172.4	0	0	0	0	0	112.2	D143 G144	G141-D143 PolarHBondContact O-N 2.83Å; G141-G144 PolarHBondContact O-N 2.84Å
142	P	45	Very low	57	Low	134 Å²	134	77 Å²	77	87%	0.87	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-22.5	-171.6	16.5	-28.5	0	0	0	115.3
143	D	54	Low	59.7	Low	96 Å²	96	69.4 Å²	69.4	51%	0.513	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	11.4	179.3	-62.5	-40.1	0	0	0	115.4	G141 V145	G141-D143 PolarHBondContact O-N 2.83Å; D143-V145 HydrophobicContact CB-CG2 4.06Å; D143-V145 PolarHBondContact O-N 3.46Å
144	G	65	Low	62.5	Low	44 Å²	44	71 Å²	71	45%	0.454	42%	0.422	S	S	.	.	S	Bend	trans	70.6	14.5	-174.3	0	0	0	0	0	114.2	G141	G141-G144 PolarHBondContact O-N 2.84Å
145	V	76.8	Confident	64.9	Low	14 Å²	14	67.9 Å²	67.9	9%	0.085	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	138.9	173	-176.2	0	0	0	0	109.9	D143 Y147 V170 A171 R172	D143-V145 HydrophobicContact CB-CG2 4.06Å; D143-V145 PolarHBondContact O-N 3.46Å; V145-Y147 HydrophobicContact CG1-CE1 3.87Å; V145-Y147 HydrophobicContact CG1-CE2 4.06Å; V145-V170 HydrophobicContact CG1-CG1 3.85Å; V145-A171 CarbonylContact C-O 3.56Å; V145-A171 VanDerWaalsContact CA-O 3.29Å; V145-A171 WeakPolarHBondContact CA-O 3.22Å; V145-A171 WeakPolarHBondContact CG1-O 3.35Å; V145-R172 HydrophobicContact CG2-CB 4.08Å; V145-R172 HydrophobicContact CG2-CG 3.85Å
146	R	81.8	Confident	67.1	Low	87 Å²	87	58.7 Å²	58.7	33%	0.328	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	148	176	-58.3	-171.6	-164.1	-167.4	6.6	111.5	F148 A171 A198	R146-F148 HydrophobicContact CB-CE2 3.73Å; R146-F148 HydrophobicContact CB-CZ 4.01Å; R146-A171 PolarHBondContact N-O 3.48Å; R146-A171 PolarHBondContact O-N 3.02Å; R146-A198 VanDerWaalsContact CZ-CA 3.44Å; R146-A198 VanDerWaalsContact NH1-C 3.3Å; R146-A198 PolarHBondContact NH1-O 3.11Å
147	Y	86	Confident	69.2	Low	36 Å²	36	62.5 Å²	62.5	14%	0.141	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135	-177.9	-52.7	-82	0	0	0	109.7	V145 L169 V170 V219 A221 F224	V145-Y147 HydrophobicContact CG1-CE1 3.87Å; V145-Y147 HydrophobicContact CG1-CE2 4.06Å; Y147-L169 CarbonylContact C-O 3.57Å; Y147-L169 WeakPolarHBondContact CA-O 3.44Å; Y147-V170 HydrophobicContact CD1-CB 4.33Å; Y147-V170 HydrophobicContact CD1-CG1 4.06Å; Y147-V170 HydrophobicContact CD1-CG2 3.96Å; Y147-V170 HydrophobicContact CE1-CB 4.35Å; Y147-V170 HydrophobicContact CE1-CG1 3.66Å; Y147-V170 HydrophobicContact CE1-CG2 4.07Å; Y147-V219 PolarHBondContact O-N 2.79Å; Y147-A221 HydrophobicContact CD2-CB 4.16Å; Y147-A221 HydrophobicContact CE2-CB 3.89Å; Y147-F224 HydrophobicContact CD1-CB 3.77Å; Y147-F224 AromaticContact CD1-CD1 3.7Å; Y147-F224 HydrophobicContact CD1-CD1 3.7Å; Y147-F224 AromaticContact CD1-CD2 3.35Å; Y147-F224 HydrophobicContact CD1-CD2 3.35Å; Y147-F224 HydrophobicContact CD1-CE1 4.09Å; Y147-F224 AromaticContact CD1-CE2 3.76Å; Y147-F224 HydrophobicContact CD1-CE2 3.76Å; Y147-F224 AromaticContact CD1-CG 3.29Å; Y147-F224 HydrophobicContact CD1-CG 3.29Å; Y147-F224 HydrophobicContact CD1-CZ 4.11Å; Y147-F224 HydrophobicContact CD2-CB 3.83Å; Y147-F224 HydrophobicContact CD2-CG 4.2Å; Y147-F224 HydrophobicContact CE1-CB 4.02Å; Y147-F224 AromaticContact CE1-CD1 3.13Å; Y147-F224 HydrophobicContact CE1-CD1 3.13Å; Y147-F224 AromaticContact CE1-CD2 3.66Å; Y147-F224 HydrophobicContact CE1-CD2 3.66Å; Y147-F224 AromaticContact CE1-CE1 3.33Å; Y147-F224 HydrophobicContact CE1-CE1 3.33Å; Y147-F224 AromaticContact CE1-CE2 3.81Å; Y147-F224 HydrophobicContact CE1-CE2 3.81Å; Y147-F224 AromaticContact CE1-CG 3.29Å; Y147-F224 HydrophobicContact CE1-CG 3.29Å; Y147-F224 AromaticContact CE1-CZ 3.66Å; Y147-F224 HydrophobicContact CE1-CZ 3.66Å; Y147-F224 HydrophobicContact CE2-CB 4.08Å; Y147-F224 HydrophobicContact CE2-CD1 4.1Å; Y147-F224 HydrophobicContact CE2-CG 4.2Å; Y147-F224 HydrophobicContact CG-CB 3.66Å; Y147-F224 HydrophobicContact CG-CD1 4.37Å; Y147-F224 HydrophobicContact CG-CD2 4.04Å; Y147-F224 AromaticContact CG-CG 3.76Å; Y147-F224 HydrophobicContact CG-CG 3.76Å; Y147-F224 AromaticContact CZ-CD1 3.35Å; Y147-F224 AromaticContact CZ-CE1 3.82Å; Y147-F224 AromaticContact CZ-CG 3.76Å
148	F	86.8	Confident	71.2	Confident	3 Å²	3	64.5 Å²	64.5	1%	0.013	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.7	178.4	-53.5	-93.7	0	0	0	110.1	R146 V150 V168 L169 A171 L200 V215 G217 I218	R146-F148 HydrophobicContact CB-CE2 3.73Å; R146-F148 HydrophobicContact CB-CZ 4.01Å; F148-V150 HydrophobicContact CB-CG1 4Å; F148-V168 CarbonylContact O-C 3.59Å; F148-V168 WeakPolarHBondContact O-CA 3.44Å; F148-L169 HydrophobicContact CB-CB 4.17Å; F148-L169 HydrophobicContact CD2-CD2 4.03Å; F148-L169 HydrophobicContact CD2-CG 4.41Å; F148-L169 PolarHBondContact N-O 3.43Å; F148-L169 PolarHBondContact O-N 3.49Å; F148-A171 HydrophobicContact CE2-CB 4.26Å; F148-L200 HydrophobicContact CD1-CB 4.31Å; F148-L200 HydrophobicContact CD2-CD1 4.39Å; F148-L200 HydrophobicContact CE1-CB 3.65Å; F148-L200 HydrophobicContact CE1-CD1 4.45Å; F148-L200 HydrophobicContact CE2-CD1 3.93Å; F148-L200 HydrophobicContact CZ-CB 3.78Å; F148-L200 HydrophobicContact CZ-CD1 3.95Å; F148-V215 HydrophobicContact CB-CG1 4.24Å; F148-V215 HydrophobicContact CD1-CG1 4.06Å; F148-G217 CarbonylContact C-O 3.6Å; F148-G217 WeakPolarHBondContact CA-O 3.44Å; F148-I218 HydrophobicContact CD1-CG1 4.07Å; F148-I218 HydrophobicContact CE1-CG1 4.08Å
149	S	86.9	Confident	72.5	Confident	46 Å²	46	72.1 Å²	72.1	32%	0.322	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	128.1	166.7	-177.7	0	0	0	0	107.8	M216 G217	S149-M216 PolarHBondContact O-N 3.31Å; S149-G217 PolarHBondContact N-O 2.75Å; S149-G217 PolarHBondContact O-N 3.05Å
150	V	89.2	Confident	74	Confident	1 Å²	1	75 Å²	75	1%	0.006	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	147.1	-174.2	-48.2	0	0	0	0	111.2	F148 D166 A167 L169 L178 I213 E214 V215	F148-V150 HydrophobicContact CB-CG1 4Å; V150-D166 CarbonylContact O-C 3.58Å; V150-A167 HydrophobicContact CG2-CB 3.86Å; V150-A167 PolarHBondContact N-O 2.99Å; V150-A167 PolarHBondContact O-N 3.38Å; V150-L169 HydrophobicContact CG1-CB 3.81Å; V150-L169 HydrophobicContact CG2-CB 4.36Å; V150-L178 HydrophobicContact CG2-CD1 3.4Å; V150-I213 HydrophobicContact CB-CB 4.36Å; V150-I213 HydrophobicContact CB-CD1 4.37Å; V150-I213 HydrophobicContact CG1-CD1 4.1Å; V150-I213 HydrophobicContact CG2-CB 4.25Å; V150-I213 HydrophobicContact CG2-CD1 4.33Å; V150-I213 HydrophobicContact CG2-CG2 4.39Å; V150-E214 CarbonylContact C-O 3.32Å; V150-E214 WeakPolarHBondContact CA-O 3.25Å; V150-E214 WeakPolarHBondContact CB-O 3.37Å; V150-V215 HydrophobicContact CG1-CG2 4.14Å
151	V	89.5	Confident	75.3	Confident	15 Å²	15	75.2 Å²	75.2	9%	0.091	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	147.7	164.3	-67.8	0	0	0	0	109.1	W163 D166 I213 E214 M216	V151-W163 HydrophobicContact CB-CB 4.49Å; V151-W163 HydrophobicContact CB-CD2 4.05Å; V151-W163 HydrophobicContact CB-CE3 3.94Å; V151-W163 HydrophobicContact CB-CG 4.27Å; V151-W163 HydrophobicContact CG2-CD2 3.6Å; V151-W163 HydrophobicContact CG2-CE3 3.64Å; V151-W163 HydrophobicContact CG2-CG 4.13Å; V151-W163 HydrophobicContact CG2-CH2 4.24Å; V151-W163 HydrophobicContact CG2-CZ2 4.21Å; V151-W163 HydrophobicContact CG2-CZ3 3.96Å; V151-D166 WeakPolarHBondContact CG1-OD1 3.45Å; V151-I213 CarbonylContact O-C 3.58Å; V151-I213 WeakPolarHBondContact O-CA 3.5Å; V151-E214 HydrophobicContact CG2-CB 3.77Å; V151-E214 PolarHBondContact N-O 3.5Å; V151-E214 PolarHBondContact O-N 2.75Å; V151-M216 HydrophobicContact CG1-CG 3.92Å; V151-M216 HydrophobicContact CG1-SD 4.07Å; V151-M216 HydrophobicContact CG2-CG 4.31Å; V151-M216 HydrophobicContact CG2-SD 4.17Å
152	W	89.8	Confident	76.7	Confident	35 Å²	35	85.4 Å²	85.4	13%	0.133	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	151	-177.2	75.9	-84	0	0	0	113.6	E164 G165 L178 I186 K211 E212 I213	W152-E164 HydrophobicContact CE3-CB 4.48Å; W152-E164 HydrophobicContact CH2-CB 4.17Å; W152-E164 WeakPolarHBondContact CH2-OE2 3.28Å; W152-E164 HydrophobicContact CZ2-CB 4.29Å; W152-E164 HydrophobicContact CZ3-CB 4.27Å; W152-E164 WeakPolarHBondContact CZ3-OE2 3.37Å; W152-E164 PolarHBondContact O-N 2.91Å; W152-G165 PolarHBondContact N-O 3.28Å; W152-G165 PolarHBondContact O-N 3.37Å; W152-L178 HydrophobicContact CB-CD2 4.29Å; W152-L178 HydrophobicContact CG-CD2 4.48Å; W152-I186 HydrophobicContact CD2-CD1 3.98Å; W152-I186 HydrophobicContact CG-CD1 4.06Å; W152-I186 HydrophobicContact CZ2-CD1 4.24Å; W152-K211 HydrophobicContact CD2-CD 4.31Å; W152-K211 HydrophobicContact CE3-CB 4.21Å; W152-K211 HydrophobicContact CE3-CD 3.52Å; W152-K211 HydrophobicContact CE3-CG 3.86Å; W152-K211 HydrophobicContact CH2-CD 4.45Å; W152-K211 HydrophobicContact CZ3-CD 3.62Å; W152-K211 VanDerWaalsContact CZ3-CE 3.44Å; W152-K211 HydrophobicContact CZ3-CG 4.02Å; W152-E212 CarbonylContact C-O 3.57Å; W152-E212 WeakPolarHBondContact CA-O 3.44Å; W152-I213 HydrophobicContact CB-CG2 3.78Å
153	C	86.1	Confident	78.6	Confident	4 Å²	4	83 Å²	83	3%	0.027	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	166.7	170.4	71.8	0	0	0	0	111.2	R162 W163 E164 K211 E212	C153-R162 WeakPolarHBondContact CB-O 3.3Å; C153-W163 HydrophobicContact CB-CE3 4.01Å; C153-W163 HydrophobicContact CB-CZ3 4.36Å; C153-E164 HydrophobicContact CB-CG 4.41Å; C153-K211 WeakPolarHBondContact O-CA 3.34Å; C153-E212 PolarHBondContact N-O 2.92Å; C153-E212 PolarHBondContact O-N 3.21Å
154	K	84	Confident	79.9	Confident	135 Å²	135	82.9 Å²	82.9	59%	0.587	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	143.3	167.5	-70.5	171.1	-168.9	160.5	0	109.9	S156 E164	K154-S156 PolarHBondContact O-N 3.3Å; K154-S156 VanDerWaalsContact O-N 3.11Å; K154-E164 VanDerWaalsContact CD-OE1 3.24Å; K154-E164 WeakPolarHBondContact CD-OE1 3.21Å; K154-E164 VanDerWaalsContact CE-OE1 3.28Å; K154-E164 WeakPolarHBondContact CE-OE1 3.25Å; K154-E164 WeakPolarHBondContact CE-OE2 3.43Å; K154-E164 WeakPolarHBondContact CG-OE1 3.2Å; K154-E164 IonicContact NZ-OE1 2.79Å
155	A	80.4	Confident	80.8	Confident	61 Å²	61	82 Å²	82	50%	0.504	38%	0.381	S	S	.	.			trans	-50.4	119.1	178.1	0	0	0	0	0	111	M207 G210	A155-M207 HydrophobicContact CB-CE 3.68Å; A155-G210 PolarHBondContact N-O 3.28Å
156	S	75.2	Confident	81.2	Confident	50 Å²	50	85.9 Å²	85.9	35%	0.35	40%	0.402	S	S	.	.			trans	-144.1	136.3	-179	-161.9	0	0	0	0	111.5	K154 K158	K154-S156 PolarHBondContact O-N 3.3Å; K154-S156 VanDerWaalsContact O-N 3.11Å; S156-K158 PolarHBondContact O-N 2.95Å
157	K	72.8	Confident	81.4	Confident	222 Å²	222	81.8 Å²	81.8	97%	0.965	39%	0.386	S	S	*	.			trans	-82.2	11.6	175.8	-61.9	-175.7	178.7	-178.2	0	113.4
158	K	74.5	Confident	81.5	Confident	152 Å²	152	80.1 Å²	80.1	66%	0.661	38%	0.38	S	S	*	.			trans	-78.5	135.9	-177.8	-70.1	-178.2	179.7	-178.8	0	110.5	S156 H160	S156-K158 PolarHBondContact O-N 2.95Å; K158-H160 VanDerWaalsContact C-N 3.29Å; K158-H160 PolarHBondContact O-N 3.48Å
159	K	66.4	Low	81.5	Confident	200 Å²	200	80 Å²	80	87%	0.87	38%	0.38	S	S	*	.	S	Bend	trans	-61.1	-34	179.5	-170.5	178.5	179.9	-177.8	0	113.3
160	H	70.4	Confident	81.5	Confident	163 Å²	163	78.9 Å²	78.9	76%	0.755	37%	0.371	S	S	*	.	S	Bend	trans	-108	112.3	170.9	-64.6	-72.5	0	0	0	108.8	K158	K158-H160 VanDerWaalsContact C-N 3.29Å; K158-H160 PolarHBondContact O-N 3.48Å
161	K	72.1	Confident	81.3	Confident	69 Å²	69	79.1 Å²	79.1	30%	0.3	37%	0.373	S	S	.	.			trans	-84.7	141.1	177.7	-64.9	173.6	-176.8	167.2	0	109.3	W163 E212	K161-W163 HydrophobicContact CB-CZ2 4.37Å; K161-W163 HydrophobicContact CD-CH2 4.06Å; K161-W163 HydrophobicContact CD-CZ2 4.03Å; K161-E212 VanDerWaalsContact CE-CD 3.43Å; K161-E212 WeakPolarHBondContact CE-OE1 3.5Å; K161-E212 WeakPolarHBondContact CE-OE2 3.48Å; K161-E212 IonicContact NZ-OE1 3.4Å; K161-E212 PolarHBondContact NZ-OE1 3.37Å; K161-E212 IonicContact NZ-OE2 3.57Å; K161-E212 PolarHBondContact NZ-OE2 3.41Å
162	R	78.9	Confident	80.9	Confident	226 Å²	226	85.2 Å²	85.2	85%	0.853	39%	0.394	S	S	*	.			trans	-101.3	107.1	167.7	-176.4	179	179.7	-176.9	0.1	106.4	C153	C153-R162 WeakPolarHBondContact CB-O 3.3Å
163	W	83.9	Confident	80.5	Confident	83 Å²	83	85.4 Å²	85.4	31%	0.314	41%	0.407	S	S	.	.			trans	-63.2	134.2	175.9	-60.7	111.8	0	0	0	109.8	V151 C153 K161 E214	V151-W163 HydrophobicContact CB-CB 4.49Å; V151-W163 HydrophobicContact CB-CD2 4.05Å; V151-W163 HydrophobicContact CB-CE3 3.94Å; V151-W163 HydrophobicContact CB-CG 4.27Å; V151-W163 HydrophobicContact CG2-CD2 3.6Å; V151-W163 HydrophobicContact CG2-CE3 3.64Å; V151-W163 HydrophobicContact CG2-CG 4.13Å; V151-W163 HydrophobicContact CG2-CH2 4.24Å; V151-W163 HydrophobicContact CG2-CZ2 4.21Å; V151-W163 HydrophobicContact CG2-CZ3 3.96Å; C153-W163 HydrophobicContact CB-CE3 4.01Å; C153-W163 HydrophobicContact CB-CZ3 4.36Å; K161-W163 HydrophobicContact CB-CZ2 4.37Å; K161-W163 HydrophobicContact CD-CH2 4.06Å; K161-W163 HydrophobicContact CD-CZ2 4.03Å; W163-E214 HydrophobicContact CH2-CB 3.52Å; W163-E214 HydrophobicContact CZ2-CB 3.86Å; W163-E214 WeakPolarHBondContact CZ2-OE2 3.45Å; W163-E214 HydrophobicContact CZ3-CB 4.19Å
164	E	80.8	Confident	80.3	Confident	94 Å²	94	93.4 Å²	93.4	44%	0.439	44%	0.437	S	S	.	.			trans	-87.9	-28	-178.9	-68.8	-167.1	172.5	0	0	111.5	W152 C153 K154	W152-E164 HydrophobicContact CE3-CB 4.48Å; W152-E164 HydrophobicContact CH2-CB 4.17Å; W152-E164 WeakPolarHBondContact CH2-OE2 3.28Å; W152-E164 HydrophobicContact CZ2-CB 4.29Å; W152-E164 HydrophobicContact CZ3-CB 4.27Å; W152-E164 WeakPolarHBondContact CZ3-OE2 3.37Å; W152-E164 PolarHBondContact O-N 2.91Å; C153-E164 HydrophobicContact CB-CG 4.41Å; K154-E164 VanDerWaalsContact CD-OE1 3.24Å; K154-E164 WeakPolarHBondContact CD-OE1 3.21Å; K154-E164 VanDerWaalsContact CE-OE1 3.28Å; K154-E164 WeakPolarHBondContact CE-OE1 3.25Å; K154-E164 WeakPolarHBondContact CE-OE2 3.43Å; K154-E164 WeakPolarHBondContact CG-OE1 3.2Å; K154-E164 IonicContact NZ-OE1 2.79Å
165	G	83.7	Confident	80.2	Confident	26 Å²	26	90.1 Å²	90.1	27%	0.268	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.1	-176.6	172	0	0	0	0	0	113.8	W152	W152-G165 PolarHBondContact N-O 3.28Å; W152-G165 PolarHBondContact O-N 3.37Å
166	D	86.9	Confident	80.6	Confident	95 Å²	95	87.2 Å²	87.2	51%	0.508	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	154.3	179.5	-55.9	-16.3	0	0	0	111.1	V150 V151 M181	V150-D166 CarbonylContact O-C 3.58Å; V151-D166 WeakPolarHBondContact CG1-OD1 3.45Å; D166-M181 HydrophobicContact CB-CG 3.83Å; D166-M181 HydrophobicContact CB-SD 4.05Å
167	A	86.2	Confident	81.2	Confident	1 Å²	1	86.5 Å²	86.5	1%	0.008	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	163.1	-177.4	0	0	0	0	0	111.9	V150 L178 K179 I186	V150-A167 HydrophobicContact CG2-CB 3.86Å; V150-A167 PolarHBondContact N-O 2.99Å; V150-A167 PolarHBondContact O-N 3.38Å; A167-L178 HydrophobicContact CB-CD1 3.82Å; A167-L178 HydrophobicContact CB-CG 4.16Å; A167-K179 CarbonylContact C-O 3.5Å; A167-K179 VanDerWaalsContact CA-O 3.24Å; A167-K179 WeakPolarHBondContact CA-O 3.39Å; A167-K179 WeakPolarHBondContact CB-O 3.17Å; A167-I186 HydrophobicContact CB-CD1 4.07Å
168	V	87.3	Confident	81.9	Confident	2 Å²	2	76 Å²	76	1%	0.012	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.8	172.9	-177.5	0	0	0	0	109.4	F148 K179 F224 C229 F230	F148-V168 CarbonylContact O-C 3.59Å; F148-V168 WeakPolarHBondContact O-CA 3.44Å; V168-K179 PolarHBondContact N-O 3.2Å; V168-K179 PolarHBondContact O-N 2.86Å; V168-F224 HydrophobicContact CG1-CD2 3.92Å; V168-F224 HydrophobicContact CG1-CE2 4.06Å; V168-C229 HydrophobicContact CG2-CB 4.29Å; V168-F230 HydrophobicContact CB-CE1 3.99Å; V168-F230 HydrophobicContact CB-CZ 4.07Å; V168-F230 HydrophobicContact CG1-CZ 4.41Å; V168-F230 HydrophobicContact CG2-CD1 4.19Å; V168-F230 HydrophobicContact CG2-CE1 3.65Å; V168-F230 HydrophobicContact CG2-CZ 3.95Å
169	L	86.8	Confident	82.3	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.4	174.7	-179.7	68.2	0	0	0	110	Y147 F148 V150 V176 L178 L200 I208 I213	Y147-L169 CarbonylContact C-O 3.57Å; Y147-L169 WeakPolarHBondContact CA-O 3.44Å; F148-L169 HydrophobicContact CB-CB 4.17Å; F148-L169 HydrophobicContact CD2-CD2 4.03Å; F148-L169 HydrophobicContact CD2-CG 4.41Å; F148-L169 PolarHBondContact N-O 3.43Å; F148-L169 PolarHBondContact O-N 3.49Å; V150-L169 HydrophobicContact CG1-CB 3.81Å; V150-L169 HydrophobicContact CG2-CB 4.36Å; L169-V176 HydrophobicContact CD1-CB 3.97Å; L169-L178 HydrophobicContact CB-CD1 4.26Å; L169-L178 HydrophobicContact CD1-CB 4.48Å; L169-L178 HydrophobicContact CD1-CD1 4.19Å; L169-L200 HydrophobicContact CD2-CD1 4.41Å; L169-I208 HydrophobicContact CD1-CD1 3.23Å; L169-I208 HydrophobicContact CD2-CD1 4.28Å; L169-I208 HydrophobicContact CG-CD1 4.39Å; L169-I213 HydrophobicContact CD1-CD1 4.28Å; L169-I213 HydrophobicContact CD2-CD1 3.77Å; L169-I213 HydrophobicContact CG-CD1 4.47Å
170	V	87.4	Confident	83.2	Confident	22 Å²	22	63.3 Å²	63.3	13%	0.133	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	113.7	173.7	-174.4	0	0	0	0	108.8	V145 Y147 V176 V177 K179 F224	V145-V170 HydrophobicContact CG1-CG1 3.85Å; Y147-V170 HydrophobicContact CD1-CB 4.33Å; Y147-V170 HydrophobicContact CD1-CG1 4.06Å; Y147-V170 HydrophobicContact CD1-CG2 3.96Å; Y147-V170 HydrophobicContact CE1-CB 4.35Å; Y147-V170 HydrophobicContact CE1-CG1 3.66Å; Y147-V170 HydrophobicContact CE1-CG2 4.07Å; V170-V176 CarbonylContact O-C 3.49Å; V170-V176 WeakPolarHBondContact O-CA 3.29Å; V170-V177 PolarHBondContact N-O 3.42Å; V170-V177 PolarHBondContact O-N 3.05Å; V170-K179 HydrophobicContact CG2-CD 4.27Å; V170-F224 HydrophobicContact CG2-CE2 3.75Å; V170-F224 HydrophobicContact CG2-CZ 3.87Å
171	A	83.6	Confident	83.7	Confident	6 Å²	6	58.3 Å²	58.3	5%	0.05	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.3	179.6	0	0	0	0	0	110.9	V145 R146 F148 V176 L197	V145-A171 CarbonylContact C-O 3.56Å; V145-A171 VanDerWaalsContact CA-O 3.29Å; V145-A171 WeakPolarHBondContact CA-O 3.22Å; V145-A171 WeakPolarHBondContact CG1-O 3.35Å; R146-A171 PolarHBondContact N-O 3.48Å; R146-A171 PolarHBondContact O-N 3.02Å; F148-A171 HydrophobicContact CE2-CB 4.26Å; A171-V176 HydrophobicContact CB-CG1 4.05Å; A171-L197 HydrophobicContact CB-CD1 4.37Å
172	R	82.9	Confident	83.7	Confident	144 Å²	144	59 Å²	59	54%	0.543	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	105.6	176.2	-174.5	172.1	-168.6	-176.4	8.2	109.7	V145 R174 T175	V145-R172 HydrophobicContact CG2-CB 4.08Å; V145-R172 HydrophobicContact CG2-CG 3.85Å; R172-R174 PolarHBondContact O-N 3.27Å; R172-T175 PolarHBondContact N-O 3.25Å; R172-T175 PolarHBondContact O-N 3.03Å; R172-T175 PolarHBondContact O-OG1 3.03Å
173	G	80.3	Confident	83.2	Confident	39 Å²	39	48.7 Å²	48.7	40%	0.402	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	-108.9	-179.1	0	0	0	0	0	112.6	L197	G173-L197 WeakPolarHBondContact O-CD1 3.14Å
174	R	80.9	Confident	83	Confident	172 Å²	172	50.1 Å²	50.1	65%	0.649	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	5.5	178	-61.4	-175.1	-179.3	175.5	-0.3	113.7	R172 G191 Y192 V194	R172-R174 PolarHBondContact O-N 3.27Å; R174-G191 PolarHBondContact O-N 3.1Å; R174-Y192 WeakPolarHBondContact CG-O 3.3Å; R174-Y192 PolarHBondContact O-N 2.96Å; R174-V194 HydrophobicContact CG-CG2 3.68Å
175	T	83.2	Confident	83.2	Confident	65 Å²	65	48.9 Å²	48.9	40%	0.399	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.6	-177.1	62	0	0	0	0	110.3	R172 G189	R172-T175 PolarHBondContact N-O 3.25Å; R172-T175 PolarHBondContact O-N 3.03Å; R172-T175 PolarHBondContact O-OG1 3.03Å; T175-G189 WeakPolarHBondContact CA-O 3.46Å
176	V	87.9	Confident	83.2	Confident	1 Å²	1	49 Å²	49	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139	176.5	-62.7	0	0	0	0	110	L169 V170 A171 K188 G189 Y192 L197 I208	L169-V176 HydrophobicContact CD1-CB 3.97Å; V170-V176 CarbonylContact O-C 3.49Å; V170-V176 WeakPolarHBondContact O-CA 3.29Å; A171-V176 HydrophobicContact CB-CG1 4.05Å; V176-K188 WeakPolarHBondContact O-CA 3.31Å; V176-G189 PolarHBondContact N-O 2.91Å; V176-G189 PolarHBondContact O-N 3.16Å; V176-Y192 HydrophobicContact CG1-CD2 4.27Å; V176-Y192 HydrophobicContact CG2-CD2 3.77Å; V176-Y192 HydrophobicContact CG2-CE2 3.34Å; V176-L197 HydrophobicContact CG1-CD1 3.67Å; V176-L197 HydrophobicContact CG1-CD2 3.65Å; V176-L197 HydrophobicContact CG1-CG 4.33Å; V176-I208 HydrophobicContact CB-CD1 4.31Å; V176-I208 HydrophobicContact CG2-CD1 3.76Å; V176-I208 HydrophobicContact CG2-CG1 4.03Å; V176-I208 HydrophobicContact CG2-CG2 3.94Å
177	V	87.7	Confident	83	Confident	35 Å²	35	45 Å²	45	21%	0.212	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.9	174.5	-178.2	0	0	0	0	107.6	V170 K179 D185 K188	V170-V177 PolarHBondContact N-O 3.42Å; V170-V177 PolarHBondContact O-N 3.05Å; V177-K179 HydrophobicContact CG1-CG 4.23Å; V177-D185 HydrophobicContact CG1-CB 4.28Å; V177-K188 HydrophobicContact CG1-CG 4.21Å; V177-K188 HydrophobicContact CG2-CD 4.44Å; V177-K188 HydrophobicContact CG2-CG 4.2Å
178	L	87.2	Confident	82.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.1	175.4	-173.8	71.3	0	0	0	108.7	V150 W152 A167 L169 D185 I186 G187 I208 I213	V150-L178 HydrophobicContact CG2-CD1 3.4Å; W152-L178 HydrophobicContact CB-CD2 4.29Å; W152-L178 HydrophobicContact CG-CD2 4.48Å; A167-L178 HydrophobicContact CB-CD1 3.82Å; A167-L178 HydrophobicContact CB-CG 4.16Å; L169-L178 HydrophobicContact CB-CD1 4.26Å; L169-L178 HydrophobicContact CD1-CB 4.48Å; L169-L178 HydrophobicContact CD1-CD1 4.19Å; L178-D185 CarbonylContact O-C 3.58Å; L178-D185 WeakPolarHBondContact O-CA 3.49Å; L178-I186 HydrophobicContact CB-CG1 4.16Å; L178-I186 HydrophobicContact CD2-CD1 3.54Å; L178-I186 HydrophobicContact CD2-CG1 3.79Å; L178-I186 HydrophobicContact CG-CD1 3.76Å; L178-I186 HydrophobicContact CG-CG1 3.71Å; L178-I186 VanDerWaalsContact O-CG1 3.27Å; L178-I186 WeakPolarHBondContact O-CG1 3.45Å; L178-I186 PolarHBondContact O-N 3.4Å; L178-G187 PolarHBondContact N-O 2.83Å; L178-G187 PolarHBondContact O-N 3.09Å; L178-I208 HydrophobicContact CB-CG2 4.43Å; L178-I213 HydrophobicContact CD1-CG2 4.08Å; L178-I213 HydrophobicContact CD2-CG2 3.66Å
179	K	84.4	Confident	82.7	Confident	59 Å²	59	51.9 Å²	51.9	26%	0.257	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.6	178.3	-62.8	-170.2	174	-168.9	0	110.1	A167 V168 V170 V177 K184 D185 F230	A167-K179 CarbonylContact C-O 3.5Å; A167-K179 VanDerWaalsContact CA-O 3.24Å; A167-K179 WeakPolarHBondContact CA-O 3.39Å; A167-K179 WeakPolarHBondContact CB-O 3.17Å; V168-K179 PolarHBondContact N-O 3.2Å; V168-K179 PolarHBondContact O-N 2.86Å; V170-K179 HydrophobicContact CG2-CD 4.27Å; V177-K179 HydrophobicContact CG1-CG 4.23Å; K179-K184 CarbonylContact C-O 3.58Å; K179-K184 VanDerWaalsContact CA-O 3.25Å; K179-K184 WeakPolarHBondContact CA-O 3.3Å; K179-D185 WeakPolarHBondContact CE-OD1 3.41Å; K179-F230 HydrophobicContact CB-CE1 4.44Å
180	D	85.3	Confident	82.3	Confident	28 Å²	28	56.7 Å²	56.7	15%	0.15	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	176.2	171.4	62.9	17.7	0	0	0	111.8	E182 G183 K184 I186	D180-E182 PolarHBondContact O-N 3.33Å; D180-E182 VanDerWaalsContact O-N 3.17Å; D180-E182 VanDerWaalsContact OD1-C 3.24Å; D180-E182 VanDerWaalsContact OD1-CA 3.32Å; D180-E182 WeakPolarHBondContact OD1-CA 3.47Å; D180-E182 WeakPolarHBondContact OD1-CB 3.13Å; D180-E182 PolarHBondContact OD1-N 2.89Å; D180-G183 WeakPolarHBondContact O-CA 3.29Å; D180-G183 PolarHBondContact O-N 3.32Å; D180-G183 PolarHBondContact OD1-N 3.37Å; D180-K184 PolarHBondContact N-O 2.83Å; D180-K184 WeakPolarHBondContact OD1-CA 3.39Å; D180-K184 VanDerWaalsContact OD1-CB 3.31Å; D180-K184 WeakPolarHBondContact OD1-CB 3.48Å; D180-K184 PolarHBondContact OD1-N 3.01Å; D180-K184 WeakPolarHBondContact OD2-CB 3.23Å; D180-I186 HydrophobicContact CB-CD1 4.12Å; D180-I186 HydrophobicContact CB-CG1 4.41Å; D180-I186 HydrophobicContact CB-CG2 3.84Å; D180-I186 WeakPolarHBondContact OD2-CG2 3.26Å
181	M	79.7	Confident	81.6	Confident	57 Å²	57	58.8 Å²	58.8	28%	0.281	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.5	175.2	-63.5	-57.4	-70.5	0	0	113.6	D166 G183 C229	D166-M181 HydrophobicContact CB-CG 3.83Å; D166-M181 HydrophobicContact CB-SD 4.05Å; M181-G183 VanDerWaalsContact C-N 3.31Å; M181-C229 VanDerWaalsContact CE-O 3.28Å; M181-C229 WeakPolarHBondContact CE-O 3.33Å
182	E	72.3	Confident	81.4	Confident	83 Å²	83	60.4 Å²	60.4	39%	0.388	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	6.4	171	-56.3	-174	-175.6	0	0	112.6	D180 K184 T514 A515	D180-E182 PolarHBondContact O-N 3.33Å; D180-E182 VanDerWaalsContact O-N 3.17Å; D180-E182 VanDerWaalsContact OD1-C 3.24Å; D180-E182 VanDerWaalsContact OD1-CA 3.32Å; D180-E182 WeakPolarHBondContact OD1-CA 3.47Å; D180-E182 WeakPolarHBondContact OD1-CB 3.13Å; D180-E182 PolarHBondContact OD1-N 2.89Å; E182-K184 VanDerWaalsContact C-N 3.26Å; E182-K184 PolarHBondContact O-N 2.95Å; E182-T514 PolarHBondContact OE2-OG1 3.21Å; E182-A515 HydrophobicContact CB-CB 4.19Å; E182-A515 HydrophobicContact CG-CB 4.45Å
183	G	69	Low	81.1	Confident	10 Å²	10	60.4 Å²	60.4	10%	0.103	33%	0.327	C	S	.	.			trans	72.7	10.5	-179.4	0	0	0	0	0	114.7	D180 M181	D180-G183 WeakPolarHBondContact O-CA 3.29Å; D180-G183 PolarHBondContact O-N 3.32Å; D180-G183 PolarHBondContact OD1-N 3.37Å; M181-G183 VanDerWaalsContact C-N 3.31Å
184	K	78.7	Confident	80.7	Confident	113 Å²	113	62.2 Å²	62.2	49%	0.491	33%	0.331	S	S	.	.			trans	-80.2	133.6	177	-171.7	175	178.4	-179.3	0	111	K179 D180 E182 I186	K179-K184 CarbonylContact C-O 3.58Å; K179-K184 VanDerWaalsContact CA-O 3.25Å; K179-K184 WeakPolarHBondContact CA-O 3.3Å; D180-K184 PolarHBondContact N-O 2.83Å; D180-K184 WeakPolarHBondContact OD1-CA 3.39Å; D180-K184 VanDerWaalsContact OD1-CB 3.31Å; D180-K184 WeakPolarHBondContact OD1-CB 3.48Å; D180-K184 PolarHBondContact OD1-N 3.01Å; D180-K184 WeakPolarHBondContact OD2-CB 3.23Å; E182-K184 VanDerWaalsContact C-N 3.26Å; E182-K184 PolarHBondContact O-N 2.95Å; K184-I186 PolarHBondContact O-N 3.42Å
185	D	84.8	Confident	80.1	Confident	69 Å²	69	58 Å²	58	37%	0.369	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	106.6	168.6	-64.9	-3	0	0	0	109.8	V177 L178 K179 K188	V177-D185 HydrophobicContact CG1-CB 4.28Å; L178-D185 CarbonylContact O-C 3.58Å; L178-D185 WeakPolarHBondContact O-CA 3.49Å; K179-D185 WeakPolarHBondContact CE-OD1 3.41Å; D185-K188 WeakPolarHBondContact OD2-CE 3.25Å; D185-K188 IonicContact OD2-NZ 3.55Å; D185-K188 PolarHBondContact OD2-NZ 3.39Å
186	I	85.4	Confident	79.6	Confident	28 Å²	28	59 Å²	59	14%	0.144	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-10.2	-179.5	54.8	160	0	0	0	112.6	W152 A167 L178 D180 K184 K211	W152-I186 HydrophobicContact CD2-CD1 3.98Å; W152-I186 HydrophobicContact CG-CD1 4.06Å; W152-I186 HydrophobicContact CZ2-CD1 4.24Å; A167-I186 HydrophobicContact CB-CD1 4.07Å; L178-I186 HydrophobicContact CB-CG1 4.16Å; L178-I186 HydrophobicContact CD2-CD1 3.54Å; L178-I186 HydrophobicContact CD2-CG1 3.79Å; L178-I186 HydrophobicContact CG-CD1 3.76Å; L178-I186 HydrophobicContact CG-CG1 3.71Å; L178-I186 VanDerWaalsContact O-CG1 3.27Å; L178-I186 WeakPolarHBondContact O-CG1 3.45Å; L178-I186 PolarHBondContact O-N 3.4Å; D180-I186 HydrophobicContact CB-CD1 4.12Å; D180-I186 HydrophobicContact CB-CG1 4.41Å; D180-I186 HydrophobicContact CB-CG2 3.84Å; D180-I186 WeakPolarHBondContact OD2-CG2 3.26Å; K184-I186 PolarHBondContact O-N 3.42Å; I186-K211 WeakPolarHBondContact O-CE 3.28Å; I186-K211 PolarHBondContact O-NZ 3.24Å
187	G	81.3	Confident	79	Confident	10 Å²	10	59.3 Å²	59.3	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	146.5	173.4	0	0	0	0	0	111.5	L178	L178-G187 PolarHBondContact N-O 2.83Å; L178-G187 PolarHBondContact O-N 3.09Å
188	K	85.5	Confident	78.1	Confident	131 Å²	131	59.3 Å²	59.3	57%	0.57	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.8	171.5	-64	-171.8	179.9	-177.3	0	108.9	V176 V177 D185	V176-K188 WeakPolarHBondContact O-CA 3.31Å; V177-K188 HydrophobicContact CG1-CG 4.21Å; V177-K188 HydrophobicContact CG2-CD 4.44Å; V177-K188 HydrophobicContact CG2-CG 4.2Å; D185-K188 WeakPolarHBondContact OD2-CE 3.25Å; D185-K188 IonicContact OD2-NZ 3.55Å; D185-K188 PolarHBondContact OD2-NZ 3.39Å
189	G	81.4	Confident	77.3	Confident	18 Å²	18	62.7 Å²	62.7	19%	0.186	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	149.7	174.3	0	0	0	0	0	111.4	T175 V176	T175-G189 WeakPolarHBondContact CA-O 3.46Å; V176-G189 PolarHBondContact N-O 2.91Å; V176-G189 PolarHBondContact O-N 3.16Å
190	S	79.6	Confident	77.1	Confident	100 Å²	100	60.3 Å²	60.3	70%	0.699	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	150.5	178.6	56.5	0	0	0	0	109.9
191	G	71.9	Confident	76.6	Confident	66 Å²	66	61.9 Å²	61.9	68%	0.68	36%	0.36	S	S	*	.			trans	100.6	11	175.8	0	0	0	0	0	114.9	R174	R174-G191 PolarHBondContact O-N 3.1Å
192	Y	80.2	Confident	76.7	Confident	41 Å²	41	66 Å²	66	16%	0.161	38%	0.379	C	S	.	.			trans	-72.1	146.2	173.4	-60.6	-89.9	0	0	0	110.8	R174 V176 V194 L197 L206 M207	R174-Y192 WeakPolarHBondContact CG-O 3.3Å; R174-Y192 PolarHBondContact O-N 2.96Å; V176-Y192 HydrophobicContact CG1-CD2 4.27Å; V176-Y192 HydrophobicContact CG2-CD2 3.77Å; V176-Y192 HydrophobicContact CG2-CE2 3.34Å; Y192-V194 PolarHBondContact O-N 2.79Å; Y192-L197 HydrophobicContact CG-CD2 4.43Å; Y192-L206 HydrophobicContact CD1-CD2 4.43Å; Y192-L206 HydrophobicContact CE1-CD2 4.38Å; Y192-M207 PolarHBondContact OH-O 3.1Å
193	K	76.4	Confident	76.9	Confident	143 Å²	143	64 Å²	64	62%	0.622	38%	0.38	S	S	*	.			trans	-70.1	129.5	174.9	-69.4	179.1	-179.7	175.9	0	109	S195 E196 L197	K193-S195 PolarHBondContact O-N 3.43Å; K193-E196 HydrophobicContact CB-CB 4.04Å; K193-E196 WeakPolarHBondContact O-CB 3.33Å; K193-E196 PolarHBondContact O-N 2.89Å; K193-L197 PolarHBondContact O-N 3.22Å; K193-L197 VanDerWaalsContact O-N 3.15Å
194	V	72.6	Confident	77.5	Confident	78 Å²	78	66.8 Å²	66.8	47%	0.473	39%	0.39	S	S	.	.	H	α-helix	trans	-57.4	-35.2	179.1	-176.5	0	0	0	0	111.1	R174 Y192 E196 A198	R174-V194 HydrophobicContact CG-CG2 3.68Å; Y192-V194 PolarHBondContact O-N 2.79Å; V194-E196 VanDerWaalsContact C-N 3.34Å; V194-E196 PolarHBondContact O-N 3.34Å; V194-A198 WeakPolarHBondContact O-CB 3.42Å; V194-A198 PolarHBondContact O-N 2.99Å
195	S	67.1	Low	77.8	Confident	84 Å²	84	64.8 Å²	64.8	59%	0.587	39%	0.388	S	S	*	.	H	α-helix	trans	-65	-34	176.2	55.8	0	0	0	0	113.8	K193 A198 S199	K193-S195 PolarHBondContact O-N 3.43Å; S195-A198 PolarHBondContact O-N 3.38Å; S195-S199 PolarHBondContact O-N 3.44Å; S195-S199 PolarHBondContact O-OG 3.49Å
196	E	73.1	Confident	77.8	Confident	84 Å²	84	62.2 Å²	62.2	39%	0.393	37%	0.374	S	S	.	.	H	α-helix	trans	-76.3	-44.6	-178.6	-174.3	179.3	179.5	0	0	110.4	K193 V194 A198 S199 L200	K193-E196 HydrophobicContact CB-CB 4.04Å; K193-E196 WeakPolarHBondContact O-CB 3.33Å; K193-E196 PolarHBondContact O-N 2.89Å; V194-E196 VanDerWaalsContact C-N 3.34Å; V194-E196 PolarHBondContact O-N 3.34Å; E196-A198 PolarHBondContact O-N 3.39Å; E196-S199 PolarHBondContact O-N 2.88Å; E196-S199 PolarHBondContact O-OG 3.16Å; E196-S199 VanDerWaalsContact O-OG 3.12Å; E196-L200 PolarHBondContact O-N 3.48Å
197	L	75.4	Confident	77.6	Confident	8 Å²	8	65 Å²	65	4%	0.042	39%	0.387	C	S	.	.	H	α-helix	trans	-64.9	-24.7	170.7	-63	177.7	0	0	0	112.3	A171 G173 V176 Y192 K193 L200 L206	A171-L197 HydrophobicContact CB-CD1 4.37Å; G173-L197 WeakPolarHBondContact O-CD1 3.14Å; V176-L197 HydrophobicContact CG1-CD1 3.67Å; V176-L197 HydrophobicContact CG1-CD2 3.65Å; V176-L197 HydrophobicContact CG1-CG 4.33Å; Y192-L197 HydrophobicContact CG-CD2 4.43Å; K193-L197 PolarHBondContact O-N 3.22Å; K193-L197 VanDerWaalsContact O-N 3.15Å; L197-L200 HydrophobicContact CB-CD1 4.47Å; L197-L200 HydrophobicContact CD2-CD1 3.86Å; L197-L206 HydrophobicContact CD2-CD1 4.38Å
198	A	68.1	Low	77.7	Confident	35 Å²	35	64.6 Å²	64.6	29%	0.289	38%	0.383	S	S	.	.	H	α-helix	trans	-79.8	-21.7	178.3	0	0	0	0	0	114.1	R146 V194 S195 E196	R146-A198 VanDerWaalsContact CZ-CA 3.44Å; R146-A198 VanDerWaalsContact NH1-C 3.3Å; R146-A198 PolarHBondContact NH1-O 3.11Å; V194-A198 WeakPolarHBondContact O-CB 3.42Å; V194-A198 PolarHBondContact O-N 2.99Å; S195-A198 PolarHBondContact O-N 3.38Å; E196-A198 PolarHBondContact O-N 3.39Å
199	S	72.1	Confident	77.1	Confident	72 Å²	72	60.9 Å²	60.9	50%	0.503	38%	0.382	S	S	.	.	H	α-helix	trans	-100.1	-1	-179.5	58.7	0	0	0	0	113.9	S195 E196 S201	S195-S199 PolarHBondContact O-N 3.44Å; S195-S199 PolarHBondContact O-OG 3.49Å; E196-S199 PolarHBondContact O-N 2.88Å; E196-S199 PolarHBondContact O-OG 3.16Å; E196-S199 VanDerWaalsContact O-OG 3.12Å; S199-S201 PolarHBondContact O-N 3.06Å; S199-S201 VanDerWaalsContact O-N 3.15Å
200	L	78.6	Confident	76.9	Confident	9 Å²	9	62.6 Å²	62.6	5%	0.047	40%	0.4	C	S	.	.			trans	-54.2	118.5	-176.8	-78.3	167.1	0	0	0	112.1	F148 L169 E196 L197 E204 L206 V215	F148-L200 HydrophobicContact CD1-CB 4.31Å; F148-L200 HydrophobicContact CD2-CD1 4.39Å; F148-L200 HydrophobicContact CE1-CB 3.65Å; F148-L200 HydrophobicContact CE1-CD1 4.45Å; F148-L200 HydrophobicContact CE2-CD1 3.93Å; F148-L200 HydrophobicContact CZ-CB 3.78Å; F148-L200 HydrophobicContact CZ-CD1 3.95Å; L169-L200 HydrophobicContact CD2-CD1 4.41Å; E196-L200 PolarHBondContact O-N 3.48Å; L197-L200 HydrophobicContact CB-CD1 4.47Å; L197-L200 HydrophobicContact CD2-CD1 3.86Å; L200-E204 WeakPolarHBondContact CA-OE2 3.38Å; L200-E204 HydrophobicContact CD2-CB 4.16Å; L200-E204 WeakPolarHBondContact CD2-OE2 3.47Å; L200-L206 HydrophobicContact CD1-CD1 3.61Å; L200-L206 HydrophobicContact CD2-CD1 3.31Å; L200-L206 HydrophobicContact CD2-CG 4.01Å; L200-L206 HydrophobicContact CG-CD1 4.04Å; L200-V215 HydrophobicContact CD2-CG2 4.2Å
201	S	76.1	Confident	77.2	Confident	61 Å²	61	59.8 Å²	59.8	43%	0.427	38%	0.375	S	S	.	.			trans	-121.5	165.1	179	66.3	0	0	0	0	111.9	S199 G203 E204	S199-S201 PolarHBondContact O-N 3.06Å; S199-S201 VanDerWaalsContact O-N 3.15Å; S201-G203 PolarHBondContact O-N 2.96Å; S201-E204 PolarHBondContact N-OE1 3.44Å; S201-E204 WeakPolarHBondContact O-CB 3.45Å; S201-E204 PolarHBondContact O-N 2.92Å; S201-E204 VanDerWaalsContact O-N 3.16Å; S201-E204 PolarHBondContact OG-OE1 2.95Å
202	E	81.5	Confident	77.9	Confident	144 Å²	144	58 Å²	58	67%	0.673	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	131.6	-179.2	-64.7	-179.2	-179.7	0	0	111.3	V215 M216	E202-V215 CarbonylContact C-O 3.57Å; E202-V215 WeakPolarHBondContact CA-O 3.41Å; E202-M216 WeakPolarHBondContact CG-O 3.39Å
203	G	75.9	Confident	78.3	Confident	41 Å²	41	56.1 Å²	56.1	42%	0.423	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-5.5	-176.7	0	0	0	0	0	115.3	S201 V215	S201-G203 PolarHBondContact O-N 2.96Å; G203-V215 PolarHBondContact N-O 2.81Å
204	E	82.4	Confident	78.9	Confident	67 Å²	67	51.7 Å²	51.7	31%	0.313	32%	0.323	S	S	.	.			trans	-75.8	138.8	175.6	-74.2	-179.7	-151.3	0	0	112.2	L200 S201 E214 V215	L200-E204 WeakPolarHBondContact CA-OE2 3.38Å; L200-E204 HydrophobicContact CD2-CB 4.16Å; L200-E204 WeakPolarHBondContact CD2-OE2 3.47Å; S201-E204 PolarHBondContact N-OE1 3.44Å; S201-E204 WeakPolarHBondContact O-CB 3.45Å; S201-E204 PolarHBondContact O-N 2.92Å; S201-E204 VanDerWaalsContact O-N 3.16Å; S201-E204 PolarHBondContact OG-OE1 2.95Å; E204-E214 WeakPolarHBondContact O-CA 3.31Å; E204-V215 PolarHBondContact O-N 2.68Å
205	T	83.6	Confident	79.6	Confident	72 Å²	72	48 Å²	48	44%	0.442	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.3	-179.5	59.9	0	0	0	0	112.8	I213 E214	T205-I213 CarbonylContact C-O 3.54Å; T205-I213 WeakPolarHBondContact CA-O 3.39Å; T205-I213 WeakPolarHBondContact CB-O 3.33Å; T205-E214 HydrophobicContact CG2-CB 4.03Å; T205-E214 HydrophobicContact CG2-CG 4.12Å
206	L	85.2	Confident	80.5	Confident	15 Å²	15	48 Å²	48	8%	0.079	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	152.7	178.3	-83.7	163.5	0	0	0	111.2	Y192 L197 L200 I213	Y192-L206 HydrophobicContact CD1-CD2 4.43Å; Y192-L206 HydrophobicContact CE1-CD2 4.38Å; L197-L206 HydrophobicContact CD2-CD1 4.38Å; L200-L206 HydrophobicContact CD1-CD1 3.61Å; L200-L206 HydrophobicContact CD2-CD1 3.31Å; L200-L206 HydrophobicContact CD2-CG 4.01Å; L200-L206 HydrophobicContact CG-CD1 4.04Å; L206-I213 HydrophobicContact CB-CD1 3.92Å; L206-I213 HydrophobicContact CB-CG1 3.67Å; L206-I213 HydrophobicContact CD1-CD1 4.45Å; L206-I213 PolarHBondContact N-O 2.92Å; L206-I213 VanDerWaalsContact O-CG1 3.23Å; L206-I213 WeakPolarHBondContact O-CG1 3.33Å; L206-I213 PolarHBondContact O-N 2.75Å
207	M	81.6	Confident	81	Confident	86 Å²	86	44.6 Å²	44.6	42%	0.424	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.5	173.3	-71.8	-60.5	-54.9	0	0	110	A155 Y192 K211 E212	A155-M207 HydrophobicContact CB-CE 3.68Å; Y192-M207 PolarHBondContact OH-O 3.1Å; M207-K211 CarbonylContact C-O 3.57Å; M207-K211 WeakPolarHBondContact CA-O 3.24Å; M207-E212 HydrophobicContact CE-CB 4.4Å; M207-E212 VanDerWaalsContact SD-CA 3.6Å; M207-E212 HydrophobicContact SD-CB 3.47Å; M207-E212 WeakPolarHBondContact SD-CB 3.41Å; M207-E212 HydrophobicContact SD-CG 3.6Å
208	I	83.1	Confident	81.3	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	117.6	-178.8	-55.5	178.2	0	0	0	109.4	L169 V176 L178 G210 K211 I213	L169-I208 HydrophobicContact CD1-CD1 3.23Å; L169-I208 HydrophobicContact CD2-CD1 4.28Å; L169-I208 HydrophobicContact CG-CD1 4.39Å; V176-I208 HydrophobicContact CB-CD1 4.31Å; V176-I208 HydrophobicContact CG2-CD1 3.76Å; V176-I208 HydrophobicContact CG2-CG1 4.03Å; V176-I208 HydrophobicContact CG2-CG2 3.94Å; L178-I208 HydrophobicContact CB-CG2 4.43Å; I208-G210 VanDerWaalsContact C-N 3.28Å; I208-G210 PolarHBondContact O-N 3.5Å; I208-K211 PolarHBondContact N-O 2.76Å; I208-K211 WeakPolarHBondContact O-CB 3.48Å; I208-K211 PolarHBondContact O-N 3.2Å; I208-I213 HydrophobicContact CD1-CD1 3.54Å; I208-I213 HydrophobicContact CD1-CG1 4.19Å; I208-I213 HydrophobicContact CG1-CD1 4.37Å
209	G	73.3	Confident	82	Confident	54 Å²	54	48 Å²	48	56%	0.557	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	36.5	174.3	0	0	0	0	0	114.8	K211	G209-K211 VanDerWaalsContact C-N 3.31Å; G209-K211 PolarHBondContact O-N 2.87Å
210	G	78.3	Confident	82.5	Confident	54 Å²	54	46.8 Å²	46.8	56%	0.557	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	7.7	-178.1	0	0	0	0	0	115.1	A155 I208	A155-G210 PolarHBondContact N-O 3.28Å; I208-G210 VanDerWaalsContact C-N 3.28Å; I208-G210 PolarHBondContact O-N 3.5Å
211	K	85.3	Confident	82.4	Confident	40 Å²	40	47.8 Å²	47.8	17%	0.174	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144.3	174.8	-65.6	169.6	176.4	-177.3	0	109.9	W152 C153 I186 M207 I208 G209	W152-K211 HydrophobicContact CD2-CD 4.31Å; W152-K211 HydrophobicContact CE3-CB 4.21Å; W152-K211 HydrophobicContact CE3-CD 3.52Å; W152-K211 HydrophobicContact CE3-CG 3.86Å; W152-K211 HydrophobicContact CH2-CD 4.45Å; W152-K211 HydrophobicContact CZ3-CD 3.62Å; W152-K211 VanDerWaalsContact CZ3-CE 3.44Å; W152-K211 HydrophobicContact CZ3-CG 4.02Å; C153-K211 WeakPolarHBondContact O-CA 3.34Å; I186-K211 WeakPolarHBondContact O-CE 3.28Å; I186-K211 PolarHBondContact O-NZ 3.24Å; M207-K211 CarbonylContact C-O 3.57Å; M207-K211 WeakPolarHBondContact CA-O 3.24Å; I208-K211 PolarHBondContact N-O 2.76Å; I208-K211 WeakPolarHBondContact O-CB 3.48Å; I208-K211 PolarHBondContact O-N 3.2Å; G209-K211 VanDerWaalsContact C-N 3.31Å; G209-K211 PolarHBondContact O-N 2.87Å
212	E	86.8	Confident	82.4	Confident	30 Å²	30	50.8 Å²	50.8	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.8	173.7	-166.3	164.8	-166.7	0	0	108.1	W152 C153 K161 M207	W152-E212 CarbonylContact C-O 3.57Å; W152-E212 WeakPolarHBondContact CA-O 3.44Å; C153-E212 PolarHBondContact N-O 2.92Å; C153-E212 PolarHBondContact O-N 3.21Å; K161-E212 VanDerWaalsContact CE-CD 3.43Å; K161-E212 WeakPolarHBondContact CE-OE1 3.5Å; K161-E212 WeakPolarHBondContact CE-OE2 3.48Å; K161-E212 IonicContact NZ-OE1 3.4Å; K161-E212 PolarHBondContact NZ-OE1 3.37Å; K161-E212 IonicContact NZ-OE2 3.57Å; K161-E212 PolarHBondContact NZ-OE2 3.41Å; M207-E212 HydrophobicContact CE-CB 4.4Å; M207-E212 VanDerWaalsContact SD-CA 3.6Å; M207-E212 HydrophobicContact SD-CB 3.47Å; M207-E212 WeakPolarHBondContact SD-CB 3.41Å; M207-E212 HydrophobicContact SD-CG 3.6Å
213	I	88.6	Confident	82.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	151.2	-179	64.7	155.2	0	0	0	109.9	V150 V151 W152 L169 L178 T205 L206 I208	V150-I213 HydrophobicContact CB-CB 4.36Å; V150-I213 HydrophobicContact CB-CD1 4.37Å; V150-I213 HydrophobicContact CG1-CD1 4.1Å; V150-I213 HydrophobicContact CG2-CB 4.25Å; V150-I213 HydrophobicContact CG2-CD1 4.33Å; V150-I213 HydrophobicContact CG2-CG2 4.39Å; V151-I213 CarbonylContact O-C 3.58Å; V151-I213 WeakPolarHBondContact O-CA 3.5Å; W152-I213 HydrophobicContact CB-CG2 3.78Å; L169-I213 HydrophobicContact CD1-CD1 4.28Å; L169-I213 HydrophobicContact CD2-CD1 3.77Å; L169-I213 HydrophobicContact CG-CD1 4.47Å; L178-I213 HydrophobicContact CD1-CG2 4.08Å; L178-I213 HydrophobicContact CD2-CG2 3.66Å; T205-I213 CarbonylContact C-O 3.54Å; T205-I213 WeakPolarHBondContact CA-O 3.39Å; T205-I213 WeakPolarHBondContact CB-O 3.33Å; L206-I213 HydrophobicContact CB-CD1 3.92Å; L206-I213 HydrophobicContact CB-CG1 3.67Å; L206-I213 HydrophobicContact CD1-CD1 4.45Å; L206-I213 PolarHBondContact N-O 2.92Å; L206-I213 VanDerWaalsContact O-CG1 3.23Å; L206-I213 WeakPolarHBondContact O-CG1 3.33Å; L206-I213 PolarHBondContact O-N 2.75Å; I208-I213 HydrophobicContact CD1-CD1 3.54Å; I208-I213 HydrophobicContact CD1-CG1 4.19Å; I208-I213 HydrophobicContact CG1-CD1 4.37Å
214	E	87.9	Confident	82.6	Confident	51 Å²	51	45.3 Å²	45.3	24%	0.238	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129	169.3	-175.7	179.6	161	0	0	109	V150 V151 W163 E204 T205 M216	V150-E214 CarbonylContact C-O 3.32Å; V150-E214 WeakPolarHBondContact CA-O 3.25Å; V150-E214 WeakPolarHBondContact CB-O 3.37Å; V151-E214 HydrophobicContact CG2-CB 3.77Å; V151-E214 PolarHBondContact N-O 3.5Å; V151-E214 PolarHBondContact O-N 2.75Å; W163-E214 HydrophobicContact CH2-CB 3.52Å; W163-E214 HydrophobicContact CZ2-CB 3.86Å; W163-E214 WeakPolarHBondContact CZ2-OE2 3.45Å; W163-E214 HydrophobicContact CZ3-CB 4.19Å; E204-E214 WeakPolarHBondContact O-CA 3.31Å; T205-E214 HydrophobicContact CG2-CB 4.03Å; T205-E214 HydrophobicContact CG2-CG 4.12Å; E214-M216 HydrophobicContact CG-CE 4.06Å; E214-M216 PolarHBondContact O-N 3.23Å
215	V	87.3	Confident	82.2	Confident	1 Å²	1	43 Å²	43	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.6	-179.1	179.3	0	0	0	0	109.9	F148 V150 L200 E202 G203 E204	F148-V215 HydrophobicContact CB-CG1 4.24Å; F148-V215 HydrophobicContact CD1-CG1 4.06Å; V150-V215 HydrophobicContact CG1-CG2 4.14Å; L200-V215 HydrophobicContact CD2-CG2 4.2Å; E202-V215 CarbonylContact C-O 3.57Å; E202-V215 WeakPolarHBondContact CA-O 3.41Å; G203-V215 PolarHBondContact N-O 2.81Å; E204-V215 PolarHBondContact O-N 2.68Å
216	M	85.5	Confident	81.9	Confident	84 Å²	84	42 Å²	42	41%	0.414	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-24.5	177.3	-61.5	-76.8	72.9	0	0	113.1	S149 V151 E202 E214	S149-M216 PolarHBondContact O-N 3.31Å; V151-M216 HydrophobicContact CG1-CG 3.92Å; V151-M216 HydrophobicContact CG1-SD 4.07Å; V151-M216 HydrophobicContact CG2-CG 4.31Å; V151-M216 HydrophobicContact CG2-SD 4.17Å; E202-M216 WeakPolarHBondContact CG-O 3.39Å; E214-M216 HydrophobicContact CG-CE 4.06Å; E214-M216 PolarHBondContact O-N 3.23Å
217	G	84.1	Confident	81.3	Confident	11 Å²	11	41.3 Å²	41.3	11%	0.113	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.1	166.4	-179.2	0	0	0	0	0	112.7	F148 S149	F148-G217 CarbonylContact C-O 3.6Å; F148-G217 WeakPolarHBondContact CA-O 3.44Å; S149-G217 PolarHBondContact N-O 2.75Å; S149-G217 PolarHBondContact O-N 3.05Å
218	I	83.1	Confident	81	Confident	96 Å²	96	41.9 Å²	41.9	49%	0.492	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.9	173.7	-58.2	173.8	0	0	0	108.3	F148	F148-I218 HydrophobicContact CD1-CG1 4.07Å; F148-I218 HydrophobicContact CE1-CG1 4.08Å
219	V	82.1	Confident	80.5	Confident	18 Å²	18	43.1 Å²	43.1	11%	0.109	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.5	171.9	175.6	0	0	0	0	107.4	Y147 D223 F224 C229	Y147-V219 PolarHBondContact O-N 2.79Å; V219-D223 HydrophobicContact CG1-CB 4.07Å; V219-F224 HydrophobicContact CG1-CB 4.14Å; V219-C229 HydrophobicContact CG1-CB 3.79Å; V219-C229 HydrophobicContact CG2-CB 4.29Å
220	S	82.9	Confident	80.4	Confident	48 Å²	48	41.6 Å²	41.6	34%	0.336	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-63.1	147.2	176.4	77.9	0	0	0	0	110	E222 D223 F224	S220-E222 PolarHBondContact O-N 3.36Å; S220-D223 PolarHBondContact O-N 3.27Å; S220-D223 VanDerWaalsContact O-N 3.09Å; S220-D223 WeakPolarHBondContact OG-CB 3.33Å; S220-D223 PolarHBondContact OG-N 3Å; S220-D223 PolarHBondContact OG-OD2 3.4Å; S220-F224 PolarHBondContact O-N 3.19Å
221	A	76.6	Confident	79.8	Confident	30 Å²	30	41.1 Å²	41.1	25%	0.248	21%	0.211	C	C	.	.	H	α-helix	trans	-56.8	-35	176	0	0	0	0	0	111.4	Y147 A225	Y147-A221 HydrophobicContact CD2-CB 4.16Å; Y147-A221 HydrophobicContact CE2-CB 3.89Å; A221-A225 WeakPolarHBondContact O-CB 3.5Å; A221-A225 PolarHBondContact O-N 2.74Å
222	E	76.3	Confident	78.2	Confident	124 Å²	124	48.7 Å²	48.7	58%	0.579	25%	0.247	S	C	*	.	H	α-helix	trans	-64.9	-43.3	174.3	-66.1	-171.1	-154.9	0	0	113.3	S220 F224 A225 K226	S220-E222 PolarHBondContact O-N 3.36Å; E222-F224 VanDerWaalsContact C-N 3.33Å; E222-A225 PolarHBondContact O-N 3.02Å; E222-K226 VanDerWaalsContact O-CB 3.28Å; E222-K226 WeakPolarHBondContact O-CB 3.2Å; E222-K226 WeakPolarHBondContact O-CD 3.27Å; E222-K226 WeakPolarHBondContact O-CG 3.44Å; E222-K226 PolarHBondContact O-N 3.04Å; E222-K226 IonicContact OE2-NZ 3.6Å; E222-K226 PolarHBondContact OE2-NZ 3.46Å
223	D	78.4	Confident	75.9	Confident	57 Å²	57	51 Å²	51	31%	0.305	26%	0.263	S	S	.	.	H	α-helix	trans	-70.1	-34.8	179.9	-69	-42.3	0	0	0	111.5	V219 S220 G227 R228	V219-D223 HydrophobicContact CG1-CB 4.07Å; S220-D223 PolarHBondContact O-N 3.27Å; S220-D223 VanDerWaalsContact O-N 3.09Å; S220-D223 WeakPolarHBondContact OG-CB 3.33Å; S220-D223 PolarHBondContact OG-N 3Å; S220-D223 PolarHBondContact OG-OD2 3.4Å; D223-G227 PolarHBondContact O-N 2.82Å; D223-R228 PolarHBondContact O-N 2.95Å; D223-R228 IonicContact OD1-NH1 3.36Å
224	F	82	Confident	73.1	Confident	13 Å²	13	60 Å²	60	6%	0.057	31%	0.305	C	S	.	.	H	α-helix	trans	-65.2	-44.1	170.6	-179.1	-91.6	0	0	0	111.5	Y147 V168 V170 V219 S220 E222 G227 F230 R543	Y147-F224 HydrophobicContact CD1-CB 3.77Å; Y147-F224 AromaticContact CD1-CD1 3.7Å; Y147-F224 HydrophobicContact CD1-CD1 3.7Å; Y147-F224 AromaticContact CD1-CD2 3.35Å; Y147-F224 HydrophobicContact CD1-CD2 3.35Å; Y147-F224 HydrophobicContact CD1-CE1 4.09Å; Y147-F224 AromaticContact CD1-CE2 3.76Å; Y147-F224 HydrophobicContact CD1-CE2 3.76Å; Y147-F224 AromaticContact CD1-CG 3.29Å; Y147-F224 HydrophobicContact CD1-CG 3.29Å; Y147-F224 HydrophobicContact CD1-CZ 4.11Å; Y147-F224 HydrophobicContact CD2-CB 3.83Å; Y147-F224 HydrophobicContact CD2-CG 4.2Å; Y147-F224 HydrophobicContact CE1-CB 4.02Å; Y147-F224 AromaticContact CE1-CD1 3.13Å; Y147-F224 HydrophobicContact CE1-CD1 3.13Å; Y147-F224 AromaticContact CE1-CD2 3.66Å; Y147-F224 HydrophobicContact CE1-CD2 3.66Å; Y147-F224 AromaticContact CE1-CE1 3.33Å; Y147-F224 HydrophobicContact CE1-CE1 3.33Å; Y147-F224 AromaticContact CE1-CE2 3.81Å; Y147-F224 HydrophobicContact CE1-CE2 3.81Å; Y147-F224 AromaticContact CE1-CG 3.29Å; Y147-F224 HydrophobicContact CE1-CG 3.29Å; Y147-F224 AromaticContact CE1-CZ 3.66Å; Y147-F224 HydrophobicContact CE1-CZ 3.66Å; Y147-F224 HydrophobicContact CE2-CB 4.08Å; Y147-F224 HydrophobicContact CE2-CD1 4.1Å; Y147-F224 HydrophobicContact CE2-CG 4.2Å; Y147-F224 HydrophobicContact CG-CB 3.66Å; Y147-F224 HydrophobicContact CG-CD1 4.37Å; Y147-F224 HydrophobicContact CG-CD2 4.04Å; Y147-F224 AromaticContact CG-CG 3.76Å; Y147-F224 HydrophobicContact CG-CG 3.76Å; Y147-F224 AromaticContact CZ-CD1 3.35Å; Y147-F224 AromaticContact CZ-CE1 3.82Å; Y147-F224 AromaticContact CZ-CG 3.76Å; V168-F224 HydrophobicContact CG1-CD2 3.92Å; V168-F224 HydrophobicContact CG1-CE2 4.06Å; V170-F224 HydrophobicContact CG2-CE2 3.75Å; V170-F224 HydrophobicContact CG2-CZ 3.87Å; V219-F224 HydrophobicContact CG1-CB 4.14Å; S220-F224 PolarHBondContact O-N 3.19Å; E222-F224 VanDerWaalsContact C-N 3.33Å; F224-G227 PolarHBondContact O-N 3.4Å; F224-F230 HydrophobicContact CD2-CE2 4.06Å; F224-F230 HydrophobicContact CD2-CZ 4.22Å; F224-F230 AromaticContact CE2-CE2 3.87Å; F224-F230 HydrophobicContact CE2-CE2 3.87Å; F224-F230 AromaticContact CE2-CZ 3.74Å; F224-F230 HydrophobicContact CE2-CZ 3.74Å; F224-R543 PolarHBondContact O-NH1 2.94Å; F224-R543 PolarHBondContact O-NH2 3.19Å
225	A	75.4	Confident	70.1	Confident	17 Å²	17	63 Å²	63	14%	0.14	33%	0.327	C	S	.	.	H	α-helix	trans	-81.5	-16	-175	0	0	0	0	0	114.2	A221 E222 L539 E542 R543	A221-A225 WeakPolarHBondContact O-CB 3.5Å; A221-A225 PolarHBondContact O-N 2.74Å; E222-A225 PolarHBondContact O-N 3.02Å; A225-L539 HydrophobicContact CB-CD1 4.37Å; A225-E542 VanDerWaalsContact C-OE2 3.31Å; A225-E542 WeakPolarHBondContact CB-OE2 3.36Å; A225-E542 WeakPolarHBondContact O-CB 3.41Å; A225-R543 VanDerWaalsContact CA-NH1 3.32Å; A225-R543 PolarHBondContact O-NH1 3.2Å
226	K	76.4	Confident	67.3	Low	52 Å²	52	70.1 Å²	70.1	23%	0.226	37%	0.365	C	S	.	.	H	α-helix	trans	-85	-28.1	160.8	-65.5	164.6	-165.4	163.3	0	113.1	E222 R228 E546	E222-K226 VanDerWaalsContact O-CB 3.28Å; E222-K226 WeakPolarHBondContact O-CB 3.2Å; E222-K226 WeakPolarHBondContact O-CD 3.27Å; E222-K226 WeakPolarHBondContact O-CG 3.44Å; E222-K226 PolarHBondContact O-N 3.04Å; E222-K226 IonicContact OE2-NZ 3.6Å; E222-K226 PolarHBondContact OE2-NZ 3.46Å; K226-R228 HydrophobicContact CB-CG 4.12Å; K226-E546 WeakPolarHBondContact O-CB 3.5Å; K226-E546 VanDerWaalsContact O-CG 3.3Å; K226-E546 WeakPolarHBondContact O-CG 3.49Å
227	G	72.2	Confident	64.5	Low	0 Å²	0	74.4 Å²	74.4	0%	0	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	12.2	172.9	0	0	0	0	0	113	D223 F224 C229 F230 R543	D223-G227 PolarHBondContact O-N 2.82Å; F224-G227 PolarHBondContact O-N 3.4Å; G227-C229 PolarHBondContact O-N 3.38Å; G227-F230 PolarHBondContact O-N 2.94Å; G227-R543 VanDerWaalsContact CA-CZ 3.44Å
228	R	74.9	Confident	61.7	Low	98 Å²	98	83.1 Å²	83.1	37%	0.37	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-63.9	-31.7	-179.5	-66.1	178.6	179.9	-178.9	-1.5	112.1	D223 K226 F230 Q231 E546	D223-R228 PolarHBondContact O-N 2.95Å; D223-R228 IonicContact OD1-NH1 3.36Å; K226-R228 HydrophobicContact CB-CG 4.12Å; R228-F230 PolarHBondContact O-N 3.38Å; R228-F230 VanDerWaalsContact O-N 3.08Å; R228-Q231 PolarHBondContact O-N 3.39Å; R228-Q231 VanDerWaalsContact O-N 3.14Å; R228-E546 IonicContact NE-OE1 3.37Å; R228-E546 IonicContact NE-OE2 2.65Å; R228-E546 IonicContact NH2-OE2 3.59Å
229	C	73.9	Confident	59	Low	27 Å²	27	85.8 Å²	85.8	18%	0.182	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-63.9	-11.4	177.4	62.3	0	0	0	0	114.3	V168 M181 V219 G227	V168-C229 HydrophobicContact CG2-CB 4.29Å; M181-C229 VanDerWaalsContact CE-O 3.28Å; M181-C229 WeakPolarHBondContact CE-O 3.33Å; V219-C229 HydrophobicContact CG1-CB 3.79Å; V219-C229 HydrophobicContact CG2-CB 4.29Å; G227-C229 PolarHBondContact O-N 3.38Å
230	F	70.7	Confident	56.4	Low	23 Å²	23	93.3 Å²	93.3	10%	0.101	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-100.7	4	178.1	-61.1	-75.9	0	0	0	113.3	V168 K179 F224 G227 R228 V519	V168-F230 HydrophobicContact CB-CE1 3.99Å; V168-F230 HydrophobicContact CB-CZ 4.07Å; V168-F230 HydrophobicContact CG1-CZ 4.41Å; V168-F230 HydrophobicContact CG2-CD1 4.19Å; V168-F230 HydrophobicContact CG2-CE1 3.65Å; V168-F230 HydrophobicContact CG2-CZ 3.95Å; K179-F230 HydrophobicContact CB-CE1 4.44Å; F224-F230 HydrophobicContact CD2-CE2 4.06Å; F224-F230 HydrophobicContact CD2-CZ 4.22Å; F224-F230 AromaticContact CE2-CE2 3.87Å; F224-F230 HydrophobicContact CE2-CE2 3.87Å; F224-F230 AromaticContact CE2-CZ 3.74Å; F224-F230 HydrophobicContact CE2-CZ 3.74Å; G227-F230 PolarHBondContact O-N 2.94Å; R228-F230 PolarHBondContact O-N 3.38Å; R228-F230 VanDerWaalsContact O-N 3.08Å; F230-V519 HydrophobicContact CB-CG2 4.07Å; F230-V519 HydrophobicContact CD2-CG1 4.36Å; F230-V519 HydrophobicContact CD2-CG2 4.14Å; F230-V519 HydrophobicContact CG-CG2 4.02Å
231	Q	65.8	Low	53.8	Low	43 Å²	43	99.6 Å²	99.6	20%	0.201	50%	0.495	C	S	.	.	S	Bend	trans	-108.2	134.8	-176.7	-60.4	-173	-6.5	0	0	112.2	R228 V233 Y520	R228-Q231 PolarHBondContact O-N 3.39Å; R228-Q231 VanDerWaalsContact O-N 3.14Å; Q231-V233 HydrophobicContact CB-CG2 4.2Å; Q231-V233 PolarHBondContact O-N 2.97Å; Q231-Y520 PolarHBondContact NE2-OH 3.48Å
232	E	50.8	Low	51.5	Low	199 Å²	199	102.3 Å²	102.3	93%	0.93	52%	0.518	S	S	*	.			trans	-78	48.4	169.8	-68.3	-174	163.7	0	0	112.1
233	V	39	Very low	49.4	Very low	79 Å²	79	106.8 Å²	106.8	48%	0.479	54%	0.535	S	S	.	.			trans	-91.3	110.4	169.6	-175.1	0	0	0	0	107.2	Q231 T235	Q231-V233 HydrophobicContact CB-CG2 4.2Å; Q231-V233 PolarHBondContact O-N 2.97Å; V233-T235 HydrophobicContact CG1-CG2 4.19Å; V233-T235 PolarHBondContact O-N 2.79Å
234	Q	30.1	Very low	47	Very low	188 Å²	188	108.7 Å²	108.7	88%	0.879	56%	0.559	S	S	*	*			trans	-59.7	84.9	158.1	-73.6	-177.7	-18.6	0	0	107.8	D236	Q234-D236 PolarHBondContact O-N 2.91Å
235	T	25.2	Very low	44.4	Very low	115 Å²	115	112.9 Å²	112.9	71%	0.706	60%	0.596	S	S	*	*			trans	-75.8	104.3	155.4	36	0	0	0	0	105.7	V233 Q237	V233-T235 HydrophobicContact CG1-CG2 4.19Å; V233-T235 PolarHBondContact O-N 2.79Å; T235-Q237 PolarHBondContact O-N 3.31Å; T235-Q237 VanDerWaalsContact O-N 3.16Å
236	D	27.8	Very low	42.2	Very low	151 Å²	151	116.8 Å²	116.8	81%	0.807	63%	0.628	S	S	*	*			trans	-43.5	124	154.7	-73.7	-37.6	0	0	0	107	Q234 E238	Q234-D236 PolarHBondContact O-N 2.91Å; D236-E238 PolarHBondContact O-N 2.98Å
237	Q	26.8	Very low	40	Very low	174 Å²	174	120.1 Å²	120.1	81%	0.813	66%	0.655	S	S	*	*			trans	-49.8	124.6	-178	-72.3	177.2	-36.8	0	0	109.9	T235 E239	T235-Q237 PolarHBondContact O-N 3.31Å; T235-Q237 VanDerWaalsContact O-N 3.16Å; Q237-E239 VanDerWaalsContact C-N 3.27Å; Q237-E239 PolarHBondContact O-N 2.85Å
238	E	26.6	Very low	38	Very low	193 Å²	193	128 Å²	128	90%	0.902	70%	0.696	S	S	*	*			trans	-63.1	94.4	158	-76.7	-178.2	156	0	0	107.4	D236 L240	D236-E238 PolarHBondContact O-N 2.98Å; E238-L240 PolarHBondContact O-N 3.18Å
239	E	25.7	Very low	36	Very low	153 Å²	153	129.3 Å²	129.3	72%	0.715	72%	0.717	S	S	*	*			trans	-63.2	114.9	164.8	-83.8	-170.8	159.1	0	0	108.8	Q237 H241	Q237-E239 VanDerWaalsContact C-N 3.27Å; Q237-E239 PolarHBondContact O-N 2.85Å; E239-H241 PolarHBondContact O-N 2.91Å
240	L	27.8	Very low	33.8	Very low	176 Å²	176	138.8 Å²	138.8	92%	0.921	75%	0.749	S	S	*	*			trans	-57.7	96.7	167.4	-72.9	158.4	0	0	0	109.7	E238 A242	E238-L240 PolarHBondContact O-N 3.18Å; L240-A242 PolarHBondContact O-N 3.4Å
241	H	27.6	Very low	31.9	Very low	179 Å²	179	149.4 Å²	149.4	83%	0.829	79%	0.788	S	S	*	*			trans	-68.8	98.9	169.5	-89.2	-67.1	0	0	0	110.8	E239	E239-H241 PolarHBondContact O-N 2.91Å
242	A	27.4	Very low	30.2	Very low	88 Å²	88	156.3 Å²	156.3	73%	0.727	82%	0.818	S	S	*	*			trans	-63.7	135.6	155.7	0	0	0	0	0	109.8	L240 A244	L240-A242 PolarHBondContact O-N 3.4Å; A242-A244 PolarHBondContact O-N 3.48Å; A242-A244 VanDerWaalsContact O-N 3.17Å
243	K	32.3	Very low	29.4	Very low	218 Å²	218	154.1 Å²	154.1	95%	0.948	81%	0.813	S	S	*	*			trans	-53.9	114.9	177	-74	176.1	175.1	174.9	0	111.3
244	A	28.6	Very low	29.3	Very low	97 Å²	97	156 Å²	156	80%	0.802	83%	0.827	S	S	*	*			trans	-133	133.5	159	0	0	0	0	0	109.3	A242	A242-A244 PolarHBondContact O-N 3.48Å; A242-A244 VanDerWaalsContact O-N 3.17Å
245	A	28.1	Very low	29.5	Very low	101 Å²	101	156.5 Å²	156.5	84%	0.835	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-61	139.1	-173.8	0	0	0	0	0	112.9
246	A	29.2	Very low	30.3	Very low	98 Å²	98	156.6 Å²	156.6	81%	0.81	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-68.6	132.7	179.4	0	0	0	0	0	112.4
247	P	29.4	Very low	30.6	Very low	123 Å²	123	158.7 Å²	158.7	80%	0.799	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-83.6	139.8	159.3	8.3	8.9	0	0	0	110.6
248	L	30.9	Very low	31.1	Very low	166 Å²	166	155.5 Å²	155.5	87%	0.869	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-55.4	142.7	177.9	-71.7	154.9	0	0	0	113.1	R250	L248-R250 PolarHBondContact O-N 2.79Å
249	P	32.3	Very low	31.7	Very low	124 Å²	124	151.3 Å²	151.3	81%	0.805	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-76.5	119.4	-179.3	29	-31.4	0	0	0	112
250	R	28.5	Very low	32.3	Very low	227 Å²	227	150 Å²	150	86%	0.857	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-76.8	121.1	163.4	-75.9	-175.9	175.4	-175.5	-0.7	109.4	L248 F252	L248-R250 PolarHBondContact O-N 2.79Å; R250-F252 PolarHBondContact O-N 3.35Å
251	R	30.1	Very low	32.6	Very low	245 Å²	245	147.5 Å²	147.5	93%	0.925	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-64.8	119.2	173.2	-71.8	178.4	175.5	176.2	-2	110.4
252	F	30.3	Very low	32.8	Very low	188 Å²	188	147.8 Å²	147.8	83%	0.825	82%	0.817	S	S	*	*			trans	-105	112.7	161.6	-88	-87	0	0	0	109	R250	R250-F252 PolarHBondContact O-N 3.35Å
253	N	33.3	Very low	33.1	Very low	153 Å²	153	151.6 Å²	151.6	82%	0.818	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-91.2	117	168.3	-99.3	-1.4	0	0	0	108.7
254	P	37.6	Very low	33	Very low	120 Å²	120	144.8 Å²	144.8	78%	0.779	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-82.3	119.7	161.9	30	-26.3	0	0	0	109.1
255	K	34.5	Very low	33	Very low	197 Å²	197	152.6 Å²	152.6	86%	0.857	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-75.8	137.1	168.4	-68.8	-179.1	179.8	179.1	0	109.3
256	P	40.7	Very low	33.2	Very low	118 Å²	118	152.7 Å²	152.7	77%	0.766	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-76.2	135.5	170.6	28.8	-29.9	0	0	0	111
257	F	35.9	Very low	33.1	Very low	194 Å²	194	151.3 Å²	151.3	85%	0.851	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-74.7	128.1	176.1	-173.6	-97.8	0	0	0	110.3
258	C	35.8	Very low	33.2	Very low	108 Å²	108	154.6 Å²	154.6	73%	0.73	83%	0.825	S	S	*	*			trans	-110	126.5	172.9	-70.7	0	0	0	0	109.5
259	P	38.8	Very low	33.4	Very low	104 Å²	104	151.9 Å²	151.9	68%	0.675	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-83	151.1	167.1	32.2	-29.6	0	0	0	111.1
260	P	39.5	Very low	33.2	Very low	126 Å²	126	154.7 Å²	154.7	82%	0.818	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-81.6	147.4	-170.6	32.8	-33.6	0	0	0	113.2
261	T	33.9	Very low	33.3	Very low	123 Å²	123	151.7 Å²	151.7	76%	0.755	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-53.3	136.6	176.2	-34	0	0	0	0	113.6
262	M	32.4	Very low	33.3	Very low	186 Å²	186	148.7 Å²	148.7	92%	0.916	81%	0.814	S	S	*	*			trans	-130.4	122	154	-84.1	-69.9	-152.4	0	0	109.1
263	L	33.2	Very low	33.6	Very low	168 Å²	168	145.8 Å²	145.8	88%	0.88	81%	0.814	S	S	*	*			trans	-70.1	137.3	173.1	-100	91.6	0	0	0	111.2
264	G	30.1	Very low	33.6	Very low	74 Å²	74	147.5 Å²	147.5	76%	0.763	82%	0.817	S	S	*	*			trans	106.6	97.7	135.3	0	0	0	0	0	118.5
265	R	29.5	Very low	33.4	Very low	261 Å²	261	146 Å²	146	99%	0.985	82%	0.815	S	S	*	*				-174.6	149.6	119.7	-119.2	177.4	172.9	-176.2	-2.5	112.2
266	A	30.5	Very low	33.6	Very low	103 Å²	103	145.5 Å²	145.5	85%	0.851	82%	0.816	S	S	*	*			trans	-83.3	155.6	-166.5	0	0	0	0	0	115.6
267	G	27.9	Very low	33.9	Very low	69 Å²	69	148.3 Å²	148.3	71%	0.711	82%	0.819	S	S	*	*			trans	110.6	93.1	135.1	0	0	0	0	0	118.7
268	H	30.9	Very low	34.4	Very low	192 Å²	192	143.9 Å²	143.9	89%	0.889	81%	0.808	S	S	*	*				163	155.7	124.8	-95	-69	0	0	0	111.9
269	P	35	Very low	35.6	Very low	109 Å²	109	141.1 Å²	141.1	71%	0.708	79%	0.79	S	S	*	*				-95.8	152.4	-127.1	36.7	-35.8	0	0	0	115.1	N271	P269-N271 PolarHBondContact O-N 3.44Å
270	E	29.4	Very low	37.5	Very low	183 Å²	183	144 Å²	144	86%	0.855	79%	0.791	S	S	*	*			trans	-11.9	106.7	159.7	-62	177.7	151.8	0	0	116.7
271	N	29.9	Very low	39.6	Very low	164 Å²	164	140 Å²	140	88%	0.877	77%	0.766	S	S	*	*			trans	-90	109.3	141.4	-115.6	-13.9	0	0	0	106.7	P269	P269-N271 PolarHBondContact O-N 3.44Å
272	K	30.2	Very low	42.1	Very low	183 Å²	183	141.2 Å²	141.2	80%	0.796	76%	0.756	S	S	*	*			trans	-45.3	126.5	173	-75.1	175.3	175.1	175.2	0	110.1	Q274	K272-Q274 PolarHBondContact O-N 2.9Å
273	P	37.3	Very low	44.9	Very low	126 Å²	126	134.2 Å²	134.2	82%	0.818	72%	0.721	S	S	*	*			trans	-62	123.6	163.3	-14.4	28	0	0	0	107.8	A275	P273-A275 PolarHBondContact O-N 3.24Å
274	Q	33.2	Very low	47.5	Very low	189 Å²	189	130.8 Å²	130.8	88%	0.883	70%	0.704	S	S	*	*			trans	-50.2	128.4	164.2	-76.5	174.7	-18	0	0	108.1	K272 E276	K272-Q274 PolarHBondContact O-N 2.9Å; Q274-E276 PolarHBondContact O-N 2.98Å
275	A	32.8	Very low	50.2	Low	88 Å²	88	129 Å²	129	73%	0.727	68%	0.679	S	S	*	*			trans	-40.7	123.8	-178.4	0	0	0	0	0	111.8	P273 Q277	P273-A275 PolarHBondContact O-N 3.24Å; A275-Q277 VanDerWaalsContact C-N 3.29Å; A275-Q277 PolarHBondContact O-N 3.47Å
276	E	38.9	Very low	53.1	Low	187 Å²	187	124.1 Å²	124.1	87%	0.874	67%	0.672	S	S	*	*			trans	-52.9	99.4	158.7	-73.7	178.4	154.6	0	0	107.2	Q274 T278	Q274-E276 PolarHBondContact O-N 2.98Å; E276-T278 VanDerWaalsContact C-N 3.25Å; E276-T278 PolarHBondContact O-N 3.37Å
277	Q	46.8	Very low	55.8	Low	178 Å²	178	121 Å²	121	83%	0.832	65%	0.645	S	S	*	*			trans	-64.6	95.6	168.3	-85.7	176.9	-7.2	0	0	106.5	A275 S279	A275-Q277 VanDerWaalsContact C-N 3.29Å; A275-Q277 PolarHBondContact O-N 3.47Å; Q277-S279 PolarHBondContact O-N 3.36Å
278	T	46.7	Very low	58.5	Low	101 Å²	101	124.1 Å²	124.1	62%	0.62	65%	0.653	S	S	*	*			trans	-50.9	109.9	164.1	55.1	0	0	0	0	106.6	E276 K280	E276-T278 VanDerWaalsContact C-N 3.25Å; E276-T278 PolarHBondContact O-N 3.37Å; T278-K280 PolarHBondContact O-N 3.06Å
279	S	61.2	Low	61.1	Low	50 Å²	50	117.4 Å²	117.4	35%	0.35	64%	0.636	S	S	.	*			trans	-73.4	70.9	-173.5	61.6	0	0	0	0	109.7	Q277 P310	Q277-S279 PolarHBondContact O-N 3.36Å; S279-P310 VanDerWaalsContact OG-CG 3.25Å; S279-P310 WeakPolarHBondContact OG-CG 3.33Å
280	K	77.2	Confident	63.6	Low	163 Å²	163	113.6 Å²	113.6	71%	0.709	61%	0.614	S	S	*	*			trans	-83.3	143.2	177.4	-68.2	-175.1	-179.8	-178.2	0	109.4	T278	T278-K280 PolarHBondContact O-N 3.06Å
281	P	84.8	Confident	66.6	Low	43 Å²	43	105.5 Å²	105.5	28%	0.279	58%	0.576	S	S	.	*			trans	-52.8	144.3	170.6	-25.2	34.6	0	0	0	111.2	H283 P285 V312 D313	P281-H283 VanDerWaalsContact C-N 3.28Å; P281-H283 VanDerWaalsContact CB-O 3.3Å; P281-H283 WeakPolarHBondContact CB-O 3.42Å; P281-H283 PolarHBondContact O-N 2.94Å; P281-P285 HydrophobicContact CG-CG 4.46Å; P281-V312 HydrophobicContact CB-CG1 4.16Å; P281-V312 HydrophobicContact CG-CG1 3.91Å; P281-D313 HydrophobicContact CB-CB 4.38Å; P281-D313 HydrophobicContact CG-CB 4.02Å
282	R	86.8	Confident	69.6	Low	148 Å²	148	100.2 Å²	100.2	56%	0.558	55%	0.55	S	S	*	.	S	Bend	trans	-64.6	-35.9	179.7	-177.9	179.5	178	78.7	6.8	112.1	Q374	R282-Q374 HydrophobicContact CB-CG 3.92Å; R282-Q374 HydrophobicContact CG-CG 4.45Å
283	H	89.7	Confident	72.6	Confident	39 Å²	39	91.7 Å²	91.7	18%	0.181	51%	0.513	C	S	.	.	S	Bend	trans	-125	155.2	176.3	-55.6	-74.9	0	0	0	109.2	P281 P285 V315 P318	P281-H283 VanDerWaalsContact C-N 3.28Å; P281-H283 VanDerWaalsContact CB-O 3.3Å; P281-H283 WeakPolarHBondContact CB-O 3.42Å; P281-H283 PolarHBondContact O-N 2.94Å; H283-P285 WeakPolarHBondContact O-CD 3.47Å; H283-V315 HydrophobicContact CB-CB 4.07Å; H283-V315 HydrophobicContact CB-CG1 4.11Å; H283-P318 HydrophobicContact CB-CG 4.38Å
284	D	88.2	Confident	75.1	Confident	97 Å²	97	87.6 Å²	87.6	52%	0.519	49%	0.486	S	S	.	.			trans	-68.5	118.1	-178.4	-176.6	3.5	0	0	0	111.1	L286 A287	D284-L286 VanDerWaalsContact C-N 3.26Å; D284-L286 PolarHBondContact O-N 2.8Å; D284-L286 PolarHBondContact OD1-N 2.97Å; D284-A287 HydrophobicContact CB-CB 4.22Å
285	P	88.2	Confident	77.7	Confident	36 Å²	36	86.2 Å²	86.2	23%	0.234	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.7	177.7	29.3	-34.6	0	0	0	113.5	P281 H283 V292 D313 V315	P281-P285 HydrophobicContact CG-CG 4.46Å; H283-P285 WeakPolarHBondContact O-CD 3.47Å; P285-V292 HydrophobicContact CB-CG2 3.91Å; P285-D313 HydrophobicContact CB-CB 4.32Å; P285-V315 HydrophobicContact CB-CG2 3.85Å
286	L	89.6	Confident	80.3	Confident	159 Å²	159	82.3 Å²	82.3	83%	0.832	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-1.7	-177.6	-60.7	177.1	0	0	0	113.2	D284	D284-L286 VanDerWaalsContact C-N 3.26Å; D284-L286 PolarHBondContact O-N 2.8Å; D284-L286 PolarHBondContact OD1-N 2.97Å
287	A	87.8	Confident	82.5	Confident	36 Å²	36	77 Å²	77	30%	0.298	42%	0.423	S	S	.	.	S	Bend	trans	-63.3	143.6	178.3	0	0	0	0	0	111.5	D284 G289 A290	D284-A287 HydrophobicContact CB-CB 4.22Å; A287-G289 PolarHBondContact O-N 3.37Å; A287-A290 HydrophobicContact CB-CB 4.36Å; A287-A290 WeakPolarHBondContact O-CB 3.5Å; A287-A290 PolarHBondContact O-N 3.15Å
288	P	84.8	Confident	84.3	Confident	136 Å²	136	73.1 Å²	73.1	88%	0.883	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	126.4	-179.8	26.1	-33.8	0	0	0	110.3	A290	P288-A290 VanDerWaalsContact C-N 3.3Å; P288-A290 PolarHBondContact O-N 2.85Å
289	G	83.9	Confident	85.9	Confident	51 Å²	51	74.8 Å²	74.8	53%	0.526	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	16.6	-176.8	0	0	0	0	0	114.5	A287 R329	A287-G289 PolarHBondContact O-N 3.37Å; G289-R329 PolarHBondContact O-NH2 3.08Å
290	A	88.9	Confident	87	Confident	29 Å²	29	73 Å²	73	24%	0.24	41%	0.407	C	S	.	.			trans	-62	141.5	167.8	0	0	0	0	0	110.9	A287 P288 V292 V315	A287-A290 HydrophobicContact CB-CB 4.36Å; A287-A290 WeakPolarHBondContact O-CB 3.5Å; A287-A290 PolarHBondContact O-N 3.15Å; P288-A290 VanDerWaalsContact C-N 3.3Å; P288-A290 PolarHBondContact O-N 2.85Å; A290-V292 HydrophobicContact CB-CG2 4.42Å; A290-V315 HydrophobicContact CB-CG1 4.17Å
291	L	92.4	Very high	87.4	Confident	13 Å²	13	68 Å²	68	7%	0.068	39%	0.387	C	S	.	.			trans	-106.9	96.1	172.3	-180	61.1	0	0	0	108.2	M293 V316 T321 L324 R329 L333	L291-M293 HydrophobicContact CD2-CE 4.04Å; L291-M293 HydrophobicContact CG-CE 3.92Å; L291-V316 HydrophobicContact CB-CB 4.19Å; L291-V316 HydrophobicContact CB-CG2 4.25Å; L291-V316 HydrophobicContact CD2-CB 4.32Å; L291-V316 HydrophobicContact CD2-CG2 3.86Å; L291-V316 HydrophobicContact CG-CB 4.48Å; L291-V316 HydrophobicContact CG-CG2 4.03Å; L291-V316 PolarHBondContact O-N 2.99Å; L291-T321 HydrophobicContact CB-CG2 3.69Å; L291-L324 HydrophobicContact CD2-CD1 4.3Å; L291-R329 HydrophobicContact CD1-CB 4.14Å; L291-R329 HydrophobicContact CD2-CB 4.04Å; L291-R329 HydrophobicContact CD2-CG 4.25Å; L291-L333 HydrophobicContact CD1-CD1 3.96Å; L291-L333 HydrophobicContact CD1-CD2 4.16Å; L291-L333 HydrophobicContact CD1-CG 4.02Å
292	V	92.2	Very high	87.2	Confident	52 Å²	52	76.4 Å²	76.4	32%	0.315	41%	0.413	S	S	.	.	B	Isolated β-bridge	trans	-88.8	127.5	-180	-171.2	0	0	0	0	109.1	P285 A290 D313 V315	P285-V292 HydrophobicContact CB-CG2 3.91Å; A290-V292 HydrophobicContact CB-CG2 4.42Å; V292-D313 HydrophobicContact CG1-CB 4.32Å; V292-V315 HydrophobicContact CG1-CG2 4.42Å; V292-V315 HydrophobicContact CG2-CG2 4.18Å
293	M	92.7	Very high	87	Confident	5 Å²	5	73.1 Å²	73.1	3%	0.025	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-74.3	149.4	176.2	-67.9	-64.5	132.9	0	0	111.1	L291 V314 V316 I332 L333 Y336	L291-M293 HydrophobicContact CD2-CE 4.04Å; L291-M293 HydrophobicContact CG-CE 3.92Å; M293-V314 HydrophobicContact CB-CB 4.02Å; M293-V314 HydrophobicContact CB-CG1 4.24Å; M293-V314 WeakPolarHBondContact CB-O 3.42Å; M293-V314 HydrophobicContact CG-CB 4.25Å; M293-V314 HydrophobicContact CG-CG1 3.92Å; M293-V314 PolarHBondContact N-O 2.89Å; M293-V316 HydrophobicContact CE-CG2 3.17Å; M293-I332 HydrophobicContact CE-CG2 3.64Å; M293-L333 HydrophobicContact CE-CD2 3.95Å; M293-L333 HydrophobicContact CE-CG 4.43Å; M293-L333 HydrophobicContact SD-CD2 3.87Å; M293-Y336 HydrophobicContact CB-CD1 3.81Å; M293-Y336 HydrophobicContact CB-CE1 3.58Å; M293-Y336 HydrophobicContact CB-CE2 4.34Å; M293-Y336 HydrophobicContact CB-CG 4.28Å; M293-Y336 HydrophobicContact CG-CD1 4Å; M293-Y336 HydrophobicContact CG-CD2 4.05Å; M293-Y336 HydrophobicContact CG-CE1 4.12Å; M293-Y336 HydrophobicContact CG-CE2 4.16Å; M293-Y336 HydrophobicContact CG-CG 3.96Å; M293-Y336 VanDerWaalsContact SD-CB 3.52Å; M293-Y336 HydrophobicContact SD-CD1 3.72Å; M293-Y336 HydrophobicContact SD-CD2 4.02Å; M293-Y336 HydrophobicContact SD-CE1 4.43Å; M293-Y336 HydrophobicContact SD-CG 3.47Å
294	P	89.4	Confident	86.5	Confident	39 Å²	39	74.3 Å²	74.3	25%	0.253	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-62.1	141.5	179.6	24.3	-32.4	0	0	0	111.5	Y336 E337 M342	P294-Y336 HydrophobicContact CG-CD1 4.2Å; P294-Y336 HydrophobicContact CG-CE1 4.4Å; P294-E337 HydrophobicContact CG-CG 3.49Å; P294-E337 VanDerWaalsContact CG-CG 3.49Å; P294-M342 HydrophobicContact CG-SD 4.36Å
295	R	88.3	Confident	86.3	Confident	161 Å²	161	70.7 Å²	70.7	61%	0.608	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-75.5	142.2	176.7	-71.2	-172.7	178.2	-173.5	0.7	110.6	D313	R295-D313 IonicContact CZ-OD1 2.76Å; R295-D313 IonicContact CZ-OD2 2.69Å; R295-D313 IonicContact NE-OD1 3.78Å; R295-D313 PolarHBondContact NE-OD1 3.47Å; R295-D313 IonicContact NH2-OD1 3.71Å; R295-D313 PolarHBondContact NH2-OD1 3.23Å; R295-D313 IonicContact NH2-OD2 3.28Å; R295-D313 PolarHBondContact NH2-OD2 2.93Å
296	P	87.4	Confident	86	Confident	6 Å²	6	77.8 Å²	77.8	4%	0.039	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-62.1	138.4	174.9	-15.8	26.5	0	0	0	112.6	H300 Q301 M342 P376 Y377	P296-H300 HydrophobicContact CB-CB 4.22Å; P296-Q301 HydrophobicContact CB-CG 4Å; P296-Q301 PolarHBondContact O-NE2 3.48Å; P296-M342 HydrophobicContact CB-CE 4.15Å; P296-M342 HydrophobicContact CG-CE 3.78Å; P296-P376 HydrophobicContact CG-CB 3.73Å; P296-P376 HydrophobicContact CG-CG 4Å; P296-Y377 WeakPolarHBondContact CB-OH 3.49Å; P296-Y377 HydrophobicContact CG-CE1 4.15Å
297	S	86.1	Confident	85.6	Confident	75 Å²	75	74.6 Å²	74.6	52%	0.524	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-69	161.6	173.9	67.3	0	0	0	0	112.3	N299 H300 Q301	S297-N299 VanDerWaalsContact C-N 3.26Å; S297-N299 PolarHBondContact O-N 3.26Å; S297-H300 WeakPolarHBondContact O-CB 3.4Å; S297-H300 PolarHBondContact O-N 3.07Å; S297-H300 PolarHBondContact OG-N 3.05Å; S297-Q301 WeakPolarHBondContact O-CG 3.28Å; S297-Q301 PolarHBondContact O-N 3.39Å
298	S	83.3	Confident	85.2	Confident	97 Å²	97	75.9 Å²	75.9	68%	0.678	43%	0.427	S	S	*	.	H	α-helix	trans	-55.3	-40	179.4	-52.7	0	0	0	0	113	Q301 W302	S298-Q301 PolarHBondContact O-N 3.26Å; S298-W302 PolarHBondContact O-N 3.43Å
299	N	81.9	Confident	85.2	Confident	136 Å²	136	72.9 Å²	72.9	73%	0.727	40%	0.4	S	S	*	.	H	α-helix	trans	-65.6	-41	177.1	-66.5	-2.6	0	0	0	111.6	S297 W302 L303	S297-N299 VanDerWaalsContact C-N 3.26Å; S297-N299 PolarHBondContact O-N 3.26Å; N299-W302 PolarHBondContact O-N 3.18Å; N299-L303 PolarHBondContact O-N 3.33Å
300	H	84.4	Confident	85.2	Confident	12 Å²	12	73.6 Å²	73.6	6%	0.056	40%	0.395	C	S	.	.	H	α-helix	trans	-64	-42.6	175.6	-173.5	-79.4	0	0	0	111.6	P296 S297 W302 L303 H304 M340 Y377	P296-H300 HydrophobicContact CB-CB 4.22Å; S297-H300 WeakPolarHBondContact O-CB 3.4Å; S297-H300 PolarHBondContact O-N 3.07Å; S297-H300 PolarHBondContact OG-N 3.05Å; H300-W302 VanDerWaalsContact C-N 3.34Å; H300-W302 PolarHBondContact O-N 3.22Å; H300-L303 PolarHBondContact O-N 3.36Å; H300-H304 AromaticContact CD2-CD2 3.56Å; H300-H304 AromaticContact CD2-NE2 3.99Å; H300-H304 AromaticContact CE1-CD2 3.4Å; H300-H304 PolarHBondContact CE1-CD2 3.26Å; H300-H304 AromaticContact CE1-CG 3.72Å; H300-H304 AromaticContact CG-CD2 3.83Å; H300-H304 AromaticContact ND1-CD2 3.73Å; H300-H304 AromaticContact NE2-CD2 3.27Å; H300-H304 PolarHBondContact NE2-CD2 2.8Å; H300-H304 VanDerWaalsContact NE2-CD2 3.27Å; H300-H304 AromaticContact NE2-CG 3.96Å; H300-H304 AromaticContact NE2-NE2 3.66Å; H300-H304 WeakPolarHBondContact O-CB 3.49Å; H300-H304 PolarHBondContact O-CD2 3.01Å; H300-H304 PolarHBondContact O-N 3.48Å; H300-M340 PolarHBondContact NE2-O 2.88Å; H300-Y377 PolarHBondContact CE1-OH 3.32Å; H300-Y377 AromaticContact ND1-CZ 3.93Å; H300-Y377 PolarHBondContact ND1-OH 3.13Å
301	Q	84.6	Confident	85.1	Confident	59 Å²	59	74.4 Å²	74.4	28%	0.276	40%	0.397	S	S	.	.	H	α-helix	trans	-61.7	-42.3	176.6	-65.2	-179.9	43.8	0	0	111.5	P296 S297 S298 L303 N305 V311 Y377	P296-Q301 HydrophobicContact CB-CG 4Å; P296-Q301 PolarHBondContact O-NE2 3.48Å; S297-Q301 WeakPolarHBondContact O-CG 3.28Å; S297-Q301 PolarHBondContact O-N 3.39Å; S298-Q301 PolarHBondContact O-N 3.26Å; Q301-L303 VanDerWaalsContact C-N 3.29Å; Q301-L303 PolarHBondContact O-N 3.15Å; Q301-N305 HydrophobicContact CB-CB 4.42Å; Q301-N305 VanDerWaalsContact O-CA 3.29Å; Q301-N305 WeakPolarHBondContact O-CA 3.2Å; Q301-N305 WeakPolarHBondContact O-CB 3.26Å; Q301-N305 PolarHBondContact O-N 2.69Å; Q301-V311 HydrophobicContact CG-CG2 4.39Å; Q301-Y377 HydrophobicContact CG-CE1 4.09Å
302	W	81.3	Confident	85	Confident	218 Å²	218	74.1 Å²	74.1	83%	0.826	40%	0.396	S	S	*	.	H	α-helix	trans	-59.9	-40.2	176.9	-173.9	81.7	0	0	0	112.3	S298 N299 H300	S298-W302 PolarHBondContact O-N 3.43Å; N299-W302 PolarHBondContact O-N 3.18Å; H300-W302 VanDerWaalsContact C-N 3.34Å; H300-W302 PolarHBondContact O-N 3.22Å
303	L	81.6	Confident	84.9	Confident	80 Å²	80	72.9 Å²	72.9	42%	0.419	39%	0.388	S	S	.	.	H	α-helix	trans	-76.6	-41.4	-178.9	-165.4	68.3	0	0	0	113.3	N299 H300 Q301	N299-L303 PolarHBondContact O-N 3.33Å; H300-L303 PolarHBondContact O-N 3.36Å; Q301-L303 VanDerWaalsContact C-N 3.29Å; Q301-L303 PolarHBondContact O-N 3.15Å
304	H	80.7	Confident	84.8	Confident	64 Å²	64	72.9 Å²	72.9	30%	0.296	39%	0.388	S	S	.	.	H	α-helix	trans	-106.4	-21.5	-169	-67.4	-80.4	0	0	0	115	H300 H348 Y377	H300-H304 AromaticContact CD2-CD2 3.56Å; H300-H304 AromaticContact CD2-NE2 3.99Å; H300-H304 AromaticContact CE1-CD2 3.4Å; H300-H304 PolarHBondContact CE1-CD2 3.26Å; H300-H304 AromaticContact CE1-CG 3.72Å; H300-H304 AromaticContact CG-CD2 3.83Å; H300-H304 AromaticContact ND1-CD2 3.73Å; H300-H304 AromaticContact NE2-CD2 3.27Å; H300-H304 PolarHBondContact NE2-CD2 2.8Å; H300-H304 VanDerWaalsContact NE2-CD2 3.27Å; H300-H304 AromaticContact NE2-CG 3.96Å; H300-H304 AromaticContact NE2-NE2 3.66Å; H300-H304 WeakPolarHBondContact O-CB 3.49Å; H300-H304 PolarHBondContact O-CD2 3.01Å; H300-H304 PolarHBondContact O-N 3.48Å; H304-H348 AromaticContact CE1-NE2 3.56Å; H304-Y377 HydrophobicContact CB-CE2 3.98Å
305	N	84.1	Confident	85	Confident	20 Å²	20	71 Å²	71	11%	0.107	38%	0.376	C	S	.	.			trans	-103.2	52.8	-179.8	-167	17.4	0	0	0	112.1	Q301 S307 G308 F309 Y377	Q301-N305 HydrophobicContact CB-CB 4.42Å; Q301-N305 VanDerWaalsContact O-CA 3.29Å; Q301-N305 WeakPolarHBondContact O-CA 3.2Å; Q301-N305 WeakPolarHBondContact O-CB 3.26Å; Q301-N305 PolarHBondContact O-N 2.69Å; N305-S307 PolarHBondContact O-N 3.08Å; N305-G308 PolarHBondContact O-N 3.33Å; N305-G308 PolarHBondContact OD1-N 2.89Å; N305-F309 PolarHBondContact ND2-N 2.96Å; N305-F309 PolarHBondContact ND2-O 2.94Å; N305-F309 PolarHBondContact OD1-N 3.37Å; N305-Y377 HydrophobicContact CB-CD1 3.72Å; N305-Y377 HydrophobicContact CB-CE1 3.56Å; N305-Y377 HydrophobicContact CB-CE2 4.46Å; N305-Y377 HydrophobicContact CB-CG 4.26Å
306	K	80.6	Confident	85.2	Confident	186 Å²	186	63.4 Å²	63.4	81%	0.809	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.5	-178.8	-62.2	-175.9	179.9	-178.3	0	113.7
307	S	80.7	Confident	85.4	Confident	91 Å²	91	63.7 Å²	63.7	64%	0.636	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-1.3	179.8	-54.2	0	0	0	0	114	N305 F309	N305-S307 PolarHBondContact O-N 3.08Å; S307-F309 VanDerWaalsContact C-N 3.33Å; S307-F309 PolarHBondContact O-N 3.08Å
308	G	80.4	Confident	85.7	Confident	63 Å²	63	62.8 Å²	62.8	65%	0.649	34%	0.341	S	S	*	.			trans	64.8	30.9	176.4	0	0	0	0	0	114.7	N305	N305-G308 PolarHBondContact O-N 3.33Å; N305-G308 PolarHBondContact OD1-N 2.89Å
309	F	84.1	Confident	86	Confident	74 Å²	74	61.9 Å²	61.9	33%	0.325	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-65.9	149	178.1	-70.5	-60.8	0	0	0	111.5	N305 S307	N305-F309 PolarHBondContact ND2-N 2.96Å; N305-F309 PolarHBondContact ND2-O 2.94Å; N305-F309 PolarHBondContact OD1-N 3.37Å; S307-F309 VanDerWaalsContact C-N 3.33Å; S307-F309 PolarHBondContact O-N 3.08Å
310	P	84.9	Confident	86.5	Confident	66 Å²	66	55.4 Å²	55.4	43%	0.429	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-62.2	140.3	173.9	26.7	-34.3	0	0	0	110.5	S279 G378	S279-P310 VanDerWaalsContact OG-CG 3.25Å; S279-P310 WeakPolarHBondContact OG-CG 3.33Å; P310-G378 PolarHBondContact O-N 3.45Å
311	V	87.2	Confident	86.8	Confident	45 Å²	45	55.1 Å²	55.1	27%	0.273	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-79.3	124.2	175.5	-178.8	0	0	0	0	109	Q301 P376 Y377	Q301-V311 HydrophobicContact CG-CG2 4.39Å; V311-P376 CarbonylContact C-O 3.54Å; V311-P376 VanDerWaalsContact CA-O 3.29Å; V311-P376 WeakPolarHBondContact CA-O 3.33Å; V311-Y377 HydrophobicContact CG2-CD1 4.45Å; V311-Y377 HydrophobicContact CG2-CE1 4.29Å
312	V	89.2	Confident	87	Confident	8 Å²	8	57.6 Å²	57.6	5%	0.048	31%	0.31	C	S	.	.			trans	-115.4	141.5	-178.7	-172.9	0	0	0	0	109.2	P281 V314 P376	P281-V312 HydrophobicContact CB-CG1 4.16Å; P281-V312 HydrophobicContact CG-CG1 3.91Å; V312-V314 PolarHBondContact O-N 3.45Å; V312-P376 PolarHBondContact N-O 2.81Å
313	D	89.9	Confident	87.4	Confident	26 Å²	26	51.9 Å²	51.9	14%	0.139	29%	0.292	C	S	.	.			trans	-63.7	129.4	172.8	-68.3	-43.8	0	0	0	110.9	P281 P285 V292 R295 V315	P281-D313 HydrophobicContact CB-CB 4.38Å; P281-D313 HydrophobicContact CG-CB 4.02Å; P285-D313 HydrophobicContact CB-CB 4.32Å; V292-D313 HydrophobicContact CG1-CB 4.32Å; R295-D313 IonicContact CZ-OD1 2.76Å; R295-D313 IonicContact CZ-OD2 2.69Å; R295-D313 IonicContact NE-OD1 3.78Å; R295-D313 PolarHBondContact NE-OD1 3.47Å; R295-D313 IonicContact NH2-OD1 3.71Å; R295-D313 PolarHBondContact NH2-OD1 3.23Å; R295-D313 IonicContact NH2-OD2 3.28Å; R295-D313 PolarHBondContact NH2-OD2 2.93Å; D313-V315 HydrophobicContact CB-CG2 4.39Å
314	V	91.8	Very high	87.8	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.024	27%	0.274	C	S	.	.			trans	-97.3	118.8	173	176.2	0	0	0	0	107.4	M293 V312 Y336 T370 Q374 G375 P376	M293-V314 HydrophobicContact CB-CB 4.02Å; M293-V314 HydrophobicContact CB-CG1 4.24Å; M293-V314 WeakPolarHBondContact CB-O 3.42Å; M293-V314 HydrophobicContact CG-CB 4.25Å; M293-V314 HydrophobicContact CG-CG1 3.92Å; M293-V314 PolarHBondContact N-O 2.89Å; V312-V314 PolarHBondContact O-N 3.45Å; V314-Y336 HydrophobicContact CG1-CE2 4.28Å; V314-T370 HydrophobicContact CG1-CG2 3.44Å; V314-T370 VanDerWaalsContact CG1-CG2 3.44Å; V314-Q374 HydrophobicContact CG1-CB 4.02Å; V314-G375 VanDerWaalsContact CG2-C 3.44Å; V314-P376 HydrophobicContact CG2-CB 4.3Å
315	V	92.6	Very high	88.3	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-121.2	127	-175.6	-175.7	0	0	0	0	108.3	H283 P285 A290 V292 D313 Q374	H283-V315 HydrophobicContact CB-CB 4.07Å; H283-V315 HydrophobicContact CB-CG1 4.11Å; P285-V315 HydrophobicContact CB-CG2 3.85Å; A290-V315 HydrophobicContact CB-CG1 4.17Å; V292-V315 HydrophobicContact CG1-CG2 4.42Å; V292-V315 HydrophobicContact CG2-CG2 4.18Å; D313-V315 HydrophobicContact CB-CG2 4.39Å; V315-Q374 PolarHBondContact O-NE2 3.48Å; V315-Q374 PolarHBondContact O-OE1 3.29Å
316	V	92.7	Very high	88.6	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.006	30%	0.296	C	S	.	.			trans	-63.5	142.5	178.1	-177.5	0	0	0	0	109.7	L291 M293 P318 L320 T321 I332	L291-V316 HydrophobicContact CB-CB 4.19Å; L291-V316 HydrophobicContact CB-CG2 4.25Å; L291-V316 HydrophobicContact CD2-CB 4.32Å; L291-V316 HydrophobicContact CD2-CG2 3.86Å; L291-V316 HydrophobicContact CG-CB 4.48Å; L291-V316 HydrophobicContact CG-CG2 4.03Å; L291-V316 PolarHBondContact O-N 2.99Å; M293-V316 HydrophobicContact CE-CG2 3.17Å; V316-P318 WeakPolarHBondContact O-CD 3.2Å; V316-L320 HydrophobicContact CG1-CB 4.46Å; V316-T321 HydrophobicContact CB-CG2 3.61Å; V316-T321 HydrophobicContact CG1-CG2 3.68Å; V316-I332 HydrophobicContact CG2-CG2 4.37Å
317	D	92.1	Very high	89.1	Confident	11 Å²	11	44.3 Å²	44.3	6%	0.059	26%	0.258	C	S	.	.			trans	-51.2	122.3	-178.6	-169	-40.9	0	0	0	111	H319 L320 T321 W369 R410	D317-H319 PolarHBondContact O-N 3.4Å; D317-H319 VanDerWaalsContact OD1-CB 3.26Å; D317-H319 WeakPolarHBondContact OD1-CB 3.5Å; D317-H319 PolarHBondContact OD1-N 2.87Å; D317-L320 HydrophobicContact CB-CD1 4.41Å; D317-L320 HydrophobicContact CB-CG 4.39Å; D317-L320 PolarHBondContact O-N 3.33Å; D317-T321 PolarHBondContact O-N 2.86Å; D317-T321 VanDerWaalsContact O-N 3.08Å; D317-W369 PolarHBondContact OD2-NE1 3.28Å; D317-R410 IonicContact OD1-NH1 3.5Å; D317-R410 PolarHBondContact OD1-NH1 2.95Å; D317-R410 IonicContact OD2-NH1 3.1Å; D317-R410 PolarHBondContact OD2-NH1 3.04Å; D317-R410 VanDerWaalsContact OD2-NH1 3.1Å
318	P	91.1	Very high	89.7	Confident	57 Å²	57	40.6 Å²	40.6	37%	0.37	23%	0.231	S	C	.	.	H	α-helix	trans	-53.6	-29.7	-179.4	-29.9	36.3	0	0	0	114.3	H283 V316 L320 T321 T322	H283-P318 HydrophobicContact CB-CG 4.38Å; V316-P318 WeakPolarHBondContact O-CD 3.2Å; P318-L320 VanDerWaalsContact C-N 3.29Å; P318-L320 PolarHBondContact O-N 3.27Å; P318-T321 VanDerWaalsContact CA-OG1 3.31Å; P318-T321 WeakPolarHBondContact CA-OG1 3.33Å; P318-T321 PolarHBondContact O-N 3.46Å; P318-T321 PolarHBondContact O-OG1 2.92Å; P318-T322 PolarHBondContact O-N 2.91Å; P318-T322 PolarHBondContact O-OG1 3.41Å
319	H	91.2	Very high	90.4	Very high	77 Å²	77	40.6 Å²	40.6	36%	0.356	21%	0.211	S	C	.	.	H	α-helix	trans	-62	-39	176	-177.4	60.3	0	0	0	111.8	D317 H323 W405	D317-H319 PolarHBondContact O-N 3.4Å; D317-H319 VanDerWaalsContact OD1-CB 3.26Å; D317-H319 WeakPolarHBondContact OD1-CB 3.5Å; D317-H319 PolarHBondContact OD1-N 2.87Å; H319-H323 PolarHBondContact O-CD2 2.92Å; H319-H323 VanDerWaalsContact O-CD2 3.32Å; H319-W405 PolarHBondContact CD2-O 3.33Å; H319-W405 PolarHBondContact NE2-O 2.9Å
320	L	91	Very high	90.8	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-78.7	-44.1	177.4	-62.3	178.5	0	0	0	111.1	V316 D317 P318 T322 H323 L324 A366 W369 W405 L406	V316-L320 HydrophobicContact CG1-CB 4.46Å; D317-L320 HydrophobicContact CB-CD1 4.41Å; D317-L320 HydrophobicContact CB-CG 4.39Å; D317-L320 PolarHBondContact O-N 3.33Å; P318-L320 VanDerWaalsContact C-N 3.29Å; P318-L320 PolarHBondContact O-N 3.27Å; L320-T322 PolarHBondContact O-N 3.35Å; L320-T322 VanDerWaalsContact O-N 3.15Å; L320-H323 PolarHBondContact O-N 3.05Å; L320-L324 WeakPolarHBondContact O-CG 3.25Å; L320-L324 PolarHBondContact O-N 3Å; L320-A366 HydrophobicContact CD1-CB 3.95Å; L320-W369 HydrophobicContact CD1-CB 4.39Å; L320-W369 HydrophobicContact CD1-CG 4.47Å; L320-W405 HydrophobicContact CD2-CB 3.88Å; L320-L406 HydrophobicContact CD1-CD2 4.06Å; L320-L406 HydrophobicContact CD2-CD2 4.03Å; L320-L406 HydrophobicContact CG-CD2 4.23Å
321	T	90.3	Very high	91.2	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-26.8	-174.6	61.6	0	0	0	0	114.1	L291 V316 D317 P318 H323 L324 R329	L291-T321 HydrophobicContact CB-CG2 3.69Å; V316-T321 HydrophobicContact CB-CG2 3.61Å; V316-T321 HydrophobicContact CG1-CG2 3.68Å; D317-T321 PolarHBondContact O-N 2.86Å; D317-T321 VanDerWaalsContact O-N 3.08Å; P318-T321 VanDerWaalsContact CA-OG1 3.31Å; P318-T321 WeakPolarHBondContact CA-OG1 3.33Å; P318-T321 PolarHBondContact O-N 3.46Å; P318-T321 PolarHBondContact O-OG1 2.92Å; T321-H323 PolarHBondContact O-N 3.25Å; T321-L324 PolarHBondContact O-N 3.17Å; T321-R329 PolarHBondContact O-NH1 3.41Å; T321-R329 VanDerWaalsContact O-NH1 3.11Å
322	T	89.4	Confident	91.6	Very high	112 Å²	112	37.3 Å²	37.3	69%	0.687	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-30.2	175.3	-55.4	0	0	0	0	112.3	P318 L320	P318-T322 PolarHBondContact O-N 2.91Å; P318-T322 PolarHBondContact O-OG1 3.41Å; L320-T322 PolarHBondContact O-N 3.35Å; L320-T322 VanDerWaalsContact O-N 3.15Å
323	H	89.6	Confident	91.8	Very high	97 Å²	97	39.1 Å²	39.1	45%	0.449	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-8.3	-177.8	-64.4	-66.8	0	0	0	113.8	H319 L320 T321 W405	H319-H323 PolarHBondContact O-CD2 2.92Å; H319-H323 VanDerWaalsContact O-CD2 3.32Å; L320-H323 PolarHBondContact O-N 3.05Å; T321-H323 PolarHBondContact O-N 3.25Å; H323-W405 HydrophobicContact CB-CE3 4.45Å; H323-W405 HydrophobicContact CB-CH2 4.17Å; H323-W405 HydrophobicContact CB-CZ3 3.56Å; H323-W405 AromaticContact CG-CZ3 3.74Å
324	L	91.4	Very high	92.1	Very high	9 Å²	9	38.3 Å²	38.3	5%	0.047	19%	0.193	C	C	.	.			trans	-79.1	128.9	-178.7	-68.7	173.6	0	0	0	112.1	L291 L320 T321 Q328 R329 I332 L362	L291-L324 HydrophobicContact CD2-CD1 4.3Å; L320-L324 WeakPolarHBondContact O-CG 3.25Å; L320-L324 PolarHBondContact O-N 3Å; T321-L324 PolarHBondContact O-N 3.17Å; L324-Q328 HydrophobicContact CB-CB 4.43Å; L324-Q328 HydrophobicContact CD2-CB 3.91Å; L324-R329 HydrophobicContact CB-CG 3.85Å; L324-I332 HydrophobicContact CD1-CD1 3.32Å; L324-I332 HydrophobicContact CD2-CD1 3.76Å; L324-I332 HydrophobicContact CG-CD1 4.21Å; L324-L362 HydrophobicContact CD2-CD1 4.43Å; L324-L362 HydrophobicContact CD2-CD2 3.81Å; L324-L362 HydrophobicContact CD2-CG 3.78Å
325	R	90.3	Very high	92.2	Very high	107 Å²	107	38.1 Å²	38.1	40%	0.404	19%	0.192	S	C	.	.			trans	-73.9	159.5	170.5	-59.4	-58.8	-174.1	-164.4	1.9	111.7	H327 Q328 R329	R325-H327 PolarHBondContact O-N 3.31Å; R325-Q328 HydrophobicContact CB-CG 4.26Å; R325-Q328 WeakPolarHBondContact O-CA 3.28Å; R325-Q328 WeakPolarHBondContact O-CB 3.39Å; R325-Q328 PolarHBondContact O-N 2.96Å; R325-R329 WeakPolarHBondContact O-CG 3.34Å; R325-R329 PolarHBondContact O-N 3.13Å
326	P	91.3	Very high	92.3	Very high	70 Å²	70	38.2 Å²	38.2	46%	0.455	19%	0.192	S	C	.	.	H	α-helix	trans	-51.6	-48.7	-177.5	-29.2	36.3	0	0	0	113.8	Q328 R329 E330	P326-Q328 VanDerWaalsContact C-N 3.31Å; P326-Q328 PolarHBondContact O-N 3.05Å; P326-R329 WeakPolarHBondContact O-CB 3.43Å; P326-R329 PolarHBondContact O-N 3.3Å; P326-R329 VanDerWaalsContact O-N 3.13Å; P326-E330 PolarHBondContact O-N 3.3Å; P326-E330 VanDerWaalsContact O-N 3.15Å
327	H	90.6	Very high	92.3	Very high	6 Å²	6	40.3 Å²	40.3	3%	0.028	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-40.3	176.9	70.4	-74.3	0	0	0	111.3	R325 R329 E330 G331 L358 R558 I562	R325-H327 PolarHBondContact O-N 3.31Å; H327-R329 VanDerWaalsContact C-N 3.26Å; H327-R329 PolarHBondContact O-N 2.87Å; H327-E330 PolarHBondContact O-N 2.97Å; H327-G331 PolarHBondContact O-N 3.27Å; H327-L358 PolarHBondContact NE2-O 2.87Å; H327-R558 VanDerWaalsContact C-NH1 3.34Å; H327-R558 PolarHBondContact O-NH1 3Å; H327-I562 HydrophobicContact CB-CG2 4.02Å
328	Q	93.1	Very high	92.4	Very high	12 Å²	12	40 Å²	40	6%	0.056	20%	0.2	C	C	.	.	H	α-helix	trans	-63.3	-34.7	178.6	-61.9	172.1	-27.4	0	0	112.1	L324 R325 P326 G331 I332 L358 Q363	L324-Q328 HydrophobicContact CB-CB 4.43Å; L324-Q328 HydrophobicContact CD2-CB 3.91Å; R325-Q328 HydrophobicContact CB-CG 4.26Å; R325-Q328 WeakPolarHBondContact O-CA 3.28Å; R325-Q328 WeakPolarHBondContact O-CB 3.39Å; R325-Q328 PolarHBondContact O-N 2.96Å; P326-Q328 VanDerWaalsContact C-N 3.31Å; P326-Q328 PolarHBondContact O-N 3.05Å; Q328-G331 PolarHBondContact O-N 2.93Å; Q328-I332 WeakPolarHBondContact O-CD1 3.44Å; Q328-I332 VanDerWaalsContact O-CG1 3.29Å; Q328-I332 WeakPolarHBondContact O-CG1 3.41Å; Q328-I332 PolarHBondContact O-N 3.21Å; Q328-L358 PolarHBondContact NE2-O 2.8Å; Q328-L358 VanDerWaalsContact NE2-O 3.13Å; Q328-Q363 HydrophobicContact CB-CG 3.89Å; Q328-Q363 HydrophobicContact CG-CG 4.1Å
329	R	94	Very high	92.4	Very high	63 Å²	63	37.3 Å²	37.3	24%	0.238	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-47.7	175.5	-59.4	168	97.8	108.8	2.6	111	G289 L291 T321 L324 R325 P326 H327 G331 I332 L333	G289-R329 PolarHBondContact O-NH2 3.08Å; L291-R329 HydrophobicContact CD1-CB 4.14Å; L291-R329 HydrophobicContact CD2-CB 4.04Å; L291-R329 HydrophobicContact CD2-CG 4.25Å; T321-R329 PolarHBondContact O-NH1 3.41Å; T321-R329 VanDerWaalsContact O-NH1 3.11Å; L324-R329 HydrophobicContact CB-CG 3.85Å; R325-R329 WeakPolarHBondContact O-CG 3.34Å; R325-R329 PolarHBondContact O-N 3.13Å; P326-R329 WeakPolarHBondContact O-CB 3.43Å; P326-R329 PolarHBondContact O-N 3.3Å; P326-R329 VanDerWaalsContact O-N 3.13Å; H327-R329 VanDerWaalsContact C-N 3.26Å; H327-R329 PolarHBondContact O-N 2.87Å; R329-G331 VanDerWaalsContact C-N 3.29Å; R329-G331 PolarHBondContact O-N 3.29Å; R329-I332 PolarHBondContact O-N 3.09Å; R329-L333 WeakPolarHBondContact O-CG 3.39Å; R329-L333 PolarHBondContact O-N 2.83Å
330	E	92.8	Very high	92.4	Very high	115 Å²	115	34 Å²	34	54%	0.537	17%	0.167	S	C	.	.	H	α-helix	trans	-59.9	-39.4	174.2	-67.6	172.5	-179.6	0	0	112.1	P326 H327 L333 F334	P326-E330 PolarHBondContact O-N 3.3Å; P326-E330 VanDerWaalsContact O-N 3.15Å; H327-E330 PolarHBondContact O-N 2.97Å; E330-L333 WeakPolarHBondContact O-CB 3.37Å; E330-L333 PolarHBondContact O-N 2.84Å; E330-F334 WeakPolarHBondContact O-CB 3.49Å; E330-F334 PolarHBondContact O-N 2.74Å
331	G	94.1	Very high	92.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.6	-36.6	179.4	0	0	0	0	0	112.9	H327 Q328 R329 L335	H327-G331 PolarHBondContact O-N 3.27Å; Q328-G331 PolarHBondContact O-N 2.93Å; R329-G331 VanDerWaalsContact C-N 3.29Å; R329-G331 PolarHBondContact O-N 3.29Å; G331-L335 WeakPolarHBondContact O-CB 3.26Å; G331-L335 VanDerWaalsContact O-CG 3.23Å; G331-L335 WeakPolarHBondContact O-CG 3.38Å; G331-L335 PolarHBondContact O-N 3.5Å
332	I	95.1	Very high	92.1	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-68.8	-41.7	174.2	-65.7	158.4	0	0	0	110.9	M293 V316 L324 Q328 R329 L335 Y336 Q363 A366	M293-I332 HydrophobicContact CE-CG2 3.64Å; V316-I332 HydrophobicContact CG2-CG2 4.37Å; L324-I332 HydrophobicContact CD1-CD1 3.32Å; L324-I332 HydrophobicContact CD2-CD1 3.76Å; L324-I332 HydrophobicContact CG-CD1 4.21Å; Q328-I332 WeakPolarHBondContact O-CD1 3.44Å; Q328-I332 VanDerWaalsContact O-CG1 3.29Å; Q328-I332 WeakPolarHBondContact O-CG1 3.41Å; Q328-I332 PolarHBondContact O-N 3.21Å; R329-I332 PolarHBondContact O-N 3.09Å; I332-L335 PolarHBondContact O-N 3.05Å; I332-Y336 WeakPolarHBondContact O-CB 3.5Å; I332-Y336 PolarHBondContact O-N 2.79Å; I332-Q363 HydrophobicContact CG1-CB 3.99Å; I332-Q363 HydrophobicContact CG1-CG 4.27Å; I332-A366 HydrophobicContact CD1-CB 3.61Å; I332-A366 HydrophobicContact CG1-CB 4.24Å
333	L	94.6	Very high	91.8	Very high	47 Å²	47	36.1 Å²	36.1	25%	0.246	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-50.6	174.2	-72.9	166.3	0	0	0	110.7	L291 M293 R329 E330 L335 Y336 E337	L291-L333 HydrophobicContact CD1-CD1 3.96Å; L291-L333 HydrophobicContact CD1-CD2 4.16Å; L291-L333 HydrophobicContact CD1-CG 4.02Å; M293-L333 HydrophobicContact CE-CD2 3.95Å; M293-L333 HydrophobicContact CE-CG 4.43Å; M293-L333 HydrophobicContact SD-CD2 3.87Å; R329-L333 WeakPolarHBondContact O-CG 3.39Å; R329-L333 PolarHBondContact O-N 2.83Å; E330-L333 WeakPolarHBondContact O-CB 3.37Å; E330-L333 PolarHBondContact O-N 2.84Å; L333-L335 PolarHBondContact O-N 3.23Å; L333-Y336 PolarHBondContact O-N 3.33Å; L333-E337 WeakPolarHBondContact O-CG 3.16Å; L333-E337 PolarHBondContact O-N 2.91Å
334	F	94.8	Very high	91.2	Very high	9 Å²	9	32.2 Å²	32.2	4%	0.039	15%	0.15	C	C	.	.	H	α-helix	trans	-56.2	-50.9	176.4	173.4	-94.2	0	0	0	112.2	E330 Y336 E337 C338 F554 L556	E330-F334 WeakPolarHBondContact O-CB 3.49Å; E330-F334 PolarHBondContact O-N 2.74Å; F334-Y336 VanDerWaalsContact C-N 3.3Å; F334-Y336 PolarHBondContact O-N 3.09Å; F334-E337 PolarHBondContact O-N 3.25Å; F334-C338 PolarHBondContact O-N 3Å; F334-C338 PolarHBondContact O-SG 3.48Å; F334-C338 VanDerWaalsContact O-SG 3.34Å; F334-F554 VanDerWaalsContact CZ-C 3.46Å; F334-L556 HydrophobicContact CB-CD2 3.96Å; F334-L556 HydrophobicContact CD1-CB 3.57Å; F334-L556 HydrophobicContact CD1-CD2 3.88Å; F334-L556 HydrophobicContact CD1-CG 4.35Å; F334-L556 HydrophobicContact CD2-CB 4.29Å; F334-L556 HydrophobicContact CE1-CB 3.41Å; F334-L556 VanDerWaalsContact CE1-CB 3.41Å; F334-L556 HydrophobicContact CE2-CB 4.15Å; F334-L556 HydrophobicContact CG-CB 4.01Å; F334-L556 HydrophobicContact CG-CD2 3.89Å; F334-L556 HydrophobicContact CG-CG 4.47Å; F334-L556 HydrophobicContact CZ-CB 3.71Å
335	L	95	Very high	90.2	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-41.4	179.2	-75.9	174.1	0	0	0	111.9	G331 I332 L333 V339 A350 L352 Q363 L367 V484	G331-L335 WeakPolarHBondContact O-CB 3.26Å; G331-L335 VanDerWaalsContact O-CG 3.23Å; G331-L335 WeakPolarHBondContact O-CG 3.38Å; G331-L335 PolarHBondContact O-N 3.5Å; I332-L335 PolarHBondContact O-N 3.05Å; L333-L335 PolarHBondContact O-N 3.23Å; L335-V339 VanDerWaalsContact O-CB 3.25Å; L335-V339 WeakPolarHBondContact O-CB 3.4Å; L335-V339 WeakPolarHBondContact O-CG2 3.49Å; L335-V339 PolarHBondContact O-N 3.31Å; L335-A350 HydrophobicContact CD2-CB 3.76Å; L335-L352 HydrophobicContact CD1-CD2 4.26Å; L335-L352 HydrophobicContact CD2-CB 4.34Å; L335-Q363 HydrophobicContact CD1-CB 4.44Å; L335-L367 HydrophobicContact CB-CD1 4.16Å; L335-L367 HydrophobicContact CB-CD2 3.9Å; L335-L367 HydrophobicContact CD1-CD2 4.26Å; L335-V484 HydrophobicContact CD2-CG1 3.85Å; L335-V484 HydrophobicContact CD2-CG2 4.46Å
336	Y	94.4	Very high	89.4	Confident	3 Å²	3	33.4 Å²	33.4	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-47.4	177.3	177	-93.4	0	0	0	111.4	M293 P294 V314 I332 L333 F334 C338 V339 M340 M342 L371	M293-Y336 HydrophobicContact CB-CD1 3.81Å; M293-Y336 HydrophobicContact CB-CE1 3.58Å; M293-Y336 HydrophobicContact CB-CE2 4.34Å; M293-Y336 HydrophobicContact CB-CG 4.28Å; M293-Y336 HydrophobicContact CG-CD1 4Å; M293-Y336 HydrophobicContact CG-CD2 4.05Å; M293-Y336 HydrophobicContact CG-CE1 4.12Å; M293-Y336 HydrophobicContact CG-CE2 4.16Å; M293-Y336 HydrophobicContact CG-CG 3.96Å; M293-Y336 VanDerWaalsContact SD-CB 3.52Å; M293-Y336 HydrophobicContact SD-CD1 3.72Å; M293-Y336 HydrophobicContact SD-CD2 4.02Å; M293-Y336 HydrophobicContact SD-CE1 4.43Å; M293-Y336 HydrophobicContact SD-CG 3.47Å; P294-Y336 HydrophobicContact CG-CD1 4.2Å; P294-Y336 HydrophobicContact CG-CE1 4.4Å; V314-Y336 HydrophobicContact CG1-CE2 4.28Å; I332-Y336 WeakPolarHBondContact O-CB 3.5Å; I332-Y336 PolarHBondContact O-N 2.79Å; L333-Y336 PolarHBondContact O-N 3.33Å; F334-Y336 VanDerWaalsContact C-N 3.3Å; F334-Y336 PolarHBondContact O-N 3.09Å; Y336-C338 VanDerWaalsContact C-N 3.34Å; Y336-C338 PolarHBondContact O-N 3.19Å; Y336-V339 PolarHBondContact O-N 2.86Å; Y336-M340 HydrophobicContact CD1-CG 4.25Å; Y336-M340 HydrophobicContact CD2-CG 4Å; Y336-M340 HydrophobicContact CE1-CG 3.98Å; Y336-M340 HydrophobicContact CE2-CG 3.71Å; Y336-M340 HydrophobicContact CE2-SD 4.28Å; Y336-M340 HydrophobicContact CG-CG 4.27Å; Y336-M340 VanDerWaalsContact O-CB 3.26Å; Y336-M340 WeakPolarHBondContact O-CB 3.35Å; Y336-M340 WeakPolarHBondContact O-CG 3.41Å; Y336-M340 PolarHBondContact O-N 3.34Å; Y336-M342 HydrophobicContact CE1-CE 3.73Å; Y336-M342 HydrophobicContact CE1-SD 4.18Å; Y336-L371 HydrophobicContact CD2-CD2 4.22Å; Y336-L371 HydrophobicContact CE2-CD2 4.25Å
337	E	92.7	Very high	89.1	Confident	45 Å²	45	33.7 Å²	33.7	21%	0.21	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-42.7	178.1	-70.6	176.4	147.1	0	0	112.4	P294 L333 F334 G341 M342 R343	P294-E337 HydrophobicContact CG-CG 3.49Å; P294-E337 VanDerWaalsContact CG-CG 3.49Å; L333-E337 WeakPolarHBondContact O-CG 3.16Å; L333-E337 PolarHBondContact O-N 2.91Å; F334-E337 PolarHBondContact O-N 3.25Å; E337-G341 PolarHBondContact O-N 3.29Å; E337-M342 HydrophobicContact CB-CB 4.4Å; E337-M342 WeakPolarHBondContact O-CB 3.41Å; E337-M342 PolarHBondContact O-N 3.5Å; E337-R343 HydrophobicContact CB-CG 4Å; E337-R343 IonicContact OE2-CZ 2.75Å; E337-R343 IonicContact OE2-NE 3.62Å; E337-R343 PolarHBondContact OE2-NE 3.04Å; E337-R343 IonicContact OE2-NH2 3.27Å; E337-R343 PolarHBondContact OE2-NH2 3.42Å
338	C	93	Very high	89.1	Confident	4 Å²	4	34.5 Å²	34.5	3%	0.027	19%	0.185	C	C	.	.	H	α-helix	trans	-65.9	-50.5	176.2	-66.4	0	0	0	0	111.7	F334 Y336 M340 G341 H348 A350	F334-C338 PolarHBondContact O-N 3Å; F334-C338 PolarHBondContact O-SG 3.48Å; F334-C338 VanDerWaalsContact O-SG 3.34Å; Y336-C338 VanDerWaalsContact C-N 3.34Å; Y336-C338 PolarHBondContact O-N 3.19Å; C338-M340 PolarHBondContact O-N 2.99Å; C338-G341 PolarHBondContact O-N 3.33Å; C338-H348 CarbonylContact O-C 3.56Å; C338-H348 WeakPolarHBondContact O-CA 3.41Å; C338-A350 HydrophobicContact CB-CB 3.55Å
339	V	92.8	Very high	89	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.1	-25.6	-175.5	170.9	0	0	0	0	112.6	L335 Y336 L367 L371 L455 R482 V484	L335-V339 VanDerWaalsContact O-CB 3.25Å; L335-V339 WeakPolarHBondContact O-CB 3.4Å; L335-V339 WeakPolarHBondContact O-CG2 3.49Å; L335-V339 PolarHBondContact O-N 3.31Å; Y336-V339 PolarHBondContact O-N 2.86Å; V339-L367 HydrophobicContact CG2-CD2 4.34Å; V339-L371 HydrophobicContact CG1-CD1 3.78Å; V339-L455 HydrophobicContact CG1-CD1 4.24Å; V339-L455 HydrophobicContact CG2-CD1 4.44Å; V339-R482 HydrophobicContact CG1-CB 3.97Å; V339-R482 VanDerWaalsContact CG1-CD 3.44Å; V339-R482 HydrophobicContact CG1-CG 3.73Å; V339-R482 WeakPolarHBondContact O-CG 3.21Å; V339-R482 PolarHBondContact O-NE 3.13Å; V339-V484 HydrophobicContact CG2-CG2 3.6Å
340	M	90.3	Very high	89	Confident	8 Å²	8	31 Å²	31	4%	0.039	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-7.8	172.9	-66.5	-58.9	-65.7	0	0	113.4	H300 Y336 C338 M342 L371 P376 V382	H300-M340 PolarHBondContact NE2-O 2.88Å; Y336-M340 HydrophobicContact CD1-CG 4.25Å; Y336-M340 HydrophobicContact CD2-CG 4Å; Y336-M340 HydrophobicContact CE1-CG 3.98Å; Y336-M340 HydrophobicContact CE2-CG 3.71Å; Y336-M340 HydrophobicContact CE2-SD 4.28Å; Y336-M340 HydrophobicContact CG-CG 4.27Å; Y336-M340 VanDerWaalsContact O-CB 3.26Å; Y336-M340 WeakPolarHBondContact O-CB 3.35Å; Y336-M340 WeakPolarHBondContact O-CG 3.41Å; Y336-M340 PolarHBondContact O-N 3.34Å; C338-M340 PolarHBondContact O-N 2.99Å; M340-M342 HydrophobicContact CB-CE 3.77Å; M340-M342 HydrophobicContact CB-CG 3.94Å; M340-M342 HydrophobicContact CB-SD 4.26Å; M340-M342 HydrophobicContact CG-CE 4.2Å; M340-L371 HydrophobicContact SD-CD2 4.16Å; M340-P376 HydrophobicContact CE-CG 3.6Å; M340-V382 HydrophobicContact CE-CG2 4.19Å; M340-V382 HydrophobicContact SD-CG1 3.9Å; M340-V382 HydrophobicContact SD-CG2 4Å
341	G	88.2	Confident	89	Confident	3 Å²	3	25.6 Å²	25.6	3%	0.031	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	28.1	-177.9	0	0	0	0	0	113.8	E337 C338 R347	E337-G341 PolarHBondContact O-N 3.29Å; C338-G341 PolarHBondContact O-N 3.33Å; G341-R347 VanDerWaalsContact CA-O 3.28Å; G341-R347 WeakPolarHBondContact CA-O 3.29Å
342	M	87.2	Confident	88.9	Confident	49 Å²	49	25.6 Å²	25.6	24%	0.241	15%	0.147	C	C	.	.	S	Bend	trans	-83.6	-28.7	179.7	-60.8	-179.9	-179.5	0	0	112.6	P294 P296 Y336 E337 M340	P294-M342 HydrophobicContact CG-SD 4.36Å; P296-M342 HydrophobicContact CB-CE 4.15Å; P296-M342 HydrophobicContact CG-CE 3.78Å; Y336-M342 HydrophobicContact CE1-CE 3.73Å; Y336-M342 HydrophobicContact CE1-SD 4.18Å; E337-M342 HydrophobicContact CB-CB 4.4Å; E337-M342 WeakPolarHBondContact O-CB 3.41Å; E337-M342 PolarHBondContact O-N 3.5Å; M340-M342 HydrophobicContact CB-CE 3.77Å; M340-M342 HydrophobicContact CB-CG 3.94Å; M340-M342 HydrophobicContact CB-SD 4.26Å; M340-M342 HydrophobicContact CG-CE 4.2Å
343	R	83.6	Confident	88.5	Confident	110 Å²	110	25.6 Å²	25.6	42%	0.415	15%	0.147	S	C	.	.	S	Bend	trans	-85.1	-39.5	177.5	-78.6	-179.3	177.2	-114.1	-5.7	113.7	E337 M553	E337-R343 HydrophobicContact CB-CG 4Å; E337-R343 IonicContact OE2-CZ 2.75Å; E337-R343 IonicContact OE2-NE 3.62Å; E337-R343 PolarHBondContact OE2-NE 3.04Å; E337-R343 IonicContact OE2-NH2 3.27Å; E337-R343 PolarHBondContact OE2-NH2 3.42Å; R343-M553 VanDerWaalsContact CD-O 3.24Å; R343-M553 WeakPolarHBondContact CD-O 3.4Å
344	A	75.7	Confident	88.1	Confident	15 Å²	15	23.3 Å²	23.3	12%	0.124	14%	0.135	C	C	.	.	S	Bend	trans	-130.6	110.1	-179.7	0	0	0	0	0	108.8	G346 R347	A344-G346 PolarHBondContact O-N 2.97Å; A344-R347 HydrophobicContact CB-CB 3.88Å; A344-R347 PolarHBondContact O-N 2.64Å; A344-R347 VanDerWaalsContact O-O 3.05Å
345	A	71.7	Confident	87.2	Confident	90 Å²	90	24.7 Å²	24.7	74%	0.744	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	130.5	-177.2	0	0	0	0	0	110.9	R347	A345-R347 PolarHBondContact O-N 3.45Å
346	G	73	Confident	86.3	Confident	51 Å²	51	26.8 Å²	26.8	53%	0.526	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	-4.3	-178.9	0	0	0	0	0	115.6	A344 H348	A344-G346 PolarHBondContact O-N 2.97Å; G346-H348 PolarHBondContact O-ND1 2.88Å
347	R	84.9	Confident	85.4	Confident	76 Å²	76	27.9 Å²	27.9	29%	0.287	16%	0.164	S	C	.	.			trans	-115.7	132.6	-177.8	-68.6	179.8	-179.1	145.7	2.5	110.2	G341 A344 A345 N506 I509	G341-R347 VanDerWaalsContact CA-O 3.28Å; G341-R347 WeakPolarHBondContact CA-O 3.29Å; A344-R347 HydrophobicContact CB-CB 3.88Å; A344-R347 PolarHBondContact O-N 2.64Å; A344-R347 VanDerWaalsContact O-O 3.05Å; A345-R347 PolarHBondContact O-N 3.45Å; R347-N506 WeakPolarHBondContact CB-OD1 3.49Å; R347-I509 VanDerWaalsContact NH1-CD1 3.27Å
348	H	89.9	Confident	84.9	Confident	24 Å²	24	25.8 Å²	25.8	11%	0.111	15%	0.154	C	C	.	.			trans	-125.9	15.1	-169.2	-52.8	83.9	0	0	0	113.2	H304 C338 G346 R482 N506	H304-H348 AromaticContact CE1-NE2 3.56Å; C338-H348 CarbonylContact O-C 3.56Å; C338-H348 WeakPolarHBondContact O-CA 3.41Å; G346-H348 PolarHBondContact O-ND1 2.88Å; H348-R482 HydrophobicContact CB-CG 3.88Å; H348-N506 PolarHBondContact N-OD1 3.45Å
349	G	91.7	Very high	84.6	Confident	2 Å²	2	26.7 Å²	26.7	2%	0.021	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	146.8	-176.6	0	0	0	0	0	113.2	R483 N506	G349-R483 CarbonylContact C-O 3.57Å; G349-R483 WeakPolarHBondContact CA-O 3.41Å; G349-N506 VanDerWaalsContact CA-OD1 3.31Å; G349-N506 WeakPolarHBondContact CA-OD1 3.41Å; G349-N506 PolarHBondContact N-OD1 3.36Å; G349-N506 PolarHBondContact O-ND2 3.43Å
350	A	93.8	Very high	84.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	148.5	177.5	0	0	0	0	0	112.2	L335 C338 R483 V484 I485 V505 F554	L335-A350 HydrophobicContact CD2-CB 3.76Å; C338-A350 HydrophobicContact CB-CB 3.55Å; A350-R483 PolarHBondContact N-O 3.06Å; A350-V484 HydrophobicContact CB-CG2 4.34Å; A350-V484 CarbonylContact O-C 3.57Å; A350-V484 VanDerWaalsContact O-CA 3.3Å; A350-V484 WeakPolarHBondContact O-CA 3.32Å; A350-I485 PolarHBondContact O-N 2.75Å; A350-V505 VanDerWaalsContact N-CG1 3.32Å; A350-F554 CarbonylContact C-O 3.58Å; A350-F554 WeakPolarHBondContact CA-O 3.49Å
351	I	92.1	Very high	84.5	Confident	1 Å²	1	29 Å²	29	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113.5	174.1	-55.6	175.1	0	0	0	108.1	A353 I485 T487 I501 I502 V505 F554 I555 L556	I351-A353 HydrophobicContact CG2-CB 4.32Å; I351-I485 CarbonylContact C-O 3.58Å; I351-I485 WeakPolarHBondContact CA-O 3.44Å; I351-I485 HydrophobicContact CG1-CB 4.37Å; I351-I485 HydrophobicContact CG2-CB 4.48Å; I351-I485 HydrophobicContact CG2-CG2 4.31Å; I351-T487 HydrophobicContact CG2-CG2 4.14Å; I351-I501 HydrophobicContact CD1-CG2 3.72Å; I351-I502 HydrophobicContact CD1-CG1 4.27Å; I351-V505 HydrophobicContact CD1-CG2 4.28Å; I351-V505 HydrophobicContact CG1-CB 4.47Å; I351-V505 HydrophobicContact CG1-CG1 4.22Å; I351-V505 HydrophobicContact CG1-CG2 3.99Å; I351-F554 HydrophobicContact CD1-CD2 4.42Å; I351-F554 HydrophobicContact CD1-CE2 4.31Å; I351-F554 PolarHBondContact N-O 3.16Å; I351-I555 HydrophobicContact CB-CB 4.4Å; I351-I555 HydrophobicContact CB-CG1 3.98Å; I351-I555 HydrophobicContact CB-CG2 4.31Å; I351-I555 HydrophobicContact CD1-CD1 3.79Å; I351-I555 HydrophobicContact CD1-CG1 3.89Å; I351-I555 HydrophobicContact CG1-CG1 4.3Å; I351-I555 HydrophobicContact CG2-CG2 4.3Å; I351-I555 WeakPolarHBondContact O-CA 3.43Å; I351-L556 PolarHBondContact O-N 3.37Å
352	L	92	Very high	84.8	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	98.9	170.2	-170.3	66	0	0	0	108.9	L335 D354 K360 Q363 I485 L486 T487 L556	L335-L352 HydrophobicContact CD1-CD2 4.26Å; L335-L352 HydrophobicContact CD2-CB 4.34Å; L352-D354 HydrophobicContact CG-CB 4.42Å; L352-K360 HydrophobicContact CD2-CB 3.93Å; L352-K360 HydrophobicContact CD2-CD 4.28Å; L352-K360 HydrophobicContact CD2-CG 3.74Å; L352-K360 HydrophobicContact CG-CD 4.25Å; L352-K360 HydrophobicContact CG-CG 4.15Å; L352-Q363 HydrophobicContact CD2-CB 4.34Å; L352-I485 PolarHBondContact N-O 3.17Å; L352-L486 HydrophobicContact CB-CD2 3.86Å; L352-L486 HydrophobicContact CD2-CD2 4.16Å; L352-T487 PolarHBondContact O-N 3.11Å; L352-L556 HydrophobicContact CD1-CB 4.21Å; L352-L556 HydrophobicContact CD1-CD2 3.92Å; L352-L556 HydrophobicContact CD1-CG 4.27Å
353	A	87.4	Confident	85.1	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.167	C	C	.	.			trans	-100	21.8	-176.5	0	0	0	0	0	113.2	I351 T487 P490 I555 L556 R557	I351-A353 HydrophobicContact CG2-CB 4.32Å; A353-T487 CarbonylContact C-O 3.6Å; A353-T487 VanDerWaalsContact CA-O 3.25Å; A353-T487 WeakPolarHBondContact CA-O 3.2Å; A353-T487 HydrophobicContact CB-CG2 4.04Å; A353-P490 HydrophobicContact CB-CB 3.7Å; A353-P490 HydrophobicContact CB-CG 3.65Å; A353-I555 HydrophobicContact CB-CG2 4.08Å; A353-L556 CarbonylContact C-O 3.57Å; A353-L556 WeakPolarHBondContact CA-O 3.45Å; A353-L556 WeakPolarHBondContact CB-O 3.35Å; A353-L556 PolarHBondContact N-O 2.98Å; A353-R557 HydrophobicContact CB-CB 4.06Å; A353-R557 HydrophobicContact CB-CG 4.49Å; A353-R557 WeakPolarHBondContact O-CG 3.29Å
354	D	85.4	Confident	85.7	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-53.1	140.5	172.8	-75.1	-11.2	0	0	0	111.4	L352 L358 K360 Q363 R558	L352-D354 HydrophobicContact CG-CB 4.42Å; D354-L358 HydrophobicContact CB-CB 4.16Å; D354-L358 HydrophobicContact CB-CD1 3.84Å; D354-K360 HydrophobicContact CB-CD 4.01Å; D354-K360 HydrophobicContact CB-CG 3.8Å; D354-K360 PolarHBondContact O-NZ 3.06Å; D354-Q363 PolarHBondContact OD2-NE2 3.31Å; D354-Q363 VanDerWaalsContact OD2-NE2 3.09Å; D354-R558 VanDerWaalsContact CG-NH2 3.33Å; D354-R558 WeakPolarHBondContact OD1-CB 3.24Å; D354-R558 IonicContact OD1-CZ 2.92Å; D354-R558 IonicContact OD1-NE 3.81Å; D354-R558 PolarHBondContact OD1-NE 3.42Å; D354-R558 IonicContact OD1-NH2 3.2Å; D354-R558 PolarHBondContact OD1-NH2 3.07Å; D354-R558 IonicContact OD2-CZ 2.68Å; D354-R558 IonicContact OD2-NE 2.71Å; D354-R558 IonicContact OD2-NH2 2.75Å; D354-R558 PolarHBondContact OD2-NH2 3.33Å
355	E	76.6	Confident	86.6	Confident	37 Å²	37	21 Å²	21	17%	0.173	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-57	157.2	173.2	-75.2	-177.3	178.9	0	0	112.7	G357 L358 K360 R558 T559 Q560	E355-G357 PolarHBondContact O-N 2.94Å; E355-L358 HydrophobicContact CB-CD1 4.41Å; E355-L358 PolarHBondContact O-N 3.48Å; E355-K360 PolarHBondContact O-NZ 3.1Å; E355-R558 PolarHBondContact N-O 3.11Å; E355-T559 WeakPolarHBondContact OE2-CA 3.23Å; E355-Q560 HydrophobicContact CB-CG 3.95Å; E355-Q560 WeakPolarHBondContact OE2-CG 3.38Å; E355-Q560 PolarHBondContact OE2-N 2.75Å
356	M	76.1	Confident	87.7	Confident	45 Å²	45	16.8 Å²	16.8	22%	0.222	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	133.9	179.2	-60.7	-174.7	71.3	0	0	109.9	Q560 Q773	M356-Q560 PolarHBondContact O-NE2 3.39Å; M356-Q773 HydrophobicContact CE-CG 4.28Å; M356-Q773 HydrophobicContact SD-CG 4.44Å
357	G	74.4	Confident	88.8	Confident	26 Å²	26	14.4 Å²	14.4	27%	0.268	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	103	-19.2	178.9	0	0	0	0	0	115.6	E355 G359	E355-G357 PolarHBondContact O-N 2.94Å; G357-G359 PolarHBondContact O-N 2.75Å; G357-G359 VanDerWaalsContact O-N 3.1Å
358	L	82.6	Confident	89.3	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	7%	0.067	C	C	.	.	S	Bend	trans	-72.5	-1.6	-179.6	-69.2	174.2	0	0	0	115.4	H327 Q328 D354 E355 R558 I563	H327-L358 PolarHBondContact NE2-O 2.87Å; Q328-L358 PolarHBondContact NE2-O 2.8Å; Q328-L358 VanDerWaalsContact NE2-O 3.13Å; D354-L358 HydrophobicContact CB-CB 4.16Å; D354-L358 HydrophobicContact CB-CD1 3.84Å; E355-L358 HydrophobicContact CB-CD1 4.41Å; E355-L358 PolarHBondContact O-N 3.48Å; L358-R558 HydrophobicContact CD1-CB 3.88Å; L358-R558 WeakPolarHBondContact CD1-O 3.39Å; L358-I563 HydrophobicContact CD2-CB 3.92Å; L358-I563 HydrophobicContact CD2-CG2 4.29Å
359	G	86.4	Confident	89.5	Confident	23 Å²	23	10.1 Å²	10.1	24%	0.237	6%	0.064	C	C	.	.			trans	83	42.1	175.8	0	0	0	0	0	114.7	G357 T361 L362 Q363	G357-G359 PolarHBondContact O-N 2.75Å; G357-G359 VanDerWaalsContact O-N 3.1Å; G359-T361 VanDerWaalsContact C-N 3.29Å; G359-T361 PolarHBondContact O-N 3.27Å; G359-L362 PolarHBondContact O-N 3.19Å; G359-Q363 PolarHBondContact O-N 3.35Å
360	K	91	Very high	89.6	Confident	19 Å²	19	10.1 Å²	10.1	8%	0.083	6%	0.063	C	C	.	.	H	α-helix	trans	-52.9	-43.6	175.4	-67	-170	-74.1	-79.9	0	112.9	L352 D354 E355 L362 Q363 S364 L486	L352-K360 HydrophobicContact CD2-CB 3.93Å; L352-K360 HydrophobicContact CD2-CD 4.28Å; L352-K360 HydrophobicContact CD2-CG 3.74Å; L352-K360 HydrophobicContact CG-CD 4.25Å; L352-K360 HydrophobicContact CG-CG 4.15Å; D354-K360 HydrophobicContact CB-CD 4.01Å; D354-K360 HydrophobicContact CB-CG 3.8Å; D354-K360 PolarHBondContact O-NZ 3.06Å; E355-K360 PolarHBondContact O-NZ 3.1Å; K360-L362 PolarHBondContact O-N 3.3Å; K360-Q363 WeakPolarHBondContact O-CB 3.35Å; K360-Q363 PolarHBondContact O-N 3.43Å; K360-S364 PolarHBondContact O-N 3.43Å; K360-S364 PolarHBondContact O-OG 3.31Å; K360-S364 VanDerWaalsContact O-OG 3.09Å; K360-L486 HydrophobicContact CD-CB 4.34Å
361	T	91.8	Very high	89.6	Confident	37 Å²	37	10.1 Å²	10.1	23%	0.227	6%	0.063	C	C	.	.	H	α-helix	trans	-59.4	-43.6	-179.8	-47.3	0	0	0	0	112.2	G359 S364 V365 W398 E401	G359-T361 VanDerWaalsContact C-N 3.29Å; G359-T361 PolarHBondContact O-N 3.27Å; T361-S364 PolarHBondContact O-N 3.35Å; T361-V365 HydrophobicContact CG2-CG2 4.48Å; T361-V365 VanDerWaalsContact O-CG2 3.28Å; T361-V365 WeakPolarHBondContact O-CG2 3.37Å; T361-V365 PolarHBondContact O-N 3.43Å; T361-W398 HydrophobicContact CG2-CD2 4.04Å; T361-W398 HydrophobicContact CG2-CE3 3.89Å; T361-W398 HydrophobicContact CG2-CH2 3.98Å; T361-W398 HydrophobicContact CG2-CZ2 4.07Å; T361-W398 HydrophobicContact CG2-CZ3 3.88Å; T361-E401 HydrophobicContact CG2-CB 4.05Å; T361-E401 HydrophobicContact CG2-CG 4.06Å
362	L	92.9	Very high	89.6	Confident	11 Å²	11	10.7 Å²	10.7	6%	0.058	7%	0.066	C	C	.	.	H	α-helix	trans	-63.8	-42.6	176.9	175.7	56.6	0	0	0	111.5	L324 G359 K360 S364 V365 A366 W405	L324-L362 HydrophobicContact CD2-CD1 4.43Å; L324-L362 HydrophobicContact CD2-CD2 3.81Å; L324-L362 HydrophobicContact CD2-CG 3.78Å; G359-L362 PolarHBondContact O-N 3.19Å; K360-L362 PolarHBondContact O-N 3.3Å; L362-S364 VanDerWaalsContact C-N 3.31Å; L362-S364 PolarHBondContact O-N 3.02Å; L362-V365 PolarHBondContact O-N 3.41Å; L362-A366 WeakPolarHBondContact O-CB 3.49Å; L362-A366 PolarHBondContact O-N 3.1Å; L362-W405 HydrophobicContact CD1-CB 4.48Å; L362-W405 HydrophobicContact CD1-CD2 3.6Å; L362-W405 HydrophobicContact CD1-CE3 4.12Å; L362-W405 HydrophobicContact CD1-CG 3.75Å; L362-W405 HydrophobicContact CD1-CZ2 4.2Å; L362-W405 HydrophobicContact CD2-CH2 4.04Å; L362-W405 HydrophobicContact CD2-CZ2 3.84Å
363	Q	94.9	Very high	89.6	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59.2	-43.5	175.1	-63.6	175.5	58.3	0	0	111	Q328 I332 L335 L352 D354 G359 K360 A366 L367	Q328-Q363 HydrophobicContact CB-CG 3.89Å; Q328-Q363 HydrophobicContact CG-CG 4.1Å; I332-Q363 HydrophobicContact CG1-CB 3.99Å; I332-Q363 HydrophobicContact CG1-CG 4.27Å; L335-Q363 HydrophobicContact CD1-CB 4.44Å; L352-Q363 HydrophobicContact CD2-CB 4.34Å; D354-Q363 PolarHBondContact OD2-NE2 3.31Å; D354-Q363 VanDerWaalsContact OD2-NE2 3.09Å; G359-Q363 PolarHBondContact O-N 3.35Å; K360-Q363 WeakPolarHBondContact O-CB 3.35Å; K360-Q363 PolarHBondContact O-N 3.43Å; Q363-A366 PolarHBondContact O-N 3.24Å; Q363-L367 WeakPolarHBondContact O-CB 3.39Å; Q363-L367 PolarHBondContact O-N 3.17Å
364	S	95.4	Very high	89.7	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-65.6	-43.2	176.1	-57.3	0	0	0	0	113.1	K360 T361 L362 A366 L367 C368 L486	K360-S364 PolarHBondContact O-N 3.43Å; K360-S364 PolarHBondContact O-OG 3.31Å; K360-S364 VanDerWaalsContact O-OG 3.09Å; T361-S364 PolarHBondContact O-N 3.35Å; L362-S364 VanDerWaalsContact C-N 3.31Å; L362-S364 PolarHBondContact O-N 3.02Å; S364-A366 VanDerWaalsContact C-N 3.33Å; S364-A366 PolarHBondContact O-N 3.32Å; S364-L367 PolarHBondContact O-N 3.4Å; S364-C368 WeakPolarHBondContact O-CB 3.2Å; S364-C368 PolarHBondContact O-N 3.26Å; S364-C368 PolarHBondContact O-SG 3.1Å; S364-L486 VanDerWaalsContact OG-CD1 3.29Å; S364-L486 WeakPolarHBondContact OG-CD1 3.09Å; S364-L486 WeakPolarHBondContact OG-CD2 3.18Å
365	V	95.3	Very high	89.9	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61.3	-43.1	176.6	170	0	0	0	0	110.7	T361 L362 C368 W369 W398 F402 W405 L406	T361-V365 HydrophobicContact CG2-CG2 4.48Å; T361-V365 VanDerWaalsContact O-CG2 3.28Å; T361-V365 WeakPolarHBondContact O-CG2 3.37Å; T361-V365 PolarHBondContact O-N 3.43Å; L362-V365 PolarHBondContact O-N 3.41Å; V365-C368 PolarHBondContact O-N 3.09Å; V365-W369 WeakPolarHBondContact O-CB 3.33Å; V365-W369 PolarHBondContact O-N 2.93Å; V365-W398 HydrophobicContact CG2-CZ3 4.48Å; V365-F402 HydrophobicContact CB-CD1 4.44Å; V365-F402 HydrophobicContact CB-CE1 4.22Å; V365-F402 HydrophobicContact CG1-CD1 3.84Å; V365-F402 HydrophobicContact CG1-CE1 3.97Å; V365-F402 HydrophobicContact CG2-CD1 3.93Å; V365-F402 HydrophobicContact CG2-CE1 3.79Å; V365-F402 HydrophobicContact CG2-CE2 4.37Å; V365-F402 HydrophobicContact CG2-CG 4.29Å; V365-F402 HydrophobicContact CG2-CZ 4.01Å; V365-W405 HydrophobicContact CG1-CB 4.47Å; V365-L406 HydrophobicContact CG1-CD1 3.86Å; V365-L406 HydrophobicContact CG1-CG 4.31Å
366	A	95.2	Very high	90.5	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64.3	-41.9	177.1	0	0	0	0	0	112.6	L320 I332 L362 Q363 S364 T370	L320-A366 HydrophobicContact CD1-CB 3.95Å; I332-A366 HydrophobicContact CD1-CB 3.61Å; I332-A366 HydrophobicContact CG1-CB 4.24Å; L362-A366 WeakPolarHBondContact O-CB 3.49Å; L362-A366 PolarHBondContact O-N 3.1Å; Q363-A366 PolarHBondContact O-N 3.24Å; S364-A366 VanDerWaalsContact C-N 3.33Å; S364-A366 PolarHBondContact O-N 3.32Å; A366-T370 WeakPolarHBondContact O-CB 3.48Å; A366-T370 PolarHBondContact O-N 2.94Å; A366-T370 PolarHBondContact O-OG1 3.34Å
367	L	95.4	Very high	91	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-61.5	-50.4	173.4	-178.9	73.6	0	0	0	111.3	L335 V339 Q363 S364 W369 T370 L371 V484	L335-L367 HydrophobicContact CB-CD1 4.16Å; L335-L367 HydrophobicContact CB-CD2 3.9Å; L335-L367 HydrophobicContact CD1-CD2 4.26Å; V339-L367 HydrophobicContact CG2-CD2 4.34Å; Q363-L367 WeakPolarHBondContact O-CB 3.39Å; Q363-L367 PolarHBondContact O-N 3.17Å; S364-L367 PolarHBondContact O-N 3.4Å; L367-W369 VanDerWaalsContact C-N 3.33Å; L367-W369 PolarHBondContact O-N 3.46Å; L367-T370 PolarHBondContact O-N 3.38Å; L367-L371 HydrophobicContact CD1-CD1 4.04Å; L367-L371 HydrophobicContact CD1-CG 4.35Å; L367-L371 HydrophobicContact CD2-CD1 4.47Å; L367-L371 HydrophobicContact CG-CD1 3.9Å; L367-L371 HydrophobicContact CG-CG 4.47Å; L367-L371 WeakPolarHBondContact O-CG 3.3Å; L367-L371 PolarHBondContact O-N 3.03Å; L367-V484 HydrophobicContact CD2-CG2 4.3Å
368	C	94.5	Very high	91.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-54	-49.8	178	-74	0	0	0	0	111.6	S364 V365 T370 L371 L372 F402 I457	S364-C368 WeakPolarHBondContact O-CB 3.2Å; S364-C368 PolarHBondContact O-N 3.26Å; S364-C368 PolarHBondContact O-SG 3.1Å; V365-C368 PolarHBondContact O-N 3.09Å; C368-T370 VanDerWaalsContact C-N 3.34Å; C368-T370 PolarHBondContact O-N 3.24Å; C368-L371 PolarHBondContact O-N 2.94Å; C368-L372 VanDerWaalsContact O-CB 3.3Å; C368-L372 WeakPolarHBondContact O-CB 3.21Å; C368-L372 VanDerWaalsContact O-CG 3.22Å; C368-L372 WeakPolarHBondContact O-CG 3.31Å; C368-L372 PolarHBondContact O-N 3.37Å; C368-F402 HydrophobicContact CB-CE1 4.47Å; C368-I457 WeakPolarHBondContact SG-CD1 3.48Å
369	W	94.6	Very high	91.1	Very high	10 Å²	10	13.8 Å²	13.8	4%	0.038	9%	0.087	C	C	.	.	H	α-helix	trans	-61.2	-43.7	180	-177.9	-117.9	0	0	0	112.2	D317 L320 V365 L367 L372 K373 L406 R410 I411	D317-W369 PolarHBondContact OD2-NE1 3.28Å; L320-W369 HydrophobicContact CD1-CB 4.39Å; L320-W369 HydrophobicContact CD1-CG 4.47Å; V365-W369 WeakPolarHBondContact O-CB 3.33Å; V365-W369 PolarHBondContact O-N 2.93Å; L367-W369 VanDerWaalsContact C-N 3.33Å; L367-W369 PolarHBondContact O-N 3.46Å; W369-L372 PolarHBondContact O-N 2.88Å; W369-K373 HydrophobicContact CD2-CG 4.04Å; W369-K373 HydrophobicContact CE3-CG 4.06Å; W369-K373 HydrophobicContact CH2-CD 4.17Å; W369-K373 HydrophobicContact CH2-CG 3.96Å; W369-K373 HydrophobicContact CZ2-CG 3.92Å; W369-K373 HydrophobicContact CZ3-CD 4.28Å; W369-K373 HydrophobicContact CZ3-CG 4.03Å; W369-K373 PolarHBondContact O-N 3.28Å; W369-L406 HydrophobicContact CB-CD1 4.08Å; W369-L406 HydrophobicContact CB-CD2 4.44Å; W369-L406 HydrophobicContact CD2-CD1 4.11Å; W369-L406 HydrophobicContact CD2-CD2 3.89Å; W369-L406 HydrophobicContact CE3-CD1 3.94Å; W369-L406 HydrophobicContact CE3-CD2 4.37Å; W369-L406 HydrophobicContact CG-CD1 4.19Å; W369-L406 HydrophobicContact CG-CD2 3.9Å; W369-R410 HydrophobicContact CH2-CB 3.73Å; W369-R410 VanDerWaalsContact CH2-O 3.28Å; W369-R410 WeakPolarHBondContact CH2-O 3.48Å; W369-R410 HydrophobicContact CZ2-CB 4.27Å; W369-R410 HydrophobicContact CZ3-CB 4.31Å; W369-R410 VanDerWaalsContact CZ3-O 3.25Å; W369-R410 WeakPolarHBondContact CZ3-O 3.49Å; W369-I411 HydrophobicContact CE3-CD1 4.25Å; W369-I411 HydrophobicContact CZ3-CB 4.13Å
370	T	94	Very high	91.1	Very high	2 Å²	2	18 Å²	18	1%	0.012	10%	0.099	C	C	.	.	H	α-helix	trans	-61	-48.1	178.8	-56.2	0	0	0	0	110.7	V314 A366 L367 C368 L372 K373 Q374	V314-T370 HydrophobicContact CG1-CG2 3.44Å; V314-T370 VanDerWaalsContact CG1-CG2 3.44Å; A366-T370 WeakPolarHBondContact O-CB 3.48Å; A366-T370 PolarHBondContact O-N 2.94Å; A366-T370 PolarHBondContact O-OG1 3.34Å; L367-T370 PolarHBondContact O-N 3.38Å; C368-T370 VanDerWaalsContact C-N 3.34Å; C368-T370 PolarHBondContact O-N 3.24Å; T370-L372 PolarHBondContact O-N 3.38Å; T370-K373 PolarHBondContact O-N 3.32Å; T370-Q374 WeakPolarHBondContact O-CA 3.48Å; T370-Q374 WeakPolarHBondContact O-CB 3.3Å; T370-Q374 PolarHBondContact O-N 2.87Å
371	L	93.6	Very high	91	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-71.1	-29.4	-179.3	-63.7	174.5	0	0	0	113.8	Y336 V339 M340 L367 C368 K373 V382 A383 L455	Y336-L371 HydrophobicContact CD2-CD2 4.22Å; Y336-L371 HydrophobicContact CE2-CD2 4.25Å; V339-L371 HydrophobicContact CG1-CD1 3.78Å; M340-L371 HydrophobicContact SD-CD2 4.16Å; L367-L371 HydrophobicContact CD1-CD1 4.04Å; L367-L371 HydrophobicContact CD1-CG 4.35Å; L367-L371 HydrophobicContact CD2-CD1 4.47Å; L367-L371 HydrophobicContact CG-CD1 3.9Å; L367-L371 HydrophobicContact CG-CG 4.47Å; L367-L371 WeakPolarHBondContact O-CG 3.3Å; L367-L371 PolarHBondContact O-N 3.03Å; C368-L371 PolarHBondContact O-N 2.94Å; L371-K373 VanDerWaalsContact C-N 3.35Å; L371-V382 HydrophobicContact CB-CB 4.38Å; L371-V382 HydrophobicContact CD2-CB 3.91Å; L371-V382 HydrophobicContact CD2-CG1 4.12Å; L371-V382 HydrophobicContact CD2-CG2 4.07Å; L371-V382 PolarHBondContact O-N 2.76Å; L371-A383 HydrophobicContact CB-CB 4.35Å; L371-A383 PolarHBondContact O-N 2.76Å; L371-L455 HydrophobicContact CD1-CD2 4.04Å
372	L	92.5	Very high	90.9	Very high	13 Å²	13	20.3 Å²	20.3	7%	0.068	12%	0.116	C	C	.	.	H	α-helix	trans	-74.4	-22.7	176.7	-78.3	172.4	0	0	0	113.4	C368 W369 T370 P381 K384 V386 I411 V433	C368-L372 VanDerWaalsContact O-CB 3.3Å; C368-L372 WeakPolarHBondContact O-CB 3.21Å; C368-L372 VanDerWaalsContact O-CG 3.22Å; C368-L372 WeakPolarHBondContact O-CG 3.31Å; C368-L372 PolarHBondContact O-N 3.37Å; W369-L372 PolarHBondContact O-N 2.88Å; T370-L372 PolarHBondContact O-N 3.38Å; L372-P381 WeakPolarHBondContact O-CB 3.35Å; L372-K384 WeakPolarHBondContact CD2-O 3.34Å; L372-V386 HydrophobicContact CD1-CG2 4.13Å; L372-V386 HydrophobicContact CD2-CG2 3.95Å; L372-V386 HydrophobicContact CG-CG2 3.98Å; L372-I411 HydrophobicContact CD1-CD1 4.24Å; L372-V433 HydrophobicContact CD1-CG2 3.93Å
373	K	91.1	Very high	90.8	Very high	70 Å²	70	19.9 Å²	19.9	30%	0.304	11%	0.114	S	C	.	.	H	α-helix	trans	-116.7	-22.5	-173.8	-62.5	-56.2	-176.5	-170.1	0	114.4	W369 T370 L371	W369-K373 HydrophobicContact CD2-CG 4.04Å; W369-K373 HydrophobicContact CE3-CG 4.06Å; W369-K373 HydrophobicContact CH2-CD 4.17Å; W369-K373 HydrophobicContact CH2-CG 3.96Å; W369-K373 HydrophobicContact CZ2-CG 3.92Å; W369-K373 HydrophobicContact CZ3-CD 4.28Å; W369-K373 HydrophobicContact CZ3-CG 4.03Å; W369-K373 PolarHBondContact O-N 3.28Å; T370-K373 PolarHBondContact O-N 3.32Å; L371-K373 VanDerWaalsContact C-N 3.35Å
374	Q	91.2	Very high	90.5	Very high	8 Å²	8	28.3 Å²	28.3	4%	0.037	15%	0.151	C	C	.	.			trans	-138.4	161.8	-172	-62	178.7	71.3	0	0	110.8	R282 V314 V315 T370 K380 V382	R282-Q374 HydrophobicContact CB-CG 3.92Å; R282-Q374 HydrophobicContact CG-CG 4.45Å; V314-Q374 HydrophobicContact CG1-CB 4.02Å; V315-Q374 PolarHBondContact O-NE2 3.48Å; V315-Q374 PolarHBondContact O-OE1 3.29Å; T370-Q374 WeakPolarHBondContact O-CA 3.48Å; T370-Q374 WeakPolarHBondContact O-CB 3.3Å; T370-Q374 PolarHBondContact O-N 2.87Å; Q374-K380 CarbonylContact C-O 3.44Å; Q374-V382 PolarHBondContact O-N 2.97Å
375	G	89	Confident	90.2	Very high	3 Å²	3	30.9 Å²	30.9	3%	0.031	16%	0.16	C	C	.	.			trans	-166.5	156.2	171	0	0	0	0	0	110	V314 Y377 G379 K380	V314-G375 VanDerWaalsContact CG2-C 3.44Å; G375-Y377 VanDerWaalsContact C-N 3.26Å; G375-Y377 PolarHBondContact O-N 3.36Å; G375-G379 WeakPolarHBondContact O-CA 3.42Å; G375-K380 WeakPolarHBondContact CA-O 3.27Å; G375-K380 PolarHBondContact N-O 3.22Å; G375-K380 VanDerWaalsContact N-O 3.09Å
376	P	87.9	Confident	90.2	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.019	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-23.5	-172.4	27.4	-34.7	0	0	0	112.7	P296 V311 V312 V314 M340	P296-P376 HydrophobicContact CG-CB 3.73Å; P296-P376 HydrophobicContact CG-CG 4Å; V311-P376 CarbonylContact C-O 3.54Å; V311-P376 VanDerWaalsContact CA-O 3.29Å; V311-P376 WeakPolarHBondContact CA-O 3.33Å; V312-P376 PolarHBondContact N-O 2.81Å; V314-P376 HydrophobicContact CG2-CB 4.3Å; M340-P376 HydrophobicContact CE-CG 3.6Å
377	Y	87.8	Confident	90.2	Very high	32 Å²	32	30.9 Å²	30.9	13%	0.125	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-98.3	104.2	-175.6	-57.8	-53.7	0	0	0	111.1	P296 H300 Q301 H304 N305 V311 G375 G379 K380	P296-Y377 WeakPolarHBondContact CB-OH 3.49Å; P296-Y377 HydrophobicContact CG-CE1 4.15Å; H300-Y377 PolarHBondContact CE1-OH 3.32Å; H300-Y377 AromaticContact ND1-CZ 3.93Å; H300-Y377 PolarHBondContact ND1-OH 3.13Å; Q301-Y377 HydrophobicContact CG-CE1 4.09Å; H304-Y377 HydrophobicContact CB-CE2 3.98Å; N305-Y377 HydrophobicContact CB-CD1 3.72Å; N305-Y377 HydrophobicContact CB-CE1 3.56Å; N305-Y377 HydrophobicContact CB-CE2 4.46Å; N305-Y377 HydrophobicContact CB-CG 4.26Å; V311-Y377 HydrophobicContact CG2-CD1 4.45Å; V311-Y377 HydrophobicContact CG2-CE1 4.29Å; G375-Y377 VanDerWaalsContact C-N 3.26Å; G375-Y377 PolarHBondContact O-N 3.36Å; Y377-G379 PolarHBondContact O-N 3.07Å; Y377-K380 PolarHBondContact O-N 3.05Å
378	G	79.5	Confident	90.2	Very high	22 Å²	22	30.9 Å²	30.9	23%	0.227	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	18.5	178.5	0	0	0	0	0	114.7	P310 K380	P310-G378 PolarHBondContact O-N 3.45Å; G378-K380 PolarHBondContact O-N 3.35Å
379	G	79.6	Confident	90.1	Very high	34 Å²	34	30.9 Å²	30.9	35%	0.351	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	12.5	-178.7	0	0	0	0	0	114.7	G375 Y377	G375-G379 WeakPolarHBondContact O-CA 3.42Å; Y377-G379 PolarHBondContact O-N 3.07Å
380	K	86.4	Confident	89.9	Confident	111 Å²	111	30.4 Å²	30.4	48%	0.483	16%	0.158	S	C	.	.			trans	-78.8	143.3	-177.1	-67.9	178	-179.9	172.1	0	111.1	Q374 G375 Y377 G378 V382	Q374-K380 CarbonylContact C-O 3.44Å; G375-K380 WeakPolarHBondContact CA-O 3.27Å; G375-K380 PolarHBondContact N-O 3.22Å; G375-K380 VanDerWaalsContact N-O 3.09Å; Y377-K380 PolarHBondContact O-N 3.05Å; G378-K380 PolarHBondContact O-N 3.35Å; K380-V382 PolarHBondContact O-N 2.82Å
381	P	89.6	Confident	89.5	Confident	74 Å²	74	30.5 Å²	30.5	48%	0.481	16%	0.159	S	C	.	.			trans	-54.7	133.5	172.8	-27.9	36.2	0	0	0	112.8	L372	L372-P381 WeakPolarHBondContact O-CB 3.35Å
382	V	89.1	Confident	89	Confident	32 Å²	32	32.3 Å²	32.3	19%	0.194	18%	0.178	C	C	.	.	S	Bend	trans	-75.2	-35.3	176.2	179.3	0	0	0	0	111.3	M340 L371 Q374 K380	M340-V382 HydrophobicContact CE-CG2 4.19Å; M340-V382 HydrophobicContact SD-CG1 3.9Å; M340-V382 HydrophobicContact SD-CG2 4Å; L371-V382 HydrophobicContact CB-CB 4.38Å; L371-V382 HydrophobicContact CD2-CB 3.91Å; L371-V382 HydrophobicContact CD2-CG1 4.12Å; L371-V382 HydrophobicContact CD2-CG2 4.07Å; L371-V382 PolarHBondContact O-N 2.76Å; Q374-V382 PolarHBondContact O-N 2.97Å; K380-V382 PolarHBondContact O-N 2.82Å
383	A	89.5	Confident	88.3	Confident	2 Å²	2	34.4 Å²	34.4	2%	0.017	19%	0.194	C	C	.	.			trans	-123.2	142.9	178.8	0	0	0	0	0	110.7	L371	L371-A383 HydrophobicContact CB-CB 4.35Å; L371-A383 PolarHBondContact O-N 2.76Å
384	K	88.5	Confident	87.9	Confident	176 Å²	176	31.4 Å²	31.4	77%	0.765	18%	0.181	S	C	*	.	S	Bend	trans	-96.8	-40.4	172.5	-67.5	-179.9	-178.5	172.1	0	112.4	L372	L372-K384 WeakPolarHBondContact CD2-O 3.34Å
385	R	91	Very high	87.7	Confident	55 Å²	55	31.2 Å²	31.2	21%	0.208	18%	0.181	C	C	.	.			trans	-132.6	141.7	-180	-70.1	-177.6	171.5	179.8	-3.9	110.1	S432 F453 G454	R385-S432 WeakPolarHBondContact CA-O 3.37Å; R385-F453 HydrophobicContact CB-CD1 4Å; R385-F453 HydrophobicContact CB-CE1 4.38Å; R385-G454 PolarHBondContact O-N 2.83Å
386	V	94.1	Very high	87.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.5	177.8	-179.2	0	0	0	0	109.7	L372 V388 S432 V433 L434 L455	L372-V386 HydrophobicContact CD1-CG2 4.13Å; L372-V386 HydrophobicContact CD2-CG2 3.95Å; L372-V386 HydrophobicContact CG-CG2 3.98Å; V386-V388 HydrophobicContact CG1-CG2 4.37Å; V386-S432 PolarHBondContact N-O 3.47Å; V386-V433 HydrophobicContact CB-CG2 4.4Å; V386-V433 WeakPolarHBondContact O-CA 3.48Å; V386-L434 PolarHBondContact O-N 2.93Å; V386-L455 HydrophobicContact CG1-CB 4.21Å; V386-L455 HydrophobicContact CG1-CD2 4.09Å; V386-L455 HydrophobicContact CG1-CG 4.24Å; V386-L455 HydrophobicContact CG2-CB 4.22Å; V386-L455 HydrophobicContact CG2-CD2 4.44Å
387	L	94.8	Very high	87.4	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.7	173.2	179.2	63.3	0	0	0	109.8	V389 L434 I436 I448 F453 L455 I456 I457 L478	L387-V389 HydrophobicContact CD1-CG2 4.38Å; L387-V389 HydrophobicContact CD2-CG2 4.03Å; L387-V389 HydrophobicContact CG-CG2 3.85Å; L387-L434 HydrophobicContact CD1-CB 4.16Å; L387-L434 HydrophobicContact CD1-CD2 3.84Å; L387-L434 HydrophobicContact CD1-CG 3.96Å; L387-I436 HydrophobicContact CD1-CG2 3.73Å; L387-I448 HydrophobicContact CD2-CG2 4.49Å; L387-F453 HydrophobicContact CB-CD1 3.66Å; L387-F453 HydrophobicContact CB-CD2 4.45Å; L387-F453 HydrophobicContact CB-CE1 3.87Å; L387-F453 HydrophobicContact CB-CG 3.97Å; L387-F453 HydrophobicContact CB-CZ 4.36Å; L387-F453 HydrophobicContact CD1-CE1 4.43Å; L387-F453 HydrophobicContact CD1-CZ 4.38Å; L387-F453 HydrophobicContact CD2-CD2 4.49Å; L387-F453 HydrophobicContact CD2-CE2 4.43Å; L387-L455 PolarHBondContact N-O 3.36Å; L387-I456 HydrophobicContact CB-CG1 4.27Å; L387-I456 HydrophobicContact CD2-CD1 4.49Å; L387-I456 HydrophobicContact CD2-CG1 4.31Å; L387-I456 CarbonylContact O-C 3.58Å; L387-I456 WeakPolarHBondContact O-CA 3.33Å; L387-I457 PolarHBondContact O-N 2.91Å; L387-L478 HydrophobicContact CD2-CD1 3.78Å
388	V	95.5	Very high	87.5	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.5	171.4	-177.4	0	0	0	0	108.5	V386 W398 F402 V433 L434 V435 I436 I457	V386-V388 HydrophobicContact CG1-CG2 4.37Å; V388-W398 HydrophobicContact CG1-CD2 3.73Å; V388-W398 HydrophobicContact CG1-CE3 3.76Å; V388-W398 HydrophobicContact CG1-CG 4.31Å; V388-W398 HydrophobicContact CG1-CH2 4.08Å; V388-W398 HydrophobicContact CG1-CZ2 4.08Å; V388-W398 HydrophobicContact CG1-CZ3 3.92Å; V388-W398 HydrophobicContact CG2-CE3 4.46Å; V388-W398 HydrophobicContact CG2-CZ3 4.37Å; V388-F402 HydrophobicContact CG2-CE2 4.42Å; V388-V433 HydrophobicContact CG2-CG1 4.17Å; V388-L434 PolarHBondContact N-O 2.96Å; V388-V435 HydrophobicContact CB-CG1 4.45Å; V388-V435 HydrophobicContact CB-CG2 4.21Å; V388-V435 HydrophobicContact CG1-CG1 4.47Å; V388-V435 WeakPolarHBondContact O-CA 3.36Å; V388-I436 PolarHBondContact O-N 3.18Å; V388-I457 CarbonylContact C-O 3.46Å; V388-I457 WeakPolarHBondContact CA-O 3.25Å; V388-I457 HydrophobicContact CG2-CB 4.41Å
389	V	93.6	Very high	88	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.1	178.1	-168.5	0	0	0	0	108.3	L387 I436 Y438 L441 I457 D459 L475	L387-V389 HydrophobicContact CD1-CG2 4.38Å; L387-V389 HydrophobicContact CD2-CG2 4.03Å; L387-V389 HydrophobicContact CG-CG2 3.85Å; V389-I436 WeakPolarHBondContact CA-O 3.47Å; V389-I436 HydrophobicContact CG2-CG2 4.1Å; V389-Y438 HydrophobicContact CB-CE1 4.26Å; V389-Y438 HydrophobicContact CG1-CD1 3.35Å; V389-Y438 HydrophobicContact CG1-CD2 4.3Å; V389-Y438 HydrophobicContact CG1-CE1 3.47Å; V389-Y438 VanDerWaalsContact CG1-CE1 3.47Å; V389-Y438 HydrophobicContact CG1-CE2 4.39Å; V389-Y438 HydrophobicContact CG1-CG 3.82Å; V389-L441 HydrophobicContact CG1-CD2 4.16Å; V389-L441 HydrophobicContact CG2-CD2 4.33Å; V389-I457 PolarHBondContact N-O 3.47Å; V389-D459 PolarHBondContact O-N 2.78Å; V389-L475 HydrophobicContact CG2-CD2 4.05Å
390	T	90.6	Very high	88.4	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	163.1	-171.8	-172.2	0	0	0	0	110.2	L394 V395 W398 V435 I436 S437 Y438 D459	T390-L394 HydrophobicContact CG2-CB 4.23Å; T390-L394 WeakPolarHBondContact OG1-CB 3.47Å; T390-V395 HydrophobicContact CG2-CB 4.42Å; T390-V395 HydrophobicContact CG2-CG2 3.73Å; T390-W398 PolarHBondContact OG1-NE1 3.46Å; T390-V435 HydrophobicContact CG2-CG1 4.02Å; T390-I436 PolarHBondContact N-O 3.28Å; T390-I436 VanDerWaalsContact N-O 3.09Å; T390-S437 WeakPolarHBondContact O-CA 3.29Å; T390-Y438 PolarHBondContact O-N 2.83Å; T390-D459 PolarHBondContact OG1-OD2 3.16Å; T390-D459 VanDerWaalsContact OG1-OD2 3.13Å
391	P	85.8	Confident	88.6	Confident	4 Å²	4	36.5 Å²	36.5	3%	0.026	20%	0.202	C	C	.	.			trans	-55.5	146.8	168.2	-27.1	35.8	0	0	0	112.1	S393 L394 E460	P391-S393 PolarHBondContact O-N 2.9Å; P391-L394 HydrophobicContact CB-CD1 4.44Å; P391-L394 HydrophobicContact CG-CD1 4.08Å; P391-L394 PolarHBondContact O-N 3.2Å; P391-E460 HydrophobicContact CG-CB 4Å; P391-E460 HydrophobicContact CG-CG 4.09Å
392	G	82.6	Confident	88.8	Confident	40 Å²	40	33 Å²	33	41%	0.412	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-54.6	-30.7	-177.8	0	0	0	0	0	114.7	L394	G392-L394 VanDerWaalsContact C-N 3.26Å; G392-L394 PolarHBondContact O-N 2.92Å
393	S	76.6	Confident	88.9	Confident	56 Å²	56	33.8 Å²	33.8	39%	0.392	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-68.8	-19.9	176.2	56.3	0	0	0	0	114.4	P391	P391-S393 PolarHBondContact O-N 2.9Å
394	L	82.8	Confident	88.9	Confident	8 Å²	8	40 Å²	40	4%	0.042	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-102.5	-9	-173.9	-72.3	179	0	0	0	113.7	T390 P391 G392 Q396 N397 W398 E460 V749	T390-L394 HydrophobicContact CG2-CB 4.23Å; T390-L394 WeakPolarHBondContact OG1-CB 3.47Å; P391-L394 HydrophobicContact CB-CD1 4.44Å; P391-L394 HydrophobicContact CG-CD1 4.08Å; P391-L394 PolarHBondContact O-N 3.2Å; G392-L394 VanDerWaalsContact C-N 3.26Å; G392-L394 PolarHBondContact O-N 2.92Å; L394-Q396 VanDerWaalsContact C-N 3.31Å; L394-Q396 PolarHBondContact O-N 2.81Å; L394-N397 HydrophobicContact CD2-CB 4.27Å; L394-N397 WeakPolarHBondContact O-CB 3.48Å; L394-N397 PolarHBondContact O-N 2.99Å; L394-W398 PolarHBondContact O-N 3.43Å; L394-E460 HydrophobicContact CD1-CG 4.43Å; L394-V749 HydrophobicContact CD1-CB 3.81Å; L394-V749 HydrophobicContact CD1-CG1 3.34Å; L394-V749 HydrophobicContact CD2-CB 4.36Å; L394-V749 HydrophobicContact CD2-CG1 4.17Å; L394-V749 WeakPolarHBondContact CD2-O 3.41Å; L394-V749 HydrophobicContact CG-CB 4.25Å; L394-V749 HydrophobicContact CG-CG1 4.17Å
395	V	87.1	Confident	89.1	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.024	18%	0.181	C	C	.	.	H	α-helix	trans	-54.4	-47.5	-177.9	173.1	0	0	0	0	111.5	T390 W398 K399 T415 V435	T390-V395 HydrophobicContact CG2-CB 4.42Å; T390-V395 HydrophobicContact CG2-CG2 3.73Å; V395-W398 PolarHBondContact O-N 3.24Å; V395-K399 PolarHBondContact O-N 3.11Å; V395-T415 HydrophobicContact CG1-CG2 3.84Å; V395-V435 HydrophobicContact CB-CG1 4.45Å; V395-V435 HydrophobicContact CG1-CG1 4.05Å
396	Q	84.6	Confident	89.1	Confident	85 Å²	85	31.1 Å²	31.1	40%	0.397	17%	0.172	S	C	.	.	H	α-helix	trans	-71.6	-33	178.5	-62.5	-58.5	-34.9	0	0	112.4	L394 K399 A400 D417	L394-Q396 VanDerWaalsContact C-N 3.31Å; L394-Q396 PolarHBondContact O-N 2.81Å; Q396-K399 WeakPolarHBondContact O-CB 3.18Å; Q396-K399 PolarHBondContact O-N 3.06Å; Q396-A400 WeakPolarHBondContact O-CB 3.38Å; Q396-A400 PolarHBondContact O-N 2.87Å; Q396-D417 VanDerWaalsContact NE2-CG 3.25Å; Q396-D417 PolarHBondContact NE2-OD1 3.23Å; Q396-D417 PolarHBondContact NE2-OD2 3.45Å
397	N	85.7	Confident	88.8	Confident	40 Å²	40	32.5 Å²	32.5	21%	0.214	19%	0.187	C	C	.	.	H	α-helix	trans	-63.4	-42.4	175.5	-68	46.7	0	0	0	110.9	L394 K399 A400 E401	L394-N397 HydrophobicContact CD2-CB 4.27Å; L394-N397 WeakPolarHBondContact O-CB 3.48Å; L394-N397 PolarHBondContact O-N 2.99Å; N397-K399 PolarHBondContact O-N 2.81Å; N397-A400 WeakPolarHBondContact O-CB 3.13Å; N397-A400 PolarHBondContact O-N 3.43Å; N397-E401 WeakPolarHBondContact O-CG 3.36Å; N397-E401 PolarHBondContact O-N 2.93Å
398	W	90.7	Very high	88.3	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.015	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-43.8	174.4	-87.9	89.8	0	0	0	112.2	T361 V365 V388 T390 L394 V395 A400 E401 F402 V435 I457 D459 L486	T361-W398 HydrophobicContact CG2-CD2 4.04Å; T361-W398 HydrophobicContact CG2-CE3 3.89Å; T361-W398 HydrophobicContact CG2-CH2 3.98Å; T361-W398 HydrophobicContact CG2-CZ2 4.07Å; T361-W398 HydrophobicContact CG2-CZ3 3.88Å; V365-W398 HydrophobicContact CG2-CZ3 4.48Å; V388-W398 HydrophobicContact CG1-CD2 3.73Å; V388-W398 HydrophobicContact CG1-CE3 3.76Å; V388-W398 HydrophobicContact CG1-CG 4.31Å; V388-W398 HydrophobicContact CG1-CH2 4.08Å; V388-W398 HydrophobicContact CG1-CZ2 4.08Å; V388-W398 HydrophobicContact CG1-CZ3 3.92Å; V388-W398 HydrophobicContact CG2-CE3 4.46Å; V388-W398 HydrophobicContact CG2-CZ3 4.37Å; T390-W398 PolarHBondContact OG1-NE1 3.46Å; L394-W398 PolarHBondContact O-N 3.43Å; V395-W398 PolarHBondContact O-N 3.24Å; W398-A400 VanDerWaalsContact C-N 3.33Å; W398-A400 PolarHBondContact O-N 3Å; W398-E401 PolarHBondContact O-N 3.46Å; W398-F402 HydrophobicContact CE3-CD2 4.43Å; W398-F402 AromaticContact CE3-CE2 3.77Å; W398-F402 HydrophobicContact CE3-CE2 3.77Å; W398-F402 HydrophobicContact CE3-CZ 4.45Å; W398-F402 HydrophobicContact CZ3-CE2 4.27Å; W398-F402 VanDerWaalsContact O-CD2 3.24Å; W398-F402 WeakPolarHBondContact O-CD2 3.46Å; W398-F402 PolarHBondContact O-N 3.47Å; W398-V435 HydrophobicContact CB-CG1 3.91Å; W398-V435 HydrophobicContact CB-CG2 4.43Å; W398-V435 HydrophobicContact CG-CG1 4.49Å; W398-I457 HydrophobicContact CH2-CG2 4.27Å; W398-D459 HydrophobicContact CZ2-CB 3.91Å; W398-D459 PolarHBondContact NE1-OD2 3.27Å; W398-L486 HydrophobicContact CH2-CD1 3.76Å; W398-L486 HydrophobicContact CZ2-CD1 3.72Å
399	K	89.6	Confident	87.7	Confident	71 Å²	71	51.9 Å²	51.9	31%	0.309	27%	0.268	S	S	.	.	H	α-helix	trans	-59.5	-43.3	174	-175.4	-175.7	-169.3	163.5	0	112.2	V395 Q396 N397 T403 T415	V395-K399 PolarHBondContact O-N 3.11Å; Q396-K399 WeakPolarHBondContact O-CB 3.18Å; Q396-K399 PolarHBondContact O-N 3.06Å; N397-K399 PolarHBondContact O-N 2.81Å; K399-T403 WeakPolarHBondContact O-CB 3.49Å; K399-T403 PolarHBondContact O-N 3.45Å; K399-T403 PolarHBondContact O-OG1 2.93Å; K399-T415 HydrophobicContact CB-CG2 3.69Å; K399-T415 HydrophobicContact CD-CG2 3.71Å; K399-T415 HydrophobicContact CG-CG2 4.06Å; K399-T415 PolarHBondContact NZ-OG1 3.22Å
400	A	88.1	Confident	87.3	Confident	56 Å²	56	57.3 Å²	57.3	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-63.8	-42.1	177.2	0	0	0	0	0	111.6	Q396 N397 W398 T403 K404	Q396-A400 WeakPolarHBondContact O-CB 3.38Å; Q396-A400 PolarHBondContact O-N 2.87Å; N397-A400 WeakPolarHBondContact O-CB 3.13Å; N397-A400 PolarHBondContact O-N 3.43Å; W398-A400 VanDerWaalsContact C-N 3.33Å; W398-A400 PolarHBondContact O-N 3Å; A400-T403 PolarHBondContact O-N 3.1Å; A400-K404 VanDerWaalsContact O-CB 3.27Å; A400-K404 WeakPolarHBondContact O-CB 3.43Å; A400-K404 PolarHBondContact O-N 3.19Å
401	E	90.8	Very high	87	Confident	60 Å²	60	57.8 Å²	57.8	28%	0.28	29%	0.292	S	S	.	.	H	α-helix	trans	-64.8	-45.5	177.2	-73	-66.9	150.6	0	0	112.1	T361 N397 W398 T403 K404 W405	T361-E401 HydrophobicContact CG2-CB 4.05Å; T361-E401 HydrophobicContact CG2-CG 4.06Å; N397-E401 WeakPolarHBondContact O-CG 3.36Å; N397-E401 PolarHBondContact O-N 2.93Å; W398-E401 PolarHBondContact O-N 3.46Å; E401-T403 VanDerWaalsContact C-N 3.28Å; E401-T403 PolarHBondContact O-N 2.98Å; E401-K404 PolarHBondContact O-N 3.44Å; E401-W405 PolarHBondContact O-N 2.75Å; E401-W405 VanDerWaalsContact O-N 3.08Å; E401-W405 PolarHBondContact OE2-NE1 2.65Å
402	F	93.1	Very high	87	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.7	-43.5	172.6	-83.4	-72	0	0	0	111.8	V365 C368 V388 W398 L406 I411 V413 V433 V435	V365-F402 HydrophobicContact CB-CD1 4.44Å; V365-F402 HydrophobicContact CB-CE1 4.22Å; V365-F402 HydrophobicContact CG1-CD1 3.84Å; V365-F402 HydrophobicContact CG1-CE1 3.97Å; V365-F402 HydrophobicContact CG2-CD1 3.93Å; V365-F402 HydrophobicContact CG2-CE1 3.79Å; V365-F402 HydrophobicContact CG2-CE2 4.37Å; V365-F402 HydrophobicContact CG2-CG 4.29Å; V365-F402 HydrophobicContact CG2-CZ 4.01Å; C368-F402 HydrophobicContact CB-CE1 4.47Å; V388-F402 HydrophobicContact CG2-CE2 4.42Å; W398-F402 HydrophobicContact CE3-CD2 4.43Å; W398-F402 AromaticContact CE3-CE2 3.77Å; W398-F402 HydrophobicContact CE3-CE2 3.77Å; W398-F402 HydrophobicContact CE3-CZ 4.45Å; W398-F402 HydrophobicContact CZ3-CE2 4.27Å; W398-F402 VanDerWaalsContact O-CD2 3.24Å; W398-F402 WeakPolarHBondContact O-CD2 3.46Å; W398-F402 PolarHBondContact O-N 3.47Å; F402-L406 HydrophobicContact CD1-CD1 4.28Å; F402-L406 WeakPolarHBondContact O-CB 3.07Å; F402-L406 PolarHBondContact O-N 3.05Å; F402-I411 HydrophobicContact CD1-CD1 3.95Å; F402-I411 HydrophobicContact CE1-CD1 4.06Å; F402-V413 HydrophobicContact CB-CG2 3.64Å; F402-V413 HydrophobicContact CD1-CG2 4.23Å; F402-V413 HydrophobicContact CD2-CG1 4.22Å; F402-V413 HydrophobicContact CD2-CG2 4Å; F402-V413 HydrophobicContact CG-CG2 3.72Å; F402-V433 HydrophobicContact CE1-CG2 4.43Å; F402-V433 HydrophobicContact CE2-CG1 3.92Å; F402-V433 HydrophobicContact CZ-CG1 3.86Å; F402-V433 HydrophobicContact CZ-CG2 4.46Å; F402-V435 HydrophobicContact CE2-CG2 4.45Å
403	T	92.1	Very high	87.3	Confident	49 Å²	49	58.7 Å²	58.7	30%	0.301	29%	0.291	S	S	.	.	H	α-helix	trans	-65.8	-39	178.6	-56.6	0	0	0	0	111.9	K399 A400 E401 G407 R408	K399-T403 WeakPolarHBondContact O-CB 3.49Å; K399-T403 PolarHBondContact O-N 3.45Å; K399-T403 PolarHBondContact O-OG1 2.93Å; A400-T403 PolarHBondContact O-N 3.1Å; E401-T403 VanDerWaalsContact C-N 3.28Å; E401-T403 PolarHBondContact O-N 2.98Å; T403-G407 WeakPolarHBondContact O-CA 3.24Å; T403-G407 PolarHBondContact O-N 3.34Å; T403-R408 HydrophobicContact CG2-CG 3.73Å
404	K	89.9	Confident	88	Confident	133 Å²	133	56.7 Å²	56.7	58%	0.578	28%	0.275	S	S	*	.	H	α-helix	trans	-64.1	-44.6	179.9	174.8	-176.4	171	-173.2	0	112	A400 E401	A400-K404 VanDerWaalsContact O-CB 3.27Å; A400-K404 WeakPolarHBondContact O-CB 3.43Å; A400-K404 PolarHBondContact O-N 3.19Å; E401-K404 PolarHBondContact O-N 3.44Å
405	W	92.1	Very high	88.3	Confident	39 Å²	39	56.5 Å²	56.5	15%	0.148	27%	0.274	C	S	.	.	H	α-helix	trans	-93	-26.6	-172.2	-64.5	113.5	0	0	0	114.8	H319 L320 H323 L362 V365 E401	H319-W405 PolarHBondContact CD2-O 3.33Å; H319-W405 PolarHBondContact NE2-O 2.9Å; L320-W405 HydrophobicContact CD2-CB 3.88Å; H323-W405 HydrophobicContact CB-CE3 4.45Å; H323-W405 HydrophobicContact CB-CH2 4.17Å; H323-W405 HydrophobicContact CB-CZ3 3.56Å; H323-W405 AromaticContact CG-CZ3 3.74Å; L362-W405 HydrophobicContact CD1-CB 4.48Å; L362-W405 HydrophobicContact CD1-CD2 3.6Å; L362-W405 HydrophobicContact CD1-CE3 4.12Å; L362-W405 HydrophobicContact CD1-CG 3.75Å; L362-W405 HydrophobicContact CD1-CZ2 4.2Å; L362-W405 HydrophobicContact CD2-CH2 4.04Å; L362-W405 HydrophobicContact CD2-CZ2 3.84Å; V365-W405 HydrophobicContact CG1-CB 4.47Å; E401-W405 PolarHBondContact O-N 2.75Å; E401-W405 VanDerWaalsContact O-N 3.08Å; E401-W405 PolarHBondContact OE2-NE1 2.65Å
406	L	90.9	Very high	88.1	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-118.4	-12	-177.4	-66.4	171.8	0	0	0	113	L320 V365 W369 F402 R410 I411	L320-L406 HydrophobicContact CD1-CD2 4.06Å; L320-L406 HydrophobicContact CD2-CD2 4.03Å; L320-L406 HydrophobicContact CG-CD2 4.23Å; V365-L406 HydrophobicContact CG1-CD1 3.86Å; V365-L406 HydrophobicContact CG1-CG 4.31Å; W369-L406 HydrophobicContact CB-CD1 4.08Å; W369-L406 HydrophobicContact CB-CD2 4.44Å; W369-L406 HydrophobicContact CD2-CD1 4.11Å; W369-L406 HydrophobicContact CD2-CD2 3.89Å; W369-L406 HydrophobicContact CE3-CD1 3.94Å; W369-L406 HydrophobicContact CE3-CD2 4.37Å; W369-L406 HydrophobicContact CG-CD1 4.19Å; W369-L406 HydrophobicContact CG-CD2 3.9Å; F402-L406 HydrophobicContact CD1-CD1 4.28Å; F402-L406 WeakPolarHBondContact O-CB 3.07Å; F402-L406 PolarHBondContact O-N 3.05Å; L406-R410 HydrophobicContact CB-CB 4.49Å; L406-R410 WeakPolarHBondContact O-CB 3.4Å; L406-R410 VanDerWaalsContact O-CD 3.3Å; L406-R410 WeakPolarHBondContact O-CD 3.32Å; L406-R410 WeakPolarHBondContact O-CG 3.25Å; L406-I411 HydrophobicContact CB-CB 4.48Å; L406-I411 HydrophobicContact CB-CG2 3.67Å; L406-I411 HydrophobicContact CD1-CB 4.29Å; L406-I411 HydrophobicContact CD1-CD1 3.96Å; L406-I411 HydrophobicContact CD1-CG2 3.89Å; L406-I411 HydrophobicContact CG-CG2 4.45Å
407	G	88.3	Confident	87.6	Confident	30 Å²	30	55 Å²	55	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	71.9	170.1	-173	0	0	0	0	0	113	T403 E409	T403-G407 WeakPolarHBondContact O-CA 3.24Å; T403-G407 PolarHBondContact O-N 3.34Å; G407-E409 VanDerWaalsContact C-N 3.3Å
408	R	83.3	Confident	86.7	Confident	211 Å²	211	61.9 Å²	61.9	80%	0.796	30%	0.3	S	S	*	.	H	α-helix	trans	-77.2	-17.2	177.7	-62	-173.6	179.4	179.2	0.6	113.5	T403	T403-R408 HydrophobicContact CG2-CG 3.73Å
409	E	82.9	Confident	85.3	Confident	195 Å²	195	68 Å²	68	91%	0.911	33%	0.333	S	S	*	.	H	α-helix	trans	-85.9	-34.4	-175	-61.7	-179	179.9	0	0	112.4	G407	G407-E409 VanDerWaalsContact C-N 3.3Å
410	R	84.9	Confident	84.5	Confident	114 Å²	114	68.3 Å²	68.3	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-82.8	-33.6	-176.1	-58.2	-173.3	178	-159.2	3.2	112.8	D317 W369 L406	D317-R410 IonicContact OD1-NH1 3.5Å; D317-R410 PolarHBondContact OD1-NH1 2.95Å; D317-R410 IonicContact OD2-NH1 3.1Å; D317-R410 PolarHBondContact OD2-NH1 3.04Å; D317-R410 VanDerWaalsContact OD2-NH1 3.1Å; W369-R410 HydrophobicContact CH2-CB 3.73Å; W369-R410 VanDerWaalsContact CH2-O 3.28Å; W369-R410 WeakPolarHBondContact CH2-O 3.48Å; W369-R410 HydrophobicContact CZ2-CB 4.27Å; W369-R410 HydrophobicContact CZ3-CB 4.31Å; W369-R410 VanDerWaalsContact CZ3-O 3.25Å; W369-R410 WeakPolarHBondContact CZ3-O 3.49Å; L406-R410 HydrophobicContact CB-CB 4.49Å; L406-R410 WeakPolarHBondContact O-CB 3.4Å; L406-R410 VanDerWaalsContact O-CD 3.3Å; L406-R410 WeakPolarHBondContact O-CD 3.32Å; L406-R410 WeakPolarHBondContact O-CG 3.25Å
411	I	86.1	Confident	84	Confident	11 Å²	11	73.2 Å²	73.2	6%	0.056	34%	0.342	C	S	.	.			trans	-138.4	132.6	-176.4	-162.3	168.4	0	0	0	111.4	W369 L372 F402 L406 V413 V433	W369-I411 HydrophobicContact CE3-CD1 4.25Å; W369-I411 HydrophobicContact CZ3-CB 4.13Å; L372-I411 HydrophobicContact CD1-CD1 4.24Å; F402-I411 HydrophobicContact CD1-CD1 3.95Å; F402-I411 HydrophobicContact CE1-CD1 4.06Å; L406-I411 HydrophobicContact CB-CB 4.48Å; L406-I411 HydrophobicContact CB-CG2 3.67Å; L406-I411 HydrophobicContact CD1-CB 4.29Å; L406-I411 HydrophobicContact CD1-CD1 3.96Å; L406-I411 HydrophobicContact CD1-CG2 3.89Å; L406-I411 HydrophobicContact CG-CG2 4.45Å; I411-V413 HydrophobicContact CG1-CG2 4.33Å; I411-V413 HydrophobicContact CG2-CG2 4.25Å; I411-V433 HydrophobicContact CD1-CG2 3.66Å; I411-V433 HydrophobicContact CG1-CG2 4.25Å
412	S	84.9	Confident	83.5	Confident	43 Å²	43	70.7 Å²	70.7	30%	0.301	33%	0.33	S	S	.	.			trans	-101.5	120.2	171	-173.3	0	0	0	0	110	L430 H431 S432	S412-L430 WeakPolarHBondContact CB-O 3.36Å; S412-H431 PolarHBondContact OG-CD2 3.15Å; S412-H431 PolarHBondContact OG-NE2 3.13Å; S412-S432 PolarHBondContact O-N 3.28Å
413	V	89.7	Confident	82.7	Confident	20 Å²	20	76.2 Å²	76.2	12%	0.121	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.8	-177.5	-177	0	0	0	0	109.2	F402 I411 V433 V435	F402-V413 HydrophobicContact CB-CG2 3.64Å; F402-V413 HydrophobicContact CD1-CG2 4.23Å; F402-V413 HydrophobicContact CD2-CG1 4.22Å; F402-V413 HydrophobicContact CD2-CG2 4Å; F402-V413 HydrophobicContact CG-CG2 3.72Å; I411-V413 HydrophobicContact CG1-CG2 4.33Å; I411-V413 HydrophobicContact CG2-CG2 4.25Å; V413-V433 HydrophobicContact CG1-CB 4.4Å; V413-V433 HydrophobicContact CG1-CG1 4.29Å; V413-V433 HydrophobicContact CG2-CB 4.27Å; V413-V435 HydrophobicContact CG1-CG2 3.63Å
414	F	90.5	Very high	82.1	Confident	14 Å²	14	78.2 Å²	78.2	6%	0.061	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.7	176	-166.7	-92.1	0	0	0	110.2	V416 H420 R421 E424 F425 H431 V433 L434 V435	F414-V416 HydrophobicContact CD1-CG2 4.3Å; F414-V416 HydrophobicContact CE1-CG2 4.25Å; F414-H420 HydrophobicContact CE1-CB 4.34Å; F414-H420 HydrophobicContact CZ-CB 3.86Å; F414-R421 WeakPolarHBondContact CZ-O 3.38Å; F414-E424 HydrophobicContact CE2-CB 4.09Å; F414-E424 HydrophobicContact CZ-CB 4.03Å; F414-F425 HydrophobicContact CB-CD2 3.72Å; F414-F425 HydrophobicContact CB-CE2 4.42Å; F414-F425 HydrophobicContact CD1-CB 3.8Å; F414-F425 HydrophobicContact CD1-CD2 4.33Å; F414-F425 HydrophobicContact CD1-CG 4.38Å; F414-F425 HydrophobicContact CD2-CB 4.39Å; F414-F425 HydrophobicContact CE1-CB 3.95Å; F414-F425 HydrophobicContact CG-CB 4.01Å; F414-F425 HydrophobicContact CG-CD2 4.03Å; F414-F425 HydrophobicContact CG-CG 4.45Å; F414-F425 HydrophobicContact CZ-CB 4.32Å; F414-H431 HydrophobicContact CB-CB 4.18Å; F414-H431 AromaticContact CD2-CD2 4Å; F414-H431 AromaticContact CD2-NE2 3.97Å; F414-V433 PolarHBondContact N-O 3.35Å; F414-L434 HydrophobicContact CB-CD1 4.33Å; F414-L434 HydrophobicContact CD1-CD1 3.65Å; F414-L434 HydrophobicContact CG-CD1 4.45Å; F414-V435 PolarHBondContact O-N 3.13Å
415	T	89.1	Confident	81.7	Confident	3 Å²	3	72 Å²	72	2%	0.018	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.3	173.4	47.8	0	0	0	0	109.7	V395 K399 D417 V435	V395-T415 HydrophobicContact CG1-CG2 3.84Å; K399-T415 HydrophobicContact CB-CG2 3.69Å; K399-T415 HydrophobicContact CD-CG2 3.71Å; K399-T415 HydrophobicContact CG-CG2 4.06Å; K399-T415 PolarHBondContact NZ-OG1 3.22Å; T415-D417 PolarHBondContact O-N 3.26Å; T415-D417 PolarHBondContact OG1-OD2 2.97Å; T415-V435 HydrophobicContact CG2-CB 4.21Å
416	V	83.3	Confident	81.1	Confident	9 Å²	9	73 Å²	73	6%	0.055	34%	0.343	C	S	.	.			trans	-85.1	110.3	174	-170.9	0	0	0	0	109	F414 I422 L434 V435 I436 M440	F414-V416 HydrophobicContact CD1-CG2 4.3Å; F414-V416 HydrophobicContact CE1-CG2 4.25Å; V416-I422 HydrophobicContact CB-CG1 4.47Å; V416-I422 HydrophobicContact CG1-CD1 4.05Å; V416-I422 HydrophobicContact CG1-CG1 3.91Å; V416-I422 HydrophobicContact CG2-CD1 4.23Å; V416-I422 HydrophobicContact CG2-CG1 3.65Å; V416-L434 HydrophobicContact CG2-CD1 3.53Å; V416-L434 HydrophobicContact CG2-CG 4.46Å; V416-V435 PolarHBondContact N-O 3.27Å; V416-I436 HydrophobicContact CB-CB 4.45Å; V416-I436 HydrophobicContact CB-CD1 4.36Å; V416-I436 HydrophobicContact CB-CG1 4.05Å; V416-I436 HydrophobicContact CG1-CD1 4.49Å; V416-I436 HydrophobicContact CG2-CB 4.16Å; V416-I436 HydrophobicContact CG2-CD1 4.08Å; V416-I436 HydrophobicContact CG2-CG1 4.07Å; V416-M440 HydrophobicContact CB-CG 4.4Å; V416-M440 HydrophobicContact CG1-CG 3.62Å; V416-M440 HydrophobicContact CG1-SD 4.48Å
417	D	74	Confident	80.4	Confident	49 Å²	49	77.3 Å²	77.3	26%	0.262	37%	0.373	S	S	.	.			trans	-119.9	-175.9	175.7	-63	-52.4	0	0	0	109.6	Q396 T415 D419 H420	Q396-D417 VanDerWaalsContact NE2-CG 3.25Å; Q396-D417 PolarHBondContact NE2-OD1 3.23Å; Q396-D417 PolarHBondContact NE2-OD2 3.45Å; T415-D417 PolarHBondContact O-N 3.26Å; T415-D417 PolarHBondContact OG1-OD2 2.97Å; D417-D419 PolarHBondContact O-N 2.76Å; D417-H420 IonicContact OD2-ND1 3.88Å
418	Q	66.8	Low	79.9	Confident	184 Å²	184	76.9 Å²	76.9	86%	0.86	37%	0.366	S	S	*	.	S	Bend	trans	-62.3	-31	175.2	-66.6	-178.6	3.1	0	0	112.4
419	D	60.6	Low	79.4	Confident	134 Å²	134	72.1 Å²	72.1	72%	0.717	36%	0.362	S	S	*	.	S	Bend	trans	-89.8	-23.9	-175.7	-55.3	-45.6	0	0	0	113.4	D417	D417-D419 PolarHBondContact O-N 2.76Å
420	H	73.3	Confident	79.1	Confident	76 Å²	76	69.1 Å²	69.1	35%	0.352	35%	0.352	S	S	.	.	S	Bend	trans	-111.6	107.8	-174.1	-60.2	109.2	0	0	0	110.9	F414 D417	F414-H420 HydrophobicContact CE1-CB 4.34Å; F414-H420 HydrophobicContact CZ-CB 3.86Å; D417-H420 IonicContact OD2-ND1 3.88Å
421	R	76.6	Confident	79	Confident	159 Å²	159	65.7 Å²	65.7	60%	0.6	34%	0.34	S	S	*	.			trans	-84.5	148.7	-177.2	-56.1	-174.3	86.5	-169.5	3.2	111.2	F414 E423 E424	F414-R421 WeakPolarHBondContact CZ-O 3.38Å; R421-E423 IonicContact NH1-OE2 3.95Å; R421-E423 PolarHBondContact O-N 3.34Å; R421-E423 VanDerWaalsContact O-N 3.16Å; R421-E424 WeakPolarHBondContact O-CB 3.44Å; R421-E424 PolarHBondContact O-N 3.26Å; R421-E424 VanDerWaalsContact O-N 3.1Å
422	I	80.3	Confident	79.1	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.036	35%	0.347	C	S	.	.	H	α-helix	trans	-61.8	-25.3	179.1	-71.7	152.5	0	0	0	112.6	V416 E424 F425 L426 I436 C444 P447 I448	V416-I422 HydrophobicContact CB-CG1 4.47Å; V416-I422 HydrophobicContact CG1-CD1 4.05Å; V416-I422 HydrophobicContact CG1-CG1 3.91Å; V416-I422 HydrophobicContact CG2-CD1 4.23Å; V416-I422 HydrophobicContact CG2-CG1 3.65Å; I422-E424 PolarHBondContact O-N 3.34Å; I422-F425 WeakPolarHBondContact O-CA 3.39Å; I422-F425 WeakPolarHBondContact O-CB 3.4Å; I422-F425 PolarHBondContact O-N 3.1Å; I422-L426 HydrophobicContact CG2-CG 4.37Å; I422-L426 WeakPolarHBondContact O-CG 3.1Å; I422-L426 PolarHBondContact O-N 3.13Å; I422-I436 HydrophobicContact CD1-CD1 3.97Å; I422-C444 HydrophobicContact CD1-CB 3.08Å; I422-P447 HydrophobicContact CG2-CB 4.19Å; I422-P447 HydrophobicContact CG2-CG 4.35Å; I422-I448 HydrophobicContact CD1-CD1 3.88Å; I422-I448 HydrophobicContact CD1-CG1 4.17Å; I422-I448 HydrophobicContact CG2-CG1 4.22Å
423	E	77.8	Confident	79.4	Confident	117 Å²	117	64.5 Å²	64.5	55%	0.547	33%	0.333	S	S	.	.	H	α-helix	trans	-56.3	-35.3	175.2	-67.4	166.9	-165.8	0	0	112.1	R421 L426 S427	R421-E423 IonicContact NH1-OE2 3.95Å; R421-E423 PolarHBondContact O-N 3.34Å; R421-E423 VanDerWaalsContact O-N 3.16Å; E423-L426 PolarHBondContact O-N 2.99Å; E423-S427 PolarHBondContact O-N 2.59Å
424	E	78.1	Confident	79.6	Confident	91 Å²	91	63.6 Å²	63.6	43%	0.425	33%	0.327	S	S	.	.	H	α-helix	trans	-66.3	-40.2	175.7	-65.3	173.6	-163	0	0	111.5	F414 R421 I422 L426 S427 S428	F414-E424 HydrophobicContact CE2-CB 4.09Å; F414-E424 HydrophobicContact CZ-CB 4.03Å; R421-E424 WeakPolarHBondContact O-CB 3.44Å; R421-E424 PolarHBondContact O-N 3.26Å; R421-E424 VanDerWaalsContact O-N 3.1Å; I422-E424 PolarHBondContact O-N 3.34Å; E424-L426 VanDerWaalsContact C-N 3.34Å; E424-L426 PolarHBondContact O-N 3.09Å; E424-S427 PolarHBondContact O-N 2.87Å; E424-S427 PolarHBondContact O-OG 3.25Å; E424-S428 WeakPolarHBondContact O-CB 3.28Å; E424-S428 PolarHBondContact O-N 3.29Å; E424-S428 VanDerWaalsContact O-N 3.11Å
425	F	82.1	Confident	79.8	Confident	1 Å²	1	62.9 Å²	62.9	0%	0.004	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-39	174	174.3	-99.2	0	0	0	112.1	F414 I422 S427 S428 H431 L434 F453	F414-F425 HydrophobicContact CB-CD2 3.72Å; F414-F425 HydrophobicContact CB-CE2 4.42Å; F414-F425 HydrophobicContact CD1-CB 3.8Å; F414-F425 HydrophobicContact CD1-CD2 4.33Å; F414-F425 HydrophobicContact CD1-CG 4.38Å; F414-F425 HydrophobicContact CD2-CB 4.39Å; F414-F425 HydrophobicContact CE1-CB 3.95Å; F414-F425 HydrophobicContact CG-CB 4.01Å; F414-F425 HydrophobicContact CG-CD2 4.03Å; F414-F425 HydrophobicContact CG-CG 4.45Å; F414-F425 HydrophobicContact CZ-CB 4.32Å; I422-F425 WeakPolarHBondContact O-CA 3.39Å; I422-F425 WeakPolarHBondContact O-CB 3.4Å; I422-F425 PolarHBondContact O-N 3.1Å; F425-S427 VanDerWaalsContact C-N 3.33Å; F425-S427 PolarHBondContact O-N 2.91Å; F425-S428 PolarHBondContact O-N 3.12Å; F425-H431 HydrophobicContact CD2-CB 3.61Å; F425-H431 HydrophobicContact CE2-CB 3.65Å; F425-H431 WeakPolarHBondContact CE2-O 3.44Å; F425-L434 HydrophobicContact CD1-CD1 4.44Å; F425-L434 HydrophobicContact CD1-CD2 4.13Å; F425-L434 HydrophobicContact CD2-CB 4.47Å; F425-L434 HydrophobicContact CD2-CD1 4.24Å; F425-L434 HydrophobicContact CE1-CB 4.24Å; F425-L434 HydrophobicContact CE1-CD2 4.06Å; F425-L434 HydrophobicContact CE2-CB 3.99Å; F425-L434 HydrophobicContact CG-CD1 4.16Å; F425-L434 HydrophobicContact CZ-CB 3.86Å; F425-F453 HydrophobicContact CE1-CE1 4.38Å; F425-F453 HydrophobicContact CE1-CZ 4.44Å; F425-F453 HydrophobicContact CZ-CE1 4.49Å
426	L	79.5	Confident	79.9	Confident	61 Å²	61	62.8 Å²	62.8	32%	0.319	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-41.2	176.6	-62.9	179.6	0	0	0	111.7	I422 E423 E424 S428 P447 V451	I422-L426 HydrophobicContact CG2-CG 4.37Å; I422-L426 WeakPolarHBondContact O-CG 3.1Å; I422-L426 PolarHBondContact O-N 3.13Å; E423-L426 PolarHBondContact O-N 2.99Å; E424-L426 VanDerWaalsContact C-N 3.34Å; E424-L426 PolarHBondContact O-N 3.09Å; L426-S428 VanDerWaalsContact C-N 3.33Å; L426-S428 PolarHBondContact O-N 3.41Å; L426-P447 HydrophobicContact CD1-CB 4.08Å; L426-V451 HydrophobicContact CD2-CG2 3.05Å
427	S	77.4	Confident	80.3	Confident	94 Å²	94	63.1 Å²	63.1	66%	0.657	33%	0.326	S	S	*	.	H	α-helix	trans	-71	-26.1	-178.9	74.1	0	0	0	0	113.6	E423 E424 F425 P429	E423-S427 PolarHBondContact O-N 2.59Å; E424-S427 PolarHBondContact O-N 2.87Å; E424-S427 PolarHBondContact O-OG 3.25Å; F425-S427 VanDerWaalsContact C-N 3.33Å; F425-S427 PolarHBondContact O-N 2.91Å; S427-P429 WeakPolarHBondContact O-CD 3.38Å
428	S	76.4	Confident	81	Confident	22 Å²	22	61.1 Å²	61.1	15%	0.154	32%	0.315	C	S	.	.			trans	-101.9	112.8	-173.1	-174.6	0	0	0	0	112.2	E424 F425 L426 L430 H431	E424-S428 WeakPolarHBondContact O-CB 3.28Å; E424-S428 PolarHBondContact O-N 3.29Å; E424-S428 VanDerWaalsContact O-N 3.11Å; F425-S428 PolarHBondContact O-N 3.12Å; L426-S428 VanDerWaalsContact C-N 3.33Å; L426-S428 PolarHBondContact O-N 3.41Å; S428-L430 PolarHBondContact O-N 3.28Å; S428-H431 WeakPolarHBondContact CB-ND1 3.24Å; S428-H431 PolarHBondContact OG-CE1 3.26Å; S428-H431 PolarHBondContact OG-ND1 2.65Å
429	P	72.3	Confident	81.9	Confident	111 Å²	111	56.2 Å²	56.2	72%	0.721	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.8	174.4	30.8	-35	0	0	0	113.1	S427	S427-P429 WeakPolarHBondContact O-CD 3.38Å
430	L	78.1	Confident	83.2	Confident	132 Å²	132	51.4 Å²	51.4	69%	0.691	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-27.4	-175.6	-62.8	173.6	0	0	0	112.7	S412 S428 S432	S412-L430 WeakPolarHBondContact CB-O 3.36Å; S428-L430 PolarHBondContact O-N 3.28Å; L430-S432 PolarHBondContact O-N 3.08Å
431	H	82.6	Confident	84	Confident	41 Å²	41	47.8 Å²	47.8	19%	0.19	25%	0.249	C	C	.	.			trans	-85.6	113	-178.3	-60	91.7	0	0	0	110.3	S412 F414 F425 S428	S412-H431 PolarHBondContact OG-CD2 3.15Å; S412-H431 PolarHBondContact OG-NE2 3.13Å; F414-H431 HydrophobicContact CB-CB 4.18Å; F414-H431 AromaticContact CD2-CD2 4Å; F414-H431 AromaticContact CD2-NE2 3.97Å; F425-H431 HydrophobicContact CD2-CB 3.61Å; F425-H431 HydrophobicContact CE2-CB 3.65Å; F425-H431 WeakPolarHBondContact CE2-O 3.44Å; S428-H431 WeakPolarHBondContact CB-ND1 3.24Å; S428-H431 PolarHBondContact OG-CE1 3.26Å; S428-H431 PolarHBondContact OG-ND1 2.65Å
432	S	87.4	Confident	84.5	Confident	29 Å²	29	43.6 Å²	43.6	20%	0.203	24%	0.238	C	C	.	.			trans	-93.3	-19.2	178.7	-48.8	0	0	0	0	112.9	R385 V386 S412 L430	R385-S432 WeakPolarHBondContact CA-O 3.37Å; V386-S432 PolarHBondContact N-O 3.47Å; S412-S432 PolarHBondContact O-N 3.28Å; L430-S432 PolarHBondContact O-N 3.08Å
433	V	92.4	Very high	84.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.6	-177.5	-176.5	0	0	0	0	110.2	L372 V386 V388 F402 I411 V413 F414 V435	L372-V433 HydrophobicContact CD1-CG2 3.93Å; V386-V433 HydrophobicContact CB-CG2 4.4Å; V386-V433 WeakPolarHBondContact O-CA 3.48Å; V388-V433 HydrophobicContact CG2-CG1 4.17Å; F402-V433 HydrophobicContact CE1-CG2 4.43Å; F402-V433 HydrophobicContact CE2-CG1 3.92Å; F402-V433 HydrophobicContact CZ-CG1 3.86Å; F402-V433 HydrophobicContact CZ-CG2 4.46Å; I411-V433 HydrophobicContact CD1-CG2 3.66Å; I411-V433 HydrophobicContact CG1-CG2 4.25Å; V413-V433 HydrophobicContact CG1-CB 4.4Å; V413-V433 HydrophobicContact CG1-CG1 4.29Å; V413-V433 HydrophobicContact CG2-CB 4.27Å; F414-V433 PolarHBondContact N-O 3.35Å; V433-V435 HydrophobicContact CG1-CG2 4.27Å
434	L	93.1	Very high	85.2	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.6	172.6	-179.8	60.4	0	0	0	109.3	V386 L387 V388 F414 V416 F425 F453	V386-L434 PolarHBondContact O-N 2.93Å; L387-L434 HydrophobicContact CD1-CB 4.16Å; L387-L434 HydrophobicContact CD1-CD2 3.84Å; L387-L434 HydrophobicContact CD1-CG 3.96Å; V388-L434 PolarHBondContact N-O 2.96Å; F414-L434 HydrophobicContact CB-CD1 4.33Å; F414-L434 HydrophobicContact CD1-CD1 3.65Å; F414-L434 HydrophobicContact CG-CD1 4.45Å; V416-L434 HydrophobicContact CG2-CD1 3.53Å; V416-L434 HydrophobicContact CG2-CG 4.46Å; F425-L434 HydrophobicContact CD1-CD1 4.44Å; F425-L434 HydrophobicContact CD1-CD2 4.13Å; F425-L434 HydrophobicContact CD2-CB 4.47Å; F425-L434 HydrophobicContact CD2-CD1 4.24Å; F425-L434 HydrophobicContact CE1-CB 4.24Å; F425-L434 HydrophobicContact CE1-CD2 4.06Å; F425-L434 HydrophobicContact CE2-CB 3.99Å; F425-L434 HydrophobicContact CG-CD1 4.16Å; F425-L434 HydrophobicContact CZ-CB 3.86Å; L434-F453 HydrophobicContact CB-CE1 4.38Å; L434-F453 HydrophobicContact CD2-CE1 4.33Å; L434-F453 HydrophobicContact CD2-CZ 3.98Å
435	V	93.9	Very high	85.6	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.6	173.2	-173.1	0	0	0	0	108.7	V388 T390 V395 W398 F402 V413 F414 T415 V416 V433	V388-V435 HydrophobicContact CB-CG1 4.45Å; V388-V435 HydrophobicContact CB-CG2 4.21Å; V388-V435 HydrophobicContact CG1-CG1 4.47Å; V388-V435 WeakPolarHBondContact O-CA 3.36Å; T390-V435 HydrophobicContact CG2-CG1 4.02Å; V395-V435 HydrophobicContact CB-CG1 4.45Å; V395-V435 HydrophobicContact CG1-CG1 4.05Å; W398-V435 HydrophobicContact CB-CG1 3.91Å; W398-V435 HydrophobicContact CB-CG2 4.43Å; W398-V435 HydrophobicContact CG-CG1 4.49Å; F402-V435 HydrophobicContact CE2-CG2 4.45Å; V413-V435 HydrophobicContact CG1-CG2 3.63Å; F414-V435 PolarHBondContact O-N 3.13Å; T415-V435 HydrophobicContact CG2-CB 4.21Å; V416-V435 PolarHBondContact N-O 3.27Å; V433-V435 HydrophobicContact CG1-CG2 4.27Å
436	I	92.1	Very high	85.9	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.4	-175.3	-168.4	167	0	0	0	111.2	L387 V388 V389 T390 V416 I422 M440 L441 I448	L387-I436 HydrophobicContact CD1-CG2 3.73Å; V388-I436 PolarHBondContact O-N 3.18Å; V389-I436 WeakPolarHBondContact CA-O 3.47Å; V389-I436 HydrophobicContact CG2-CG2 4.1Å; T390-I436 PolarHBondContact N-O 3.28Å; T390-I436 VanDerWaalsContact N-O 3.09Å; V416-I436 HydrophobicContact CB-CB 4.45Å; V416-I436 HydrophobicContact CB-CD1 4.36Å; V416-I436 HydrophobicContact CB-CG1 4.05Å; V416-I436 HydrophobicContact CG1-CD1 4.49Å; V416-I436 HydrophobicContact CG2-CB 4.16Å; V416-I436 HydrophobicContact CG2-CD1 4.08Å; V416-I436 HydrophobicContact CG2-CG1 4.07Å; I422-I436 HydrophobicContact CD1-CD1 3.97Å; I436-M440 HydrophobicContact CD1-CB 4.2Å; I436-M440 HydrophobicContact CD1-CG 4.06Å; I436-M440 HydrophobicContact CG1-CB 3.82Å; I436-M440 HydrophobicContact CG1-CG 4.03Å; I436-L441 HydrophobicContact CD1-CB 4.21Å; I436-L441 HydrophobicContact CG1-CB 4.49Å; I436-L441 HydrophobicContact CG2-CB 4.44Å; I436-L441 HydrophobicContact CG2-CD1 4.5Å; I436-I448 HydrophobicContact CD1-CD1 3.53Å
437	S	91.3	Very high	86.2	Confident	16 Å²	16	52 Å²	52	11%	0.112	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	152.9	172	98	0	0	0	0	112.5	T390 E439 M440 L441	T390-S437 WeakPolarHBondContact O-CA 3.29Å; S437-E439 WeakPolarHBondContact CB-OE2 3.19Å; S437-E439 PolarHBondContact O-N 2.8Å; S437-E439 PolarHBondContact OG-N 3Å; S437-E439 PolarHBondContact OG-OE2 2.81Å; S437-M440 PolarHBondContact O-N 2.95Å; S437-M440 PolarHBondContact OG-N 2.79Å; S437-M440 VanDerWaalsContact OG-N 3.09Å; S437-L441 WeakPolarHBondContact O-CB 3.28Å; S437-L441 PolarHBondContact O-N 2.99Å
438	Y	88.7	Confident	86.7	Confident	7 Å²	7	47.6 Å²	47.6	3%	0.027	24%	0.244	C	C	.	.	H	α-helix	trans	-53.5	-39.9	173.4	-77.7	-69.6	0	0	0	113.1	V389 T390 D459 R463 L464 T471 L475	V389-Y438 HydrophobicContact CB-CE1 4.26Å; V389-Y438 HydrophobicContact CG1-CD1 3.35Å; V389-Y438 HydrophobicContact CG1-CD2 4.3Å; V389-Y438 HydrophobicContact CG1-CE1 3.47Å; V389-Y438 VanDerWaalsContact CG1-CE1 3.47Å; V389-Y438 HydrophobicContact CG1-CE2 4.39Å; V389-Y438 HydrophobicContact CG1-CG 3.82Å; T390-Y438 PolarHBondContact O-N 2.83Å; Y438-D459 WeakPolarHBondContact CE2-O 3.39Å; Y438-D459 PolarHBondContact OH-O 3.35Å; Y438-R463 HydrophobicContact CE2-CB 4.33Å; Y438-L464 HydrophobicContact CE1-CD2 3.9Å; Y438-L464 HydrophobicContact CE1-CG 4.35Å; Y438-T471 HydrophobicContact CD1-CG2 3.48Å; Y438-T471 VanDerWaalsContact CD1-CG2 3.48Å; Y438-T471 HydrophobicContact CE1-CG2 4.17Å; Y438-T471 HydrophobicContact CG-CG2 4.36Å; Y438-L475 HydrophobicContact CE1-CD1 4.24Å
439	E	87.2	Confident	87.2	Confident	82 Å²	82	51.4 Å²	51.4	38%	0.383	26%	0.259	S	S	.	.	H	α-helix	trans	-73.2	-37.2	-178.8	-54.5	77.5	-169.3	0	0	111.7	S437 R463	S437-E439 WeakPolarHBondContact CB-OE2 3.19Å; S437-E439 PolarHBondContact O-N 2.8Å; S437-E439 PolarHBondContact OG-N 3Å; S437-E439 PolarHBondContact OG-OE2 2.81Å; E439-R463 IonicContact OE1-CZ 3.05Å; E439-R463 IonicContact OE1-NH1 3.78Å; E439-R463 PolarHBondContact OE1-NH1 3.4Å
440	M	87.8	Confident	87.9	Confident	33 Å²	33	54.5 Å²	54.5	16%	0.163	26%	0.261	C	S	.	.	H	α-helix	trans	-74.3	-34.1	178.2	-169.6	61.6	78	0	0	112.1	V416 I436 S437 L442 R443 C444	V416-M440 HydrophobicContact CB-CG 4.4Å; V416-M440 HydrophobicContact CG1-CG 3.62Å; V416-M440 HydrophobicContact CG1-SD 4.48Å; I436-M440 HydrophobicContact CD1-CB 4.2Å; I436-M440 HydrophobicContact CD1-CG 4.06Å; I436-M440 HydrophobicContact CG1-CB 3.82Å; I436-M440 HydrophobicContact CG1-CG 4.03Å; S437-M440 PolarHBondContact O-N 2.95Å; S437-M440 PolarHBondContact OG-N 2.79Å; S437-M440 VanDerWaalsContact OG-N 3.09Å; M440-L442 VanDerWaalsContact C-N 3.26Å; M440-L442 PolarHBondContact O-N 3.42Å; M440-R443 WeakPolarHBondContact O-CB 3.49Å; M440-R443 PolarHBondContact O-N 3.16Å; M440-R443 HydrophobicContact SD-CB 4.29Å; M440-C444 PolarHBondContact O-N 3.04Å; M440-C444 VanDerWaalsContact O-N 3.07Å
441	L	88.8	Confident	88.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-54.6	-44.5	173.6	177.2	69.1	0	0	0	111.5	V389 I436 S437 R443 C444 L445 I448 L475	V389-L441 HydrophobicContact CG1-CD2 4.16Å; V389-L441 HydrophobicContact CG2-CD2 4.33Å; I436-L441 HydrophobicContact CD1-CB 4.21Å; I436-L441 HydrophobicContact CG1-CB 4.49Å; I436-L441 HydrophobicContact CG2-CB 4.44Å; I436-L441 HydrophobicContact CG2-CD1 4.5Å; S437-L441 WeakPolarHBondContact O-CB 3.28Å; S437-L441 PolarHBondContact O-N 2.99Å; L441-R443 VanDerWaalsContact C-N 3.29Å; L441-R443 PolarHBondContact O-N 3.27Å; L441-C444 CarbonylContact O-C 3.57Å; L441-C444 PolarHBondContact O-N 3.32Å; L441-L445 PolarHBondContact O-N 2.91Å; L441-L445 VanDerWaalsContact O-N 3.08Å; L441-I448 HydrophobicContact CD1-CD1 3.65Å; L441-I448 HydrophobicContact CD1-CG2 4.23Å; L441-L475 HydrophobicContact CD2-CD2 3.42Å; L441-L475 VanDerWaalsContact CD2-CD2 3.42Å; L441-L475 HydrophobicContact CD2-CG 3.77Å
442	L	88	Confident	88.6	Confident	70 Å²	70	54 Å²	54	37%	0.366	26%	0.256	S	S	.	.	H	α-helix	trans	-63.6	-33.6	177.6	-71.2	177.1	0	0	0	113	M440 C444 K470 A474	M440-L442 VanDerWaalsContact C-N 3.26Å; M440-L442 PolarHBondContact O-N 3.42Å; L442-C444 VanDerWaalsContact C-N 3.34Å; L442-K470 HydrophobicContact CD2-CB 4.19Å; L442-A474 HydrophobicContact CD2-CB 3.78Å
443	R	86.9	Confident	88.8	Confident	192 Å²	192	53 Å²	53	73%	0.725	25%	0.248	S	C	*	.	H	α-helix	trans	-75.4	-26.2	179	-66.6	177.7	-178	173.6	0.3	112.7	M440 L441	M440-R443 WeakPolarHBondContact O-CB 3.49Å; M440-R443 PolarHBondContact O-N 3.16Å; M440-R443 HydrophobicContact SD-CB 4.29Å; L441-R443 VanDerWaalsContact C-N 3.29Å; L441-R443 PolarHBondContact O-N 3.27Å
444	C	85.9	Confident	88.7	Confident	32 Å²	32	53.7 Å²	53.7	22%	0.216	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	32.9	-172.1	-55.9	0	0	0	0	112.5	I422 M440 L441 L442 P447 I448	I422-C444 HydrophobicContact CD1-CB 3.08Å; M440-C444 PolarHBondContact O-N 3.04Å; M440-C444 VanDerWaalsContact O-N 3.07Å; L441-C444 CarbonylContact O-C 3.57Å; L441-C444 PolarHBondContact O-N 3.32Å; L442-C444 VanDerWaalsContact C-N 3.34Å; C444-P447 HydrophobicContact CB-CG 4.17Å; C444-P447 VanDerWaalsContact O-CD 3.25Å; C444-P447 WeakPolarHBondContact O-CD 3.23Å; C444-P447 VanDerWaalsContact O-CG 3.28Å; C444-P447 WeakPolarHBondContact O-CG 3.45Å; C444-I448 HydrophobicContact CB-CD1 4.36Å; C444-I448 WeakPolarHBondContact O-CD1 3.27Å; C444-I448 VanDerWaalsContact O-CG1 3.23Å; C444-I448 WeakPolarHBondContact O-CG1 3.43Å; C444-I448 PolarHBondContact O-N 2.97Å
445	L	86.7	Confident	88.8	Confident	42 Å²	42	53.6 Å²	53.6	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-63.6	-44.4	-177	-174.7	61.3	0	0	0	112.3	L441 I448 Q449 A474 L478	L441-L445 PolarHBondContact O-N 2.91Å; L441-L445 VanDerWaalsContact O-N 3.08Å; L445-I448 PolarHBondContact O-N 3.04Å; L445-I448 VanDerWaalsContact O-N 3.16Å; L445-Q449 WeakPolarHBondContact O-CB 3.48Å; L445-Q449 PolarHBondContact O-N 2.92Å; L445-A474 HydrophobicContact CD1-CB 3.96Å; L445-A474 HydrophobicContact CD2-CB 3.79Å; L445-L478 HydrophobicContact CD1-CD2 4.24Å
446	E	87.1	Confident	88.9	Confident	155 Å²	155	53.6 Å²	53.6	72%	0.724	26%	0.255	S	S	*	.	H	α-helix	trans	-56.2	-50.5	-177.9	-67	-178.6	-174.7	0	0	114.4	I448	E446-I448 VanDerWaalsContact C-N 3.33Å; E446-I448 PolarHBondContact O-N 2.87Å
447	P	86.4	Confident	89	Confident	34 Å²	34	53.6 Å²	53.6	22%	0.221	26%	0.255	C	S	.	.	H	α-helix	trans	-68.3	-30.9	176.5	24.7	-33.8	0	0	0	112.9	I422 L426 C444 K450	I422-P447 HydrophobicContact CG2-CB 4.19Å; I422-P447 HydrophobicContact CG2-CG 4.35Å; L426-P447 HydrophobicContact CD1-CB 4.08Å; C444-P447 HydrophobicContact CB-CG 4.17Å; C444-P447 VanDerWaalsContact O-CD 3.25Å; C444-P447 WeakPolarHBondContact O-CD 3.23Å; C444-P447 VanDerWaalsContact O-CG 3.28Å; C444-P447 WeakPolarHBondContact O-CG 3.45Å; P447-K450 PolarHBondContact O-N 2.91Å
448	I	87.1	Confident	89.2	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-71.7	-37.8	179.9	-68.8	172.7	0	0	0	110.9	L387 I422 I436 L441 C444 L445 E446 K450 V451 F453 L478	L387-I448 HydrophobicContact CD2-CG2 4.49Å; I422-I448 HydrophobicContact CD1-CD1 3.88Å; I422-I448 HydrophobicContact CD1-CG1 4.17Å; I422-I448 HydrophobicContact CG2-CG1 4.22Å; I436-I448 HydrophobicContact CD1-CD1 3.53Å; L441-I448 HydrophobicContact CD1-CD1 3.65Å; L441-I448 HydrophobicContact CD1-CG2 4.23Å; C444-I448 HydrophobicContact CB-CD1 4.36Å; C444-I448 WeakPolarHBondContact O-CD1 3.27Å; C444-I448 VanDerWaalsContact O-CG1 3.23Å; C444-I448 WeakPolarHBondContact O-CG1 3.43Å; C444-I448 PolarHBondContact O-N 2.97Å; L445-I448 PolarHBondContact O-N 3.04Å; L445-I448 VanDerWaalsContact O-N 3.16Å; E446-I448 VanDerWaalsContact C-N 3.33Å; E446-I448 PolarHBondContact O-N 2.87Å; I448-K450 PolarHBondContact O-N 2.93Å; I448-V451 WeakPolarHBondContact O-CB 3.42Å; I448-V451 PolarHBondContact O-N 3.2Å; I448-F453 HydrophobicContact CG2-CE2 3.68Å; I448-F453 HydrophobicContact CG2-CZ 4.23Å; I448-L478 HydrophobicContact CG2-CD1 4.39Å; I448-L478 HydrophobicContact CG2-CD2 3.87Å
449	Q	88.1	Confident	89.3	Confident	101 Å²	101	53 Å²	53	47%	0.472	25%	0.251	S	S	.	.	H	α-helix	trans	-64.3	-23.1	178.9	-165.8	177.3	4.7	0	0	112.9	L445 V451 L478	L445-Q449 WeakPolarHBondContact O-CB 3.48Å; L445-Q449 PolarHBondContact O-N 2.92Å; Q449-V451 PolarHBondContact O-N 2.89Å; Q449-L478 HydrophobicContact CB-CD2 4.38Å
450	K	85.9	Confident	89.1	Confident	176 Å²	176	49.7 Å²	49.7	77%	0.765	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-11.1	174.1	-63.9	175.2	-175.1	176	0	113.2	P447 I448	P447-K450 PolarHBondContact O-N 2.91Å; I448-K450 PolarHBondContact O-N 2.93Å
451	V	86.4	Confident	88.7	Confident	10 Å²	10	48.1 Å²	48.1	6%	0.061	23%	0.228	C	C	.	.	S	Bend	trans	-101.9	130.2	-178.4	-178.1	0	0	0	0	110.6	L426 I448 Q449 F453	L426-V451 HydrophobicContact CD2-CG2 3.05Å; I448-V451 WeakPolarHBondContact O-CB 3.42Å; I448-V451 PolarHBondContact O-N 3.2Å; Q449-V451 PolarHBondContact O-N 2.89Å; V451-F453 HydrophobicContact CB-CD2 4.31Å; V451-F453 HydrophobicContact CB-CE2 3.68Å; V451-F453 HydrophobicContact CB-CZ 3.91Å; V451-F453 HydrophobicContact CG1-CD1 4.41Å; V451-F453 HydrophobicContact CG1-CD2 4.23Å; V451-F453 HydrophobicContact CG1-CE1 4.02Å; V451-F453 HydrophobicContact CG1-CE2 3.81Å; V451-F453 HydrophobicContact CG1-CZ 3.71Å; V451-F453 WeakPolarHBondContact O-CD2 3.41Å; V451-F453 PolarHBondContact O-N 3.06Å
452	E	89.1	Confident	88	Confident	152 Å²	152	50.4 Å²	50.4	71%	0.71	24%	0.239	S	C	*	.			trans	-79.4	112	170.2	-167.4	-174.4	177.8	0	0	110.2
453	F	91.6	Very high	87.4	Confident	8 Å²	8	52 Å²	52	4%	0.035	24%	0.24	C	C	.	.			trans	-96.8	134.9	172.3	-65.5	-80.2	0	0	0	110.2	R385 L387 F425 L434 I448 V451 C480	R385-F453 HydrophobicContact CB-CD1 4Å; R385-F453 HydrophobicContact CB-CE1 4.38Å; L387-F453 HydrophobicContact CB-CD1 3.66Å; L387-F453 HydrophobicContact CB-CD2 4.45Å; L387-F453 HydrophobicContact CB-CE1 3.87Å; L387-F453 HydrophobicContact CB-CG 3.97Å; L387-F453 HydrophobicContact CB-CZ 4.36Å; L387-F453 HydrophobicContact CD1-CE1 4.43Å; L387-F453 HydrophobicContact CD1-CZ 4.38Å; L387-F453 HydrophobicContact CD2-CD2 4.49Å; L387-F453 HydrophobicContact CD2-CE2 4.43Å; F425-F453 HydrophobicContact CE1-CE1 4.38Å; F425-F453 HydrophobicContact CE1-CZ 4.44Å; F425-F453 HydrophobicContact CZ-CE1 4.49Å; L434-F453 HydrophobicContact CB-CE1 4.38Å; L434-F453 HydrophobicContact CD2-CE1 4.33Å; L434-F453 HydrophobicContact CD2-CZ 3.98Å; I448-F453 HydrophobicContact CG2-CE2 3.68Å; I448-F453 HydrophobicContact CG2-CZ 4.23Å; V451-F453 HydrophobicContact CB-CD2 4.31Å; V451-F453 HydrophobicContact CB-CE2 3.68Å; V451-F453 HydrophobicContact CB-CZ 3.91Å; V451-F453 HydrophobicContact CG1-CD1 4.41Å; V451-F453 HydrophobicContact CG1-CD2 4.23Å; V451-F453 HydrophobicContact CG1-CE1 4.02Å; V451-F453 HydrophobicContact CG1-CE2 3.81Å; V451-F453 HydrophobicContact CG1-CZ 3.71Å; V451-F453 WeakPolarHBondContact O-CD2 3.41Å; V451-F453 PolarHBondContact O-N 3.06Å; F453-C480 PolarHBondContact O-SG 2.76Å; F453-C480 VanDerWaalsContact O-SG 3.37Å
454	G	91.1	Very high	86.8	Confident	15 Å²	15	43 Å²	43	16%	0.155	21%	0.206	C	C	.	.	S	Bend	trans	-87.1	-15.7	176.7	0	0	0	0	0	113.7	R385 R482	R385-G454 PolarHBondContact O-N 2.83Å; G454-R482 WeakPolarHBondContact O-CB 3.42Å; G454-R482 VanDerWaalsContact O-CD 3.31Å; G454-R482 WeakPolarHBondContact O-CD 3.28Å
455	L	94.7	Very high	86.1	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	134.9	179	177.4	66.7	0	0	0	110	V339 L371 V386 L387 I457 R482 V484	V339-L455 HydrophobicContact CG1-CD1 4.24Å; V339-L455 HydrophobicContact CG2-CD1 4.44Å; L371-L455 HydrophobicContact CD1-CD2 4.04Å; V386-L455 HydrophobicContact CG1-CB 4.21Å; V386-L455 HydrophobicContact CG1-CD2 4.09Å; V386-L455 HydrophobicContact CG1-CG 4.24Å; V386-L455 HydrophobicContact CG2-CB 4.22Å; V386-L455 HydrophobicContact CG2-CD2 4.44Å; L387-L455 PolarHBondContact N-O 3.36Å; L455-I457 HydrophobicContact CD2-CD1 4Å; L455-I457 HydrophobicContact CD2-CG1 4.07Å; L455-I457 HydrophobicContact CG-CG1 4.05Å; L455-R482 HydrophobicContact CD1-CB 3.9Å; L455-V484 HydrophobicContact CD1-CG2 3.96Å
456	I	95.3	Very high	85	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.2	168.7	-62.3	176.6	0	0	0	108.8	L387 L475 L478 C480 R482 R483 V484	L387-I456 HydrophobicContact CB-CG1 4.27Å; L387-I456 HydrophobicContact CD2-CD1 4.49Å; L387-I456 HydrophobicContact CD2-CG1 4.31Å; L387-I456 CarbonylContact O-C 3.58Å; L387-I456 WeakPolarHBondContact O-CA 3.33Å; I456-L475 HydrophobicContact CG2-CD2 4.47Å; I456-L478 HydrophobicContact CD1-CB 4.02Å; I456-L478 HydrophobicContact CD1-CD1 3.88Å; I456-C480 HydrophobicContact CD1-CB 3.56Å; I456-C480 HydrophobicContact CG1-CB 3.79Å; I456-R482 PolarHBondContact N-O 3.08Å; I456-R483 WeakPolarHBondContact O-CA 3.49Å; I456-V484 PolarHBondContact O-N 3.14Å
457	I	95.8	Very high	83.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121.7	172.1	-54.3	-168.8	0	0	0	108.7	C368 L387 V388 V389 W398 L455 V484 L486	C368-I457 WeakPolarHBondContact SG-CD1 3.48Å; L387-I457 PolarHBondContact O-N 2.91Å; V388-I457 CarbonylContact C-O 3.46Å; V388-I457 WeakPolarHBondContact CA-O 3.25Å; V388-I457 HydrophobicContact CG2-CB 4.41Å; V389-I457 PolarHBondContact N-O 3.47Å; W398-I457 HydrophobicContact CH2-CG2 4.27Å; L455-I457 HydrophobicContact CD2-CD1 4Å; L455-I457 HydrophobicContact CD2-CG1 4.07Å; L455-I457 HydrophobicContact CG-CG1 4.05Å; I457-V484 CarbonylContact C-O 3.59Å; I457-V484 WeakPolarHBondContact CA-O 3.37Å; I457-V484 HydrophobicContact CG1-CB 4.32Å; I457-L486 HydrophobicContact CG2-CD1 3.81Å; I457-L486 HydrophobicContact CG2-CG 3.96Å
458	C	93.6	Very high	82.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	109.7	176.3	-71.7	0	0	0	0	109	L464 V484 I485 L486	C458-L464 HydrophobicContact CB-CD1 4.07Å; C458-V484 PolarHBondContact N-O 2.98Å; C458-I485 HydrophobicContact CB-CG1 4.06Å; C458-I485 WeakPolarHBondContact O-CA 3.49Å; C458-L486 PolarHBondContact O-N 3.49Å
459	D	91.2	Very high	81.2	Confident	10 Å²	10	48.2 Å²	48.2	5%	0.053	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	145	177.1	-170.4	26.4	0	0	0	111.5	V389 T390 W398 Y438 L486	V389-D459 PolarHBondContact O-N 2.78Å; T390-D459 PolarHBondContact OG1-OD2 3.16Å; T390-D459 VanDerWaalsContact OG1-OD2 3.13Å; W398-D459 HydrophobicContact CZ2-CB 3.91Å; W398-D459 PolarHBondContact NE1-OD2 3.27Å; Y438-D459 WeakPolarHBondContact CE2-O 3.39Å; Y438-D459 PolarHBondContact OH-O 3.35Å; D459-L486 HydrophobicContact CB-CD1 4.46Å
460	E	84.2	Confident	80.8	Confident	13 Å²	13	51.5 Å²	51.5	6%	0.061	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	52.5	-169.7	-64.6	-64.8	175.3	0	0	112.7	P391 L394 H462 R463 L486 V749	P391-E460 HydrophobicContact CG-CB 4Å; P391-E460 HydrophobicContact CG-CG 4.09Å; L394-E460 HydrophobicContact CD1-CG 4.43Å; E460-H462 PolarHBondContact O-N 3.14Å; E460-H462 IonicContact OE2-CE1 2.77Å; E460-H462 PolarHBondContact OE2-CE1 2.97Å; E460-H462 IonicContact OE2-ND1 3Å; E460-H462 PolarHBondContact OE2-ND1 2.85Å; E460-R463 WeakPolarHBondContact O-CB 3.22Å; E460-R463 PolarHBondContact O-N 3.33Å; E460-L486 WeakPolarHBondContact CA-O 3.32Å; E460-L486 PolarHBondContact N-O 2.65Å; E460-V749 HydrophobicContact CG-CG1 3.93Å; E460-V749 HydrophobicContact CG-CG2 4.16Å; E460-V749 WeakPolarHBondContact OE1-CG1 3.46Å
461	G	78.3	Confident	80.6	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-58.9	-12.5	-176.3	0	0	0	0	0	115.4	R463 L464 L486	G461-R463 PolarHBondContact O-N 3.01Å; G461-L464 WeakPolarHBondContact O-CB 3.31Å; G461-L464 PolarHBondContact O-N 3.14Å; G461-L486 PolarHBondContact N-O 2.87Å
462	H	74	Confident	80.4	Confident	48 Å²	48	44 Å²	44	22%	0.222	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-60.7	-8.8	165.8	78.9	-94.1	0	0	0	112.6	E460 L464 K465	E460-H462 PolarHBondContact O-N 3.14Å; E460-H462 IonicContact OE2-CE1 2.77Å; E460-H462 PolarHBondContact OE2-CE1 2.97Å; E460-H462 IonicContact OE2-ND1 3Å; E460-H462 PolarHBondContact OE2-ND1 2.85Å; H462-L464 VanDerWaalsContact C-N 3.29Å; H462-K465 WeakPolarHBondContact O-CD 3.09Å; H462-K465 WeakPolarHBondContact O-CE 3.41Å; H462-K465 WeakPolarHBondContact O-CG 3.38Å
463	R	75.8	Confident	80.1	Confident	104 Å²	104	40.8 Å²	40.8	39%	0.392	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-76	-15	167.5	-74.2	-173.1	155.6	-147.7	-6.4	113.8	Y438 E439 E460 G461 K465	Y438-R463 HydrophobicContact CE2-CB 4.33Å; E439-R463 IonicContact OE1-CZ 3.05Å; E439-R463 IonicContact OE1-NH1 3.78Å; E439-R463 PolarHBondContact OE1-NH1 3.4Å; E460-R463 WeakPolarHBondContact O-CB 3.22Å; E460-R463 PolarHBondContact O-N 3.33Å; G461-R463 PolarHBondContact O-N 3.01Å; R463-K465 VanDerWaalsContact C-N 3.32Å
464	L	74.9	Confident	79.9	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-94.4	17.4	-178.7	-58.4	174.7	0	0	0	113.1	Y438 C458 G461 H462 N466 T471 L475 I485 F504	Y438-L464 HydrophobicContact CE1-CD2 3.9Å; Y438-L464 HydrophobicContact CE1-CG 4.35Å; C458-L464 HydrophobicContact CB-CD1 4.07Å; G461-L464 WeakPolarHBondContact O-CB 3.31Å; G461-L464 PolarHBondContact O-N 3.14Å; H462-L464 VanDerWaalsContact C-N 3.29Å; L464-N466 PolarHBondContact O-N 3.09Å; L464-T471 HydrophobicContact CD2-CG2 4.06Å; L464-L475 HydrophobicContact CD1-CD1 4.22Å; L464-L475 HydrophobicContact CD2-CD1 3.78Å; L464-I485 HydrophobicContact CD1-CD1 4.09Å; L464-F504 HydrophobicContact CD1-CD1 4.33Å; L464-F504 HydrophobicContact CD1-CE1 4.21Å
465	K	70.6	Confident	79.7	Confident	32 Å²	32	39.9 Å²	39.9	14%	0.139	22%	0.218	C	C	.	.			trans	-51.8	-41.6	-174.1	-84.3	166.5	179.4	-114.8	0	115.6	H462 R463 Q492 E497 A500	H462-K465 WeakPolarHBondContact O-CD 3.09Å; H462-K465 WeakPolarHBondContact O-CE 3.41Å; H462-K465 WeakPolarHBondContact O-CG 3.38Å; R463-K465 VanDerWaalsContact C-N 3.32Å; K465-Q492 VanDerWaalsContact NZ-OE1 3.17Å; K465-E497 HydrophobicContact CB-CB 4.34Å; K465-E497 HydrophobicContact CB-CG 3.72Å; K465-E497 VanDerWaalsContact CD-CD 3.48Å; K465-E497 HydrophobicContact CD-CG 4.36Å; K465-E497 VanDerWaalsContact CD-OE1 3.31Å; K465-E497 WeakPolarHBondContact CD-OE1 3.34Å; K465-E497 WeakPolarHBondContact CD-OE2 2.91Å; K465-E497 WeakPolarHBondContact CE-OE2 3.31Å; K465-E497 HydrophobicContact CG-CB 4.12Å; K465-E497 HydrophobicContact CG-CG 3.73Å; K465-E497 WeakPolarHBondContact CG-OE2 3.36Å; K465-E497 IonicContact NZ-OE1 2.65Å; K465-E497 PolarHBondContact NZ-OE1 2.82Å; K465-E497 IonicContact NZ-OE2 2.84Å; K465-E497 PolarHBondContact NZ-OE2 2.78Å; K465-A500 WeakPolarHBondContact O-CB 3.42Å
466	N	64.6	Low	79.3	Confident	84 Å²	84	42.6 Å²	42.6	45%	0.449	24%	0.237	S	C	.	.			trans	-104.1	125	-175.4	-64	-14.7	0	0	0	111	L464 S468 I469	L464-N466 PolarHBondContact O-N 3.09Å; N466-S468 PolarHBondContact O-N 3.36Å; N466-S468 VanDerWaalsContact O-N 3.14Å; N466-I469 HydrophobicContact CB-CD1 3.65Å; N466-I469 HydrophobicContact CB-CG1 3.78Å; N466-I469 WeakPolarHBondContact O-CB 3Å; N466-I469 PolarHBondContact O-N 3.46Å
467	S	58.5	Low	78.9	Confident	97 Å²	97	45 Å²	45	68%	0.678	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.9	172.1	-177.7	0	0	0	0	112.6	I469	S467-I469 VanDerWaalsContact C-N 3.3Å; S467-I469 PolarHBondContact O-N 2.82Å
468	S	53.4	Low	78.6	Confident	108 Å²	108	45.3 Å²	45.3	76%	0.755	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-7	177.3	60	0	0	0	0	115.1	N466 K470	N466-S468 PolarHBondContact O-N 3.36Å; N466-S468 VanDerWaalsContact O-N 3.14Å; S468-K470 PolarHBondContact O-N 3.19Å
469	I	69	Low	78.1	Confident	53 Å²	53	49.3 Å²	49.3	27%	0.272	28%	0.283	S	S	.	.	S	Bend	trans	-74.6	128	-179.8	-69	162.6	0	0	0	109.7	N466 S467 T471 S472 S473	N466-I469 HydrophobicContact CB-CD1 3.65Å; N466-I469 HydrophobicContact CB-CG1 3.78Å; N466-I469 WeakPolarHBondContact O-CB 3Å; N466-I469 PolarHBondContact O-N 3.46Å; S467-I469 VanDerWaalsContact C-N 3.3Å; S467-I469 PolarHBondContact O-N 2.82Å; I469-T471 WeakPolarHBondContact CG2-OG1 3.38Å; I469-T471 PolarHBondContact O-N 3.32Å; I469-S472 PolarHBondContact O-N 3.43Å; I469-S473 PolarHBondContact O-N 3.35Å
470	K	78.8	Confident	77.9	Confident	170 Å²	170	49.1 Å²	49.1	74%	0.739	28%	0.283	S	S	*	.	H	α-helix	trans	-47.8	-34.4	175.6	-65.1	-177	179.2	-178.7	0	113	L442 S468 A474	L442-K470 HydrophobicContact CD2-CB 4.19Å; S468-K470 PolarHBondContact O-N 3.19Å; K470-A474 VanDerWaalsContact O-CB 3.26Å; K470-A474 WeakPolarHBondContact O-CB 3.31Å; K470-A474 PolarHBondContact O-N 3.34Å
471	T	81.9	Confident	78	Confident	19 Å²	19	54.2 Å²	54.2	12%	0.117	31%	0.31	C	S	.	.	H	α-helix	trans	-60.7	-43.3	176.3	-43.5	0	0	0	0	113.8	Y438 L464 I469 A474 L475	Y438-T471 HydrophobicContact CD1-CG2 3.48Å; Y438-T471 VanDerWaalsContact CD1-CG2 3.48Å; Y438-T471 HydrophobicContact CE1-CG2 4.17Å; Y438-T471 HydrophobicContact CG-CG2 4.36Å; L464-T471 HydrophobicContact CD2-CG2 4.06Å; I469-T471 WeakPolarHBondContact CG2-OG1 3.38Å; I469-T471 PolarHBondContact O-N 3.32Å; T471-A474 PolarHBondContact O-N 2.86Å; T471-L475 HydrophobicContact CG2-CD1 4.23Å; T471-L475 WeakPolarHBondContact O-CB 3.48Å; T471-L475 WeakPolarHBondContact O-CG 3.14Å; T471-L475 PolarHBondContact O-N 3.29Å
472	S	81.4	Confident	78.7	Confident	10 Å²	10	57 Å²	57	7%	0.07	32%	0.321	C	S	.	.	H	α-helix	trans	-67.6	-44.6	179.5	-173.7	0	0	0	0	110.5	I469 A474 L475 S476	I469-S472 PolarHBondContact O-N 3.43Å; S472-A474 PolarHBondContact O-N 2.79Å; S472-L475 PolarHBondContact O-N 3.18Å; S472-S476 WeakPolarHBondContact O-CB 3.37Å; S472-S476 PolarHBondContact O-N 2.97Å; S472-S476 PolarHBondContact O-OG 2.91Å
473	S	84	Confident	79.7	Confident	83 Å²	83	56 Å²	56	58%	0.58	32%	0.315	S	S	*	.	H	α-helix	trans	-60.1	-44.4	173.9	179	0	0	0	0	112.3	I469 L475 S476 S477	I469-S473 PolarHBondContact O-N 3.35Å; S473-L475 PolarHBondContact O-N 2.95Å; S473-S476 PolarHBondContact O-N 3.14Å; S473-S477 PolarHBondContact O-N 2.87Å
474	A	86.6	Confident	80.6	Confident	5 Å²	5	51.1 Å²	51.1	4%	0.041	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-45.9	176.8	0	0	0	0	0	112.1	L442 L445 K470 T471 S472 S477	L442-A474 HydrophobicContact CD2-CB 3.78Å; L445-A474 HydrophobicContact CD1-CB 3.96Å; L445-A474 HydrophobicContact CD2-CB 3.79Å; K470-A474 VanDerWaalsContact O-CB 3.26Å; K470-A474 WeakPolarHBondContact O-CB 3.31Å; K470-A474 PolarHBondContact O-N 3.34Å; T471-A474 PolarHBondContact O-N 2.86Å; S472-A474 PolarHBondContact O-N 2.79Å; A474-S477 PolarHBondContact O-N 2.85Å; A474-S477 PolarHBondContact O-OG 3.37Å
475	L	87.1	Confident	81.4	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66.7	-37.6	176.9	-73.6	166	0	0	0	112.4	V389 Y438 L441 I456 L464 T471 S472 S473 S477 L478 F504	V389-L475 HydrophobicContact CG2-CD2 4.05Å; Y438-L475 HydrophobicContact CE1-CD1 4.24Å; L441-L475 HydrophobicContact CD2-CD2 3.42Å; L441-L475 VanDerWaalsContact CD2-CD2 3.42Å; L441-L475 HydrophobicContact CD2-CG 3.77Å; I456-L475 HydrophobicContact CG2-CD2 4.47Å; L464-L475 HydrophobicContact CD1-CD1 4.22Å; L464-L475 HydrophobicContact CD2-CD1 3.78Å; T471-L475 HydrophobicContact CG2-CD1 4.23Å; T471-L475 WeakPolarHBondContact O-CB 3.48Å; T471-L475 WeakPolarHBondContact O-CG 3.14Å; T471-L475 PolarHBondContact O-N 3.29Å; S472-L475 PolarHBondContact O-N 3.18Å; S473-L475 PolarHBondContact O-N 2.95Å; L475-S477 VanDerWaalsContact C-N 3.26Å; L475-S477 PolarHBondContact O-N 3.14Å; L475-L478 HydrophobicContact CD2-CD1 4.21Å; L475-L478 WeakPolarHBondContact O-CB 3.37Å; L475-L478 PolarHBondContact O-N 3.18Å; L475-F504 HydrophobicContact CB-CE2 3.39Å; L475-F504 HydrophobicContact CB-CZ 3.74Å; L475-F504 HydrophobicContact CD1-CE2 4.24Å; L475-F504 HydrophobicContact CD1-CZ 4.04Å; L475-F504 HydrophobicContact CG-CE2 4.42Å; L475-F504 HydrophobicContact CG-CZ 4.4Å
476	S	86.1	Confident	82.4	Confident	57 Å²	57	49.5 Å²	49.5	40%	0.399	29%	0.29	S	S	.	.	H	α-helix	trans	-67.3	-27.2	176.6	-73.6	0	0	0	0	113.1	S472 S473 L478 R483	S472-S476 WeakPolarHBondContact O-CB 3.37Å; S472-S476 PolarHBondContact O-N 2.97Å; S472-S476 PolarHBondContact O-OG 2.91Å; S473-S476 PolarHBondContact O-N 3.14Å; S476-L478 PolarHBondContact O-N 3.45Å; S476-R483 PolarHBondContact O-NH2 3.37Å; S476-R483 PolarHBondContact OG-NH1 2.79Å
477	S	87.9	Confident	83.4	Confident	50 Å²	50	45.5 Å²	45.5	35%	0.35	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-14.9	174.3	79	0	0	0	0	114.3	S473 A474 L475	S473-S477 PolarHBondContact O-N 2.87Å; A474-S477 PolarHBondContact O-N 2.85Å; A474-S477 PolarHBondContact O-OG 3.37Å; L475-S477 VanDerWaalsContact C-N 3.26Å; L475-S477 PolarHBondContact O-N 3.14Å
478	L	88.6	Confident	84	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.037	24%	0.239	C	C	.	.	S	Bend	trans	-77.6	136.3	178.1	-59.5	176.3	0	0	0	110.9	L387 L445 I448 Q449 I456 L475 S476 C480	L387-L478 HydrophobicContact CD2-CD1 3.78Å; L445-L478 HydrophobicContact CD1-CD2 4.24Å; I448-L478 HydrophobicContact CG2-CD1 4.39Å; I448-L478 HydrophobicContact CG2-CD2 3.87Å; Q449-L478 HydrophobicContact CB-CD2 4.38Å; I456-L478 HydrophobicContact CD1-CB 4.02Å; I456-L478 HydrophobicContact CD1-CD1 3.88Å; L475-L478 HydrophobicContact CD2-CD1 4.21Å; L475-L478 WeakPolarHBondContact O-CB 3.37Å; L475-L478 PolarHBondContact O-N 3.18Å; S476-L478 PolarHBondContact O-N 3.45Å; L478-C480 PolarHBondContact O-N 2.83Å
479	S	83.4	Confident	84.5	Confident	83 Å²	83	38.5 Å²	38.5	58%	0.58	22%	0.218	S	C	*	.			trans	-77.7	55	-176.6	65	0	0	0	0	113.3
480	C	88	Confident	83.6	Confident	6 Å²	6	36.6 Å²	36.6	4%	0.041	21%	0.209	C	C	.	.			trans	-127.4	121.3	178.5	-174.4	0	0	0	0	111.9	F453 I456 L478 R482 R483	F453-C480 PolarHBondContact O-SG 2.76Å; F453-C480 VanDerWaalsContact O-SG 3.37Å; I456-C480 HydrophobicContact CD1-CB 3.56Å; I456-C480 HydrophobicContact CG1-CB 3.79Å; L478-C480 PolarHBondContact O-N 2.83Å; C480-R482 PolarHBondContact SG-O 2.8Å; C480-R483 PolarHBondContact O-NE 3.38Å
481	N	85.6	Confident	82.5	Confident	121 Å²	121	30.5 Å²	30.5	65%	0.647	19%	0.186	S	C	*	.	S	Bend	trans	-80.1	-30.8	178.7	-62.9	-13.7	0	0	0	112.4
482	R	93.3	Very high	80.9	Confident	57 Å²	57	33.1 Å²	33.1	22%	0.215	20%	0.197	C	C	.	.			trans	-89.1	111.2	-177.2	-69.2	175.9	-176.1	94.5	3	110.1	V339 H348 G454 L455 I456 C480	V339-R482 HydrophobicContact CG1-CB 3.97Å; V339-R482 VanDerWaalsContact CG1-CD 3.44Å; V339-R482 HydrophobicContact CG1-CG 3.73Å; V339-R482 WeakPolarHBondContact O-CG 3.21Å; V339-R482 PolarHBondContact O-NE 3.13Å; H348-R482 HydrophobicContact CB-CG 3.88Å; G454-R482 WeakPolarHBondContact O-CB 3.42Å; G454-R482 VanDerWaalsContact O-CD 3.31Å; G454-R482 WeakPolarHBondContact O-CD 3.28Å; L455-R482 HydrophobicContact CD1-CB 3.9Å; I456-R482 PolarHBondContact N-O 3.08Å; C480-R482 PolarHBondContact SG-O 2.8Å
483	R	93.5	Very high	79.5	Confident	28 Å²	28	35.8 Å²	35.8	11%	0.106	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	122.7	-174.5	-62	178.7	-177.8	-159.1	-2	110	G349 A350 I456 S476 C480 F504	G349-R483 CarbonylContact C-O 3.57Å; G349-R483 WeakPolarHBondContact CA-O 3.41Å; A350-R483 PolarHBondContact N-O 3.06Å; I456-R483 WeakPolarHBondContact O-CA 3.49Å; S476-R483 PolarHBondContact O-NH2 3.37Å; S476-R483 PolarHBondContact OG-NH1 2.79Å; C480-R483 PolarHBondContact O-NE 3.38Å; R483-F504 WeakPolarHBondContact CD-O 3.4Å; R483-F504 VanDerWaalsContact NH1-CE2 3.32Å; R483-F504 PolarHBondContact NH1-O 3.36Å
484	V	95	Very high	78.6	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.4	176.6	178.3	0	0	0	0	108.9	L335 V339 A350 L367 L455 I456 I457 C458 L486	L335-V484 HydrophobicContact CD2-CG1 3.85Å; L335-V484 HydrophobicContact CD2-CG2 4.46Å; V339-V484 HydrophobicContact CG2-CG2 3.6Å; A350-V484 HydrophobicContact CB-CG2 4.34Å; A350-V484 CarbonylContact O-C 3.57Å; A350-V484 VanDerWaalsContact O-CA 3.3Å; A350-V484 WeakPolarHBondContact O-CA 3.32Å; L367-V484 HydrophobicContact CD2-CG2 4.3Å; L455-V484 HydrophobicContact CD1-CG2 3.96Å; I456-V484 PolarHBondContact O-N 3.14Å; I457-V484 CarbonylContact C-O 3.59Å; I457-V484 WeakPolarHBondContact CA-O 3.37Å; I457-V484 HydrophobicContact CG1-CB 4.32Å; C458-V484 PolarHBondContact N-O 2.98Å; V484-L486 HydrophobicContact CG1-CD2 3.84Å
485	I	93.1	Very high	78.1	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.2	169.9	-74.1	-174.9	0	0	0	109.5	A350 I351 L352 C458 L464 T487 I501 F504 V505	A350-I485 PolarHBondContact O-N 2.75Å; I351-I485 CarbonylContact C-O 3.58Å; I351-I485 WeakPolarHBondContact CA-O 3.44Å; I351-I485 HydrophobicContact CG1-CB 4.37Å; I351-I485 HydrophobicContact CG2-CB 4.48Å; I351-I485 HydrophobicContact CG2-CG2 4.31Å; L352-I485 PolarHBondContact N-O 3.17Å; C458-I485 HydrophobicContact CB-CG1 4.06Å; C458-I485 WeakPolarHBondContact O-CA 3.49Å; L464-I485 HydrophobicContact CD1-CD1 4.09Å; I485-T487 HydrophobicContact CG2-CG2 4.45Å; I485-I501 HydrophobicContact CD1-CG2 3.66Å; I485-F504 HydrophobicContact CD1-CD1 3.67Å; I485-F504 HydrophobicContact CD1-CE1 4.13Å; I485-F504 HydrophobicContact CG1-CD1 4.29Å; I485-F504 HydrophobicContact CG1-CE1 4.31Å; I485-V505 HydrophobicContact CB-CG2 4.3Å; I485-V505 HydrophobicContact CD1-CG2 3.47Å; I485-V505 VanDerWaalsContact CD1-CG2 3.47Å; I485-V505 HydrophobicContact CG1-CG2 3.7Å
486	L	91.4	Very high	77.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125.8	168.9	-45	177.6	0	0	0	108.2	L352 K360 S364 W398 I457 C458 D459 E460 G461 V484	L352-L486 HydrophobicContact CB-CD2 3.86Å; L352-L486 HydrophobicContact CD2-CD2 4.16Å; K360-L486 HydrophobicContact CD-CB 4.34Å; S364-L486 VanDerWaalsContact OG-CD1 3.29Å; S364-L486 WeakPolarHBondContact OG-CD1 3.09Å; S364-L486 WeakPolarHBondContact OG-CD2 3.18Å; W398-L486 HydrophobicContact CH2-CD1 3.76Å; W398-L486 HydrophobicContact CZ2-CD1 3.72Å; I457-L486 HydrophobicContact CG2-CD1 3.81Å; I457-L486 HydrophobicContact CG2-CG 3.96Å; C458-L486 PolarHBondContact O-N 3.49Å; D459-L486 HydrophobicContact CB-CD1 4.46Å; E460-L486 WeakPolarHBondContact CA-O 3.32Å; E460-L486 PolarHBondContact N-O 2.65Å; G461-L486 PolarHBondContact N-O 2.87Å; V484-L486 HydrophobicContact CG1-CD2 3.84Å
487	T	84.1	Confident	77.3	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	20%	0.204	C	C	.	.			trans	-144.2	141.8	176.4	-177.9	0	0	0	0	110.1	I351 L352 A353 I485 T489 P490	I351-T487 HydrophobicContact CG2-CG2 4.14Å; L352-T487 PolarHBondContact O-N 3.11Å; A353-T487 CarbonylContact C-O 3.6Å; A353-T487 VanDerWaalsContact CA-O 3.25Å; A353-T487 WeakPolarHBondContact CA-O 3.2Å; A353-T487 HydrophobicContact CB-CG2 4.04Å; I485-T487 HydrophobicContact CG2-CG2 4.45Å; T487-T489 VanDerWaalsContact C-N 3.32Å; T487-T489 PolarHBondContact OG1-N 2.95Å; T487-T489 PolarHBondContact OG1-O 2.83Å; T487-T489 VanDerWaalsContact OG1-O 3.13Å; T487-P490 HydrophobicContact CG2-CB 3.99Å
488	G	71.5	Confident	77	Confident	6 Å²	6	35.9 Å²	35.9	6%	0.062	19%	0.191	C	C	.	.	S	Bend	trans	-81	-16.3	171.3	0	0	0	0	0	113.3
489	T	64.1	Low	76.8	Confident	51 Å²	51	36.2 Å²	36.2	31%	0.313	19%	0.192	S	C	.	.			trans	-149.7	88.6	-169.8	50.2	0	0	0	0	107.9	T487 V491 Q492	T487-T489 VanDerWaalsContact C-N 3.32Å; T487-T489 PolarHBondContact OG1-N 2.95Å; T487-T489 PolarHBondContact OG1-O 2.83Å; T487-T489 VanDerWaalsContact OG1-O 3.13Å; T489-V491 VanDerWaalsContact C-N 3.26Å; T489-V491 PolarHBondContact O-N 3.12Å; T489-Q492 HydrophobicContact CG2-CG 4.17Å; T489-Q492 WeakPolarHBondContact OG1-CG 2.98Å; T489-Q492 PolarHBondContact OG1-NE2 3.36Å
490	P	50.4	Low	76.9	Confident	13 Å²	13	32.8 Å²	32.8	8%	0.084	17%	0.168	C	C	.	.	S	Bend	trans	-67.8	-26.9	-173.4	28	-36.4	0	0	0	113.3	A353 T487	A353-P490 HydrophobicContact CB-CB 3.7Å; A353-P490 HydrophobicContact CB-CG 3.65Å; T487-P490 HydrophobicContact CG2-CB 3.99Å
491	V	56.3	Low	76.7	Confident	43 Å²	43	32.8 Å²	32.8	26%	0.261	17%	0.168	S	C	.	.			trans	-132.4	90.3	-178.4	-175.2	0	0	0	0	106.6	T489 F498 V816	T489-V491 VanDerWaalsContact C-N 3.26Å; T489-V491 PolarHBondContact O-N 3.12Å; V491-F498 HydrophobicContact CG2-CD2 3.64Å; V491-F498 HydrophobicContact CG2-CE2 3.97Å; V491-F498 HydrophobicContact CG2-CG 4.16Å; V491-V816 HydrophobicContact CG1-CG1 3.89Å
492	Q	47.3	Very low	76.8	Confident	73 Å²	73	27 Å²	27	34%	0.341	14%	0.137	S	C	.	.	S	Bend	trans	-85.2	-51.9	176.5	-77.7	-174.3	-29.3	0	0	110.8	K465 T489	K465-Q492 VanDerWaalsContact NZ-OE1 3.17Å; T489-Q492 HydrophobicContact CG2-CG 4.17Å; T489-Q492 WeakPolarHBondContact OG1-CG 2.98Å; T489-Q492 PolarHBondContact OG1-NE2 3.36Å
493	N	52.5	Low	76.5	Confident	67 Å²	67	27.1 Å²	27.1	36%	0.358	14%	0.14	S	C	.	.	S	Bend	trans	-146.2	-5.9	-166.7	-59.2	-41.4	0	0	0	116.3	L819	N493-L819 VanDerWaalsContact C-CD2 3.43Å; N493-L819 WeakPolarHBondContact O-CD2 3.46Å
494	D	64.9	Low	76.2	Confident	41 Å²	41	26.1 Å²	26.1	22%	0.219	14%	0.136	C	C	.	.			trans	-153	140.6	-179.5	-159.3	-17.5	0	0	0	113.1	Q496 E497 F498	D494-Q496 PolarHBondContact O-N 2.69Å; D494-Q496 WeakPolarHBondContact OD1-CB 3.15Å; D494-Q496 PolarHBondContact OD1-N 2.76Å; D494-Q496 WeakPolarHBondContact OD2-CB 3.17Å; D494-E497 HydrophobicContact CB-CB 4.07Å; D494-E497 HydrophobicContact CB-CG 3.75Å; D494-E497 PolarHBondContact O-N 2.94Å; D494-F498 PolarHBondContact O-N 3.04Å
495	L	76.8	Confident	75.9	Confident	10 Å²	10	26.1 Å²	26.1	5%	0.052	14%	0.136	C	C	.	.	H	α-helix	trans	-69.4	-24	169	-78.3	171.6	0	0	0	111.1	F498 Y499 Y516 E521 I524 L525 L547 L819	L495-F498 WeakPolarHBondContact O-CB 3.5Å; L495-F498 PolarHBondContact O-N 2.79Å; L495-Y499 PolarHBondContact O-N 2.8Å; L495-Y516 WeakPolarHBondContact O-CE1 3.48Å; L495-Y516 PolarHBondContact O-OH 2.8Å; L495-E521 HydrophobicContact CB-CG 3.95Å; L495-E521 HydrophobicContact CD1-CB 4.46Å; L495-E521 HydrophobicContact CD1-CG 4.12Å; L495-I524 HydrophobicContact CD1-CB 4.13Å; L495-I524 HydrophobicContact CD1-CD1 4.5Å; L495-I524 HydrophobicContact CD1-CG2 3.89Å; L495-L525 HydrophobicContact CD1-CG 4.47Å; L495-L547 HydrophobicContact CD2-CD2 4.5Å; L495-L819 HydrophobicContact CD1-CD1 3.82Å; L495-L819 HydrophobicContact CG-CD1 3.66Å
496	Q	77.9	Confident	75.7	Confident	97 Å²	97	26.3 Å²	26.3	45%	0.453	14%	0.137	S	C	.	.	H	α-helix	trans	-71.7	-39.3	173.8	-165.8	172.4	45.6	0	0	112	D494 F498 Y499 A500	D494-Q496 PolarHBondContact O-N 2.69Å; D494-Q496 WeakPolarHBondContact OD1-CB 3.15Å; D494-Q496 PolarHBondContact OD1-N 2.76Å; D494-Q496 WeakPolarHBondContact OD2-CB 3.17Å; Q496-F498 VanDerWaalsContact C-N 3.27Å; Q496-F498 PolarHBondContact O-N 3.13Å; Q496-Y499 PolarHBondContact O-N 3.47Å; Q496-A500 PolarHBondContact O-N 3.04Å
497	E	78.4	Confident	75.5	Confident	31 Å²	31	30.6 Å²	30.6	15%	0.145	17%	0.165	C	C	.	.	H	α-helix	trans	-60	-41.7	171.4	-73.1	-179.4	174.8	0	0	110.8	K465 D494 A500 I501	K465-E497 HydrophobicContact CB-CB 4.34Å; K465-E497 HydrophobicContact CB-CG 3.72Å; K465-E497 VanDerWaalsContact CD-CD 3.48Å; K465-E497 HydrophobicContact CD-CG 4.36Å; K465-E497 VanDerWaalsContact CD-OE1 3.31Å; K465-E497 WeakPolarHBondContact CD-OE1 3.34Å; K465-E497 WeakPolarHBondContact CD-OE2 2.91Å; K465-E497 WeakPolarHBondContact CE-OE2 3.31Å; K465-E497 HydrophobicContact CG-CB 4.12Å; K465-E497 HydrophobicContact CG-CG 3.73Å; K465-E497 WeakPolarHBondContact CG-OE2 3.36Å; K465-E497 IonicContact NZ-OE1 2.65Å; K465-E497 PolarHBondContact NZ-OE1 2.82Å; K465-E497 IonicContact NZ-OE2 2.84Å; K465-E497 PolarHBondContact NZ-OE2 2.78Å; D494-E497 HydrophobicContact CB-CB 4.07Å; D494-E497 HydrophobicContact CB-CG 3.75Å; D494-E497 PolarHBondContact O-N 2.94Å; E497-A500 PolarHBondContact O-N 3Å; E497-I501 WeakPolarHBondContact O-CG1 3.1Å; E497-I501 PolarHBondContact O-N 3.42Å; E497-I501 VanDerWaalsContact O-N 3.14Å
498	F	80.3	Confident	75.4	Confident	17 Å²	17	32.5 Å²	32.5	8%	0.075	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-44.5	177.6	-174.2	-117.9	0	0	0	111.7	V491 D494 L495 Q496 A500 I501 I502 L547 T551 I555	V491-F498 HydrophobicContact CG2-CD2 3.64Å; V491-F498 HydrophobicContact CG2-CE2 3.97Å; V491-F498 HydrophobicContact CG2-CG 4.16Å; D494-F498 PolarHBondContact O-N 3.04Å; L495-F498 WeakPolarHBondContact O-CB 3.5Å; L495-F498 PolarHBondContact O-N 2.79Å; Q496-F498 VanDerWaalsContact C-N 3.27Å; Q496-F498 PolarHBondContact O-N 3.13Å; F498-A500 PolarHBondContact O-N 3.37Å; F498-I501 PolarHBondContact O-N 3.24Å; F498-I502 HydrophobicContact CD1-CD1 3.66Å; F498-I502 HydrophobicContact CD2-CD1 4.31Å; F498-I502 HydrophobicContact CE1-CD1 3.37Å; F498-I502 HydrophobicContact CE2-CD1 4.05Å; F498-I502 HydrophobicContact CG-CD1 4.14Å; F498-I502 HydrophobicContact CZ-CD1 3.6Å; F498-I502 VanDerWaalsContact O-CG1 3.31Å; F498-I502 WeakPolarHBondContact O-CG1 3.4Å; F498-I502 PolarHBondContact O-N 3.46Å; F498-I502 VanDerWaalsContact O-N 3.08Å; F498-L547 HydrophobicContact CE1-CD2 4.29Å; F498-L547 HydrophobicContact CE1-CG 4.36Å; F498-T551 HydrophobicContact CE1-CG2 3.88Å; F498-T551 HydrophobicContact CZ-CG2 3.87Å; F498-I555 HydrophobicContact CE2-CD1 3.56Å; F498-I555 HydrophobicContact CZ-CD1 3.61Å
499	Y	85.6	Confident	76	Confident	15 Å²	15	32.9 Å²	32.9	6%	0.059	19%	0.186	C	C	.	.	H	α-helix	trans	-58.9	-46	173.8	176	-93.4	0	0	0	112.2	L495 Q496 I501 I502 E503 L510 G511 T513 Y516	L495-Y499 PolarHBondContact O-N 2.8Å; Q496-Y499 PolarHBondContact O-N 3.47Å; Y499-I501 VanDerWaalsContact C-N 3.3Å; Y499-I501 PolarHBondContact O-N 2.97Å; Y499-I502 PolarHBondContact O-N 3.47Å; Y499-I502 VanDerWaalsContact O-N 3.14Å; Y499-E503 HydrophobicContact CE1-CB 4.27Å; Y499-E503 HydrophobicContact CE1-CG 4.49Å; Y499-E503 WeakPolarHBondContact O-CB 3.4Å; Y499-E503 PolarHBondContact O-N 3.18Å; Y499-L510 HydrophobicContact CD2-CB 4.27Å; Y499-L510 HydrophobicContact CD2-CD1 4.29Å; Y499-L510 HydrophobicContact CE2-CB 4.11Å; Y499-G511 PolarHBondContact OH-O 3.14Å; Y499-T513 HydrophobicContact CD1-CG2 4.24Å; Y499-T513 HydrophobicContact CE1-CG2 4.01Å; Y499-T513 WeakPolarHBondContact CE1-OG1 3.35Å; Y499-T513 PolarHBondContact OH-N 3.27Å; Y499-T513 VanDerWaalsContact OH-N 3.09Å; Y499-T513 PolarHBondContact OH-OG1 2.73Å; Y499-Y516 AromaticContact CD2-CD1 3.72Å; Y499-Y516 HydrophobicContact CD2-CD1 3.72Å; Y499-Y516 AromaticContact CD2-CD2 3.83Å; Y499-Y516 HydrophobicContact CD2-CD2 3.83Å; Y499-Y516 HydrophobicContact CD2-CE1 4.27Å; Y499-Y516 HydrophobicContact CD2-CE2 4.37Å; Y499-Y516 AromaticContact CD2-CG 3.45Å; Y499-Y516 HydrophobicContact CD2-CG 3.45Å; Y499-Y516 VanDerWaalsContact CD2-CG 3.45Å; Y499-Y516 HydrophobicContact CE2-CG 4.05Å; Y499-Y516 AromaticContact CG-CD1 3.92Å; Y499-Y516 HydrophobicContact CG-CD1 3.92Å; Y499-Y516 HydrophobicContact CG-CE1 4.23Å; Y499-Y516 HydrophobicContact CG-CG 4.14Å
500	A	84.3	Confident	76.9	Confident	11 Å²	11	31 Å²	31	9%	0.091	17%	0.173	C	C	.	.	H	α-helix	trans	-60.1	-39.2	-179.5	0	0	0	0	0	112.7	K465 Q496 E497 F498 F504	K465-A500 WeakPolarHBondContact O-CB 3.42Å; Q496-A500 PolarHBondContact O-N 3.04Å; E497-A500 PolarHBondContact O-N 3Å; F498-A500 PolarHBondContact O-N 3.37Å; A500-F504 WeakPolarHBondContact O-CB 3.42Å; A500-F504 PolarHBondContact O-N 3.48Å; A500-F504 VanDerWaalsContact O-N 3.11Å
501	I	85.4	Confident	78.5	Confident	5 Å²	5	32 Å²	32	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-66.7	-43.3	176.1	-68.5	172.7	0	0	0	110.7	I351 I485 E497 F498 Y499 F504 V505	I351-I501 HydrophobicContact CD1-CG2 3.72Å; I485-I501 HydrophobicContact CD1-CG2 3.66Å; E497-I501 WeakPolarHBondContact O-CG1 3.1Å; E497-I501 PolarHBondContact O-N 3.42Å; E497-I501 VanDerWaalsContact O-N 3.14Å; F498-I501 PolarHBondContact O-N 3.24Å; Y499-I501 VanDerWaalsContact C-N 3.3Å; Y499-I501 PolarHBondContact O-N 2.97Å; I501-F504 PolarHBondContact O-N 2.93Å; I501-V505 VanDerWaalsContact O-CG2 3.3Å; I501-V505 WeakPolarHBondContact O-CG2 3.28Å; I501-V505 PolarHBondContact O-N 2.78Å
502	I	86.8	Confident	79.9	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-65.7	-46.6	179.7	-68.3	172.5	0	0	0	110.9	I351 F498 Y499 F504 V505 N506 I509 L510 T551 F554 I555	I351-I502 HydrophobicContact CD1-CG1 4.27Å; F498-I502 HydrophobicContact CD1-CD1 3.66Å; F498-I502 HydrophobicContact CD2-CD1 4.31Å; F498-I502 HydrophobicContact CE1-CD1 3.37Å; F498-I502 HydrophobicContact CE2-CD1 4.05Å; F498-I502 HydrophobicContact CG-CD1 4.14Å; F498-I502 HydrophobicContact CZ-CD1 3.6Å; F498-I502 VanDerWaalsContact O-CG1 3.31Å; F498-I502 WeakPolarHBondContact O-CG1 3.4Å; F498-I502 PolarHBondContact O-N 3.46Å; F498-I502 VanDerWaalsContact O-N 3.08Å; Y499-I502 PolarHBondContact O-N 3.47Å; Y499-I502 VanDerWaalsContact O-N 3.14Å; I502-F504 VanDerWaalsContact C-N 3.27Å; I502-F504 PolarHBondContact O-N 2.69Å; I502-V505 PolarHBondContact O-N 3.45Å; I502-N506 CarbonylContact O-C 3.57Å; I502-N506 PolarHBondContact O-N 3.46Å; I502-I509 HydrophobicContact CG2-CG2 3.3Å; I502-L510 HydrophobicContact CB-CD1 4.34Å; I502-L510 HydrophobicContact CD1-CD1 3.71Å; I502-L510 HydrophobicContact CG2-CD1 3.89Å; I502-L510 HydrophobicContact CG2-CG 4.25Å; I502-T551 HydrophobicContact CD1-CG2 3.56Å; I502-F554 HydrophobicContact CD1-CZ 4.47Å; I502-F554 HydrophobicContact CG1-CE2 4.07Å; I502-F554 HydrophobicContact CG1-CZ 4.38Å; I502-F554 HydrophobicContact CG2-CE2 3.96Å; I502-F554 HydrophobicContact CG2-CZ 3.8Å; I502-I555 HydrophobicContact CD1-CD1 4.48Å; I502-I555 HydrophobicContact CG1-CD1 4.5Å
503	E	87.5	Confident	81.7	Confident	59 Å²	59	31.9 Å²	31.9	28%	0.276	19%	0.193	S	C	.	.	H	α-helix	trans	-61.8	-37.1	179.6	-175.5	57.5	-155.6	0	0	111.6	Y499 V505 P507 G508	Y499-E503 HydrophobicContact CE1-CB 4.27Å; Y499-E503 HydrophobicContact CE1-CG 4.49Å; Y499-E503 WeakPolarHBondContact O-CB 3.4Å; Y499-E503 PolarHBondContact O-N 3.18Å; E503-V505 VanDerWaalsContact C-N 3.32Å; E503-V505 PolarHBondContact O-N 3.28Å; E503-P507 VanDerWaalsContact O-CA 3.27Å; E503-P507 WeakPolarHBondContact O-CA 3.38Å; E503-P507 WeakPolarHBondContact OE1-CA 3.29Å; E503-P507 WeakPolarHBondContact OE1-CB 3.34Å; E503-G508 PolarHBondContact OE1-N 3.31Å; E503-G508 PolarHBondContact OE2-N 3.04Å
504	F	87.1	Confident	83.2	Confident	6 Å²	6	32.1 Å²	32.1	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-37.1	174.1	172.8	-97.5	0	0	0	113.3	L464 L475 R483 I485 A500 I501 I502	L464-F504 HydrophobicContact CD1-CD1 4.33Å; L464-F504 HydrophobicContact CD1-CE1 4.21Å; L475-F504 HydrophobicContact CB-CE2 3.39Å; L475-F504 HydrophobicContact CB-CZ 3.74Å; L475-F504 HydrophobicContact CD1-CE2 4.24Å; L475-F504 HydrophobicContact CD1-CZ 4.04Å; L475-F504 HydrophobicContact CG-CE2 4.42Å; L475-F504 HydrophobicContact CG-CZ 4.4Å; R483-F504 WeakPolarHBondContact CD-O 3.4Å; R483-F504 VanDerWaalsContact NH1-CE2 3.32Å; R483-F504 PolarHBondContact NH1-O 3.36Å; I485-F504 HydrophobicContact CD1-CD1 3.67Å; I485-F504 HydrophobicContact CD1-CE1 4.13Å; I485-F504 HydrophobicContact CG1-CD1 4.29Å; I485-F504 HydrophobicContact CG1-CE1 4.31Å; A500-F504 WeakPolarHBondContact O-CB 3.42Å; A500-F504 PolarHBondContact O-N 3.48Å; A500-F504 VanDerWaalsContact O-N 3.11Å; I501-F504 PolarHBondContact O-N 2.93Å; I502-F504 VanDerWaalsContact C-N 3.27Å; I502-F504 PolarHBondContact O-N 2.69Å
505	V	88.6	Confident	84.1	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-83.4	-48.2	-174.7	171.7	0	0	0	0	111.5	A350 I351 I485 I501 I502 E503	A350-V505 VanDerWaalsContact N-CG1 3.32Å; I351-V505 HydrophobicContact CD1-CG2 4.28Å; I351-V505 HydrophobicContact CG1-CB 4.47Å; I351-V505 HydrophobicContact CG1-CG1 4.22Å; I351-V505 HydrophobicContact CG1-CG2 3.99Å; I485-V505 HydrophobicContact CB-CG2 4.3Å; I485-V505 HydrophobicContact CD1-CG2 3.47Å; I485-V505 VanDerWaalsContact CD1-CG2 3.47Å; I485-V505 HydrophobicContact CG1-CG2 3.7Å; I501-V505 VanDerWaalsContact O-CG2 3.3Å; I501-V505 WeakPolarHBondContact O-CG2 3.28Å; I501-V505 PolarHBondContact O-N 2.78Å; I502-V505 PolarHBondContact O-N 3.45Å; E503-V505 VanDerWaalsContact C-N 3.32Å; E503-V505 PolarHBondContact O-N 3.28Å
506	N	88.6	Confident	84.6	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.021	19%	0.188	C	C	.	.	S	Bend	trans	-136.2	85.7	-178.8	-73.9	-43.7	0	0	0	108.6	R347 H348 G349 I502 I509	R347-N506 WeakPolarHBondContact CB-OD1 3.49Å; H348-N506 PolarHBondContact N-OD1 3.45Å; G349-N506 VanDerWaalsContact CA-OD1 3.31Å; G349-N506 WeakPolarHBondContact CA-OD1 3.41Å; G349-N506 PolarHBondContact N-OD1 3.36Å; G349-N506 PolarHBondContact O-ND2 3.43Å; I502-N506 CarbonylContact O-C 3.57Å; I502-N506 PolarHBondContact O-N 3.46Å; N506-I509 HydrophobicContact CB-CB 4.42Å; N506-I509 HydrophobicContact CB-CG2 4.12Å; N506-I509 WeakPolarHBondContact O-CG2 3.43Å; N506-I509 PolarHBondContact O-N 3.31Å
507	P	86.8	Confident	85	Confident	90 Å²	90	31.8 Å²	31.8	58%	0.584	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	139.7	-175.2	24.1	-33.5	0	0	0	112.1	E503 I509	E503-P507 VanDerWaalsContact O-CA 3.27Å; E503-P507 WeakPolarHBondContact O-CA 3.38Å; E503-P507 WeakPolarHBondContact OE1-CA 3.29Å; E503-P507 WeakPolarHBondContact OE1-CB 3.34Å; P507-I509 VanDerWaalsContact C-N 3.34Å; P507-I509 PolarHBondContact O-N 3.01Å
508	G	81.8	Confident	85.3	Confident	41 Å²	41	33.5 Å²	33.5	42%	0.423	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	9.3	176.5	0	0	0	0	0	115.8	E503	E503-G508 PolarHBondContact OE1-N 3.31Å; E503-G508 PolarHBondContact OE2-N 3.04Å
509	I	84.4	Confident	85.5	Confident	14 Å²	14	33 Å²	33	7%	0.072	20%	0.195	C	C	.	.	S	Bend	trans	-71.5	-33.5	179.7	-175.7	156.1	0	0	0	114.4	R347 I502 N506 P507 F554	R347-I509 VanDerWaalsContact NH1-CD1 3.27Å; I502-I509 HydrophobicContact CG2-CG2 3.3Å; N506-I509 HydrophobicContact CB-CB 4.42Å; N506-I509 HydrophobicContact CB-CG2 4.12Å; N506-I509 WeakPolarHBondContact O-CG2 3.43Å; N506-I509 PolarHBondContact O-N 3.31Å; P507-I509 VanDerWaalsContact C-N 3.34Å; P507-I509 PolarHBondContact O-N 3.01Å; I509-F554 HydrophobicContact CD1-CD1 3.8Å; I509-F554 HydrophobicContact CD1-CE1 3.26Å; I509-F554 HydrophobicContact CD1-CZ 3.96Å; I509-F554 HydrophobicContact CG1-CE1 4.27Å; I509-F554 HydrophobicContact CG2-CZ 4.4Å
510	L	82.8	Confident	85.5	Confident	11 Å²	11	32.6 Å²	32.6	6%	0.058	19%	0.193	C	C	.	.	S	Bend	trans	-105.6	12.1	179.5	-65.3	175.7	0	0	0	112.6	Y499 I502 Y516 L547 L550	Y499-L510 HydrophobicContact CD2-CB 4.27Å; Y499-L510 HydrophobicContact CD2-CD1 4.29Å; Y499-L510 HydrophobicContact CE2-CB 4.11Å; I502-L510 HydrophobicContact CB-CD1 4.34Å; I502-L510 HydrophobicContact CD1-CD1 3.71Å; I502-L510 HydrophobicContact CG2-CD1 3.89Å; I502-L510 HydrophobicContact CG2-CG 4.25Å; L510-Y516 HydrophobicContact CB-CD2 4.12Å; L510-Y516 HydrophobicContact CD1-CD2 3.9Å; L510-Y516 HydrophobicContact CD1-CE2 3.81Å; L510-L547 HydrophobicContact CD1-CD1 3.99Å; L510-L547 HydrophobicContact CD2-CD1 3.84Å; L510-L550 HydrophobicContact CD2-CD1 4.45Å
511	G	84	Confident	85.5	Confident	35 Å²	35	33 Å²	33	36%	0.361	19%	0.194	S	C	.	.			trans	73.1	-162.2	-173.4	0	0	0	0	0	113.3	Y499	Y499-G511 PolarHBondContact OH-O 3.14Å
512	S	85.9	Confident	85.5	Confident	46 Å²	46	35.7 Å²	35.7	32%	0.322	21%	0.206	S	C	.	.			trans	-68.7	158.9	179.1	67.7	0	0	0	0	111.8	T514 A515 Y516	S512-T514 PolarHBondContact O-N 3.08Å; S512-T514 PolarHBondContact OG-OG1 2.93Å; S512-A515 PolarHBondContact O-N 3.12Å; S512-A515 VanDerWaalsContact O-N 3.16Å; S512-A515 WeakPolarHBondContact OG-CB 3.48Å; S512-A515 PolarHBondContact OG-N 3.23Å; S512-Y516 PolarHBondContact O-N 2.96Å
513	T	84.6	Confident	85.5	Confident	67 Å²	67	36.7 Å²	36.7	41%	0.411	21%	0.212	S	C	.	.	H	α-helix	trans	-59.9	-32.7	177.5	-47.3	0	0	0	0	111.8	Y499 R517	Y499-T513 HydrophobicContact CD1-CG2 4.24Å; Y499-T513 HydrophobicContact CE1-CG2 4.01Å; Y499-T513 WeakPolarHBondContact CE1-OG1 3.35Å; Y499-T513 PolarHBondContact OH-N 3.27Å; Y499-T513 VanDerWaalsContact OH-N 3.09Å; Y499-T513 PolarHBondContact OH-OG1 2.73Å; T513-R517 WeakPolarHBondContact O-CB 3.23Å; T513-R517 PolarHBondContact O-N 3.16Å; T513-R517 VanDerWaalsContact O-N 3.12Å
514	T	84.5	Confident	85.3	Confident	71 Å²	71	34 Å²	34	44%	0.436	20%	0.2	S	C	.	.	H	α-helix	trans	-69.2	-43.4	176.5	48.2	0	0	0	0	111.9	E182 S512 R517 K518	E182-T514 PolarHBondContact OE2-OG1 3.21Å; S512-T514 PolarHBondContact O-N 3.08Å; S512-T514 PolarHBondContact OG-OG1 2.93Å; T514-R517 PolarHBondContact O-N 3Å; T514-K518 PolarHBondContact O-N 2.94Å
515	A	84.1	Confident	85.1	Confident	11 Å²	11	36.2 Å²	36.2	9%	0.091	21%	0.212	C	C	.	.	H	α-helix	trans	-63.4	-49.2	176.4	0	0	0	0	0	111.3	E182 S512 R517 K518 V519	E182-A515 HydrophobicContact CB-CB 4.19Å; E182-A515 HydrophobicContact CG-CB 4.45Å; S512-A515 PolarHBondContact O-N 3.12Å; S512-A515 VanDerWaalsContact O-N 3.16Å; S512-A515 WeakPolarHBondContact OG-CB 3.48Å; S512-A515 PolarHBondContact OG-N 3.23Å; A515-R517 VanDerWaalsContact C-N 3.29Å; A515-R517 PolarHBondContact O-N 3.17Å; A515-K518 PolarHBondContact O-N 2.88Å; A515-V519 WeakPolarHBondContact O-CB 3.48Å; A515-V519 VanDerWaalsContact O-CG2 3.29Å; A515-V519 WeakPolarHBondContact O-CG2 3.38Å; A515-V519 PolarHBondContact O-N 2.87Å
516	Y	87.4	Confident	84.7	Confident	1 Å²	1	40 Å²	40	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-56.1	-45.2	178	173.3	-98.5	0	0	0	112	L495 Y499 L510 S512 K518 Y520 E521 L547	L495-Y516 WeakPolarHBondContact O-CE1 3.48Å; L495-Y516 PolarHBondContact O-OH 2.8Å; Y499-Y516 AromaticContact CD2-CD1 3.72Å; Y499-Y516 HydrophobicContact CD2-CD1 3.72Å; Y499-Y516 AromaticContact CD2-CD2 3.83Å; Y499-Y516 HydrophobicContact CD2-CD2 3.83Å; Y499-Y516 HydrophobicContact CD2-CE1 4.27Å; Y499-Y516 HydrophobicContact CD2-CE2 4.37Å; Y499-Y516 AromaticContact CD2-CG 3.45Å; Y499-Y516 HydrophobicContact CD2-CG 3.45Å; Y499-Y516 VanDerWaalsContact CD2-CG 3.45Å; Y499-Y516 HydrophobicContact CE2-CG 4.05Å; Y499-Y516 AromaticContact CG-CD1 3.92Å; Y499-Y516 HydrophobicContact CG-CD1 3.92Å; Y499-Y516 HydrophobicContact CG-CE1 4.23Å; Y499-Y516 HydrophobicContact CG-CG 4.14Å; L510-Y516 HydrophobicContact CB-CD2 4.12Å; L510-Y516 HydrophobicContact CD1-CD2 3.9Å; L510-Y516 HydrophobicContact CD1-CE2 3.81Å; S512-Y516 PolarHBondContact O-N 2.96Å; Y516-K518 PolarHBondContact O-N 2.9Å; Y516-Y520 AromaticContact CD2-CD2 3.76Å; Y516-Y520 HydrophobicContact CD2-CD2 3.76Å; Y516-Y520 HydrophobicContact CD2-CG 4.33Å; Y516-Y520 HydrophobicContact CE2-CD2 4.22Å; Y516-Y520 HydrophobicContact CE2-CG 4.38Å; Y516-Y520 WeakPolarHBondContact O-CB 3.34Å; Y516-Y520 PolarHBondContact O-N 3.2Å; Y516-E521 HydrophobicContact CE1-CB 4.3Å; Y516-E521 PolarHBondContact O-N 3.11Å; Y516-L547 HydrophobicContact CE2-CD1 4Å; Y516-L547 HydrophobicContact CE2-CD2 4.19Å
517	R	85.8	Confident	84.2	Confident	130 Å²	130	40.9 Å²	40.9	49%	0.491	24%	0.236	S	C	.	.	I	π-helix	trans	-60.6	-43.6	-179	178.6	174.2	157.9	168.8	4.9	112.4	T513 T514 A515 E521 E522	T513-R517 WeakPolarHBondContact O-CB 3.23Å; T513-R517 PolarHBondContact O-N 3.16Å; T513-R517 VanDerWaalsContact O-N 3.12Å; T514-R517 PolarHBondContact O-N 3Å; A515-R517 VanDerWaalsContact C-N 3.29Å; A515-R517 PolarHBondContact O-N 3.17Å; R517-E521 HydrophobicContact CB-CB 4.44Å; R517-E521 HydrophobicContact CG-CB 4.3Å; R517-E521 WeakPolarHBondContact O-CB 3.39Å; R517-E521 PolarHBondContact O-N 3.28Å; R517-E522 HydrophobicContact CG-CG 4.1Å; R517-E522 IonicContact CZ-OE1 2.87Å; R517-E522 IonicContact NE-OE1 2.78Å; R517-E522 PolarHBondContact NE-OE1 2.77Å; R517-E522 IonicContact NH2-OE1 2.69Å; R517-E522 PolarHBondContact NH2-OE1 2.93Å; R517-E522 WeakPolarHBondContact O-CG 3.15Å; R517-E522 PolarHBondContact O-N 3.01Å
518	K	84.1	Confident	83.5	Confident	66 Å²	66	40.3 Å²	40.3	29%	0.287	22%	0.222	S	C	.	.	I	π-helix	trans	-80.6	-35.8	-177.4	-71.1	-176.9	-179.5	167	0	113.9	T514 A515 Y516 P523	T514-K518 PolarHBondContact O-N 2.94Å; A515-K518 PolarHBondContact O-N 2.88Å; Y516-K518 PolarHBondContact O-N 2.9Å; K518-P523 WeakPolarHBondContact O-CD 3.37Å
519	V	85.5	Confident	83	Confident	8 Å²	8	42.8 Å²	42.8	5%	0.048	22%	0.223	C	C	.	.	I	π-helix	trans	-79.6	-40.3	-176.7	178	0	0	0	0	110.6	F230 A515 R543	F230-V519 HydrophobicContact CB-CG2 4.07Å; F230-V519 HydrophobicContact CD2-CG1 4.36Å; F230-V519 HydrophobicContact CD2-CG2 4.14Å; F230-V519 HydrophobicContact CG-CG2 4.02Å; A515-V519 WeakPolarHBondContact O-CB 3.48Å; A515-V519 VanDerWaalsContact O-CG2 3.29Å; A515-V519 WeakPolarHBondContact O-CG2 3.38Å; A515-V519 PolarHBondContact O-N 2.87Å; V519-R543 WeakPolarHBondContact O-CD 3.3Å; V519-R543 PolarHBondContact O-NE 3.05Å
520	Y	85.5	Confident	82.1	Confident	5 Å²	5	49 Å²	49	2%	0.02	26%	0.264	C	S	.	.	I	π-helix	trans	-114.3	-57.9	-174.4	-61.6	-73.3	0	0	0	113	Q231 Y516 P523 I524 R543 E546 L547	Q231-Y520 PolarHBondContact NE2-OH 3.48Å; Y516-Y520 AromaticContact CD2-CD2 3.76Å; Y516-Y520 HydrophobicContact CD2-CD2 3.76Å; Y516-Y520 HydrophobicContact CD2-CG 4.33Å; Y516-Y520 HydrophobicContact CE2-CD2 4.22Å; Y516-Y520 HydrophobicContact CE2-CG 4.38Å; Y516-Y520 WeakPolarHBondContact O-CB 3.34Å; Y516-Y520 PolarHBondContact O-N 3.2Å; Y520-P523 WeakPolarHBondContact O-CD 3.38Å; Y520-I524 VanDerWaalsContact O-CB 3.28Å; Y520-I524 WeakPolarHBondContact O-CB 3.45Å; Y520-I524 VanDerWaalsContact O-CD1 3.24Å; Y520-I524 WeakPolarHBondContact O-CD1 3.37Å; Y520-I524 WeakPolarHBondContact O-CG1 3.32Å; Y520-I524 PolarHBondContact O-N 2.6Å; Y520-I524 VanDerWaalsContact O-N 3.09Å; Y520-R543 HydrophobicContact CD1-CB 4.32Å; Y520-E546 HydrophobicContact CE1-CG 4.49Å; Y520-L547 HydrophobicContact CD1-CB 3.93Å; Y520-L547 HydrophobicContact CE1-CB 4.21Å
521	E	84.9	Confident	81.7	Confident	21 Å²	21	53.6 Å²	53.6	10%	0.098	30%	0.297	C	S	.	.	I	π-helix	trans	-60.5	-55.6	-167.9	-169.5	-176.1	154.8	0	0	113.3	L495 Y516 R517 I524 L525	L495-E521 HydrophobicContact CB-CG 3.95Å; L495-E521 HydrophobicContact CD1-CB 4.46Å; L495-E521 HydrophobicContact CD1-CG 4.12Å; Y516-E521 HydrophobicContact CE1-CB 4.3Å; Y516-E521 PolarHBondContact O-N 3.11Å; R517-E521 HydrophobicContact CB-CB 4.44Å; R517-E521 HydrophobicContact CG-CB 4.3Å; R517-E521 WeakPolarHBondContact O-CB 3.39Å; R517-E521 PolarHBondContact O-N 3.28Å; E521-I524 PolarHBondContact O-N 2.94Å; E521-L525 HydrophobicContact CG-CD1 3.93Å; E521-L525 WeakPolarHBondContact O-CB 3.34Å; E521-L525 VanDerWaalsContact O-CG 3.25Å; E521-L525 WeakPolarHBondContact O-CG 3.38Å; E521-L525 PolarHBondContact O-N 3.18Å
522	E	85.8	Confident	81.5	Confident	61 Å²	61	53.7 Å²	53.7	29%	0.285	29%	0.292	S	S	.	.	H	α-helix	trans	-61.5	-51.6	-177	-73.5	171.9	178.4	0	0	112	R517 I524 L525 H526	R517-E522 HydrophobicContact CG-CG 4.1Å; R517-E522 IonicContact CZ-OE1 2.87Å; R517-E522 IonicContact NE-OE1 2.78Å; R517-E522 PolarHBondContact NE-OE1 2.77Å; R517-E522 IonicContact NH2-OE1 2.69Å; R517-E522 PolarHBondContact NH2-OE1 2.93Å; R517-E522 WeakPolarHBondContact O-CG 3.15Å; R517-E522 PolarHBondContact O-N 3.01Å; E522-I524 VanDerWaalsContact C-N 3.32Å; E522-I524 PolarHBondContact O-N 2.98Å; E522-L525 PolarHBondContact O-N 2.69Å; E522-H526 PolarHBondContact O-CD2 3.47Å; E522-H526 PolarHBondContact O-N 3.48Å
523	P	85.4	Confident	81.3	Confident	21 Å²	21	54 Å²	54	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-58.2	-40.8	176.3	-26.4	35.5	0	0	0	113.7	K518 Y520 H526 S527 R543	K518-P523 WeakPolarHBondContact O-CD 3.37Å; Y520-P523 WeakPolarHBondContact O-CD 3.38Å; P523-H526 PolarHBondContact O-N 3Å; P523-S527 WeakPolarHBondContact O-CB 3.4Å; P523-S527 PolarHBondContact O-N 3.23Å; P523-S527 PolarHBondContact O-OG 3.35Å; P523-R543 HydrophobicContact CB-CG 4.3Å
524	I	83.9	Confident	81.3	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.015	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-41.1	179.1	-67.7	168.9	0	0	0	110.5	L495 Y520 E521 E522 S527 R528 R543 A544 L547	L495-I524 HydrophobicContact CD1-CB 4.13Å; L495-I524 HydrophobicContact CD1-CD1 4.5Å; L495-I524 HydrophobicContact CD1-CG2 3.89Å; Y520-I524 VanDerWaalsContact O-CB 3.28Å; Y520-I524 WeakPolarHBondContact O-CB 3.45Å; Y520-I524 VanDerWaalsContact O-CD1 3.24Å; Y520-I524 WeakPolarHBondContact O-CD1 3.37Å; Y520-I524 WeakPolarHBondContact O-CG1 3.32Å; Y520-I524 PolarHBondContact O-N 2.6Å; Y520-I524 VanDerWaalsContact O-N 3.09Å; E521-I524 PolarHBondContact O-N 2.94Å; E522-I524 VanDerWaalsContact C-N 3.32Å; E522-I524 PolarHBondContact O-N 2.98Å; I524-S527 PolarHBondContact O-OG 2.85Å; I524-R528 VanDerWaalsContact CG2-NH2 3.34Å; I524-R528 WeakPolarHBondContact O-CD 3.37Å; I524-R528 WeakPolarHBondContact O-CG 3.32Å; I524-R543 HydrophobicContact CG1-CB 4.18Å; I524-A544 HydrophobicContact CD1-CB 4.09Å; I524-A544 HydrophobicContact CG1-CB 4.1Å; I524-L547 HydrophobicContact CD1-CD2 4.2Å
525	L	82.5	Confident	81	Confident	52 Å²	52	56.7 Å²	56.7	27%	0.272	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-42.3	177.4	-70.9	175.3	0	0	0	112.1	L495 E521 E522 R528 L819	L495-L525 HydrophobicContact CD1-CG 4.47Å; E521-L525 HydrophobicContact CG-CD1 3.93Å; E521-L525 WeakPolarHBondContact O-CB 3.34Å; E521-L525 VanDerWaalsContact O-CG 3.25Å; E521-L525 WeakPolarHBondContact O-CG 3.38Å; E521-L525 PolarHBondContact O-N 3.18Å; E522-L525 PolarHBondContact O-N 2.69Å; L525-R528 PolarHBondContact O-N 2.95Å; L525-L819 HydrophobicContact CD2-CB 3.56Å; L525-L819 HydrophobicContact CD2-CD1 3.63Å; L525-L819 HydrophobicContact CD2-CG 4.25Å
526	H	79.5	Confident	81	Confident	83 Å²	83	60.4 Å²	60.4	38%	0.384	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-42.8	177.8	-76	-61.9	0	0	0	112.3	E522 P523 R528 Q529 C532	E522-H526 PolarHBondContact O-CD2 3.47Å; E522-H526 PolarHBondContact O-N 3.48Å; P523-H526 PolarHBondContact O-N 3Å; H526-R528 PolarHBondContact O-N 3.47Å; H526-Q529 PolarHBondContact O-N 3.02Å; H526-Q529 VanDerWaalsContact O-N 3.11Å; H526-C532 WeakPolarHBondContact O-CB 3.26Å
527	S	79.7	Confident	80.6	Confident	22 Å²	22	65 Å²	65	15%	0.154	33%	0.332	C	S	.	.	H	α-helix	trans	-60.8	-17.3	177.3	68.8	0	0	0	0	114.9	P523 I524 E536	P523-S527 WeakPolarHBondContact O-CB 3.4Å; P523-S527 PolarHBondContact O-N 3.23Å; P523-S527 PolarHBondContact O-OG 3.35Å; I524-S527 PolarHBondContact O-OG 2.85Å; S527-E536 WeakPolarHBondContact CB-O 3.25Å
528	R	71	Confident	80.6	Confident	78 Å²	78	61.6 Å²	61.6	29%	0.294	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-3	-178.1	-68.5	174.7	-179.6	166.2	7.2	113.2	I524 L525 H526 V816 V817	I524-R528 VanDerWaalsContact CG2-NH2 3.34Å; I524-R528 WeakPolarHBondContact O-CD 3.37Å; I524-R528 WeakPolarHBondContact O-CG 3.32Å; L525-R528 PolarHBondContact O-N 2.95Å; H526-R528 PolarHBondContact O-N 3.47Å; R528-V816 VanDerWaalsContact NH1-CB 3.3Å; R528-V816 PolarHBondContact NH1-O 2.92Å; R528-V817 HydrophobicContact CG-CG2 4.5Å
529	Q	72.7	Confident	80.5	Confident	93 Å²	93	61.1 Å²	61.1	44%	0.435	33%	0.326	S	S	.	.	S	Bend	trans	-81.6	137.6	177.6	-67.7	177.3	-4.4	0	0	110.4	H526 S531 C532	H526-Q529 PolarHBondContact O-N 3.02Å; H526-Q529 VanDerWaalsContact O-N 3.11Å; Q529-S531 PolarHBondContact O-N 3.18Å; Q529-C532 WeakPolarHBondContact O-CB 3.44Å; Q529-C532 PolarHBondContact O-N 3.09Å; Q529-C532 VanDerWaalsContact O-N 3.14Å
530	P	63.9	Low	80.2	Confident	145 Å²	145	60.8 Å²	60.8	94%	0.942	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-18	-179.1	-24.1	33.4	0	0	0	115
531	S	75.3	Confident	79.9	Confident	106 Å²	106	65 Å²	65	74%	0.741	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	14.4	-179.4	59.4	0	0	0	0	113.7	Q529	Q529-S531 PolarHBondContact O-N 3.18Å
532	C	78.8	Confident	79.9	Confident	38 Å²	38	67.3 Å²	67.3	26%	0.257	36%	0.355	S	S	.	.			trans	-74.5	150.6	-175.1	77.5	0	0	0	0	113.1	H526 Q529	H526-C532 WeakPolarHBondContact O-CB 3.26Å; Q529-C532 WeakPolarHBondContact O-CB 3.44Å; Q529-C532 PolarHBondContact O-N 3.09Å; Q529-C532 VanDerWaalsContact O-N 3.14Å
533	S	83.1	Confident	79.8	Confident	51 Å²	51	64.8 Å²	64.8	36%	0.357	34%	0.343	S	S	.	.			trans	-73.8	158.2	169	62.1	0	0	0	0	111.5	D535 E536 R537	S533-D535 VanDerWaalsContact C-N 3.32Å; S533-D535 PolarHBondContact O-N 3.16Å; S533-E536 PolarHBondContact N-OE2 2.91Å; S533-E536 VanDerWaalsContact N-OE2 3.12Å; S533-E536 PolarHBondContact O-N 3.39Å; S533-E536 WeakPolarHBondContact OG-CB 3.2Å; S533-E536 WeakPolarHBondContact OG-CG 3Å; S533-E536 PolarHBondContact OG-N 2.86Å; S533-E536 PolarHBondContact OG-OE2 3.48Å; S533-R537 PolarHBondContact O-N 3.21Å
534	E	83.6	Confident	79.6	Confident	108 Å²	108	65.2 Å²	65.2	51%	0.505	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-38.5	179	-174.4	60.6	-168.2	0	0	111.9	E536 R537 V538	E534-E536 PolarHBondContact O-N 2.83Å; E534-R537 WeakPolarHBondContact O-CB 3.22Å; E534-R537 PolarHBondContact O-N 3.04Å; E534-R537 VanDerWaalsContact O-N 3.16Å; E534-R537 IonicContact OE1-CZ 3.35Å; E534-R537 IonicContact OE1-NE 3.99Å; E534-R537 PolarHBondContact OE1-NE 3.42Å; E534-R537 IonicContact OE1-NH2 3.79Å; E534-R537 PolarHBondContact OE1-NH2 2.98Å; E534-R537 IonicContact OE2-CZ 2.79Å; E534-R537 IonicContact OE2-NE 3.83Å; E534-R537 PolarHBondContact OE2-NE 3.43Å; E534-R537 IonicContact OE2-NH2 3.44Å; E534-V538 WeakPolarHBondContact O-CG2 3.41Å; E534-V538 PolarHBondContact O-N 3.48Å
535	D	79.6	Confident	79.4	Confident	87 Å²	87	68 Å²	68	47%	0.465	37%	0.371	S	S	.	.	H	α-helix	trans	-62.4	-41.1	177.2	-56.9	-12.2	0	0	0	111.9	S533 R537 L539	S533-D535 VanDerWaalsContact C-N 3.32Å; S533-D535 PolarHBondContact O-N 3.16Å; D535-R537 VanDerWaalsContact C-N 3.33Å; D535-L539 WeakPolarHBondContact O-CB 3.43Å; D535-L539 PolarHBondContact O-N 3.34Å
536	E	82.6	Confident	79.4	Confident	89 Å²	89	65.8 Å²	65.8	42%	0.416	36%	0.359	S	S	.	.	H	α-helix	trans	-69	-34.2	176	-73	168.7	149.7	0	0	111.8	S527 S533 E534 G540	S527-E536 WeakPolarHBondContact CB-O 3.25Å; S533-E536 PolarHBondContact N-OE2 2.91Å; S533-E536 VanDerWaalsContact N-OE2 3.12Å; S533-E536 PolarHBondContact O-N 3.39Å; S533-E536 WeakPolarHBondContact OG-CB 3.2Å; S533-E536 WeakPolarHBondContact OG-CG 3Å; S533-E536 PolarHBondContact OG-N 2.86Å; S533-E536 PolarHBondContact OG-OE2 3.48Å; E534-E536 PolarHBondContact O-N 2.83Å; E536-G540 PolarHBondContact O-N 2.96Å
537	R	79.8	Confident	79.6	Confident	98 Å²	98	62.3 Å²	62.3	37%	0.37	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-51.5	175.7	-164.9	-178.6	72.2	77.6	-1.4	110.7	S533 E534 D535 G540 E541	S533-R537 PolarHBondContact O-N 3.21Å; E534-R537 WeakPolarHBondContact O-CB 3.22Å; E534-R537 PolarHBondContact O-N 3.04Å; E534-R537 VanDerWaalsContact O-N 3.16Å; E534-R537 IonicContact OE1-CZ 3.35Å; E534-R537 IonicContact OE1-NE 3.99Å; E534-R537 PolarHBondContact OE1-NE 3.42Å; E534-R537 IonicContact OE1-NH2 3.79Å; E534-R537 PolarHBondContact OE1-NH2 2.98Å; E534-R537 IonicContact OE2-CZ 2.79Å; E534-R537 IonicContact OE2-NE 3.83Å; E534-R537 PolarHBondContact OE2-NE 3.43Å; E534-R537 IonicContact OE2-NH2 3.44Å; D535-R537 VanDerWaalsContact C-N 3.33Å; R537-G540 PolarHBondContact O-N 3.13Å; R537-E541 IonicContact NH1-OE2 2.81Å; R537-E541 WeakPolarHBondContact O-CB 3.46Å; R537-E541 PolarHBondContact O-N 3.36Å
538	V	84.4	Confident	79.6	Confident	58 Å²	58	63.8 Å²	63.8	35%	0.352	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-46.7	178.7	175.1	0	0	0	0	110.9	E534 G540 E541 E542	E534-V538 WeakPolarHBondContact O-CG2 3.41Å; E534-V538 PolarHBondContact O-N 3.48Å; V538-G540 PolarHBondContact O-N 3.48Å; V538-E541 PolarHBondContact O-N 3.05Å; V538-E542 WeakPolarHBondContact O-CG 3.5Å; V538-E542 PolarHBondContact O-N 2.89Å
539	L	82.4	Confident	80.1	Confident	57 Å²	57	65.8 Å²	65.8	30%	0.298	36%	0.361	S	S	.	.	H	α-helix	trans	-60.3	-44.5	178.8	179.7	63.6	0	0	0	112.2	A225 D535 E541 R543	A225-L539 HydrophobicContact CB-CD1 4.37Å; D535-L539 WeakPolarHBondContact O-CB 3.43Å; D535-L539 PolarHBondContact O-N 3.34Å; L539-E541 VanDerWaalsContact C-N 3.33Å; L539-R543 HydrophobicContact CD1-CG 4.39Å; L539-R543 WeakPolarHBondContact O-CB 3.42Å; L539-R543 WeakPolarHBondContact O-CG 3.25Å; L539-R543 PolarHBondContact O-N 2.9Å
540	G	80	Confident	80.6	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-66.3	-35.2	178	0	0	0	0	0	113	E536 R537 V538 A544	E536-G540 PolarHBondContact O-N 2.96Å; R537-G540 PolarHBondContact O-N 3.13Å; V538-G540 PolarHBondContact O-N 3.48Å; G540-A544 WeakPolarHBondContact O-CB 3.42Å; G540-A544 PolarHBondContact O-N 3.03Å
541	E	78.3	Confident	81.6	Confident	92 Å²	92	55.5 Å²	55.5	43%	0.43	30%	0.302	S	S	.	.	H	α-helix	trans	-66.6	-46	175.7	-172.8	165.9	-171.7	0	0	111.9	R537 V538 L539 R543 A544 A545	R537-E541 IonicContact NH1-OE2 2.81Å; R537-E541 WeakPolarHBondContact O-CB 3.46Å; R537-E541 PolarHBondContact O-N 3.36Å; V538-E541 PolarHBondContact O-N 3.05Å; L539-E541 VanDerWaalsContact C-N 3.33Å; E541-R543 PolarHBondContact O-N 3.22Å; E541-A544 PolarHBondContact O-N 3.46Å; E541-A545 WeakPolarHBondContact O-CB 3.34Å; E541-A545 PolarHBondContact O-N 3.46Å
542	E	84.6	Confident	82	Confident	70 Å²	70	51.5 Å²	51.5	33%	0.327	28%	0.277	S	S	.	.	H	α-helix	trans	-63.3	-40.4	176.2	-70.2	-169.8	180	0	0	112.4	A225 V538 A545 E546	A225-E542 VanDerWaalsContact C-OE2 3.31Å; A225-E542 WeakPolarHBondContact CB-OE2 3.36Å; A225-E542 WeakPolarHBondContact O-CB 3.41Å; V538-E542 WeakPolarHBondContact O-CG 3.5Å; V538-E542 PolarHBondContact O-N 2.89Å; E542-A545 PolarHBondContact O-N 3.3Å; E542-E546 PolarHBondContact O-N 3.11Å
543	R	84.4	Confident	82.3	Confident	9 Å²	9	52.6 Å²	52.6	3%	0.034	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-41.5	174.1	-73.6	-66.8	-162.2	-102.4	4.6	112.5	F224 A225 G227 V519 Y520 P523 I524 L539 E541 L547	F224-R543 PolarHBondContact O-NH1 2.94Å; F224-R543 PolarHBondContact O-NH2 3.19Å; A225-R543 VanDerWaalsContact CA-NH1 3.32Å; A225-R543 PolarHBondContact O-NH1 3.2Å; G227-R543 VanDerWaalsContact CA-CZ 3.44Å; V519-R543 WeakPolarHBondContact O-CD 3.3Å; V519-R543 PolarHBondContact O-NE 3.05Å; Y520-R543 HydrophobicContact CD1-CB 4.32Å; P523-R543 HydrophobicContact CB-CG 4.3Å; I524-R543 HydrophobicContact CG1-CB 4.18Å; L539-R543 HydrophobicContact CD1-CG 4.39Å; L539-R543 WeakPolarHBondContact O-CB 3.42Å; L539-R543 WeakPolarHBondContact O-CG 3.25Å; L539-R543 PolarHBondContact O-N 2.9Å; E541-R543 PolarHBondContact O-N 3.22Å; R543-L547 WeakPolarHBondContact O-CB 3.32Å; R543-L547 PolarHBondContact O-N 3.26Å
544	A	80.4	Confident	82.6	Confident	29 Å²	29	50.3 Å²	50.3	24%	0.24	26%	0.263	C	S	.	.	H	α-helix	trans	-64.7	-41.6	175.6	0	0	0	0	0	111.6	I524 G540 E541 L547 S548	I524-A544 HydrophobicContact CD1-CB 4.09Å; I524-A544 HydrophobicContact CG1-CB 4.1Å; G540-A544 WeakPolarHBondContact O-CB 3.42Å; G540-A544 PolarHBondContact O-N 3.03Å; E541-A544 PolarHBondContact O-N 3.46Å; A544-L547 PolarHBondContact O-N 2.91Å; A544-S548 WeakPolarHBondContact O-CB 3.35Å; A544-S548 PolarHBondContact O-N 3.04Å
545	A	79.8	Confident	82.8	Confident	61 Å²	61	46 Å²	46	50%	0.504	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-43.6	177.3	0	0	0	0	0	111.9	E541 E542 S548 R549	E541-A545 WeakPolarHBondContact O-CB 3.34Å; E541-A545 PolarHBondContact O-N 3.46Å; E542-A545 PolarHBondContact O-N 3.3Å; A545-S548 WeakPolarHBondContact O-CB 3.29Å; A545-S548 PolarHBondContact O-N 3.44Å; A545-R549 PolarHBondContact O-N 2.88Å
546	E	82.9	Confident	83.2	Confident	7 Å²	7	42.4 Å²	42.4	3%	0.033	22%	0.224	C	C	.	.	H	α-helix	trans	-65.5	-43.4	176.2	-178.6	67.9	178.2	0	0	111.9	K226 R228 Y520 E542 S548 R549 L550	K226-E546 WeakPolarHBondContact O-CB 3.5Å; K226-E546 VanDerWaalsContact O-CG 3.3Å; K226-E546 WeakPolarHBondContact O-CG 3.49Å; R228-E546 IonicContact NE-OE1 3.37Å; R228-E546 IonicContact NE-OE2 2.65Å; R228-E546 IonicContact NH2-OE2 3.59Å; Y520-E546 HydrophobicContact CE1-CG 4.49Å; E542-E546 PolarHBondContact O-N 3.11Å; E546-S548 VanDerWaalsContact C-N 3.27Å; E546-S548 PolarHBondContact O-N 3.19Å; E546-R549 WeakPolarHBondContact O-CB 3.34Å; E546-R549 PolarHBondContact O-N 3.4Å; E546-R549 VanDerWaalsContact O-N 3.16Å; E546-R549 IonicContact OE1-CZ 3.51Å; E546-R549 IonicContact OE1-NE 3.15Å; E546-R549 PolarHBondContact OE1-NE 2.88Å; E546-R549 IonicContact OE1-NH2 2.91Å; E546-R549 PolarHBondContact OE1-NH2 3.37Å; E546-R549 IonicContact OE2-CZ 3.26Å; E546-R549 IonicContact OE2-NE 2.75Å; E546-R549 PolarHBondContact OE2-NE 2.9Å; E546-R549 IonicContact OE2-NH2 2.97Å; E546-L550 HydrophobicContact CG-CD1 3.96Å; E546-L550 HydrophobicContact CG-CG 4.4Å; E546-L550 WeakPolarHBondContact O-CG 3.44Å; E546-L550 PolarHBondContact O-N 2.97Å
547	L	83.9	Confident	83.4	Confident	9 Å²	9	43.8 Å²	43.8	5%	0.047	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-41.7	175.3	-178.2	61.8	0	0	0	111.1	L495 F498 L510 Y516 Y520 I524 R543 A544 L550 T551	L495-L547 HydrophobicContact CD2-CD2 4.5Å; F498-L547 HydrophobicContact CE1-CD2 4.29Å; F498-L547 HydrophobicContact CE1-CG 4.36Å; L510-L547 HydrophobicContact CD1-CD1 3.99Å; L510-L547 HydrophobicContact CD2-CD1 3.84Å; Y516-L547 HydrophobicContact CE2-CD1 4Å; Y516-L547 HydrophobicContact CE2-CD2 4.19Å; Y520-L547 HydrophobicContact CD1-CB 3.93Å; Y520-L547 HydrophobicContact CE1-CB 4.21Å; I524-L547 HydrophobicContact CD1-CD2 4.2Å; R543-L547 WeakPolarHBondContact O-CB 3.32Å; R543-L547 PolarHBondContact O-N 3.26Å; A544-L547 PolarHBondContact O-N 2.91Å; L547-L550 PolarHBondContact O-N 3.35Å; L547-T551 HydrophobicContact CD1-CG2 4.02Å; L547-T551 HydrophobicContact CG-CG2 4.47Å; L547-T551 WeakPolarHBondContact O-CB 3.39Å; L547-T551 VanDerWaalsContact O-CG2 3.25Å; L547-T551 WeakPolarHBondContact O-CG2 3.49Å; L547-T551 PolarHBondContact O-N 3.44Å; L547-T551 PolarHBondContact O-OG1 3.23Å
548	S	79.9	Confident	83.6	Confident	53 Å²	53	40.1 Å²	40.1	37%	0.371	21%	0.211	S	C	.	.	H	α-helix	trans	-61.6	-45.2	174.8	-171.4	0	0	0	0	111.8	A544 A545 E546 L550 T551 G552	A544-S548 WeakPolarHBondContact O-CB 3.35Å; A544-S548 PolarHBondContact O-N 3.04Å; A545-S548 WeakPolarHBondContact O-CB 3.29Å; A545-S548 PolarHBondContact O-N 3.44Å; E546-S548 VanDerWaalsContact C-N 3.27Å; E546-S548 PolarHBondContact O-N 3.19Å; S548-L550 PolarHBondContact O-N 2.97Å; S548-T551 PolarHBondContact O-N 2.76Å; S548-T551 PolarHBondContact O-OG1 3.2Å; S548-G552 PolarHBondContact O-N 3.49Å
549	R	82.6	Confident	83.5	Confident	121 Å²	121	39.9 Å²	39.9	46%	0.457	21%	0.21	S	C	.	.	H	α-helix	trans	-60.4	-46	177.7	-170.7	-169	71.7	81.1	0.1	112.2	A545 E546	A545-R549 PolarHBondContact O-N 2.88Å; E546-R549 WeakPolarHBondContact O-CB 3.34Å; E546-R549 PolarHBondContact O-N 3.4Å; E546-R549 VanDerWaalsContact O-N 3.16Å; E546-R549 IonicContact OE1-CZ 3.51Å; E546-R549 IonicContact OE1-NE 3.15Å; E546-R549 PolarHBondContact OE1-NE 2.88Å; E546-R549 IonicContact OE1-NH2 2.91Å; E546-R549 PolarHBondContact OE1-NH2 3.37Å; E546-R549 IonicContact OE2-CZ 3.26Å; E546-R549 IonicContact OE2-NE 2.75Å; E546-R549 PolarHBondContact OE2-NE 2.9Å; E546-R549 IonicContact OE2-NH2 2.97Å
550	L	83.1	Confident	83.1	Confident	11 Å²	11	39.1 Å²	39.1	6%	0.058	21%	0.205	C	C	.	.	H	α-helix	trans	-66.4	-44.6	-179.5	-69.9	166.7	0	0	0	111.5	L510 E546 L547 S548 M553 F554	L510-L550 HydrophobicContact CD2-CD1 4.45Å; E546-L550 HydrophobicContact CG-CD1 3.96Å; E546-L550 HydrophobicContact CG-CG 4.4Å; E546-L550 WeakPolarHBondContact O-CG 3.44Å; E546-L550 PolarHBondContact O-N 2.97Å; L547-L550 PolarHBondContact O-N 3.35Å; S548-L550 PolarHBondContact O-N 2.97Å; L550-M553 HydrophobicContact CD2-CE 4.25Å; L550-M553 VanDerWaalsContact O-CE 3.32Å; L550-M553 WeakPolarHBondContact O-CE 3.47Å; L550-M553 PolarHBondContact O-N 3.44Å; L550-F554 VanDerWaalsContact O-CE1 3.25Å; L550-F554 WeakPolarHBondContact O-CE1 3.48Å
551	T	84.2	Confident	82.9	Confident	11 Å²	11	43.1 Å²	43.1	7%	0.067	22%	0.224	C	C	.	.	H	α-helix	trans	-73.7	-30.3	-179.2	57.7	0	0	0	0	112.4	F498 I502 L547 S548 M553 F554 I555	F498-T551 HydrophobicContact CE1-CG2 3.88Å; F498-T551 HydrophobicContact CZ-CG2 3.87Å; I502-T551 HydrophobicContact CD1-CG2 3.56Å; L547-T551 HydrophobicContact CD1-CG2 4.02Å; L547-T551 HydrophobicContact CG-CG2 4.47Å; L547-T551 WeakPolarHBondContact O-CB 3.39Å; L547-T551 VanDerWaalsContact O-CG2 3.25Å; L547-T551 WeakPolarHBondContact O-CG2 3.49Å; L547-T551 PolarHBondContact O-N 3.44Å; L547-T551 PolarHBondContact O-OG1 3.23Å; S548-T551 PolarHBondContact O-N 2.76Å; S548-T551 PolarHBondContact O-OG1 3.2Å; T551-M553 PolarHBondContact O-N 3.46Å; T551-F554 HydrophobicContact CG2-CZ 3.96Å; T551-F554 CarbonylContact O-C 3.45Å; T551-F554 PolarHBondContact O-N 2.87Å; T551-I555 HydrophobicContact CG2-CD1 4.35Å; T551-I555 WeakPolarHBondContact O-CB 3.31Å; T551-I555 VanDerWaalsContact O-CG1 3.31Å; T551-I555 WeakPolarHBondContact O-CG1 3.17Å; T551-I555 PolarHBondContact O-N 3.02Å
552	G	82.6	Confident	83	Confident	22 Å²	22	41.3 Å²	41.3	23%	0.227	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.1	174.8	0	0	0	0	0	114.7	S548 F554	S548-G552 PolarHBondContact O-N 3.49Å; G552-F554 VanDerWaalsContact C-N 3.27Å; G552-F554 PolarHBondContact O-N 3.4Å
553	M	86	Confident	82.6	Confident	60 Å²	60	38.9 Å²	38.9	30%	0.296	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-25.2	173.1	-62.8	-169.7	-68	0	0	113.4	R343 L550 T551	R343-M553 VanDerWaalsContact CD-O 3.24Å; R343-M553 WeakPolarHBondContact CD-O 3.4Å; L550-M553 HydrophobicContact CD2-CE 4.25Å; L550-M553 VanDerWaalsContact O-CE 3.32Å; L550-M553 WeakPolarHBondContact O-CE 3.47Å; L550-M553 PolarHBondContact O-N 3.44Å; T551-M553 PolarHBondContact O-N 3.46Å
554	F	88.5	Confident	82.3	Confident	3 Å²	3	40.1 Å²	40.1	1%	0.013	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139.6	2.8	-175	60.3	-90.7	0	0	0	114.1	F334 A350 I351 I502 I509 L550 T551 G552	F334-F554 VanDerWaalsContact CZ-C 3.46Å; A350-F554 CarbonylContact C-O 3.58Å; A350-F554 WeakPolarHBondContact CA-O 3.49Å; I351-F554 HydrophobicContact CD1-CD2 4.42Å; I351-F554 HydrophobicContact CD1-CE2 4.31Å; I351-F554 PolarHBondContact N-O 3.16Å; I502-F554 HydrophobicContact CD1-CZ 4.47Å; I502-F554 HydrophobicContact CG1-CE2 4.07Å; I502-F554 HydrophobicContact CG1-CZ 4.38Å; I502-F554 HydrophobicContact CG2-CE2 3.96Å; I502-F554 HydrophobicContact CG2-CZ 3.8Å; I509-F554 HydrophobicContact CD1-CD1 3.8Å; I509-F554 HydrophobicContact CD1-CE1 3.26Å; I509-F554 HydrophobicContact CD1-CZ 3.96Å; I509-F554 HydrophobicContact CG1-CE1 4.27Å; I509-F554 HydrophobicContact CG2-CZ 4.4Å; L550-F554 VanDerWaalsContact O-CE1 3.25Å; L550-F554 WeakPolarHBondContact O-CE1 3.48Å; T551-F554 HydrophobicContact CG2-CZ 3.96Å; T551-F554 CarbonylContact O-C 3.45Å; T551-F554 PolarHBondContact O-N 2.87Å; G552-F554 VanDerWaalsContact C-N 3.27Å; G552-F554 PolarHBondContact O-N 3.4Å
555	I	89.1	Confident	82.2	Confident	19 Å²	19	47 Å²	47	10%	0.097	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127	169.3	-51.8	-165.4	0	0	0	109.8	I351 A353 F498 I502 T551	I351-I555 HydrophobicContact CB-CB 4.4Å; I351-I555 HydrophobicContact CB-CG1 3.98Å; I351-I555 HydrophobicContact CB-CG2 4.31Å; I351-I555 HydrophobicContact CD1-CD1 3.79Å; I351-I555 HydrophobicContact CD1-CG1 3.89Å; I351-I555 HydrophobicContact CG1-CG1 4.3Å; I351-I555 HydrophobicContact CG2-CG2 4.3Å; I351-I555 WeakPolarHBondContact O-CA 3.43Å; A353-I555 HydrophobicContact CB-CG2 4.08Å; F498-I555 HydrophobicContact CE2-CD1 3.56Å; F498-I555 HydrophobicContact CZ-CD1 3.61Å; I502-I555 HydrophobicContact CD1-CD1 4.48Å; I502-I555 HydrophobicContact CG1-CD1 4.5Å; T551-I555 HydrophobicContact CG2-CD1 4.35Å; T551-I555 WeakPolarHBondContact O-CB 3.31Å; T551-I555 VanDerWaalsContact O-CG1 3.31Å; T551-I555 WeakPolarHBondContact O-CG1 3.17Å; T551-I555 PolarHBondContact O-N 3.02Å
556	L	88.4	Confident	82.3	Confident	11 Å²	11	49 Å²	49	6%	0.058	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	121.9	170.1	178.9	64.7	0	0	0	109.5	F334 I351 L352 A353	F334-L556 HydrophobicContact CB-CD2 3.96Å; F334-L556 HydrophobicContact CD1-CB 3.57Å; F334-L556 HydrophobicContact CD1-CD2 3.88Å; F334-L556 HydrophobicContact CD1-CG 4.35Å; F334-L556 HydrophobicContact CD2-CB 4.29Å; F334-L556 HydrophobicContact CE1-CB 3.41Å; F334-L556 VanDerWaalsContact CE1-CB 3.41Å; F334-L556 HydrophobicContact CE2-CB 4.15Å; F334-L556 HydrophobicContact CG-CB 4.01Å; F334-L556 HydrophobicContact CG-CD2 3.89Å; F334-L556 HydrophobicContact CG-CG 4.47Å; F334-L556 HydrophobicContact CZ-CB 3.71Å; I351-L556 PolarHBondContact O-N 3.37Å; L352-L556 HydrophobicContact CD1-CB 4.21Å; L352-L556 HydrophobicContact CD1-CD2 3.92Å; L352-L556 HydrophobicContact CD1-CG 4.27Å; A353-L556 CarbonylContact C-O 3.57Å; A353-L556 WeakPolarHBondContact CA-O 3.45Å; A353-L556 WeakPolarHBondContact CB-O 3.35Å; A353-L556 PolarHBondContact N-O 2.98Å
557	R	85.9	Confident	82.4	Confident	118 Å²	118	49.6 Å²	49.6	45%	0.445	23%	0.231	S	C	.	.			trans	-125.4	132.1	175.8	179	173.3	-177	-174.4	-3.3	110.2	A353	A353-R557 HydrophobicContact CB-CB 4.06Å; A353-R557 HydrophobicContact CB-CG 4.49Å; A353-R557 WeakPolarHBondContact O-CG 3.29Å
558	R	84.5	Confident	82.6	Confident	20 Å²	20	50.4 Å²	50.4	8%	0.075	24%	0.237	C	C	.	.			trans	-136.5	149.5	175.4	-68.6	171.9	-69.3	-158.7	5.8	110.4	H327 D354 E355 L358 I562	H327-R558 VanDerWaalsContact C-NH1 3.34Å; H327-R558 PolarHBondContact O-NH1 3Å; D354-R558 VanDerWaalsContact CG-NH2 3.33Å; D354-R558 WeakPolarHBondContact OD1-CB 3.24Å; D354-R558 IonicContact OD1-CZ 2.92Å; D354-R558 IonicContact OD1-NE 3.81Å; D354-R558 PolarHBondContact OD1-NE 3.42Å; D354-R558 IonicContact OD1-NH2 3.2Å; D354-R558 PolarHBondContact OD1-NH2 3.07Å; D354-R558 IonicContact OD2-CZ 2.68Å; D354-R558 IonicContact OD2-NE 2.71Å; D354-R558 IonicContact OD2-NH2 2.75Å; D354-R558 PolarHBondContact OD2-NH2 3.33Å; E355-R558 PolarHBondContact N-O 3.11Å; L358-R558 HydrophobicContact CD1-CB 3.88Å; L358-R558 WeakPolarHBondContact CD1-O 3.39Å; R558-I562 HydrophobicContact CB-CD1 3.79Å; R558-I562 HydrophobicContact CG-CD1 3.98Å
559	T	81.4	Confident	83.1	Confident	54 Å²	54	50.4 Å²	50.4	33%	0.331	24%	0.236	S	C	.	.			trans	-94.8	160.8	-177.1	57.1	0	0	0	0	112	E355 E561 I562	E355-T559 WeakPolarHBondContact OE2-CA 3.23Å; T559-E561 PolarHBondContact O-N 3.33Å; T559-I562 PolarHBondContact O-N 2.94Å
560	Q	74.4	Confident	83.4	Confident	40 Å²	40	46 Å²	46	19%	0.187	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.7	176.6	-78	-178.3	-5.1	0	0	113.4	E355 M356 I562 I563 N564	E355-Q560 HydrophobicContact CB-CG 3.95Å; E355-Q560 WeakPolarHBondContact OE2-CG 3.38Å; E355-Q560 PolarHBondContact OE2-N 2.75Å; M356-Q560 PolarHBondContact O-NE2 3.39Å; Q560-I562 PolarHBondContact O-N 3.03Å; Q560-I563 HydrophobicContact CB-CG2 4.43Å; Q560-I563 WeakPolarHBondContact O-CG2 3.49Å; Q560-I563 PolarHBondContact O-N 3.35Å; Q560-N564 PolarHBondContact O-N 3.21Å; Q560-N564 VanDerWaalsContact O-N 3.16Å; Q560-N564 PolarHBondContact O-OD1 2.92Å
561	E	75.3	Confident	83.8	Confident	85 Å²	85	47 Å²	47	40%	0.397	22%	0.224	S	C	.	.	H	α-helix	trans	-54.5	-30.2	178.6	-62.3	179.1	166.5	0	0	113.4	T559 I563 N564 K890	T559-E561 PolarHBondContact O-N 3.33Å; E561-I563 VanDerWaalsContact C-N 3.33Å; E561-I563 PolarHBondContact O-N 3.38Å; E561-N564 WeakPolarHBondContact O-CB 3.17Å; E561-N564 PolarHBondContact O-N 2.7Å; E561-K890 WeakPolarHBondContact OE1-CD 3.34Å; E561-K890 WeakPolarHBondContact OE1-CG 3.42Å
562	I	80.8	Confident	84.1	Confident	55 Å²	55	46.7 Å²	46.7	28%	0.282	22%	0.222	S	C	.	.	H	α-helix	trans	-64.3	-39.2	176	-55.5	-179.9	0	0	0	111.3	H327 R558 T559 Q560 Y566	H327-I562 HydrophobicContact CB-CG2 4.02Å; R558-I562 HydrophobicContact CB-CD1 3.79Å; R558-I562 HydrophobicContact CG-CD1 3.98Å; T559-I562 PolarHBondContact O-N 2.94Å; Q560-I562 PolarHBondContact O-N 3.03Å; I562-Y566 WeakPolarHBondContact O-CD2 3.27Å; I562-Y566 WeakPolarHBondContact O-CE2 3.23Å
563	I	77.1	Confident	84.6	Confident	18 Å²	18	45.6 Å²	45.6	9%	0.092	21%	0.211	C	C	.	.	H	α-helix	trans	-80.8	-23.6	-179.3	-155.6	161	0	0	0	112.4	L358 Q560 E561 R565 Y566 L567	L358-I563 HydrophobicContact CD2-CB 3.92Å; L358-I563 HydrophobicContact CD2-CG2 4.29Å; Q560-I563 HydrophobicContact CB-CG2 4.43Å; Q560-I563 WeakPolarHBondContact O-CG2 3.49Å; Q560-I563 PolarHBondContact O-N 3.35Å; E561-I563 VanDerWaalsContact C-N 3.33Å; E561-I563 PolarHBondContact O-N 3.38Å; I563-R565 PolarHBondContact O-N 3.37Å; I563-Y566 PolarHBondContact O-N 3.31Å; I563-L567 HydrophobicContact CG1-CD1 4.22Å; I563-L567 HydrophobicContact CG1-CG 4.14Å; I563-L567 HydrophobicContact CG2-CD1 3.83Å; I563-L567 PolarHBondContact O-N 2.91Å
564	N	78.1	Confident	84.9	Confident	35 Å²	35	42.8 Å²	42.8	19%	0.187	20%	0.197	C	C	.	.	H	α-helix	trans	-56.2	-26.3	178.6	-63	-1.1	0	0	0	112.3	Q560 E561 Y566 W779	Q560-N564 PolarHBondContact O-N 3.21Å; Q560-N564 VanDerWaalsContact O-N 3.16Å; Q560-N564 PolarHBondContact O-OD1 2.92Å; E561-N564 WeakPolarHBondContact O-CB 3.17Å; E561-N564 PolarHBondContact O-N 2.7Å; N564-Y566 PolarHBondContact O-N 3.16Å; N564-W779 HydrophobicContact CB-CH2 4.16Å; N564-W779 VanDerWaalsContact CG-CH2 3.44Å; N564-W779 WeakPolarHBondContact OD1-CH2 2.91Å; N564-W779 WeakPolarHBondContact OD1-CZ3 3.39Å
565	R	78.6	Confident	85.2	Confident	173 Å²	173	42.6 Å²	42.6	65%	0.653	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.1	174.4	-58.4	-171	177.5	175.9	0.7	114.2	I563	I563-R565 PolarHBondContact O-N 3.37Å
566	Y	80.9	Confident	85.4	Confident	105 Å²	105	41.7 Å²	41.7	41%	0.412	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-6.3	-173.6	-54.7	-80	0	0	0	112.9	I562 I563 N564	I562-Y566 WeakPolarHBondContact O-CD2 3.27Å; I562-Y566 WeakPolarHBondContact O-CE2 3.23Å; I563-Y566 PolarHBondContact O-N 3.31Å; N564-Y566 PolarHBondContact O-N 3.16Å
567	L	84.4	Confident	85.6	Confident	19 Å²	19	41.2 Å²	41.2	10%	0.099	19%	0.189	C	C	.	.	S	Bend	trans	-97	150.8	178.1	-65.8	176.5	0	0	0	110.4	I563 W779	I563-L567 HydrophobicContact CG1-CD1 4.22Å; I563-L567 HydrophobicContact CG1-CG 4.14Å; I563-L567 HydrophobicContact CG2-CD1 3.83Å; I563-L567 PolarHBondContact O-N 2.91Å; L567-W779 HydrophobicContact CB-CZ2 3.96Å; L567-W779 HydrophobicContact CD1-CD2 3.84Å; L567-W779 HydrophobicContact CD1-CE3 4.1Å; L567-W779 HydrophobicContact CD1-CG 4.41Å; L567-W779 HydrophobicContact CD1-CH2 4.35Å; L567-W779 HydrophobicContact CD1-CZ2 4.04Å; L567-W779 HydrophobicContact CD1-CZ3 4.34Å
568	P	88.3	Confident	85.9	Confident	25 Å²	25	38.2 Å²	38.2	16%	0.162	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-58.7	158.7	169.3	-24.4	35.9	0	0	0	111.9	W779 Q783 K785	P568-W779 PolarHBondContact O-NE1 3.43Å; P568-Q783 WeakPolarHBondContact CD-O 3.06Å; P568-Q783 HydrophobicContact CG-CG 4.12Å; P568-Q783 WeakPolarHBondContact CG-O 3.47Å; P568-K785 VanDerWaalsContact CB-O 3.29Å; P568-K785 WeakPolarHBondContact CB-O 3.34Å
569	P	89.9	Confident	86.2	Confident	54 Å²	54	38 Å²	38	35%	0.351	19%	0.185	S	C	.	.	P	Polyproline II helix	trans	-54.5	146.6	176	-25	34.5	0	0	0	112.6	T786 V787 I930	P569-T786 HydrophobicContact CB-CG2 4.25Å; P569-T786 WeakPolarHBondContact O-CA 3.39Å; P569-T786 WeakPolarHBondContact O-CG2 3.45Å; P569-V787 PolarHBondContact O-N 2.81Å; P569-I930 WeakPolarHBondContact CA-O 3.45Å
570	R	90.1	Very high	86.6	Confident	29 Å²	29	36 Å²	36	11%	0.109	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128	175.6	-169.7	-177.2	94.1	-165.6	4.6	110	D572 W779 V787 I789 I930	R570-D572 WeakPolarHBondContact CD-OD1 3.46Å; R570-D572 WeakPolarHBondContact CG-OD1 3.36Å; R570-D572 IonicContact CZ-OD1 3.64Å; R570-D572 IonicContact CZ-OD2 3.04Å; R570-D572 IonicContact NE-OD1 3.03Å; R570-D572 PolarHBondContact NE-OD1 2.91Å; R570-D572 IonicContact NE-OD2 3.48Å; R570-D572 PolarHBondContact NE-OD2 2.79Å; R570-D572 IonicContact NH2-OD1 3.39Å; R570-D572 IonicContact NH2-OD2 3.63Å; R570-D572 PolarHBondContact NH2-OD2 3.35Å; R570-W779 HydrophobicContact CB-CD2 4.19Å; R570-W779 HydrophobicContact CB-CG 4.41Å; R570-W779 HydrophobicContact CB-CZ2 4.01Å; R570-W779 HydrophobicContact CG-CD2 4.35Å; R570-W779 HydrophobicContact CG-CG 4.32Å; R570-V787 CarbonylContact C-O 3.58Å; R570-V787 WeakPolarHBondContact CA-O 3.21Å; R570-V787 HydrophobicContact CG-CB 4.45Å; R570-I789 HydrophobicContact CG-CD1 3.94Å; R570-I789 HydrophobicContact CG-CG1 4.23Å; R570-I930 HydrophobicContact CB-CB 4.34Å; R570-I930 VanDerWaalsContact CZ-CD1 3.46Å; R570-I930 PolarHBondContact N-O 3.2Å; R570-I930 PolarHBondContact O-N 3.44Å
571	L	91	Very high	87.4	Confident	30 Å²	30	38.6 Å²	38.6	16%	0.157	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	116.2	176.2	-67.3	166.1	0	0	0	108.5	T786 V787 H788 I789 T929	L571-T786 HydrophobicContact CD1-CG2 4.2Å; L571-V787 PolarHBondContact N-O 3.07Å; L571-H788 VanDerWaalsContact CD1-CE1 3.41Å; L571-H788 WeakPolarHBondContact CD1-CE1 3.45Å; L571-I789 PolarHBondContact O-N 3Å; L571-T929 HydrophobicContact CD2-CG2 3.67Å; L571-T929 WeakPolarHBondContact CD2-OG1 3.08Å
572	D	91.3	Very high	88	Confident	5 Å²	5	35.8 Å²	35.8	3%	0.027	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.9	178	-65.7	-7.1	0	0	0	109.5	R570 Q927 T928	R570-D572 WeakPolarHBondContact CD-OD1 3.46Å; R570-D572 WeakPolarHBondContact CG-OD1 3.36Å; R570-D572 IonicContact CZ-OD1 3.64Å; R570-D572 IonicContact CZ-OD2 3.04Å; R570-D572 IonicContact NE-OD1 3.03Å; R570-D572 PolarHBondContact NE-OD1 2.91Å; R570-D572 IonicContact NE-OD2 3.48Å; R570-D572 PolarHBondContact NE-OD2 2.79Å; R570-D572 IonicContact NH2-OD1 3.39Å; R570-D572 IonicContact NH2-OD2 3.63Å; R570-D572 PolarHBondContact NH2-OD2 3.35Å; D572-Q927 WeakPolarHBondContact O-CA 3.42Å; D572-T928 HydrophobicContact CB-CG2 3.66Å; D572-T928 PolarHBondContact N-O 3.2Å; D572-T928 PolarHBondContact O-N 2.65Å
573	W	92.5	Very high	88.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	128.1	178.4	-71.6	104.4	0	0	0	110.1	L575 I789 Y790 R791 F903 F910 D912 L915 A925 F926 Q927	W573-L575 HydrophobicContact CB-CD2 4.08Å; W573-L575 HydrophobicContact CB-CG 4.36Å; W573-L575 HydrophobicContact CE3-CD2 4.23Å; W573-I789 PolarHBondContact N-O 2.96Å; W573-Y790 HydrophobicContact CB-CD1 3.73Å; W573-Y790 HydrophobicContact CB-CE1 4.27Å; W573-Y790 AromaticContact CD1-CD1 3.8Å; W573-Y790 AromaticContact CD1-CE1 3.45Å; W573-Y790 VanDerWaalsContact CD1-CE1 3.45Å; W573-Y790 AromaticContact CG-CD1 3.96Å; W573-Y790 HydrophobicContact CG-CD1 3.96Å; W573-Y790 AromaticContact CG-CE1 3.98Å; W573-Y790 HydrophobicContact CG-CE1 3.98Å; W573-Y790 CarbonylContact O-C 3.56Å; W573-R791 PolarHBondContact O-N 3.5Å; W573-F903 HydrophobicContact CH2-CD2 4.28Å; W573-F903 AromaticContact CH2-CE2 3.87Å; W573-F903 HydrophobicContact CH2-CE2 3.87Å; W573-F903 HydrophobicContact CH2-CZ 4.13Å; W573-F903 AromaticContact CZ3-CD2 3.85Å; W573-F903 HydrophobicContact CZ3-CD2 3.85Å; W573-F903 AromaticContact CZ3-CE2 3.83Å; W573-F903 HydrophobicContact CZ3-CE2 3.83Å; W573-F903 HydrophobicContact CZ3-CZ 4.49Å; W573-F910 HydrophobicContact CH2-CB 4.26Å; W573-F910 WeakPolarHBondContact CH2-O 3.45Å; W573-F910 HydrophobicContact CZ3-CD1 4.47Å; W573-D912 HydrophobicContact CZ2-CB 3.61Å; W573-D912 PolarHBondContact NE1-OD2 3.27Å; W573-D912 VanDerWaalsContact NE1-OD2 3.13Å; W573-L915 HydrophobicContact CD2-CD1 3.47Å; W573-L915 VanDerWaalsContact CD2-CD1 3.47Å; W573-L915 HydrophobicContact CE3-CD1 3.74Å; W573-L915 HydrophobicContact CG-CD1 3.86Å; W573-L915 HydrophobicContact CH2-CD1 4.26Å; W573-L915 HydrophobicContact CZ2-CD1 3.98Å; W573-L915 HydrophobicContact CZ3-CD1 4.12Å; W573-A925 HydrophobicContact CE3-CB 4.2Å; W573-A925 HydrophobicContact CZ3-CB 4.24Å; W573-F926 WeakPolarHBondContact CA-O 3.47Å; W573-Q927 HydrophobicContact CD2-CB 4.25Å; W573-Q927 HydrophobicContact CD2-CG 3.92Å; W573-Q927 HydrophobicContact CE3-CB 3.77Å; W573-Q927 HydrophobicContact CE3-CG 3.94Å; W573-Q927 HydrophobicContact CH2-CB 3.87Å; W573-Q927 VanDerWaalsContact CH2-CD 3.44Å; W573-Q927 HydrophobicContact CH2-CG 3.68Å; W573-Q927 HydrophobicContact CZ2-CB 4.39Å; W573-Q927 VanDerWaalsContact CZ2-CD 3.45Å; W573-Q927 HydrophobicContact CZ2-CG 3.71Å; W573-Q927 HydrophobicContact CZ3-CB 3.57Å; W573-Q927 HydrophobicContact CZ3-CG 3.83Å
574	T	93.1	Very high	89.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	109.4	167.3	-56.2	0	0	0	0	108.2	F576 L793 F803 A925 F926	T574-F576 HydrophobicContact CG2-CE2 4.12Å; T574-F576 HydrophobicContact CG2-CZ 4.18Å; T574-L793 HydrophobicContact CG2-CD1 3.54Å; T574-L793 HydrophobicContact CG2-CG 4.38Å; T574-F803 HydrophobicContact CG2-CE1 4.18Å; T574-F803 HydrophobicContact CG2-CE2 4.18Å; T574-F803 HydrophobicContact CG2-CZ 3.88Å; T574-A925 CarbonylContact O-C 3.26Å; T574-A925 VanDerWaalsContact O-CA 3.25Å; T574-A925 WeakPolarHBondContact O-CA 3.39Å; T574-F926 PolarHBondContact N-O 2.98Å; T574-F926 PolarHBondContact O-N 2.92Å
575	L	93.4	Very high	89.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.2	-171.3	-53.1	-179.9	0	0	0	110.1	W573 V670 Y790 R791 L792 L793 L915 I922 A925	W573-L575 HydrophobicContact CB-CD2 4.08Å; W573-L575 HydrophobicContact CB-CG 4.36Å; W573-L575 HydrophobicContact CE3-CD2 4.23Å; L575-V670 HydrophobicContact CD1-CG1 4.35Å; L575-Y790 HydrophobicContact CD1-CD1 4.14Å; L575-R791 PolarHBondContact N-O 3.14Å; L575-L792 HydrophobicContact CB-CD2 4.12Å; L575-L792 HydrophobicContact CD1-CD2 3.76Å; L575-L792 HydrophobicContact CG-CD2 4.39Å; L575-L793 PolarHBondContact O-N 3.02Å; L575-L915 HydrophobicContact CD1-CD2 3.56Å; L575-L915 HydrophobicContact CD2-CD1 3.99Å; L575-L915 HydrophobicContact CD2-CD2 4.31Å; L575-I922 HydrophobicContact CD1-CD1 4.33Å; L575-I922 HydrophobicContact CD2-CD1 4.43Å; L575-A925 HydrophobicContact CD2-CB 3.69Å
576	F	93.6	Very high	90	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	111.9	172.6	-61.4	-92	0	0	0	108.6	T574 L793 A795 E800 F803 I922 T923 F924 F926	T574-F576 HydrophobicContact CG2-CE2 4.12Å; T574-F576 HydrophobicContact CG2-CZ 4.18Å; F576-L793 CarbonylContact C-O 3.55Å; F576-L793 WeakPolarHBondContact CA-O 3.44Å; F576-L793 HydrophobicContact CD1-CB 4.19Å; F576-L793 HydrophobicContact CD1-CD1 4.34Å; F576-L793 HydrophobicContact CE1-CB 4.4Å; F576-L793 HydrophobicContact CE1-CD1 3.75Å; F576-L793 HydrophobicContact CZ-CD1 4.02Å; F576-A795 HydrophobicContact CB-CB 4.17Å; F576-E800 HydrophobicContact CE1-CG 3.91Å; F576-E800 WeakPolarHBondContact CE1-OE1 3.38Å; F576-F803 HydrophobicContact CZ-CE1 4.5Å; F576-I922 CarbonylContact O-C 3.55Å; F576-I922 WeakPolarHBondContact O-CA 3.48Å; F576-T923 WeakPolarHBondContact CB-OG1 3.48Å; F576-T923 PolarHBondContact O-N 3.17Å; F576-T923 PolarHBondContact O-OG1 3.03Å; F576-F924 HydrophobicContact CB-CB 4.24Å; F576-F924 WeakPolarHBondContact CB-O 3.19Å; F576-F924 HydrophobicContact CD2-CB 4.01Å; F576-F924 AromaticContact CD2-CD1 3.98Å; F576-F924 HydrophobicContact CD2-CD1 3.98Å; F576-F924 WeakPolarHBondContact CD2-O 3.43Å; F576-F924 HydrophobicContact CE2-CD1 4.12Å; F576-F924 HydrophobicContact CG-CB 4.42Å; F576-F924 PolarHBondContact N-O 3.26Å; F576-F926 AromaticContact CE2-CD2 3.45Å; F576-F926 HydrophobicContact CE2-CD2 3.45Å; F576-F926 VanDerWaalsContact CE2-CD2 3.45Å; F576-F926 AromaticContact CE2-CE2 3.48Å; F576-F926 HydrophobicContact CE2-CE2 3.48Å; F576-F926 VanDerWaalsContact CE2-CE2 3.48Å; F576-F926 AromaticContact CZ-CD2 3.93Å; F576-F926 HydrophobicContact CZ-CD2 3.93Å; F576-F926 AromaticContact CZ-CE2 3.7Å; F576-F926 HydrophobicContact CZ-CE2 3.7Å
577	C	92.8	Very high	90.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	138.1	-176.3	-51.4	0	0	0	0	109.8	K667 V670 L793 A795 H921	C577-K667 HydrophobicContact CB-CG 4.23Å; C577-V670 HydrophobicContact CB-CG2 4.25Å; C577-L793 WeakPolarHBondContact CB-O 3.31Å; C577-L793 PolarHBondContact N-O 3.32Å; C577-A795 PolarHBondContact O-N 3.21Å; C577-H921 WeakPolarHBondContact CA-O 3.49Å
578	T	91.9	Very high	90.7	Very high	55 Å²	55	32.1 Å²	32.1	34%	0.337	17%	0.168	S	C	.	.	P	Polyproline II helix	trans	-68.6	122.7	176.1	-50.2	0	0	0	0	110.2	G666 H921 T923	T578-G666 VanDerWaalsContact O-CA 3.3Å; T578-G666 WeakPolarHBondContact O-CA 3.33Å; T578-H921 PolarHBondContact N-O 3.38Å; T578-H921 PolarHBondContact OG1-O 2.67Å; T578-T923 HydrophobicContact CG2-CG2 4.42Å; T578-T923 WeakPolarHBondContact OG1-CG2 3.28Å
579	P	91.1	Very high	90.6	Very high	17 Å²	17	34.1 Å²	34.1	11%	0.11	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-65.6	139.3	176.1	22.9	-29.2	0	0	0	111.3	Q583 Q584 T794	P579-Q583 HydrophobicContact CB-CB 4.33Å; P579-Q584 HydrophobicContact CB-CG 3.91Å; P579-Q584 HydrophobicContact CG-CG 3.84Å; P579-Q584 PolarHBondContact O-NE2 3.06Å; P579-T794 HydrophobicContact CB-CG2 3.67Å; P579-T794 HydrophobicContact CG-CG2 4.17Å
580	S	91.1	Very high	90.3	Very high	10 Å²	10	31.6 Å²	31.6	7%	0.07	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-63.5	155.3	178.3	80	0	0	0	0	111.6	L582 Q583 Q584 D664	S580-L582 PolarHBondContact O-N 3.48Å; S580-L582 VanDerWaalsContact O-N 3.15Å; S580-Q583 WeakPolarHBondContact O-CB 3.48Å; S580-Q583 PolarHBondContact O-N 3.37Å; S580-Q583 WeakPolarHBondContact OG-CB 3.45Å; S580-Q583 VanDerWaalsContact OG-CG 3.29Å; S580-Q583 WeakPolarHBondContact OG-CG 3.25Å; S580-Q583 PolarHBondContact OG-N 3.26Å; S580-Q583 PolarHBondContact OG-OE1 3.34Å; S580-Q584 WeakPolarHBondContact O-CG 3.35Å; S580-Q584 PolarHBondContact O-N 3.42Å; S580-D664 WeakPolarHBondContact CB-O 3.04Å; S580-D664 PolarHBondContact OG-O 3.19Å
581	P	89.6	Confident	90.1	Very high	96 Å²	96	31.8 Å²	31.8	62%	0.623	16%	0.161	S	C	*	.	H	α-helix	trans	-56.4	-33.3	177.1	-26.3	35.1	0	0	0	113.1	K585	P581-K585 VanDerWaalsContact O-CG 3.27Å; P581-K585 WeakPolarHBondContact O-CG 3.4Å; P581-K585 PolarHBondContact O-N 3.24Å
582	L	88	Confident	89.8	Confident	25 Å²	25	33.7 Å²	33.7	13%	0.131	18%	0.176	C	C	.	.	H	α-helix	trans	-69.4	-46.2	174.5	-179.1	59.8	0	0	0	111.3	S580 Q584 K585 L586 P623 Y655	S580-L582 PolarHBondContact O-N 3.48Å; S580-L582 VanDerWaalsContact O-N 3.15Å; L582-Q584 VanDerWaalsContact C-N 3.33Å; L582-Q584 PolarHBondContact O-N 2.75Å; L582-K585 PolarHBondContact O-N 3.32Å; L582-L586 HydrophobicContact CD1-CD1 4Å; L582-L586 HydrophobicContact CD1-CG 4.16Å; L582-L586 HydrophobicContact CG-CD1 3.95Å; L582-L586 WeakPolarHBondContact O-CG 3.44Å; L582-L586 PolarHBondContact O-N 2.89Å; L582-P623 HydrophobicContact CD2-CB 4.08Å; L582-P623 HydrophobicContact CD2-CG 4.2Å; L582-P623 HydrophobicContact CG-CB 4.48Å; L582-P623 HydrophobicContact CG-CG 4.41Å; L582-Y655 HydrophobicContact CD2-CD2 4.38Å; L582-Y655 HydrophobicContact CD2-CE2 3.98Å
583	Q	90.4	Very high	89.3	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.028	18%	0.182	C	C	.	.	H	α-helix	trans	-56.9	-45.8	175.8	-75.9	175.4	-50.9	0	0	111.4	P579 S580 K585 L586 Y587 L619 C620 P623 S665	P579-Q583 HydrophobicContact CB-CB 4.33Å; S580-Q583 WeakPolarHBondContact O-CB 3.48Å; S580-Q583 PolarHBondContact O-N 3.37Å; S580-Q583 WeakPolarHBondContact OG-CB 3.45Å; S580-Q583 VanDerWaalsContact OG-CG 3.29Å; S580-Q583 WeakPolarHBondContact OG-CG 3.25Å; S580-Q583 PolarHBondContact OG-N 3.26Å; S580-Q583 PolarHBondContact OG-OE1 3.34Å; Q583-K585 PolarHBondContact O-N 2.78Å; Q583-L586 PolarHBondContact O-N 3.35Å; Q583-Y587 VanDerWaalsContact O-CB 3.24Å; Q583-Y587 WeakPolarHBondContact O-CB 3.43Å; Q583-Y587 PolarHBondContact O-N 2.83Å; Q583-L619 HydrophobicContact CG-CD1 4.34Å; Q583-L619 PolarHBondContact NE2-O 2.82Å; Q583-C620 PolarHBondContact NE2-O 2.85Å; Q583-C620 VanDerWaalsContact NE2-O 3.16Å; Q583-P623 HydrophobicContact CG-CG 3.66Å; Q583-S665 PolarHBondContact NE2-OG 3.41Å
584	Q	90.3	Very high	88.6	Confident	61 Å²	61	45.2 Å²	45.2	29%	0.285	22%	0.221	S	C	.	.	H	α-helix	trans	-62.5	-43.8	179.2	-66.3	-176.8	12	0	0	112.6	P579 S580 L582 Y587 K588	P579-Q584 HydrophobicContact CB-CG 3.91Å; P579-Q584 HydrophobicContact CG-CG 3.84Å; P579-Q584 PolarHBondContact O-NE2 3.06Å; S580-Q584 WeakPolarHBondContact O-CG 3.35Å; S580-Q584 PolarHBondContact O-N 3.42Å; L582-Q584 VanDerWaalsContact C-N 3.33Å; L582-Q584 PolarHBondContact O-N 2.75Å; Q584-Y587 PolarHBondContact O-N 3.03Å; Q584-K588 WeakPolarHBondContact O-CB 3.41Å; Q584-K588 WeakPolarHBondContact O-CG 3.48Å; Q584-K588 PolarHBondContact O-N 2.89Å
585	K	89	Confident	87.7	Confident	145 Å²	145	46.7 Å²	46.7	63%	0.63	23%	0.23	S	C	*	.	H	α-helix	trans	-61.8	-48.6	177.5	-74.5	172.6	-175.5	178.9	0	111.4	P581 L582 Q583 Y587 K588 H589	P581-K585 VanDerWaalsContact O-CG 3.27Å; P581-K585 WeakPolarHBondContact O-CG 3.4Å; P581-K585 PolarHBondContact O-N 3.24Å; L582-K585 PolarHBondContact O-N 3.32Å; Q583-K585 PolarHBondContact O-N 2.78Å; K585-Y587 PolarHBondContact O-N 2.85Å; K585-K588 PolarHBondContact O-N 3.16Å; K585-H589 PolarHBondContact O-N 2.85Å; K585-H589 VanDerWaalsContact O-N 3.08Å
586	L	87.9	Confident	87	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-40.6	178.5	-69.9	172.8	0	0	0	111.7	L582 Q583 H589 L590 L619 P623 L650 F651	L582-L586 HydrophobicContact CD1-CD1 4Å; L582-L586 HydrophobicContact CD1-CG 4.16Å; L582-L586 HydrophobicContact CG-CD1 3.95Å; L582-L586 WeakPolarHBondContact O-CG 3.44Å; L582-L586 PolarHBondContact O-N 2.89Å; Q583-L586 PolarHBondContact O-N 3.35Å; L586-H589 PolarHBondContact O-N 2.93Å; L586-L590 WeakPolarHBondContact O-CG 3.43Å; L586-L590 PolarHBondContact O-N 2.74Å; L586-L619 HydrophobicContact CB-CD1 3.84Å; L586-L619 HydrophobicContact CB-CD2 3.83Å; L586-L619 HydrophobicContact CD1-CD1 3.74Å; L586-L619 HydrophobicContact CG-CD1 4.46Å; L586-P623 HydrophobicContact CD1-CB 4.05Å; L586-L650 HydrophobicContact CD2-CB 3.72Å; L586-L650 HydrophobicContact CD2-CD1 4.03Å; L586-F651 HydrophobicContact CD1-CE1 3.8Å; L586-F651 HydrophobicContact CD1-CE2 4.41Å; L586-F651 HydrophobicContact CD1-CZ 3.7Å; L586-F651 HydrophobicContact CD2-CE2 4.11Å; L586-F651 HydrophobicContact CD2-CZ 4.22Å
587	Y	89.9	Confident	86.2	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.016	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-48.5	179.6	-161.4	-77.9	0	0	0	110.9	Q583 Q584 K585 H589 L590 L591 L616 L619 T797 I798 L839	Q583-Y587 VanDerWaalsContact O-CB 3.24Å; Q583-Y587 WeakPolarHBondContact O-CB 3.43Å; Q583-Y587 PolarHBondContact O-N 2.83Å; Q584-Y587 PolarHBondContact O-N 3.03Å; K585-Y587 PolarHBondContact O-N 2.85Å; Y587-H589 VanDerWaalsContact C-N 3.28Å; Y587-H589 PolarHBondContact O-N 3.48Å; Y587-L590 PolarHBondContact O-N 2.79Å; Y587-L591 HydrophobicContact CD1-CD1 3.8Å; Y587-L591 HydrophobicContact CD1-CG 3.94Å; Y587-L591 HydrophobicContact CE1-CD1 3.65Å; Y587-L591 HydrophobicContact CE1-CD2 4.16Å; Y587-L591 HydrophobicContact CE1-CG 3.91Å; Y587-L591 WeakPolarHBondContact O-CG 3.33Å; Y587-L591 PolarHBondContact O-N 2.92Å; Y587-L616 HydrophobicContact CD2-CD2 3.89Å; Y587-L616 HydrophobicContact CE1-CD2 4.44Å; Y587-L616 HydrophobicContact CE2-CB 4.25Å; Y587-L616 HydrophobicContact CE2-CD1 4.38Å; Y587-L616 HydrophobicContact CE2-CD2 3.7Å; Y587-L616 HydrophobicContact CE2-CG 4.33Å; Y587-L616 HydrophobicContact CG-CD2 4.34Å; Y587-L619 HydrophobicContact CD2-CD2 4Å; Y587-L619 HydrophobicContact CG-CD2 4.34Å; Y587-T797 HydrophobicContact CE2-CG2 4.14Å; Y587-I798 PolarHBondContact OH-N 3.2Å; Y587-I798 VanDerWaalsContact OH-N 3.08Å; Y587-L839 HydrophobicContact CD1-CB 3.94Å; Y587-L839 HydrophobicContact CD1-CD1 3.91Å; Y587-L839 HydrophobicContact CD1-CD2 3.98Å; Y587-L839 HydrophobicContact CD1-CG 4.17Å; Y587-L839 HydrophobicContact CE1-CB 3.76Å; Y587-L839 HydrophobicContact CE1-CD1 3.93Å; Y587-L839 HydrophobicContact CE1-CG 4.3Å; Y587-L839 HydrophobicContact CG-CD1 4.43Å
588	K	88.8	Confident	85.3	Confident	113 Å²	113	54.8 Å²	54.8	49%	0.491	27%	0.266	S	S	.	.	H	α-helix	trans	-59.2	-39.3	176.5	-73	174.5	-179.3	174.5	0	111.8	Q584 K585 C592 L839	Q584-K588 WeakPolarHBondContact O-CB 3.41Å; Q584-K588 WeakPolarHBondContact O-CG 3.48Å; Q584-K588 PolarHBondContact O-N 2.89Å; K585-K588 PolarHBondContact O-N 3.16Å; K588-C592 PolarHBondContact O-N 3.4Å; K588-C592 PolarHBondContact O-SG 3Å; K588-L839 HydrophobicContact CD-CD2 4.4Å; K588-L839 HydrophobicContact CG-CD2 3.72Å
589	H	86.4	Confident	84.4	Confident	67 Å²	67	52.2 Å²	52.2	31%	0.31	25%	0.25	S	S	.	.	H	α-helix	trans	-68	-44.8	177.2	-171	92.6	0	0	0	112.5	K585 L586 Y587 L591 C592 H593 L650	K585-H589 PolarHBondContact O-N 2.85Å; K585-H589 VanDerWaalsContact O-N 3.08Å; L586-H589 PolarHBondContact O-N 2.93Å; Y587-H589 VanDerWaalsContact C-N 3.28Å; Y587-H589 PolarHBondContact O-N 3.48Å; H589-L591 VanDerWaalsContact C-N 3.33Å; H589-L591 PolarHBondContact O-N 2.98Å; H589-C592 PolarHBondContact O-N 3Å; H589-C592 VanDerWaalsContact O-N 3.09Å; H589-H593 PolarHBondContact O-N 3.42Å; H589-L650 HydrophobicContact CB-CD1 3.57Å
590	L	84.8	Confident	83.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-56.5	-46.4	175.6	-77.7	172.1	0	0	0	111.5	L586 Y587 C592 H593 F596 L616 L619 L626 L647	L586-L590 WeakPolarHBondContact O-CG 3.43Å; L586-L590 PolarHBondContact O-N 2.74Å; Y587-L590 PolarHBondContact O-N 2.79Å; L590-C592 PolarHBondContact O-N 2.79Å; L590-H593 WeakPolarHBondContact O-CB 3.41Å; L590-H593 PolarHBondContact O-N 3.49Å; L590-F596 HydrophobicContact CB-CE2 4.06Å; L590-F596 HydrophobicContact CB-CZ 4.33Å; L590-F596 HydrophobicContact CD2-CE2 4.1Å; L590-F596 WeakPolarHBondContact O-CB 3.01Å; L590-F596 WeakPolarHBondContact O-CD2 3.37Å; L590-F596 VanDerWaalsContact O-CG 3.26Å; L590-F596 WeakPolarHBondContact O-CG 3.38Å; L590-L616 HydrophobicContact CB-CD2 4.22Å; L590-L616 HydrophobicContact CD1-CD2 3.96Å; L590-L619 HydrophobicContact CD1-CD2 3.78Å; L590-L626 HydrophobicContact CD1-CD2 4.13Å; L590-L647 HydrophobicContact CD2-CD1 3.5Å; L590-L647 HydrophobicContact CD2-CD2 3.78Å; L590-L647 HydrophobicContact CD2-CG 4.2Å; L590-L647 HydrophobicContact CG-CD1 4.47Å; L590-L647 HydrophobicContact CG-CD2 3.99Å
591	L	85.5	Confident	82.5	Confident	33 Å²	33	59.5 Å²	59.5	17%	0.173	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-31.9	177.6	-68.3	-172.9	0	0	0	113.4	Y587 H589 H593 F596 L616 F837 L839	Y587-L591 HydrophobicContact CD1-CD1 3.8Å; Y587-L591 HydrophobicContact CD1-CG 3.94Å; Y587-L591 HydrophobicContact CE1-CD1 3.65Å; Y587-L591 HydrophobicContact CE1-CD2 4.16Å; Y587-L591 HydrophobicContact CE1-CG 3.91Å; Y587-L591 WeakPolarHBondContact O-CG 3.33Å; Y587-L591 PolarHBondContact O-N 2.92Å; H589-L591 VanDerWaalsContact C-N 3.33Å; H589-L591 PolarHBondContact O-N 2.98Å; L591-H593 VanDerWaalsContact C-N 3.29Å; L591-F596 HydrophobicContact CD2-CD1 4.16Å; L591-F596 HydrophobicContact CD2-CE1 4.4Å; L591-L616 HydrophobicContact CD2-CD1 4.45Å; L591-F837 WeakPolarHBondContact CD1-O 3.35Å; L591-F837 HydrophobicContact CD2-CB 4.02Å; L591-F837 WeakPolarHBondContact CD2-O 3.31Å; L591-L839 HydrophobicContact CD1-CB 4.05Å
592	C	83.8	Confident	81.3	Confident	70 Å²	70	57.6 Å²	57.6	47%	0.473	28%	0.28	S	S	.	.	H	α-helix	trans	-77.7	-15	177.2	-67.7	0	0	0	0	113.5	K588 H589 L590 R597	K588-C592 PolarHBondContact O-N 3.4Å; K588-C592 PolarHBondContact O-SG 3Å; H589-C592 PolarHBondContact O-N 3Å; H589-C592 VanDerWaalsContact O-N 3.09Å; L590-C592 PolarHBondContact O-N 2.79Å; C592-R597 PolarHBondContact O-NH1 2.84Å
593	H	82.4	Confident	79.8	Confident	29 Å²	29	64.2 Å²	64.2	13%	0.134	31%	0.308	C	S	.	.	S	Bend	trans	-65.2	146.4	-174.4	-169	-95.1	0	0	0	112	H589 L590 L591 V595 F596 R597 S642	H589-H593 PolarHBondContact O-N 3.42Å; L590-H593 WeakPolarHBondContact O-CB 3.41Å; L590-H593 PolarHBondContact O-N 3.49Å; L591-H593 VanDerWaalsContact C-N 3.29Å; H593-V595 PolarHBondContact ND1-N 2.92Å; H593-V595 PolarHBondContact O-N 2.82Å; H593-V595 VanDerWaalsContact O-N 3.16Å; H593-F596 HydrophobicContact CB-CD2 4.35Å; H593-F596 PolarHBondContact O-N 3.47Å; H593-F596 VanDerWaalsContact O-N 3.08Å; H593-R597 PolarHBondContact O-N 3.07Å; H593-R597 VanDerWaalsContact O-N 3.08Å; H593-S642 PolarHBondContact CE1-O 3.14Å; H593-S642 PolarHBondContact NE2-O 3.47Å
594	R	77.1	Confident	78.4	Confident	218 Å²	218	66.2 Å²	66.2	82%	0.823	32%	0.321	S	S	*	.	H	α-helix	trans	-56.4	-36.7	-173.9	-68.7	-177.4	174.9	-175	-0.5	112.8	R597 A598	R594-R597 PolarHBondContact O-N 3.25Å; R594-A598 WeakPolarHBondContact O-CB 3.47Å; R594-A598 PolarHBondContact O-N 2.87Å
595	V	74.6	Confident	76.8	Confident	31 Å²	31	71 Å²	71	19%	0.188	34%	0.344	C	S	.	.	H	α-helix	trans	-68.6	-39.8	179.8	-179.5	0	0	0	0	111.9	H593 A598 C599 L643	H593-V595 PolarHBondContact ND1-N 2.92Å; H593-V595 PolarHBondContact O-N 2.82Å; H593-V595 VanDerWaalsContact O-N 3.16Å; V595-A598 PolarHBondContact O-N 3.05Å; V595-C599 PolarHBondContact O-N 2.96Å; V595-C599 PolarHBondContact O-SG 2.86Å; V595-L643 HydrophobicContact CB-CD1 3.72Å; V595-L643 HydrophobicContact CG1-CD1 3.75Å; V595-L643 HydrophobicContact CG2-CD1 4.34Å
596	F	77.5	Confident	75.5	Confident	1 Å²	1	65.8 Å²	65.8	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-66.1	-42	174.6	-85.1	-95.7	0	0	0	111.1	L590 L591 H593 A598 C599 L600 C612 L616 L643 F837	L590-F596 HydrophobicContact CB-CE2 4.06Å; L590-F596 HydrophobicContact CB-CZ 4.33Å; L590-F596 HydrophobicContact CD2-CE2 4.1Å; L590-F596 WeakPolarHBondContact O-CB 3.01Å; L590-F596 WeakPolarHBondContact O-CD2 3.37Å; L590-F596 VanDerWaalsContact O-CG 3.26Å; L590-F596 WeakPolarHBondContact O-CG 3.38Å; L591-F596 HydrophobicContact CD2-CD1 4.16Å; L591-F596 HydrophobicContact CD2-CE1 4.4Å; H593-F596 HydrophobicContact CB-CD2 4.35Å; H593-F596 PolarHBondContact O-N 3.47Å; H593-F596 VanDerWaalsContact O-N 3.08Å; F596-A598 PolarHBondContact O-N 3.28Å; F596-C599 WeakPolarHBondContact O-CB 3.31Å; F596-C599 PolarHBondContact O-N 3.01Å; F596-L600 WeakPolarHBondContact O-CG 3.22Å; F596-L600 PolarHBondContact O-N 2.94Å; F596-C612 HydrophobicContact CD1-CB 4.11Å; F596-C612 HydrophobicContact CE1-CB 3.56Å; F596-C612 HydrophobicContact CE2-CB 4.14Å; F596-C612 HydrophobicContact CZ-CB 3.58Å; F596-L616 HydrophobicContact CE1-CD1 3.76Å; F596-L616 HydrophobicContact CE1-CD2 4.15Å; F596-L616 HydrophobicContact CE1-CG 3.87Å; F596-L616 HydrophobicContact CZ-CD1 4.31Å; F596-L616 HydrophobicContact CZ-CD2 4.03Å; F596-L616 HydrophobicContact CZ-CG 3.9Å; F596-L643 HydrophobicContact CD2-CD1 3.92Å; F596-L643 HydrophobicContact CE2-CD1 3.71Å; F596-F837 HydrophobicContact CD1-CD1 4.48Å; F596-F837 HydrophobicContact CD1-CG 4.41Å; F596-F837 HydrophobicContact CE1-CD1 4.25Å; F596-F837 HydrophobicContact CE1-CE1 4.3Å
597	R	77.9	Confident	74.5	Confident	144 Å²	144	70.2 Å²	70.2	54%	0.543	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-40.4	174.7	-73.6	-176.6	158.7	152.6	-6.7	112.9	C592 H593 R594 C599 L600 Q601	C592-R597 PolarHBondContact O-NH1 2.84Å; H593-R597 PolarHBondContact O-N 3.07Å; H593-R597 VanDerWaalsContact O-N 3.08Å; R594-R597 PolarHBondContact O-N 3.25Å; R597-C599 VanDerWaalsContact C-N 3.31Å; R597-C599 PolarHBondContact O-N 3Å; R597-L600 PolarHBondContact O-N 2.79Å; R597-Q601 WeakPolarHBondContact O-CG 3.49Å; R597-Q601 PolarHBondContact O-N 3.39Å; R597-Q601 VanDerWaalsContact O-N 3.11Å
598	A	73.8	Confident	73.6	Confident	26 Å²	26	71.2 Å²	71.2	22%	0.215	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-33.8	174.6	0	0	0	0	0	112.4	R594 V595 F596 G602 F603 T604	R594-A598 WeakPolarHBondContact O-CB 3.47Å; R594-A598 PolarHBondContact O-N 2.87Å; V595-A598 PolarHBondContact O-N 3.05Å; F596-A598 PolarHBondContact O-N 3.28Å; A598-G602 PolarHBondContact O-N 3.01Å; A598-F603 PolarHBondContact O-N 2.91Å; A598-T604 HydrophobicContact CB-CG2 4.14Å; A598-T604 PolarHBondContact O-OG1 2.83Å
599	C	71.8	Confident	73.1	Confident	1 Å²	1	67 Å²	67	1%	0.007	35%	0.353	C	S	.	.	H	α-helix	trans	-64.7	-41.8	172.2	-73.1	0	0	0	0	112	V595 F596 R597 Q601 G602 T604 H609 F837	V595-C599 PolarHBondContact O-N 2.96Å; V595-C599 PolarHBondContact O-SG 2.86Å; F596-C599 WeakPolarHBondContact O-CB 3.31Å; F596-C599 PolarHBondContact O-N 3.01Å; R597-C599 VanDerWaalsContact C-N 3.31Å; R597-C599 PolarHBondContact O-N 3Å; C599-Q601 VanDerWaalsContact C-N 3.32Å; C599-Q601 PolarHBondContact O-N 3.48Å; C599-G602 PolarHBondContact O-N 3.35Å; C599-T604 WeakPolarHBondContact CA-OG1 3.43Å; C599-H609 WeakPolarHBondContact CB-ND1 3.36Å; C599-H609 PolarHBondContact O-CE1 3.1Å; C599-H609 PolarHBondContact SG-ND1 2.86Å; C599-H609 VanDerWaalsContact SG-ND1 3.38Å; C599-F837 HydrophobicContact CB-CE2 4.39Å
600	L	71.9	Confident	72.8	Confident	50 Å²	50	68.6 Å²	68.6	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-69.7	-27.6	179.8	-70.9	173.5	0	0	0	113.7	F596 R597 R834 F837	F596-L600 WeakPolarHBondContact O-CG 3.22Å; F596-L600 PolarHBondContact O-N 2.94Å; R597-L600 PolarHBondContact O-N 2.79Å; L600-R834 HydrophobicContact CD2-CB 4.34Å; L600-R834 HydrophobicContact CD2-CG 3.75Å; L600-F837 HydrophobicContact CD2-CB 4.23Å; L600-F837 HydrophobicContact CD2-CD2 3.77Å; L600-F837 HydrophobicContact CG-CD2 4.32Å
601	Q	70.6	Confident	72.7	Confident	130 Å²	130	70.5 Å²	70.5	61%	0.607	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.3	-179.7	-68.3	174.9	-11.6	0	0	113.5	R597 C599 F603	R597-Q601 WeakPolarHBondContact O-CG 3.49Å; R597-Q601 PolarHBondContact O-N 3.39Å; R597-Q601 VanDerWaalsContact O-N 3.11Å; C599-Q601 VanDerWaalsContact C-N 3.32Å; C599-Q601 PolarHBondContact O-N 3.48Å; Q601-F603 VanDerWaalsContact C-N 3.33Å; Q601-F603 HydrophobicContact CB-CD2 3.36Å; Q601-F603 HydrophobicContact CB-CE2 3.5Å; Q601-F603 VanDerWaalsContact CB-CE2 3.5Å; Q601-F603 HydrophobicContact CB-CG 4.48Å; Q601-F603 HydrophobicContact CG-CD2 4.46Å; Q601-F603 HydrophobicContact CG-CE2 4.33Å; Q601-F603 PolarHBondContact O-N 3Å
602	G	65.3	Low	72.6	Confident	55 Å²	55	69 Å²	69	57%	0.567	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	14.3	176.5	0	0	0	0	0	115.1	A598 C599	A598-G602 PolarHBondContact O-N 3.01Å; C599-G602 PolarHBondContact O-N 3.35Å
603	F	57.1	Low	72.7	Confident	164 Å²	164	65.9 Å²	65.9	72%	0.719	35%	0.35	S	S	*	.			trans	-86.8	0.2	-176.5	-67.6	-63.9	0	0	0	114.3	A598 Q601	A598-F603 PolarHBondContact O-N 2.91Å; Q601-F603 VanDerWaalsContact C-N 3.33Å; Q601-F603 HydrophobicContact CB-CD2 3.36Å; Q601-F603 HydrophobicContact CB-CE2 3.5Å; Q601-F603 VanDerWaalsContact CB-CE2 3.5Å; Q601-F603 HydrophobicContact CB-CG 4.48Å; Q601-F603 HydrophobicContact CG-CD2 4.46Å; Q601-F603 HydrophobicContact CG-CE2 4.33Å; Q601-F603 PolarHBondContact O-N 3Å
604	T	59.7	Low	72.9	Confident	48 Å²	48	66.9 Å²	66.9	29%	0.294	36%	0.358	S	S	.	.	S	Bend	trans	-125.1	146.5	-173.2	38.3	0	0	0	0	112.4	A598 C599	A598-T604 HydrophobicContact CB-CG2 4.14Å; A598-T604 PolarHBondContact O-OG1 2.83Å; C599-T604 WeakPolarHBondContact CA-OG1 3.43Å
605	Q	57.8	Low	73.4	Confident	162 Å²	162	56.5 Å²	56.5	76%	0.757	32%	0.319	S	S	*	.			trans	-70.3	156	178.2	-64.6	-70.6	-9.9	0	0	111.6	S607 A608	Q605-S607 PolarHBondContact O-N 2.69Å; Q605-A608 PolarHBondContact O-N 3.28Å
606	G	60.8	Low	74.1	Confident	35 Å²	35	55 Å²	55	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-54.7	-22.4	-170.3	0	0	0	0	0	117.6	A608 H609	G606-A608 VanDerWaalsContact C-N 3.33Å; G606-A608 PolarHBondContact O-N 2.78Å; G606-H609 PolarHBondContact O-N 2.78Å
607	S	66.9	Low	74.8	Confident	93 Å²	93	55.1 Å²	55.1	65%	0.65	31%	0.31	S	S	*	.	H	α-helix	trans	-65.9	-32.2	176.5	56.9	0	0	0	0	113.4	Q605 L610 A611	Q605-S607 PolarHBondContact O-N 2.69Å; S607-L610 PolarHBondContact O-N 3.49Å; S607-A611 PolarHBondContact O-N 3.01Å
608	A	72.1	Confident	75.3	Confident	26 Å²	26	49.4 Å²	49.4	22%	0.215	29%	0.29	C	S	.	.	H	α-helix	trans	-69.5	-36	179.3	0	0	0	0	0	112.2	Q605 G606 A611 C612	Q605-A608 PolarHBondContact O-N 3.28Å; G606-A608 VanDerWaalsContact C-N 3.33Å; G606-A608 PolarHBondContact O-N 2.78Å; A608-A611 PolarHBondContact O-N 2.79Å; A608-C612 PolarHBondContact O-N 3.16Å; A608-C612 VanDerWaalsContact O-N 3.07Å; A608-C612 PolarHBondContact O-SG 3.12Å
609	H	77.4	Confident	76.2	Confident	24 Å²	24	48.2 Å²	48.2	11%	0.111	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-44.1	176.7	-57.3	-41.9	0	0	0	111.7	C599 G606 A611 C612 I613	C599-H609 WeakPolarHBondContact CB-ND1 3.36Å; C599-H609 PolarHBondContact O-CE1 3.1Å; C599-H609 PolarHBondContact SG-ND1 2.86Å; C599-H609 VanDerWaalsContact SG-ND1 3.38Å; G606-H609 PolarHBondContact O-N 2.78Å; H609-A611 VanDerWaalsContact C-N 3.33Å; H609-A611 PolarHBondContact O-N 3.28Å; H609-C612 PolarHBondContact O-N 3.37Å; H609-I613 VanDerWaalsContact O-CG1 3.28Å; H609-I613 WeakPolarHBondContact O-CG1 3.46Å; H609-I613 PolarHBondContact O-N 3.2Å
610	L	80.9	Confident	77.1	Confident	101 Å²	101	48.3 Å²	48.3	53%	0.529	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-36.8	178.2	-66.3	177.1	0	0	0	112.3	S607 T614	S607-L610 PolarHBondContact O-N 3.49Å; L610-T614 WeakPolarHBondContact O-CB 3.43Å; L610-T614 PolarHBondContact O-N 3.41Å; L610-T614 PolarHBondContact O-OG1 3.05Å
611	A	80.8	Confident	78	Confident	40 Å²	40	46 Å²	46	33%	0.331	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-44.5	174.6	0	0	0	0	0	111.7	S607 A608 H609 T614 A615 L643	S607-A611 PolarHBondContact O-N 3.01Å; A608-A611 PolarHBondContact O-N 2.79Å; H609-A611 VanDerWaalsContact C-N 3.33Å; H609-A611 PolarHBondContact O-N 3.28Å; A611-T614 PolarHBondContact O-N 3.43Å; A611-A615 PolarHBondContact O-N 3.21Å; A611-L643 HydrophobicContact CB-CD2 4.4Å
612	C	83.4	Confident	79	Confident	0 Å²	0	40 Å²	40	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-47.2	176.4	-67.5	0	0	0	0	112.1	F596 A608 H609 T614 A615 L616 F837	F596-C612 HydrophobicContact CD1-CB 4.11Å; F596-C612 HydrophobicContact CE1-CB 3.56Å; F596-C612 HydrophobicContact CE2-CB 4.14Å; F596-C612 HydrophobicContact CZ-CB 3.58Å; A608-C612 PolarHBondContact O-N 3.16Å; A608-C612 VanDerWaalsContact O-N 3.07Å; A608-C612 PolarHBondContact O-SG 3.12Å; H609-C612 PolarHBondContact O-N 3.37Å; C612-T614 VanDerWaalsContact C-N 3.31Å; C612-T614 PolarHBondContact O-N 3.33Å; C612-A615 PolarHBondContact O-N 3.08Å; C612-L616 PolarHBondContact O-N 2.83Å; C612-F837 HydrophobicContact CB-CE1 4.41Å; C612-F837 HydrophobicContact CB-CZ 4.09Å
613	I	87	Confident	80.1	Confident	5 Å²	5	37.4 Å²	37.4	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-57.5	-46.3	174.9	-70.3	167.9	0	0	0	110.5	H609 A615 L616 K617 W766 I798 F828 L836 F837	H609-I613 VanDerWaalsContact O-CG1 3.28Å; H609-I613 WeakPolarHBondContact O-CG1 3.46Å; H609-I613 PolarHBondContact O-N 3.2Å; I613-A615 VanDerWaalsContact C-N 3.33Å; I613-A615 PolarHBondContact O-N 2.88Å; I613-L616 PolarHBondContact O-N 3.33Å; I613-K617 HydrophobicContact CG2-CD 4.27Å; I613-K617 HydrophobicContact CG2-CG 4.46Å; I613-K617 WeakPolarHBondContact O-CG 3.49Å; I613-K617 PolarHBondContact O-N 3.27Å; I613-W766 HydrophobicContact CD1-CZ2 4.17Å; I613-W766 HydrophobicContact CG2-CZ2 3.94Å; I613-I798 HydrophobicContact CB-CD1 4.26Å; I613-I798 HydrophobicContact CG1-CD1 4.09Å; I613-I798 HydrophobicContact CG2-CD1 3.97Å; I613-F828 HydrophobicContact CD1-CE2 4.02Å; I613-F828 HydrophobicContact CD1-CZ 4.46Å; I613-L836 HydrophobicContact CD1-CD2 3.86Å; I613-L836 HydrophobicContact CG1-CD2 3.7Å; I613-F837 HydrophobicContact CG1-CE1 3.68Å; I613-F837 HydrophobicContact CG1-CZ 3.85Å
614	T	87.1	Confident	81.4	Confident	51 Å²	51	30 Å²	30	31%	0.313	18%	0.183	S	C	.	.	H	α-helix	trans	-63.2	-40	-179.6	-58.7	0	0	0	0	111.6	L610 A611 C612 K617 K618	L610-T614 WeakPolarHBondContact O-CB 3.43Å; L610-T614 PolarHBondContact O-N 3.41Å; L610-T614 PolarHBondContact O-OG1 3.05Å; A611-T614 PolarHBondContact O-N 3.43Å; C612-T614 VanDerWaalsContact C-N 3.31Å; C612-T614 PolarHBondContact O-N 3.33Å; T614-K617 PolarHBondContact O-N 2.52Å; T614-K618 HydrophobicContact CG2-CD 4.49Å; T614-K618 WeakPolarHBondContact O-CB 3.07Å; T614-K618 WeakPolarHBondContact O-CG 3.18Å; T614-K618 PolarHBondContact O-N 3.12Å
615	A	86.9	Confident	82.6	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.1	-44.8	176.3	0	0	0	0	0	112.1	A611 C612 I613 K618 L619 Y644	A611-A615 PolarHBondContact O-N 3.21Å; C612-A615 PolarHBondContact O-N 3.08Å; I613-A615 VanDerWaalsContact C-N 3.33Å; I613-A615 PolarHBondContact O-N 2.88Å; A615-K618 PolarHBondContact O-N 2.77Å; A615-L619 PolarHBondContact O-N 3.14Å; A615-Y644 HydrophobicContact CB-CE1 4.33Å
616	L	89.8	Confident	83.9	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-42.4	176.5	-65.3	-179.8	0	0	0	112	Y587 L590 L591 F596 C612 I613 K618 L619 C620 I798 F837	Y587-L616 HydrophobicContact CD2-CD2 3.89Å; Y587-L616 HydrophobicContact CE1-CD2 4.44Å; Y587-L616 HydrophobicContact CE2-CB 4.25Å; Y587-L616 HydrophobicContact CE2-CD1 4.38Å; Y587-L616 HydrophobicContact CE2-CD2 3.7Å; Y587-L616 HydrophobicContact CE2-CG 4.33Å; Y587-L616 HydrophobicContact CG-CD2 4.34Å; L590-L616 HydrophobicContact CB-CD2 4.22Å; L590-L616 HydrophobicContact CD1-CD2 3.96Å; L591-L616 HydrophobicContact CD2-CD1 4.45Å; F596-L616 HydrophobicContact CE1-CD1 3.76Å; F596-L616 HydrophobicContact CE1-CD2 4.15Å; F596-L616 HydrophobicContact CE1-CG 3.87Å; F596-L616 HydrophobicContact CZ-CD1 4.31Å; F596-L616 HydrophobicContact CZ-CD2 4.03Å; F596-L616 HydrophobicContact CZ-CG 3.9Å; C612-L616 PolarHBondContact O-N 2.83Å; I613-L616 PolarHBondContact O-N 3.33Å; L616-K618 PolarHBondContact O-N 3.34Å; L616-L619 PolarHBondContact O-N 3.08Å; L616-C620 PolarHBondContact O-N 3.43Å; L616-C620 PolarHBondContact O-SG 3.11Å; L616-I798 HydrophobicContact CB-CD1 4.33Å; L616-I798 HydrophobicContact CB-CG2 3.87Å; L616-I798 HydrophobicContact CD1-CB 4.46Å; L616-I798 HydrophobicContact CD1-CD1 4.09Å; L616-F837 HydrophobicContact CD1-CD1 3.68Å; L616-F837 HydrophobicContact CD1-CE1 4.08Å
617	K	91.1	Very high	84.9	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.009	13%	0.126	C	C	.	.	H	α-helix	trans	-61.6	-42.2	175.3	-71.8	-169.8	73.1	176.6	0	112.1	I613 T614 L619 C620 N621 Y693 I764 I802	I613-K617 HydrophobicContact CG2-CD 4.27Å; I613-K617 HydrophobicContact CG2-CG 4.46Å; I613-K617 WeakPolarHBondContact O-CG 3.49Å; I613-K617 PolarHBondContact O-N 3.27Å; T614-K617 PolarHBondContact O-N 2.52Å; K617-L619 VanDerWaalsContact C-N 3.34Å; K617-L619 PolarHBondContact O-N 3.01Å; K617-C620 PolarHBondContact O-N 3.1Å; K617-N621 PolarHBondContact O-N 3.41Å; K617-N621 VanDerWaalsContact O-N 3.08Å; K617-Y693 WeakPolarHBondContact CD-OH 3.39Å; K617-Y693 WeakPolarHBondContact CE-OH 3.15Å; K617-Y693 PolarHBondContact NZ-OH 2.52Å; K617-Y693 VanDerWaalsContact NZ-OH 3.15Å; K617-I764 PolarHBondContact NZ-O 3.13Å; K617-I802 HydrophobicContact CD-CD1 4.13Å
618	K	90.1	Very high	85.6	Confident	25 Å²	25	18.9 Å²	18.9	11%	0.109	11%	0.11	C	C	.	.	H	α-helix	trans	-59.6	-44.3	174.5	-78.4	-179.1	168.1	-162.8	0	111.7	T614 A615 L616 N621 H622 L625 T629	T614-K618 HydrophobicContact CG2-CD 4.49Å; T614-K618 WeakPolarHBondContact O-CB 3.07Å; T614-K618 WeakPolarHBondContact O-CG 3.18Å; T614-K618 PolarHBondContact O-N 3.12Å; A615-K618 PolarHBondContact O-N 2.77Å; L616-K618 PolarHBondContact O-N 3.34Å; K618-N621 WeakPolarHBondContact O-CB 3.43Å; K618-N621 PolarHBondContact O-N 3.47Å; K618-H622 PolarHBondContact O-N 2.76Å; K618-H622 VanDerWaalsContact O-O 3.05Å; K618-L625 HydrophobicContact CB-CB 4.36Å; K618-T629 PolarHBondContact NZ-OG1 3.25Å
619	L	90.8	Very high	86	Confident	1 Å²	1	18.1 Å²	18.1	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-63.2	-41.7	177.9	179.2	61.3	0	0	0	112.5	Q583 L586 Y587 L590 A615 L616 K617 N621 P623 L626	Q583-L619 HydrophobicContact CG-CD1 4.34Å; Q583-L619 PolarHBondContact NE2-O 2.82Å; L586-L619 HydrophobicContact CB-CD1 3.84Å; L586-L619 HydrophobicContact CB-CD2 3.83Å; L586-L619 HydrophobicContact CD1-CD1 3.74Å; L586-L619 HydrophobicContact CG-CD1 4.46Å; Y587-L619 HydrophobicContact CD2-CD2 4Å; Y587-L619 HydrophobicContact CG-CD2 4.34Å; L590-L619 HydrophobicContact CD1-CD2 3.78Å; A615-L619 PolarHBondContact O-N 3.14Å; L616-L619 PolarHBondContact O-N 3.08Å; K617-L619 VanDerWaalsContact C-N 3.34Å; K617-L619 PolarHBondContact O-N 3.01Å; L619-N621 VanDerWaalsContact C-N 3.28Å; L619-N621 PolarHBondContact O-N 2.96Å; L619-P623 HydrophobicContact CD1-CB 4.38Å; L619-P623 HydrophobicContact CD1-CG 4.35Å; L619-L626 HydrophobicContact CD1-CD2 4.24Å
620	C	91.4	Very high	86	Confident	3 Å²	3	17.5 Å²	17.5	2%	0.02	10%	0.1	C	C	.	.	H	α-helix	trans	-62.7	-36.5	176.6	-63.2	0	0	0	0	111.7	Q583 L616 K617 E799	Q583-C620 PolarHBondContact NE2-O 2.85Å; Q583-C620 VanDerWaalsContact NE2-O 3.16Å; L616-C620 PolarHBondContact O-N 3.43Å; L616-C620 PolarHBondContact O-SG 3.11Å; K617-C620 PolarHBondContact O-N 3.1Å; C620-E799 HydrophobicContact CB-CG 4.12Å
621	N	91.3	Very high	85.8	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-67.5	-58.1	174.4	-73.8	-15.3	0	0	0	112	K617 K618 L619 L625 S665 T696 Y762	K617-N621 PolarHBondContact O-N 3.41Å; K617-N621 VanDerWaalsContact O-N 3.08Å; K618-N621 WeakPolarHBondContact O-CB 3.43Å; K618-N621 PolarHBondContact O-N 3.47Å; L619-N621 VanDerWaalsContact C-N 3.28Å; L619-N621 PolarHBondContact O-N 2.96Å; N621-L625 HydrophobicContact CB-CD1 3.86Å; N621-S665 PolarHBondContact O-OG 2.91Å; N621-T696 PolarHBondContact ND2-OG1 3.18Å; N621-T696 VanDerWaalsContact ND2-OG1 3.13Å; N621-Y762 HydrophobicContact CB-CE1 3.96Å; N621-Y762 PolarHBondContact O-OH 3.34Å
622	H	90.8	Very high	85.5	Confident	5 Å²	5	20.5 Å²	20.5	2%	0.023	10%	0.103	C	C	.	.			trans	-166.1	136.3	176.5	-166.3	-95.2	0	0	0	111.8	K618 G624 L625 L699	K618-H622 PolarHBondContact O-N 2.76Å; K618-H622 VanDerWaalsContact O-O 3.05Å; H622-G624 WeakPolarHBondContact ND1-CA 3.46Å; H622-G624 PolarHBondContact ND1-N 3.41Å; H622-G624 PolarHBondContact O-N 3.45Å; H622-L625 HydrophobicContact CB-CD1 4.34Å; H622-L625 HydrophobicContact CB-CG 4.26Å; H622-L625 PolarHBondContact O-N 2.7Å; H622-L699 HydrophobicContact CB-CD1 3.62Å
623	P	88.3	Confident	84.9	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56.2	-33.2	176.5	-26.4	35.3	0	0	0	114.4	L582 Q583 L586 L619 L625 L626 H627 F651 D664	L582-P623 HydrophobicContact CD2-CB 4.08Å; L582-P623 HydrophobicContact CD2-CG 4.2Å; L582-P623 HydrophobicContact CG-CB 4.48Å; L582-P623 HydrophobicContact CG-CG 4.41Å; Q583-P623 HydrophobicContact CG-CG 3.66Å; L586-P623 HydrophobicContact CD1-CB 4.05Å; L619-P623 HydrophobicContact CD1-CB 4.38Å; L619-P623 HydrophobicContact CD1-CG 4.35Å; P623-L625 VanDerWaalsContact C-N 3.29Å; P623-L625 PolarHBondContact O-N 3.21Å; P623-L626 WeakPolarHBondContact O-CB 3.35Å; P623-L626 PolarHBondContact O-N 3.34Å; P623-H627 PolarHBondContact O-N 3.32Å; P623-F651 HydrophobicContact CB-CE1 4.04Å; P623-D664 WeakPolarHBondContact CD-O 3.36Å; P623-D664 HydrophobicContact CG-CB 4.4Å; P623-D664 VanDerWaalsContact CG-O 3.31Å; P623-D664 WeakPolarHBondContact CG-O 3.44Å
624	G	84.9	Confident	84	Confident	8 Å²	8	32.1 Å²	32.1	8%	0.082	15%	0.152	C	C	.	.	H	α-helix	trans	-58.9	-35.4	178.5	0	0	0	0	0	114	H622 L626 H627 D628 Y655	H622-G624 WeakPolarHBondContact ND1-CA 3.46Å; H622-G624 PolarHBondContact ND1-N 3.41Å; H622-G624 PolarHBondContact O-N 3.45Å; G624-L626 PolarHBondContact O-N 2.93Å; G624-H627 WeakPolarHBondContact O-CB 3.12Å; G624-H627 PolarHBondContact O-N 2.93Å; G624-D628 PolarHBondContact O-N 2.72Å; G624-Y655 WeakPolarHBondContact CA-OH 3.44Å; G624-Y655 PolarHBondContact N-OH 2.71Å
625	L	85.6	Confident	82.9	Confident	11 Å²	11	36.3 Å²	36.3	6%	0.058	17%	0.167	C	C	.	.	H	α-helix	trans	-64.6	-33.3	177	-62.8	175	0	0	0	111.9	K618 N621 H622 P623 T629 Q695 L699	K618-L625 HydrophobicContact CB-CB 4.36Å; N621-L625 HydrophobicContact CB-CD1 3.86Å; H622-L625 HydrophobicContact CB-CD1 4.34Å; H622-L625 HydrophobicContact CB-CG 4.26Å; H622-L625 PolarHBondContact O-N 2.7Å; P623-L625 VanDerWaalsContact C-N 3.29Å; P623-L625 PolarHBondContact O-N 3.21Å; L625-T629 PolarHBondContact O-N 2.96Å; L625-T629 PolarHBondContact O-OG1 3.08Å; L625-Q695 HydrophobicContact CD2-CB 4.01Å; L625-L699 HydrophobicContact CD2-CD1 4.29Å; L625-L699 HydrophobicContact CG-CD1 4.27Å
626	L	84.6	Confident	81.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-72.8	-45.5	174.6	-174	65.4	0	0	0	110.2	L590 L619 P623 G624 D628 T629 V630 Y644 L647	L590-L626 HydrophobicContact CD1-CD2 4.13Å; L619-L626 HydrophobicContact CD1-CD2 4.24Å; P623-L626 WeakPolarHBondContact O-CB 3.35Å; P623-L626 PolarHBondContact O-N 3.34Å; G624-L626 PolarHBondContact O-N 2.93Å; L626-D628 PolarHBondContact O-N 3.03Å; L626-T629 WeakPolarHBondContact O-CB 3.37Å; L626-T629 PolarHBondContact O-N 3.3Å; L626-V630 HydrophobicContact CG-CG2 4.42Å; L626-V630 WeakPolarHBondContact O-CG2 3.47Å; L626-V630 PolarHBondContact O-N 2.94Å; L626-Y644 HydrophobicContact CD1-CD1 3.98Å; L626-Y644 HydrophobicContact CD1-CE1 3.6Å; L626-L647 HydrophobicContact CD2-CD1 4.43Å
627	H	82.4	Confident	79.8	Confident	34 Å²	34	49.1 Å²	49.1	16%	0.157	24%	0.238	C	C	.	.	H	α-helix	trans	-57.1	-47.2	177.4	-180	-97.4	0	0	0	112.6	P623 G624 T629 V630 K631 F651 Y655 S657	P623-H627 PolarHBondContact O-N 3.32Å; G624-H627 WeakPolarHBondContact O-CB 3.12Å; G624-H627 PolarHBondContact O-N 2.93Å; H627-T629 VanDerWaalsContact C-N 3.31Å; H627-T629 PolarHBondContact O-N 3.21Å; H627-V630 WeakPolarHBondContact O-CB 3.27Å; H627-V630 PolarHBondContact O-N 3.25Å; H627-V630 VanDerWaalsContact O-N 3.15Å; H627-K631 PolarHBondContact O-N 3.45Å; H627-F651 HydrophobicContact CB-CD1 4.31Å; H627-F651 HydrophobicContact CB-CE1 3.83Å; H627-F651 HydrophobicContact CB-CE2 4.27Å; H627-F651 HydrophobicContact CB-CZ 3.82Å; H627-F651 AromaticContact CD2-CD2 3.99Å; H627-F651 AromaticContact CD2-CG 3.94Å; H627-Y655 HydrophobicContact CB-CD1 4.46Å; H627-Y655 HydrophobicContact CB-CE1 3.97Å; H627-S657 PolarHBondContact ND1-OG 3.15Å; H627-S657 VanDerWaalsContact ND1-OG 3.1Å
628	D	80.8	Confident	77.9	Confident	60 Å²	60	51.4 Å²	51.4	32%	0.321	25%	0.254	S	S	.	.	H	α-helix	trans	-62.1	-41.4	177.8	-67.4	-21.5	0	0	0	111.5	G624 L626 V630 K631 E632 S657	G624-D628 PolarHBondContact O-N 2.72Å; L626-D628 PolarHBondContact O-N 3.03Å; D628-V630 VanDerWaalsContact C-N 3.33Å; D628-V630 PolarHBondContact O-N 2.81Å; D628-K631 PolarHBondContact O-N 2.61Å; D628-E632 WeakPolarHBondContact O-CB 3.38Å; D628-E632 WeakPolarHBondContact O-CG 3.48Å; D628-E632 PolarHBondContact O-N 3.09Å; D628-S657 WeakPolarHBondContact OD1-CB 3.25Å; D628-S657 PolarHBondContact OD1-OG 3.34Å
629	T	79.9	Confident	75.9	Confident	9 Å²	9	57.3 Å²	57.3	6%	0.055	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-41.7	175.4	-54.6	0	0	0	0	111.1	K618 L625 L626 H627 R633 Y644	K618-T629 PolarHBondContact NZ-OG1 3.25Å; L625-T629 PolarHBondContact O-N 2.96Å; L625-T629 PolarHBondContact O-OG1 3.08Å; L626-T629 WeakPolarHBondContact O-CB 3.37Å; L626-T629 PolarHBondContact O-N 3.3Å; H627-T629 VanDerWaalsContact C-N 3.31Å; H627-T629 PolarHBondContact O-N 3.21Å; T629-R633 HydrophobicContact CG2-CG 4.43Å; T629-R633 WeakPolarHBondContact O-CB 3.47Å; T629-R633 WeakPolarHBondContact O-CG 3.38Å; T629-R633 PolarHBondContact O-N 3.47Å; T629-R633 VanDerWaalsContact O-N 3.15Å; T629-Y644 HydrophobicContact CG2-CE1 4.33Å
630	V	78.3	Confident	73.9	Confident	11 Å²	11	63.3 Å²	63.3	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-63.7	-44.9	177.6	174.3	0	0	0	0	110.4	L626 H627 D628 R633 K634 Y644 L647 A648	L626-V630 HydrophobicContact CG-CG2 4.42Å; L626-V630 WeakPolarHBondContact O-CG2 3.47Å; L626-V630 PolarHBondContact O-N 2.94Å; H627-V630 WeakPolarHBondContact O-CB 3.27Å; H627-V630 PolarHBondContact O-N 3.25Å; H627-V630 VanDerWaalsContact O-N 3.15Å; D628-V630 VanDerWaalsContact C-N 3.33Å; D628-V630 PolarHBondContact O-N 2.81Å; V630-R633 PolarHBondContact O-N 3.35Å; V630-K634 WeakPolarHBondContact O-CB 3.35Å; V630-K634 PolarHBondContact O-N 3.27Å; V630-Y644 HydrophobicContact CG2-CD1 3.82Å; V630-Y644 HydrophobicContact CG2-CG 4.24Å; V630-L647 HydrophobicContact CG2-CB 4.36Å; V630-L647 HydrophobicContact CG2-CD1 4.45Å; V630-A648 HydrophobicContact CG1-CB 4.08Å
631	K	76.1	Confident	72.2	Confident	107 Å²	107	65.1 Å²	65.1	47%	0.465	33%	0.333	S	S	.	.	H	α-helix	trans	-63.9	-50.8	179.9	-172.4	179.8	177.2	-175.6	0	112.2	H627 D628 R633 K634 E635	H627-K631 PolarHBondContact O-N 3.45Å; D628-K631 PolarHBondContact O-N 2.61Å; K631-R633 PolarHBondContact O-N 3.42Å; K631-K634 PolarHBondContact O-N 3.15Å; K631-E635 VanDerWaalsContact CE-OE1 3.27Å; K631-E635 WeakPolarHBondContact CE-OE1 3.24Å; K631-E635 WeakPolarHBondContact O-CG 3.05Å; K631-E635 PolarHBondContact O-N 3.43Å; K631-E635 VanDerWaalsContact O-N 3.08Å
632	E	74.3	Confident	70.9	Confident	97 Å²	97	68 Å²	68	45%	0.453	35%	0.352	S	S	.	.	H	α-helix	trans	-58.4	-37.3	177.8	-74.7	-178.1	172.5	0	0	112.4	D628 R636	D628-E632 WeakPolarHBondContact O-CB 3.38Å; D628-E632 WeakPolarHBondContact O-CG 3.48Å; D628-E632 PolarHBondContact O-N 3.09Å; E632-R636 WeakPolarHBondContact O-CB 3.4Å; E632-R636 WeakPolarHBondContact O-CG 3.42Å; E632-R636 PolarHBondContact O-N 3.19Å; E632-R636 VanDerWaalsContact O-N 3.14Å
633	R	71.6	Confident	69.6	Low	81 Å²	81	68.3 Å²	68.3	31%	0.306	35%	0.354	S	S	.	.	H	α-helix	trans	-75.2	-37.3	-179.4	-69	-72.2	-176.1	126.7	-6.7	112.2	T629 V630 K631 E635 R636 G637 E640	T629-R633 HydrophobicContact CG2-CG 4.43Å; T629-R633 WeakPolarHBondContact O-CB 3.47Å; T629-R633 WeakPolarHBondContact O-CG 3.38Å; T629-R633 PolarHBondContact O-N 3.47Å; T629-R633 VanDerWaalsContact O-N 3.15Å; V630-R633 PolarHBondContact O-N 3.35Å; K631-R633 PolarHBondContact O-N 3.42Å; R633-E635 VanDerWaalsContact C-N 3.29Å; R633-E635 PolarHBondContact O-N 3.28Å; R633-R636 PolarHBondContact O-N 3.09Å; R633-G637 PolarHBondContact O-N 2.92Å; R633-E640 IonicContact CZ-OE2 3.62Å; R633-E640 IonicContact NH1-OE2 3.96Å; R633-E640 PolarHBondContact NH1-OE2 2.91Å; R633-E640 IonicContact NH2-OE2 3.1Å
634	K	68.2	Low	68.6	Low	169 Å²	169	69.6 Å²	69.6	74%	0.735	36%	0.359	S	S	*	.	H	α-helix	trans	-61.8	-37.8	173	-169.9	174.6	-178.6	176.1	0	111.5	V630 K631	V630-K634 WeakPolarHBondContact O-CB 3.35Å; V630-K634 PolarHBondContact O-N 3.27Å; K631-K634 PolarHBondContact O-N 3.15Å
635	E	63	Low	67.6	Low	138 Å²	138	75.8 Å²	75.8	65%	0.645	39%	0.386	S	S	*	.	H	α-helix	trans	-75.4	-30.7	178.5	-69.9	172.6	-175.5	0	0	113.4	K631 R633	K631-E635 VanDerWaalsContact CE-OE1 3.27Å; K631-E635 WeakPolarHBondContact CE-OE1 3.24Å; K631-E635 WeakPolarHBondContact O-CG 3.05Å; K631-E635 PolarHBondContact O-N 3.43Å; K631-E635 VanDerWaalsContact O-N 3.08Å; R633-E635 VanDerWaalsContact C-N 3.29Å; R633-E635 PolarHBondContact O-N 3.28Å
636	R	59.9	Low	66.5	Low	200 Å²	200	76.7 Å²	76.7	76%	0.755	40%	0.398	S	S	*	.	H	α-helix	trans	-89	-7	-176.2	-72.5	-179.8	-173.4	-119	4.7	116	E632 R633 S638	E632-R636 WeakPolarHBondContact O-CB 3.4Å; E632-R636 WeakPolarHBondContact O-CG 3.42Å; E632-R636 PolarHBondContact O-N 3.19Å; E632-R636 VanDerWaalsContact O-N 3.14Å; R633-R636 PolarHBondContact O-N 3.09Å; R636-S638 PolarHBondContact O-N 2.85Å
637	G	53.4	Low	65.7	Low	70 Å²	70	76.8 Å²	76.8	72%	0.722	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	34	170.4	0	0	0	0	0	116.7	R633	R633-G637 PolarHBondContact O-N 2.92Å
638	S	49.8	Very low	65	Low	50 Å²	50	76.8 Å²	76.8	35%	0.35	41%	0.405	S	S	.	.			trans	-88.5	147.4	-178.8	168.5	0	0	0	0	113.2	R636 E640 S641	R636-S638 PolarHBondContact O-N 2.85Å; S638-E640 PolarHBondContact O-N 2.74Å; S638-E640 VanDerWaalsContact O-N 3.15Å; S638-E640 PolarHBondContact OG-N 3.22Å; S638-S641 WeakPolarHBondContact O-CB 3.18Å; S638-S641 PolarHBondContact O-N 2.65Å; S638-S641 VanDerWaalsContact O-N 3.08Å; S638-S641 PolarHBondContact O-OG 3.37Å
639	V	48.3	Very low	64.4	Low	148 Å²	148	80.6 Å²	80.6	90%	0.897	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-63.3	-15.7	178.2	-175.4	0	0	0	0	113.2	S641	V639-S641 PolarHBondContact O-N 3.02Å
640	E	49.3	Very low	63.9	Low	127 Å²	127	83.5 Å²	83.5	59%	0.593	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-73.6	2.6	170.8	-68.2	-173.9	165.5	0	0	114.1	R633 S638 S642	R633-E640 IonicContact CZ-OE2 3.62Å; R633-E640 IonicContact NH1-OE2 3.96Å; R633-E640 PolarHBondContact NH1-OE2 2.91Å; R633-E640 IonicContact NH2-OE2 3.1Å; S638-E640 PolarHBondContact O-N 2.74Å; S638-E640 VanDerWaalsContact O-N 3.15Å; S638-E640 PolarHBondContact OG-N 3.22Å; E640-S642 PolarHBondContact O-N 2.86Å
641	S	55.5	Low	63.7	Low	42 Å²	42	83.6 Å²	83.6	29%	0.294	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-70.6	-4.7	-175.6	-61.9	0	0	0	0	115.2	S638 V639 L643	S638-S641 WeakPolarHBondContact O-CB 3.18Å; S638-S641 PolarHBondContact O-N 2.65Å; S638-S641 VanDerWaalsContact O-N 3.08Å; S638-S641 PolarHBondContact O-OG 3.37Å; V639-S641 PolarHBondContact O-N 3.02Å; S641-L643 PolarHBondContact O-N 2.88Å
642	S	63.3	Low	63.5	Low	60 Å²	60	81.6 Å²	81.6	42%	0.42	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-69.7	-29.9	-176.7	64.5	0	0	0	0	113.7	H593 E640 Y644	H593-S642 PolarHBondContact CE1-O 3.14Å; H593-S642 PolarHBondContact NE2-O 3.47Å; E640-S642 PolarHBondContact O-N 2.86Å; S642-Y644 VanDerWaalsContact C-N 3.31Å; S642-Y644 PolarHBondContact O-N 3.39Å
643	L	63.7	Low	62.9	Low	12 Å²	12	87 Å²	87	6%	0.063	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-67.6	-30.5	-178	-179.8	65	0	0	0	113.3	V595 F596 A611 S641	V595-L643 HydrophobicContact CB-CD1 3.72Å; V595-L643 HydrophobicContact CG1-CD1 3.75Å; V595-L643 HydrophobicContact CG2-CD1 4.34Å; F596-L643 HydrophobicContact CD2-CD1 3.92Å; F596-L643 HydrophobicContact CE2-CD1 3.71Å; A611-L643 HydrophobicContact CB-CD2 4.4Å; S641-L643 PolarHBondContact O-N 2.88Å
644	Y	67.4	Low	62.3	Low	27 Å²	27	88.3 Å²	88.3	11%	0.106	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-104.1	5.4	-171.4	-61.8	-77.9	0	0	0	113.1	A615 L626 T629 V630 S642 L647	A615-Y644 HydrophobicContact CB-CE1 4.33Å; L626-Y644 HydrophobicContact CD1-CD1 3.98Å; L626-Y644 HydrophobicContact CD1-CE1 3.6Å; T629-Y644 HydrophobicContact CG2-CE1 4.33Å; V630-Y644 HydrophobicContact CG2-CD1 3.82Å; V630-Y644 HydrophobicContact CG2-CG 4.24Å; S642-Y644 VanDerWaalsContact C-N 3.31Å; S642-Y644 PolarHBondContact O-N 3.39Å; Y644-L647 HydrophobicContact CD1-CD1 3.85Å; Y644-L647 PolarHBondContact O-N 2.75Å
645	E	64.9	Low	62.2	Low	138 Å²	138	81.7 Å²	81.7	65%	0.645	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	134.4	178.9	-166.2	173.5	-176.2	0	0	110.6	L647	E645-L647 PolarHBondContact O-N 2.85Å
646	G	61.2	Low	62.1	Low	31 Å²	31	78.5 Å²	78.5	32%	0.32	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	76	-8.8	-178.7	0	0	0	0	0	116.1
647	L	67.6	Low	61.9	Low	1 Å²	1	71.6 Å²	71.6	1%	0.005	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-32	176.4	-71.7	172.7	0	0	0	113	L590 L626 V630 Y644 E645 D649 L650 F651	L590-L647 HydrophobicContact CD2-CD1 3.5Å; L590-L647 HydrophobicContact CD2-CD2 3.78Å; L590-L647 HydrophobicContact CD2-CG 4.2Å; L590-L647 HydrophobicContact CG-CD1 4.47Å; L590-L647 HydrophobicContact CG-CD2 3.99Å; L626-L647 HydrophobicContact CD2-CD1 4.43Å; V630-L647 HydrophobicContact CG2-CB 4.36Å; V630-L647 HydrophobicContact CG2-CD1 4.45Å; Y644-L647 HydrophobicContact CD1-CD1 3.85Å; Y644-L647 PolarHBondContact O-N 2.75Å; E645-L647 PolarHBondContact O-N 2.85Å; L647-D649 PolarHBondContact O-N 2.95Å; L647-L650 HydrophobicContact CD2-CD1 4.29Å; L647-L650 PolarHBondContact O-N 3.27Å; L647-F651 WeakPolarHBondContact O-CD2 3.28Å; L647-F651 WeakPolarHBondContact O-CE2 3.41Å
648	A	68.1	Low	61.9	Low	35 Å²	35	71.6 Å²	71.6	29%	0.289	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-59.7	-33.4	179.6	0	0	0	0	0	112	V630 L650 F651	V630-A648 HydrophobicContact CG1-CB 4.08Å; A648-L650 VanDerWaalsContact C-N 3.25Å; A648-L650 PolarHBondContact O-N 3.3Å; A648-F651 PolarHBondContact O-N 3.39Å
649	D	68.1	Low	62.4	Low	139 Å²	139	71.3 Å²	71.3	74%	0.743	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-77.9	-10.4	-175.5	-51.6	-35.4	0	0	0	113	L647	L647-D649 PolarHBondContact O-N 2.95Å
650	L	69.8	Low	63.2	Low	70 Å²	70	66 Å²	66	37%	0.366	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-91.5	-14.6	177.8	-62.9	172.6	0	0	0	113.2	L586 H589 L647 A648	L586-L650 HydrophobicContact CD2-CB 3.72Å; L586-L650 HydrophobicContact CD2-CD1 4.03Å; H589-L650 HydrophobicContact CB-CD1 3.57Å; L647-L650 HydrophobicContact CD2-CD1 4.29Å; L647-L650 PolarHBondContact O-N 3.27Å; A648-L650 VanDerWaalsContact C-N 3.25Å; A648-L650 PolarHBondContact O-N 3.3Å
651	F	74.6	Confident	64.3	Low	14 Å²	14	63.9 Å²	63.9	6%	0.061	39%	0.385	C	S	.	.	S	Bend	trans	-76.6	139.8	172.2	-70.3	-88.2	0	0	0	109	L586 P623 H627 L647 A648 Y655	L586-F651 HydrophobicContact CD1-CE1 3.8Å; L586-F651 HydrophobicContact CD1-CE2 4.41Å; L586-F651 HydrophobicContact CD1-CZ 3.7Å; L586-F651 HydrophobicContact CD2-CE2 4.11Å; L586-F651 HydrophobicContact CD2-CZ 4.22Å; P623-F651 HydrophobicContact CB-CE1 4.04Å; H627-F651 HydrophobicContact CB-CD1 4.31Å; H627-F651 HydrophobicContact CB-CE1 3.83Å; H627-F651 HydrophobicContact CB-CE2 4.27Å; H627-F651 HydrophobicContact CB-CZ 3.82Å; H627-F651 AromaticContact CD2-CD2 3.99Å; H627-F651 AromaticContact CD2-CG 3.94Å; L647-F651 WeakPolarHBondContact O-CD2 3.28Å; L647-F651 WeakPolarHBondContact O-CE2 3.41Å; A648-F651 PolarHBondContact O-N 3.39Å; F651-Y655 HydrophobicContact CB-CD1 4.43Å; F651-Y655 HydrophobicContact CB-CG 4.37Å; F651-Y655 AromaticContact CD1-CD1 3.65Å; F651-Y655 HydrophobicContact CD1-CD1 3.65Å; F651-Y655 HydrophobicContact CD1-CD2 4.33Å; F651-Y655 AromaticContact CD1-CE1 3.76Å; F651-Y655 HydrophobicContact CD1-CE1 3.76Å; F651-Y655 HydrophobicContact CD1-CE2 4.41Å; F651-Y655 AromaticContact CD1-CG 3.96Å; F651-Y655 HydrophobicContact CD1-CG 3.96Å; F651-Y655 HydrophobicContact CE1-CD1 4.34Å; F651-Y655 HydrophobicContact CE1-CE1 4Å; F651-Y655 HydrophobicContact CG-CD1 4.35Å
652	P	71.9	Confident	65.2	Low	65 Å²	65	62.8 Å²	62.8	42%	0.422	38%	0.379	S	S	.	.			trans	-53.3	143.5	171.6	-23.9	32	0	0	0	111.3	S654 Y655	P652-S654 PolarHBondContact O-N 2.83Å; P652-S654 VanDerWaalsContact O-N 3.09Å; P652-Y655 WeakPolarHBondContact O-CB 3.43Å; P652-Y655 PolarHBondContact O-N 2.82Å
653	E	61.4	Low	66.1	Low	210 Å²	210	62.2 Å²	62.2	98%	0.981	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-23.7	178.8	-65.5	-176.8	173.3	0	0	113	Y655	E653-Y655 VanDerWaalsContact C-N 3.34Å
654	S	59.2	Low	67	Low	108 Å²	108	63 Å²	63	76%	0.755	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-5.6	173.9	56.1	0	0	0	0	114.3	P652 C656	P652-S654 PolarHBondContact O-N 2.83Å; P652-S654 VanDerWaalsContact O-N 3.09Å; S654-C656 PolarHBondContact O-N 3.36Å; S654-C656 VanDerWaalsContact O-N 3.09Å
655	Y	66.1	Low	68.1	Low	30 Å²	30	61.7 Å²	61.7	12%	0.118	38%	0.377	C	S	.	.			trans	-71.9	104.9	-177.1	-164.7	-89.4	0	0	0	109.7	L582 G624 H627 F651 P652 E653 D664	L582-Y655 HydrophobicContact CD2-CD2 4.38Å; L582-Y655 HydrophobicContact CD2-CE2 3.98Å; G624-Y655 WeakPolarHBondContact CA-OH 3.44Å; G624-Y655 PolarHBondContact N-OH 2.71Å; H627-Y655 HydrophobicContact CB-CD1 4.46Å; H627-Y655 HydrophobicContact CB-CE1 3.97Å; F651-Y655 HydrophobicContact CB-CD1 4.43Å; F651-Y655 HydrophobicContact CB-CG 4.37Å; F651-Y655 AromaticContact CD1-CD1 3.65Å; F651-Y655 HydrophobicContact CD1-CD1 3.65Å; F651-Y655 HydrophobicContact CD1-CD2 4.33Å; F651-Y655 AromaticContact CD1-CE1 3.76Å; F651-Y655 HydrophobicContact CD1-CE1 3.76Å; F651-Y655 HydrophobicContact CD1-CE2 4.41Å; F651-Y655 AromaticContact CD1-CG 3.96Å; F651-Y655 HydrophobicContact CD1-CG 3.96Å; F651-Y655 HydrophobicContact CE1-CD1 4.34Å; F651-Y655 HydrophobicContact CE1-CE1 4Å; F651-Y655 HydrophobicContact CG-CD1 4.35Å; P652-Y655 WeakPolarHBondContact O-CB 3.43Å; P652-Y655 PolarHBondContact O-N 2.82Å; E653-Y655 VanDerWaalsContact C-N 3.34Å; Y655-D664 VanDerWaalsContact CE2-OD2 3.29Å; Y655-D664 WeakPolarHBondContact CE2-OD2 3.49Å
656	C	60.8	Low	69.3	Low	72 Å²	72	55.3 Å²	55.3	49%	0.486	35%	0.347	S	S	.	.			trans	-110.6	134	-179.9	-170.5	0	0	0	0	109.2	S654 A658 G659	S654-C656 PolarHBondContact O-N 3.36Å; S654-C656 VanDerWaalsContact O-N 3.09Å; C656-A658 PolarHBondContact O-N 2.81Å; C656-G659 CarbonylContact O-C 3.54Å; C656-G659 WeakPolarHBondContact O-CA 3.28Å; C656-G659 PolarHBondContact O-N 3.19Å
657	S	56	Low	70.8	Confident	55 Å²	55	53.8 Å²	53.8	39%	0.385	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.6	172.3	-56.5	0	0	0	0	113.2	H627 D628	H627-S657 PolarHBondContact ND1-OG 3.15Å; H627-S657 VanDerWaalsContact ND1-OG 3.1Å; D628-S657 WeakPolarHBondContact OD1-CB 3.25Å; D628-S657 PolarHBondContact OD1-OG 3.34Å
658	A	53.2	Low	71.9	Confident	70 Å²	70	53.8 Å²	53.8	58%	0.579	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-20.4	173.6	0	0	0	0	0	113.8	C656 F660 R706	C656-A658 PolarHBondContact O-N 2.81Å; A658-F660 VanDerWaalsContact C-N 3.35Å; A658-F660 PolarHBondContact O-N 2.83Å; A658-R706 PolarHBondContact O-NH2 3.03Å
659	G	59.7	Low	73	Confident	43 Å²	43	53.9 Å²	53.9	44%	0.443	33%	0.327	S	S	.	.			trans	-86.7	71.5	174.7	0	0	0	0	0	110.4	C656 D661	C656-G659 CarbonylContact O-C 3.54Å; C656-G659 WeakPolarHBondContact O-CA 3.28Å; C656-G659 PolarHBondContact O-N 3.19Å; G659-D661 PolarHBondContact O-N 2.64Å
660	F	65.1	Low	74.2	Confident	36 Å²	36	47.2 Å²	47.2	16%	0.158	29%	0.292	C	S	.	.			trans	-67.2	114.4	173.1	172.5	-87	0	0	0	109.8	A658 L668 L699 L703 R706	A658-F660 VanDerWaalsContact C-N 3.35Å; A658-F660 PolarHBondContact O-N 2.83Å; F660-L668 HydrophobicContact CE1-CD2 4.38Å; F660-L668 HydrophobicContact CE2-CD2 3.66Å; F660-L668 HydrophobicContact CZ-CD1 4.23Å; F660-L668 HydrophobicContact CZ-CD2 3.46Å; F660-L668 VanDerWaalsContact CZ-CD2 3.46Å; F660-L668 HydrophobicContact CZ-CG 4.23Å; F660-L699 HydrophobicContact CD2-CG 4.28Å; F660-L699 HydrophobicContact CE2-CD1 4.3Å; F660-L699 HydrophobicContact CE2-CD2 3.82Å; F660-L699 HydrophobicContact CE2-CG 3.74Å; F660-L703 HydrophobicContact CE1-CB 4.01Å; F660-L703 HydrophobicContact CE1-CD1 3.53Å; F660-L703 HydrophobicContact CE1-CG 4.37Å; F660-L703 HydrophobicContact CZ-CB 3.6Å; F660-L703 HydrophobicContact CZ-CD1 3.67Å; F660-L703 HydrophobicContact CZ-CG 4.16Å; F660-R706 PolarHBondContact O-NH1 3.22Å
661	D	72.9	Confident	75.4	Confident	84 Å²	84	43.9 Å²	43.9	45%	0.449	27%	0.274	S	S	.	.			trans	-112.8	126.7	169.3	-170.2	-6.1	0	0	0	109.5	G659 A663 D664	G659-D661 PolarHBondContact O-N 2.64Å; D661-A663 PolarHBondContact O-N 3.07Å; D661-A663 WeakPolarHBondContact OD1-CB 3.44Å; D661-A663 PolarHBondContact OD1-N 3.33Å; D661-D664 PolarHBondContact O-N 3.03Å
662	A	74.4	Confident	76.2	Confident	19 Å²	19	44.9 Å²	44.9	16%	0.157	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-63.8	-26.4	177.1	0	0	0	0	0	111.9	D664 S665 L668 L669	A662-D664 PolarHBondContact O-N 3.13Å; A662-S665 PolarHBondContact O-N 2.87Å; A662-L668 HydrophobicContact CB-CD2 4.33Å; A662-L668 HydrophobicContact CB-CG 4.35Å; A662-L669 HydrophobicContact CB-CD2 4.4Å; A662-L669 WeakPolarHBondContact O-CG 3.48Å
663	A	81.4	Confident	77.2	Confident	47 Å²	47	44 Å²	44	39%	0.388	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-68	-15.6	-178.4	0	0	0	0	0	114.5	D661 S665 L669	D661-A663 PolarHBondContact O-N 3.07Å; D661-A663 WeakPolarHBondContact OD1-CB 3.44Å; D661-A663 PolarHBondContact OD1-N 3.33Å; A663-S665 PolarHBondContact O-N 3.02Å; A663-L669 HydrophobicContact CB-CD2 4.39Å
664	D	84.1	Confident	78.7	Confident	29 Å²	29	34 Å²	34	16%	0.155	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-72.2	-17.9	-178.9	-72.5	-36.2	0	0	0	113.2	S580 P623 Y655 D661 A662	S580-D664 WeakPolarHBondContact CB-O 3.04Å; S580-D664 PolarHBondContact OG-O 3.19Å; P623-D664 WeakPolarHBondContact CD-O 3.36Å; P623-D664 HydrophobicContact CG-CB 4.4Å; P623-D664 VanDerWaalsContact CG-O 3.31Å; P623-D664 WeakPolarHBondContact CG-O 3.44Å; Y655-D664 VanDerWaalsContact CE2-OD2 3.29Å; Y655-D664 WeakPolarHBondContact CE2-OD2 3.49Å; D661-D664 PolarHBondContact O-N 3.03Å; A662-D664 PolarHBondContact O-N 3.13Å
665	S	89.9	Confident	80.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	19%	0.192	C	C	.	.			trans	-133	127.2	178.7	-179.1	0	0	0	0	112.5	Q583 N621 A662 A663 K667 L668 L669	Q583-S665 PolarHBondContact NE2-OG 3.41Å; N621-S665 PolarHBondContact O-OG 2.91Å; A662-S665 PolarHBondContact O-N 2.87Å; A663-S665 PolarHBondContact O-N 3.02Å; S665-K667 VanDerWaalsContact C-N 3.3Å; S665-K667 PolarHBondContact O-N 3.49Å; S665-L668 WeakPolarHBondContact O-CB 3.34Å; S665-L668 PolarHBondContact O-N 2.98Å; S665-L668 VanDerWaalsContact O-N 3.09Å; S665-L669 PolarHBondContact O-N 3.34Å
666	G	89.9	Confident	81.6	Confident	3 Å²	3	29.3 Å²	29.3	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-58.5	-39.8	177.8	0	0	0	0	0	113.5	T578 L668 L669 V670	T578-G666 VanDerWaalsContact O-CA 3.3Å; T578-G666 WeakPolarHBondContact O-CA 3.33Å; G666-L668 VanDerWaalsContact C-N 3.31Å; G666-L668 PolarHBondContact O-N 3Å; G666-L669 PolarHBondContact O-N 3.05Å; G666-V670 WeakPolarHBondContact O-CG2 3.25Å; G666-V670 PolarHBondContact O-N 3.13Å; G666-V670 VanDerWaalsContact O-N 3.14Å
667	K	92.3	Very high	83	Confident	0 Å²	0	26 Å²	26	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-37.9	176.2	-73.6	-173.4	163.5	-163.8	0	112.8	C577 S665 L671 Y762 L792 T794 E799	C577-K667 HydrophobicContact CB-CG 4.23Å; S665-K667 VanDerWaalsContact C-N 3.3Å; S665-K667 PolarHBondContact O-N 3.49Å; K667-L671 WeakPolarHBondContact O-CB 3.44Å; K667-L671 PolarHBondContact O-N 2.88Å; K667-Y762 HydrophobicContact CB-CE2 4.07Å; K667-Y762 PolarHBondContact NZ-O 3.22Å; K667-L792 HydrophobicContact CD-CB 4.41Å; K667-L792 VanDerWaalsContact CE-O 3.3Å; K667-L792 WeakPolarHBondContact CE-O 3.33Å; K667-L792 HydrophobicContact CG-CB 4.43Å; K667-L792 PolarHBondContact NZ-O 3.05Å; K667-T794 WeakPolarHBondContact CE-OG1 3.28Å; K667-E799 WeakPolarHBondContact CE-OE2 3.34Å; K667-E799 IonicContact NZ-OE1 2.69Å; K667-E799 PolarHBondContact NZ-OE1 2.89Å; K667-E799 IonicContact NZ-OE2 2.6Å; K667-E799 PolarHBondContact NZ-OE2 3.42Å
668	L	91.7	Very high	84.8	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-73.8	-36.1	-176.6	-166.9	65.8	0	0	0	111.2	F660 A662 S665 G666 L671 S672 L699 L700 L703	F660-L668 HydrophobicContact CE1-CD2 4.38Å; F660-L668 HydrophobicContact CE2-CD2 3.66Å; F660-L668 HydrophobicContact CZ-CD1 4.23Å; F660-L668 HydrophobicContact CZ-CD2 3.46Å; F660-L668 VanDerWaalsContact CZ-CD2 3.46Å; F660-L668 HydrophobicContact CZ-CG 4.23Å; A662-L668 HydrophobicContact CB-CD2 4.33Å; A662-L668 HydrophobicContact CB-CG 4.35Å; S665-L668 WeakPolarHBondContact O-CB 3.34Å; S665-L668 PolarHBondContact O-N 2.98Å; S665-L668 VanDerWaalsContact O-N 3.09Å; G666-L668 VanDerWaalsContact C-N 3.31Å; G666-L668 PolarHBondContact O-N 3Å; L668-L671 HydrophobicContact CD1-CD2 4.5Å; L668-L671 PolarHBondContact O-N 2.79Å; L668-S672 VanDerWaalsContact O-CB 3.3Å; L668-S672 WeakPolarHBondContact O-CB 3.46Å; L668-S672 PolarHBondContact O-N 2.99Å; L668-L699 HydrophobicContact CD1-CD2 4.07Å; L668-L699 HydrophobicContact CD2-CD2 4.36Å; L668-L700 HydrophobicContact CD1-CD2 4.08Å; L668-L703 HydrophobicContact CD1-CD2 3.75Å
669	L	91.5	Very high	86.6	Confident	37 Å²	37	25.4 Å²	25.4	19%	0.194	15%	0.151	C	C	.	.	H	α-helix	trans	-58.7	-54.7	169.2	-74.5	175.1	0	0	0	111.4	A662 A663 S665 G666 L671 S672 D673	A662-L669 HydrophobicContact CB-CD2 4.4Å; A662-L669 WeakPolarHBondContact O-CG 3.48Å; A663-L669 HydrophobicContact CB-CD2 4.39Å; S665-L669 PolarHBondContact O-N 3.34Å; G666-L669 PolarHBondContact O-N 3.05Å; L669-L671 VanDerWaalsContact C-N 3.25Å; L669-L671 PolarHBondContact O-N 2.81Å; L669-S672 PolarHBondContact O-N 3.1Å; L669-S672 VanDerWaalsContact O-N 3.1Å; L669-D673 PolarHBondContact O-N 2.94Å
670	V	92.9	Very high	88.1	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-55.8	-43.7	177.5	172.8	0	0	0	0	110.9	L575 C577 G666 L674 L792 A918 H921 I922	L575-V670 HydrophobicContact CD1-CG1 4.35Å; C577-V670 HydrophobicContact CB-CG2 4.25Å; G666-V670 WeakPolarHBondContact O-CG2 3.25Å; G666-V670 PolarHBondContact O-N 3.13Å; G666-V670 VanDerWaalsContact O-N 3.14Å; V670-L674 WeakPolarHBondContact O-CB 3.49Å; V670-L674 PolarHBondContact O-N 3.42Å; V670-L792 HydrophobicContact CG1-CD2 4.02Å; V670-A918 HydrophobicContact CG1-CB 4.2Å; V670-H921 HydrophobicContact CG2-CB 3.55Å; V670-I922 HydrophobicContact CG1-CD1 4.34Å; V670-I922 HydrophobicContact CG1-CG1 4.34Å; V670-I922 HydrophobicContact CG2-CG1 3.95Å
671	L	93.8	Very high	89.3	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64	-45.3	177.5	177.5	63.9	0	0	0	112.3	K667 L668 L669 L674 L675 L689 L700 L703 V760 Y762 L792	K667-L671 WeakPolarHBondContact O-CB 3.44Å; K667-L671 PolarHBondContact O-N 2.88Å; L668-L671 HydrophobicContact CD1-CD2 4.5Å; L668-L671 PolarHBondContact O-N 2.79Å; L669-L671 VanDerWaalsContact C-N 3.25Å; L669-L671 PolarHBondContact O-N 2.81Å; L671-L674 PolarHBondContact O-N 2.77Å; L671-L675 HydrophobicContact CD1-CD1 3.95Å; L671-L675 HydrophobicContact CD1-CD2 4.32Å; L671-L675 HydrophobicContact CD1-CG 3.86Å; L671-L675 HydrophobicContact CG-CD1 3.98Å; L671-L675 HydrophobicContact CG-CG 4.26Å; L671-L675 WeakPolarHBondContact O-CB 3.36Å; L671-L675 VanDerWaalsContact O-CG 3.22Å; L671-L675 WeakPolarHBondContact O-CG 3.36Å; L671-L675 PolarHBondContact O-N 2.79Å; L671-L689 HydrophobicContact CD1-CD2 3.51Å; L671-L689 HydrophobicContact CD2-CD2 4.15Å; L671-L689 HydrophobicContact CG-CD2 4.49Å; L671-L700 HydrophobicContact CD2-CD2 3.44Å; L671-L700 VanDerWaalsContact CD2-CD2 3.44Å; L671-L703 HydrophobicContact CD2-CD2 4.12Å; L671-L703 HydrophobicContact CG-CD2 4.5Å; L671-V760 HydrophobicContact CD1-CG1 4.16Å; L671-V760 HydrophobicContact CD1-CG2 4.45Å; L671-Y762 HydrophobicContact CD2-CD2 3.95Å; L671-Y762 HydrophobicContact CD2-CE2 3.95Å; L671-L792 HydrophobicContact CB-CD1 4.37Å
672	S	92.5	Very high	90	Very high	34 Å²	34	29 Å²	29	24%	0.238	16%	0.16	C	C	.	.	H	α-helix	trans	-60.5	-47.9	-179.2	-179.9	0	0	0	0	111.3	L668 L669 L675 S676	L668-S672 VanDerWaalsContact O-CB 3.3Å; L668-S672 WeakPolarHBondContact O-CB 3.46Å; L668-S672 PolarHBondContact O-N 2.99Å; L669-S672 PolarHBondContact O-N 3.1Å; L669-S672 VanDerWaalsContact O-N 3.1Å; S672-L675 PolarHBondContact O-N 2.83Å; S672-S676 WeakPolarHBondContact O-CB 2.99Å; S672-S676 PolarHBondContact O-N 2.94Å
673	D	91.9	Very high	90.6	Very high	47 Å²	47	32.2 Å²	32.2	25%	0.251	18%	0.178	S	C	.	.	H	α-helix	trans	-66.3	-42.1	179.5	-67.3	-18.3	0	0	0	111.3	L669 S676 A677 A918 H921	L669-D673 PolarHBondContact O-N 2.94Å; D673-S676 PolarHBondContact O-N 3.26Å; D673-A677 WeakPolarHBondContact O-CB 3.42Å; D673-A677 PolarHBondContact O-N 3.09Å; D673-A918 HydrophobicContact CB-CB 3.82Å; D673-H921 IonicContact OD2-CD2 3.12Å; D673-H921 PolarHBondContact OD2-CD2 3.27Å; D673-H921 IonicContact OD2-NE2 2.69Å
674	L	92.8	Very high	90.8	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.2	-46.3	175.7	179.3	62.1	0	0	0	112	V670 L671 S676 A677 I678 V760 Y790 L915	V670-L674 WeakPolarHBondContact O-CB 3.49Å; V670-L674 PolarHBondContact O-N 3.42Å; L671-L674 PolarHBondContact O-N 2.77Å; L674-S676 VanDerWaalsContact C-N 3.34Å; L674-S676 PolarHBondContact O-N 3.37Å; L674-A677 PolarHBondContact O-N 3.43Å; L674-I678 HydrophobicContact CD1-CD1 3.95Å; L674-I678 HydrophobicContact CD1-CG1 4.24Å; L674-I678 HydrophobicContact CG-CD1 3.87Å; L674-I678 VanDerWaalsContact O-CG1 3.25Å; L674-I678 WeakPolarHBondContact O-CG1 3.41Å; L674-I678 PolarHBondContact O-N 3Å; L674-V760 HydrophobicContact CD2-CG2 4.03Å; L674-Y790 HydrophobicContact CD1-CE2 4.3Å; L674-Y790 HydrophobicContact CD2-CD1 4.43Å; L674-Y790 HydrophobicContact CD2-CD2 3.85Å; L674-Y790 HydrophobicContact CD2-CE2 4.15Å; L674-Y790 HydrophobicContact CD2-CG 3.99Å; L674-L915 HydrophobicContact CD1-CD2 4.14Å
675	L	93.3	Very high	91.1	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-64	-40.5	178.5	-71.5	-179.9	0	0	0	111.8	L671 S672 R679 V687 Y709 F738 L739	L671-L675 HydrophobicContact CD1-CD1 3.95Å; L671-L675 HydrophobicContact CD1-CD2 4.32Å; L671-L675 HydrophobicContact CD1-CG 3.86Å; L671-L675 HydrophobicContact CG-CD1 3.98Å; L671-L675 HydrophobicContact CG-CG 4.26Å; L671-L675 WeakPolarHBondContact O-CB 3.36Å; L671-L675 VanDerWaalsContact O-CG 3.22Å; L671-L675 WeakPolarHBondContact O-CG 3.36Å; L671-L675 PolarHBondContact O-N 2.79Å; S672-L675 PolarHBondContact O-N 2.83Å; L675-R679 WeakPolarHBondContact O-CB 3.21Å; L675-R679 PolarHBondContact O-N 3.25Å; L675-V687 HydrophobicContact CD2-CB 4.25Å; L675-V687 HydrophobicContact CD2-CG1 4.02Å; L675-V687 HydrophobicContact CD2-CG2 4.05Å; L675-Y709 HydrophobicContact CB-CE2 4.16Å; L675-Y709 HydrophobicContact CD1-CE2 4.48Å; L675-F738 HydrophobicContact CD2-CE1 4.32Å; L675-L739 HydrophobicContact CD1-CD1 4.28Å; L675-L739 HydrophobicContact CD1-CD2 4.4Å; L675-L739 HydrophobicContact CD2-CD2 3.72Å
676	S	92.4	Very high	91.3	Very high	39 Å²	39	34.7 Å²	34.7	27%	0.273	19%	0.19	S	C	.	.	H	α-helix	trans	-61.7	-47.3	174.7	-171.9	0	0	0	0	111.1	S672 D673 L674 R679 Q680	S672-S676 WeakPolarHBondContact O-CB 2.99Å; S672-S676 PolarHBondContact O-N 2.94Å; D673-S676 PolarHBondContact O-N 3.26Å; L674-S676 VanDerWaalsContact C-N 3.34Å; L674-S676 PolarHBondContact O-N 3.37Å; S676-R679 PolarHBondContact O-N 3.28Å; S676-Q680 WeakPolarHBondContact O-CB 3.42Å; S676-Q680 VanDerWaalsContact O-CG 3.28Å; S676-Q680 WeakPolarHBondContact O-CG 3.14Å; S676-Q680 PolarHBondContact O-N 3.06Å; S676-Q680 PolarHBondContact OG-NE2 2.94Å
677	A	92.2	Very high	91.6	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-46.7	178.2	0	0	0	0	0	112.1	D673 L674 R679 Q680 L681 H917	D673-A677 WeakPolarHBondContact O-CB 3.42Å; D673-A677 PolarHBondContact O-N 3.09Å; L674-A677 PolarHBondContact O-N 3.43Å; A677-R679 VanDerWaalsContact C-N 3.3Å; A677-R679 PolarHBondContact O-N 2.84Å; A677-Q680 PolarHBondContact O-N 3.37Å; A677-L681 VanDerWaalsContact O-CB 3.31Å; A677-L681 WeakPolarHBondContact O-CB 3.3Å; A677-L681 WeakPolarHBondContact O-CG 3.33Å; A677-L681 PolarHBondContact O-N 2.83Å; A677-H917 HydrophobicContact CB-CB 3.82Å
678	I	92.9	Very high	91.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.4	-43.8	176.6	-67.5	165.4	0	0	0	110.3	L674 Q680 S682 D685 V687 F738 H758 Y914	L674-I678 HydrophobicContact CD1-CD1 3.95Å; L674-I678 HydrophobicContact CD1-CG1 4.24Å; L674-I678 HydrophobicContact CG-CD1 3.87Å; L674-I678 VanDerWaalsContact O-CG1 3.25Å; L674-I678 WeakPolarHBondContact O-CG1 3.41Å; L674-I678 PolarHBondContact O-N 3Å; I678-Q680 PolarHBondContact O-N 2.82Å; I678-S682 CarbonylContact O-C 3.56Å; I678-S682 VanDerWaalsContact O-C 3.26Å; I678-S682 WeakPolarHBondContact O-CA 3.46Å; I678-S682 PolarHBondContact O-N 2.79Å; I678-S682 VanDerWaalsContact O-O 3.12Å; I678-D685 HydrophobicContact CG2-CB 4.15Å; I678-V687 HydrophobicContact CD1-CG2 3.97Å; I678-V687 HydrophobicContact CG2-CG2 4Å; I678-F738 HydrophobicContact CB-CZ 4.46Å; I678-F738 HydrophobicContact CG2-CE2 4.06Å; I678-F738 HydrophobicContact CG2-CZ 4.09Å; I678-H758 HydrophobicContact CD1-CB 4.14Å; I678-Y914 HydrophobicContact CB-CD1 4.44Å; I678-Y914 HydrophobicContact CG1-CD1 3.83Å; I678-Y914 HydrophobicContact CG1-CE1 4.41Å; I678-Y914 HydrophobicContact CG1-CG 4.13Å
679	R	91.4	Very high	91.9	Very high	113 Å²	113	34.6 Å²	34.6	43%	0.426	19%	0.189	S	C	.	.	H	α-helix	trans	-66.1	-37.4	-179.1	-175.6	58.3	175.7	168.5	0.3	112.7	L675 S676 A677 P683 Y709 F738	L675-R679 WeakPolarHBondContact O-CB 3.21Å; L675-R679 PolarHBondContact O-N 3.25Å; S676-R679 PolarHBondContact O-N 3.28Å; A677-R679 VanDerWaalsContact C-N 3.3Å; A677-R679 PolarHBondContact O-N 2.84Å; R679-P683 PolarHBondContact NH1-O 2.81Å; R679-Y709 HydrophobicContact CG-CE1 4.24Å; R679-F738 HydrophobicContact CB-CE1 4.42Å; R679-F738 HydrophobicContact CB-CZ 4.07Å
680	Q	90.7	Very high	92.1	Very high	132 Å²	132	32.9 Å²	32.9	62%	0.617	18%	0.18	S	C	*	.	H	α-helix	trans	-77	-48.5	-179.2	-70.4	177.4	29.4	0	0	112.3	S676 A677 I678	S676-Q680 WeakPolarHBondContact O-CB 3.42Å; S676-Q680 VanDerWaalsContact O-CG 3.28Å; S676-Q680 WeakPolarHBondContact O-CG 3.14Å; S676-Q680 PolarHBondContact O-N 3.06Å; S676-Q680 PolarHBondContact OG-NE2 2.94Å; A677-Q680 PolarHBondContact O-N 3.37Å; I678-Q680 PolarHBondContact O-N 2.82Å
681	L	90.4	Very high	92.1	Very high	84 Å²	84	32.9 Å²	32.9	44%	0.44	18%	0.18	S	C	.	.	H	α-helix	trans	-75.6	-37.4	-176.4	-64.9	174.1	0	0	0	112	A677 P913 Y914	A677-L681 VanDerWaalsContact O-CB 3.31Å; A677-L681 WeakPolarHBondContact O-CB 3.3Å; A677-L681 WeakPolarHBondContact O-CG 3.33Å; A677-L681 PolarHBondContact O-N 2.83Å; L681-P913 HydrophobicContact CD1-CB 4.12Å; L681-Y914 HydrophobicContact CB-CD1 4.26Å; L681-Y914 HydrophobicContact CB-CE1 3.85Å; L681-Y914 HydrophobicContact CD1-CD1 3.76Å; L681-Y914 HydrophobicContact CD1-CE1 4.08Å
682	S	87.9	Confident	91.9	Very high	24 Å²	24	33.8 Å²	33.8	17%	0.168	18%	0.184	C	C	.	.			trans	-135.5	77.9	-173.7	-70	0	0	0	0	112.1	I678 S684 D685 Y914	I678-S682 CarbonylContact O-C 3.56Å; I678-S682 VanDerWaalsContact O-C 3.26Å; I678-S682 WeakPolarHBondContact O-CA 3.46Å; I678-S682 PolarHBondContact O-N 2.79Å; I678-S682 VanDerWaalsContact O-O 3.12Å; S682-S684 PolarHBondContact O-N 2.71Å; S682-D685 WeakPolarHBondContact O-CB 3.37Å; S682-D685 PolarHBondContact O-N 2.89Å; S682-Y914 PolarHBondContact OG-OH 2.87Å
683	P	85.7	Confident	91.8	Very high	85 Å²	85	35.2 Å²	35.2	55%	0.552	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.4	-177.3	-24.3	33.7	0	0	0	115.1	R679	R679-P683 PolarHBondContact NH1-O 2.81Å
684	S	86.9	Confident	91.7	Very high	84 Å²	84	35.8 Å²	35.8	59%	0.587	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.5	178.6	81.2	0	0	0	0	114	S682 K785	S682-S684 PolarHBondContact O-N 2.71Å; S684-K785 PolarHBondContact O-NZ 2.77Å; S684-K785 PolarHBondContact OG-NZ 3.11Å
685	D	90.9	Very high	91.6	Very high	16 Å²	16	39.4 Å²	39.4	9%	0.086	21%	0.207	C	C	.	.			trans	-83.9	151.3	-178.7	-81.1	13.8	0	0	0	110.9	I678 S682 F738 S757 H758 K785	I678-D685 HydrophobicContact CG2-CB 4.15Å; S682-D685 WeakPolarHBondContact O-CB 3.37Å; S682-D685 PolarHBondContact O-N 2.89Å; D685-F738 WeakPolarHBondContact O-CD2 3.49Å; D685-F738 WeakPolarHBondContact O-CE2 3.44Å; D685-S757 VanDerWaalsContact CB-OG 3.28Å; D685-S757 WeakPolarHBondContact CB-OG 2.86Å; D685-S757 PolarHBondContact OD1-OG 2.69Å; D685-S757 PolarHBondContact OD2-OG 3.44Å; D685-H758 IonicContact OD2-CD2 3.62Å; D685-H758 IonicContact OD2-NE2 3.41Å; D685-H758 PolarHBondContact OD2-NE2 2.9Å; D685-K785 IonicContact OD1-NZ 3.47Å; D685-K785 PolarHBondContact OD1-NZ 3.47Å
686	R	93.6	Very high	91.5	Very high	29 Å²	29	39.5 Å²	39.5	11%	0.109	21%	0.208	C	C	.	.			trans	-132.2	150.5	-177.7	-57	176.6	-163.1	165.9	1.3	109.4	F730 S732 P733 F738 A756 S757 H758	R686-F730 HydrophobicContact CB-CE2 4.13Å; R686-F730 HydrophobicContact CB-CZ 3.78Å; R686-F730 PolarHBondContact NH1-O 3.27Å; R686-S732 VanDerWaalsContact CZ-O 3.29Å; R686-S732 PolarHBondContact NH1-O 3.22Å; R686-S732 PolarHBondContact NH2-O 3Å; R686-P733 PolarHBondContact NH2-O 3.17Å; R686-F738 WeakPolarHBondContact CA-O 3.19Å; R686-A756 WeakPolarHBondContact O-CA 3.29Å; R686-S757 PolarHBondContact O-N 3.25Å; R686-S757 VanDerWaalsContact O-N 3.09Å; R686-H758 PolarHBondContact O-N 3Å
687	V	95.6	Very high	91.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.6	-169.9	-171.5	0	0	0	0	110.2	L675 I678 F738 L739 F740 H758 V760	L675-V687 HydrophobicContact CD2-CB 4.25Å; L675-V687 HydrophobicContact CD2-CG1 4.02Å; L675-V687 HydrophobicContact CD2-CG2 4.05Å; I678-V687 HydrophobicContact CD1-CG2 3.97Å; I678-V687 HydrophobicContact CG2-CG2 4Å; V687-F738 HydrophobicContact CG2-CE2 3.99Å; V687-F738 HydrophobicContact CG2-CZ 3.86Å; V687-F738 PolarHBondContact N-O 3.41Å; V687-L739 HydrophobicContact CB-CD2 3.65Å; V687-L739 HydrophobicContact CG1-CD2 4.08Å; V687-L739 HydrophobicContact CG2-CD2 4.42Å; V687-L739 CarbonylContact O-C 3.6Å; V687-L739 WeakPolarHBondContact O-CA 3.5Å; V687-F740 PolarHBondContact O-N 3.26Å; V687-H758 CarbonylContact C-O 3.57Å; V687-H758 WeakPolarHBondContact CA-O 3.46Å; V687-H758 HydrophobicContact CB-CB 4.33Å; V687-H758 HydrophobicContact CG1-CB 4.11Å; V687-H758 HydrophobicContact CG2-CB 4.01Å; V687-V760 HydrophobicContact CG1-CG2 4.09Å
688	V	95.6	Very high	91.5	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.4	168	177.4	0	0	0	0	108.5	V690 F730 F740 L742 L753 A756 H758 L759 V760 V778	V688-V690 HydrophobicContact CG1-CG2 3.87Å; V688-F730 HydrophobicContact CG2-CE1 4.2Å; V688-F730 HydrophobicContact CG2-CZ 4.41Å; V688-F740 CarbonylContact C-O 3.55Å; V688-F740 WeakPolarHBondContact CA-O 3.42Å; V688-F740 HydrophobicContact CG2-CB 4.18Å; V688-L742 HydrophobicContact CG1-CB 4.25Å; V688-L742 HydrophobicContact CG1-CD2 4.46Å; V688-L753 HydrophobicContact CG1-CD1 4.22Å; V688-L753 HydrophobicContact CG2-CB 4.36Å; V688-L753 HydrophobicContact CG2-CD1 4.2Å; V688-A756 HydrophobicContact CG2-CB 3.5Å; V688-H758 PolarHBondContact N-O 2.93Å; V688-L759 WeakPolarHBondContact O-CA 3.45Å; V688-V760 PolarHBondContact O-N 3.09Å; V688-V778 HydrophobicContact CB-CG2 4.2Å; V688-V778 HydrophobicContact CG2-CG2 3.84Å
689	L	95.4	Very high	91.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	121.4	173.6	-74.1	170.7	0	0	0	109.1	L671 L739 F740 L741 L742 V760	L671-L689 HydrophobicContact CD1-CD2 3.51Å; L671-L689 HydrophobicContact CD2-CD2 4.15Å; L671-L689 HydrophobicContact CG-CD2 4.49Å; L689-L739 HydrophobicContact CD1-CD2 3.71Å; L689-L739 HydrophobicContact CG-CD2 4.02Å; L689-F740 PolarHBondContact N-O 2.9Å; L689-L741 HydrophobicContact CB-CD2 3.79Å; L689-L741 HydrophobicContact CD1-CD2 3.6Å; L689-L741 HydrophobicContact CG-CD2 4.28Å; L689-L742 PolarHBondContact O-N 2.84Å; L689-V760 HydrophobicContact CD2-CB 3.65Å; L689-V760 HydrophobicContact CD2-CG1 4.05Å; L689-V760 HydrophobicContact CD2-CG2 4.19Å
690	V	94.4	Very high	91.4	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.1	-178.7	-174.2	0	0	0	0	110	V688 L742 S744 L759 V760 L761 Y762 A774	V688-V690 HydrophobicContact CG1-CG2 3.87Å; V690-L742 VanDerWaalsContact CA-O 3.32Å; V690-L742 WeakPolarHBondContact CA-O 3.3Å; V690-L742 HydrophobicContact CG2-CB 4.42Å; V690-L742 HydrophobicContact CG2-CD2 4.33Å; V690-S744 WeakPolarHBondContact CG1-OG 3.32Å; V690-L759 HydrophobicContact CG2-CD1 4.39Å; V690-L759 HydrophobicContact CG2-CG 4.28Å; V690-V760 PolarHBondContact N-O 2.92Å; V690-L761 HydrophobicContact CB-CD2 3.7Å; V690-L761 HydrophobicContact CG1-CD2 4.02Å; V690-L761 HydrophobicContact CG2-CD2 4.02Å; V690-Y762 PolarHBondContact O-N 2.97Å; V690-A774 HydrophobicContact CG1-CB 4.07Å; V690-A774 HydrophobicContact CG2-CB 4.44Å
691	S	93.4	Very high	91.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	146.6	172.7	179.7	0	0	0	0	112.3	Y693 T696 L742 S743 S744 D763	S691-Y693 VanDerWaalsContact C-N 3.34Å; S691-Y693 PolarHBondContact OG-N 3.18Å; S691-Y693 PolarHBondContact OG-O 3.32Å; S691-T696 WeakPolarHBondContact OG-CB 3.46Å; S691-L742 PolarHBondContact N-O 2.89Å; S691-L742 VanDerWaalsContact N-O 3.07Å; S691-S743 CarbonylContact O-C 3.59Å; S691-S743 VanDerWaalsContact O-CA 3.26Å; S691-S743 WeakPolarHBondContact O-CA 3.34Å; S691-S744 PolarHBondContact O-N 3.46Å; S691-S744 PolarHBondContact O-OG 2.9Å; S691-D763 WeakPolarHBondContact CA-OD1 3.37Å; S691-D763 WeakPolarHBondContact CB-OD1 3.45Å; S691-D763 PolarHBondContact OG-OD1 3.19Å
692	N	89.7	Confident	91.4	Very high	18 Å²	18	32.8 Å²	32.8	10%	0.096	18%	0.18	C	C	.	.	S	Bend	trans	-79.3	-19	176	-58.5	-61.5	0	0	0	112.8	S744 D763 D765	N692-S744 WeakPolarHBondContact OD1-CB 3.07Å; N692-S744 PolarHBondContact OD1-OG 3.07Å; N692-D763 WeakPolarHBondContact CB-OD2 3.25Å; N692-D763 VanDerWaalsContact CG-OD2 3.31Å; N692-D763 PolarHBondContact N-OD1 3.32Å; N692-D763 PolarHBondContact N-OD2 3.25Å; N692-D763 VanDerWaalsContact N-OD2 3.12Å; N692-D763 PolarHBondContact ND2-O 2.95Å; N692-D763 PolarHBondContact ND2-OD2 3.45Å; N692-D765 PolarHBondContact ND2-N 2.84Å
693	Y	90	Very high	91.5	Very high	64 Å²	64	32 Å²	32	25%	0.251	17%	0.174	S	C	.	.			trans	-114.6	127.6	-172.5	-58.9	-86.7	0	0	0	111.5	K617 S691 Q695 T696 L697 D763	K617-Y693 WeakPolarHBondContact CD-OH 3.39Å; K617-Y693 WeakPolarHBondContact CE-OH 3.15Å; K617-Y693 PolarHBondContact NZ-OH 2.52Å; K617-Y693 VanDerWaalsContact NZ-OH 3.15Å; S691-Y693 VanDerWaalsContact C-N 3.34Å; S691-Y693 PolarHBondContact OG-N 3.18Å; S691-Y693 PolarHBondContact OG-O 3.32Å; Y693-Q695 VanDerWaalsContact C-N 3.3Å; Y693-Q695 PolarHBondContact O-N 3.31Å; Y693-T696 WeakPolarHBondContact O-CB 3.38Å; Y693-T696 PolarHBondContact O-N 3.03Å; Y693-L697 PolarHBondContact O-N 2.98Å; Y693-L697 VanDerWaalsContact O-N 3.16Å; Y693-D763 WeakPolarHBondContact CD2-OD2 3.43Å; Y693-D763 WeakPolarHBondContact CE2-OD2 3.45Å
694	T	90.7	Very high	91.7	Very high	60 Å²	60	28 Å²	28	37%	0.368	15%	0.148	S	C	.	.	H	α-helix	trans	-64.6	-34.6	177.9	54.1	0	0	0	0	112.7	T696 L697 D698	T694-T696 VanDerWaalsContact C-N 3.26Å; T694-T696 PolarHBondContact O-N 3.06Å; T694-L697 CarbonylContact O-C 3.6Å; T694-L697 WeakPolarHBondContact O-CA 3.17Å; T694-L697 WeakPolarHBondContact O-CB 3.42Å; T694-L697 PolarHBondContact O-N 3.27Å; T694-D698 PolarHBondContact O-N 3.43Å; T694-D698 VanDerWaalsContact O-OD2 3.1Å
695	Q	89.9	Confident	91.9	Very high	76 Å²	76	26.9 Å²	26.9	36%	0.355	14%	0.144	S	C	.	.	H	α-helix	trans	-60.6	-37.4	176.2	-61	-175.6	-35.5	0	0	111.8	L625 Y693 D698 L699	L625-Q695 HydrophobicContact CD2-CB 4.01Å; Y693-Q695 VanDerWaalsContact C-N 3.3Å; Y693-Q695 PolarHBondContact O-N 3.31Å; Q695-D698 WeakPolarHBondContact CA-OD2 3.17Å; Q695-D698 PolarHBondContact O-N 3.34Å; Q695-L699 PolarHBondContact O-N 2.9Å
696	T	91.6	Very high	91.7	Very high	2 Å²	2	33 Å²	33	1%	0.012	17%	0.166	C	C	.	.	H	α-helix	trans	-68.7	-39.5	173	-55.6	0	0	0	0	110.9	N621 S691 Y693 T694 D698 L699 L700 Y762	N621-T696 PolarHBondContact ND2-OG1 3.18Å; N621-T696 VanDerWaalsContact ND2-OG1 3.13Å; S691-T696 WeakPolarHBondContact OG-CB 3.46Å; Y693-T696 WeakPolarHBondContact O-CB 3.38Å; Y693-T696 PolarHBondContact O-N 3.03Å; T694-T696 VanDerWaalsContact C-N 3.26Å; T694-T696 PolarHBondContact O-N 3.06Å; T696-D698 VanDerWaalsContact C-N 3.32Å; T696-D698 PolarHBondContact O-N 3.47Å; T696-L699 WeakPolarHBondContact O-CB 3.49Å; T696-L699 PolarHBondContact O-N 2.66Å; T696-L700 HydrophobicContact CG2-CD1 4.3Å; T696-L700 HydrophobicContact CG2-CG 4.38Å; T696-L700 VanDerWaalsContact O-CG 3.31Å; T696-L700 WeakPolarHBondContact O-CG 3.49Å; T696-L700 PolarHBondContact O-N 2.81Å; T696-Y762 HydrophobicContact CG2-CD1 3.51Å; T696-Y762 HydrophobicContact CG2-CE1 3.56Å; T696-Y762 HydrophobicContact CG2-CG 4.45Å
697	L	92.7	Very high	91.4	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-36.7	174.7	-66.3	176.1	0	0	0	112.7	Y693 T694 L699 L700 Q701 L741	Y693-L697 PolarHBondContact O-N 2.98Å; Y693-L697 VanDerWaalsContact O-N 3.16Å; T694-L697 CarbonylContact O-C 3.6Å; T694-L697 WeakPolarHBondContact O-CA 3.17Å; T694-L697 WeakPolarHBondContact O-CB 3.42Å; T694-L697 PolarHBondContact O-N 3.27Å; L697-L699 VanDerWaalsContact C-N 3.34Å; L697-L700 PolarHBondContact O-N 3.08Å; L697-Q701 WeakPolarHBondContact O-CB 3.35Å; L697-Q701 PolarHBondContact O-N 2.83Å; L697-L741 HydrophobicContact CD2-CB 4.3Å
698	D	91.7	Very high	91.2	Very high	69 Å²	69	37.1 Å²	37.1	37%	0.369	21%	0.209	S	C	.	.	H	α-helix	trans	-60.3	-46.4	173.6	-58.8	-39.3	0	0	0	110.2	T694 Q695 T696 L700 Q701 D702 R713	T694-D698 PolarHBondContact O-N 3.43Å; T694-D698 VanDerWaalsContact O-OD2 3.1Å; Q695-D698 WeakPolarHBondContact CA-OD2 3.17Å; Q695-D698 PolarHBondContact O-N 3.34Å; T696-D698 VanDerWaalsContact C-N 3.32Å; T696-D698 PolarHBondContact O-N 3.47Å; D698-L700 PolarHBondContact O-N 3.15Å; D698-Q701 VanDerWaalsContact O-CB 3.25Å; D698-Q701 WeakPolarHBondContact O-CB 3.23Å; D698-Q701 PolarHBondContact O-N 3.41Å; D698-D702 PolarHBondContact O-N 2.96Å; D698-D702 VanDerWaalsContact O-N 3.11Å; D698-R713 IonicContact OD1-CZ 3.2Å; D698-R713 IonicContact OD1-NH1 2.76Å; D698-R713 PolarHBondContact OD1-NH1 3.34Å; D698-R713 IonicContact OD1-NH2 3.9Å; D698-R713 PolarHBondContact OD1-NH2 2.96Å
699	L	90.3	Very high	91	Very high	17 Å²	17	39 Å²	39	9%	0.089	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-43.3	176.2	-179.3	143.5	0	0	0	112.9	H622 L625 F660 L668 Q695 T696 L697 Q701 D702 L703	H622-L699 HydrophobicContact CB-CD1 3.62Å; L625-L699 HydrophobicContact CD2-CD1 4.29Å; L625-L699 HydrophobicContact CG-CD1 4.27Å; F660-L699 HydrophobicContact CD2-CG 4.28Å; F660-L699 HydrophobicContact CE2-CD1 4.3Å; F660-L699 HydrophobicContact CE2-CD2 3.82Å; F660-L699 HydrophobicContact CE2-CG 3.74Å; L668-L699 HydrophobicContact CD1-CD2 4.07Å; L668-L699 HydrophobicContact CD2-CD2 4.36Å; Q695-L699 PolarHBondContact O-N 2.9Å; T696-L699 WeakPolarHBondContact O-CB 3.49Å; T696-L699 PolarHBondContact O-N 2.66Å; L697-L699 VanDerWaalsContact C-N 3.34Å; L699-Q701 VanDerWaalsContact C-N 3.27Å; L699-Q701 PolarHBondContact O-N 3.38Å; L699-D702 PolarHBondContact O-N 3.06Å; L699-L703 PolarHBondContact O-N 2.89Å; L699-L703 VanDerWaalsContact O-N 3.1Å
700	L	91.8	Very high	90.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-32.6	176.1	-67.5	178.8	0	0	0	111.7	L668 L671 T696 L697 D698 D702 L703 C704 Y762	L668-L700 HydrophobicContact CD1-CD2 4.08Å; L671-L700 HydrophobicContact CD2-CD2 3.44Å; L671-L700 VanDerWaalsContact CD2-CD2 3.44Å; T696-L700 HydrophobicContact CG2-CD1 4.3Å; T696-L700 HydrophobicContact CG2-CG 4.38Å; T696-L700 VanDerWaalsContact O-CG 3.31Å; T696-L700 WeakPolarHBondContact O-CG 3.49Å; T696-L700 PolarHBondContact O-N 2.81Å; L697-L700 PolarHBondContact O-N 3.08Å; D698-L700 PolarHBondContact O-N 3.15Å; L700-D702 VanDerWaalsContact C-N 3.35Å; L700-L703 WeakPolarHBondContact O-CB 3.35Å; L700-L703 PolarHBondContact O-N 3.29Å; L700-C704 PolarHBondContact O-N 3.15Å; L700-C704 PolarHBondContact O-SG 2.95Å; L700-Y762 HydrophobicContact CD1-CD2 4.37Å; L700-Y762 HydrophobicContact CD1-CG 4.25Å; L700-Y762 HydrophobicContact CD2-CD2 4.19Å; L700-Y762 HydrophobicContact CD2-CE2 4.01Å
701	Q	92.1	Very high	90.9	Very high	58 Å²	58	44.2 Å²	44.2	27%	0.271	25%	0.248	S	C	.	.	H	α-helix	trans	-63	-43.2	174.8	-164.7	-178.9	-67.2	0	0	111.4	L697 D698 L699 C704 A705 F711 R713 L741	L697-Q701 WeakPolarHBondContact O-CB 3.35Å; L697-Q701 PolarHBondContact O-N 2.83Å; D698-Q701 VanDerWaalsContact O-CB 3.25Å; D698-Q701 WeakPolarHBondContact O-CB 3.23Å; D698-Q701 PolarHBondContact O-N 3.41Å; L699-Q701 VanDerWaalsContact C-N 3.27Å; L699-Q701 PolarHBondContact O-N 3.38Å; Q701-C704 WeakPolarHBondContact O-CB 3.3Å; Q701-C704 PolarHBondContact O-N 2.55Å; Q701-A705 PolarHBondContact O-N 3.36Å; Q701-F711 HydrophobicContact CG-CD2 4.18Å; Q701-F711 HydrophobicContact CG-CE1 4.01Å; Q701-F711 HydrophobicContact CG-CE2 3.33Å; Q701-F711 HydrophobicContact CG-CZ 3.22Å; Q701-R713 VanDerWaalsContact OE1-CD 3.22Å; Q701-L741 HydrophobicContact CB-CD1 3.93Å; Q701-L741 HydrophobicContact CG-CD1 4.19Å
702	D	89.6	Confident	90.9	Very high	85 Å²	85	45.1 Å²	45.1	46%	0.455	25%	0.254	S	S	.	.	H	α-helix	trans	-65.5	-39.4	177	-70.7	-17.7	0	0	0	111.9	D698 L699 L700 C704 A705 R706	D698-D702 PolarHBondContact O-N 2.96Å; D698-D702 VanDerWaalsContact O-N 3.11Å; L699-D702 PolarHBondContact O-N 3.06Å; L700-D702 VanDerWaalsContact C-N 3.35Å; D702-C704 VanDerWaalsContact C-N 3.34Å; D702-C704 PolarHBondContact O-N 3.46Å; D702-A705 PolarHBondContact O-N 3.45Å; D702-R706 WeakPolarHBondContact O-CG 3.46Å; D702-R706 PolarHBondContact O-N 2.77Å
703	L	89.4	Confident	91.1	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-56.4	-48.2	171.3	178.2	68.4	0	0	0	111.3	F660 L668 L671 L699 L700 A705 R706 S707	F660-L703 HydrophobicContact CE1-CB 4.01Å; F660-L703 HydrophobicContact CE1-CD1 3.53Å; F660-L703 HydrophobicContact CE1-CG 4.37Å; F660-L703 HydrophobicContact CZ-CB 3.6Å; F660-L703 HydrophobicContact CZ-CD1 3.67Å; F660-L703 HydrophobicContact CZ-CG 4.16Å; L668-L703 HydrophobicContact CD1-CD2 3.75Å; L671-L703 HydrophobicContact CD2-CD2 4.12Å; L671-L703 HydrophobicContact CG-CD2 4.5Å; L699-L703 PolarHBondContact O-N 2.89Å; L699-L703 VanDerWaalsContact O-N 3.1Å; L700-L703 WeakPolarHBondContact O-CB 3.35Å; L700-L703 PolarHBondContact O-N 3.29Å; L703-A705 VanDerWaalsContact C-N 3.34Å; L703-A705 PolarHBondContact O-N 3Å; L703-R706 PolarHBondContact O-N 2.97Å; L703-S707 WeakPolarHBondContact O-CB 3.26Å; L703-S707 PolarHBondContact O-N 2.99Å; L703-S707 PolarHBondContact O-OG 3.41Å
704	C	90.7	Very high	91.1	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-43.5	-179.3	-63.5	0	0	0	0	111.2	L700 Q701 D702 S707 G708 Y709 F711 L739	L700-C704 PolarHBondContact O-N 3.15Å; L700-C704 PolarHBondContact O-SG 2.95Å; Q701-C704 WeakPolarHBondContact O-CB 3.3Å; Q701-C704 PolarHBondContact O-N 2.55Å; D702-C704 VanDerWaalsContact C-N 3.34Å; D702-C704 PolarHBondContact O-N 3.46Å; C704-S707 PolarHBondContact O-N 2.89Å; C704-G708 PolarHBondContact O-N 2.98Å; C704-G708 VanDerWaalsContact O-N 3.13Å; C704-Y709 PolarHBondContact O-N 3.29Å; C704-F711 HydrophobicContact CB-CD1 3.6Å; C704-F711 HydrophobicContact CB-CE1 4.16Å; C704-F711 HydrophobicContact CB-CG 4.27Å; C704-L739 HydrophobicContact CB-CD1 4.33Å; C704-L739 WeakPolarHBondContact SG-CD1 2.89Å
705	A	90.4	Very high	91	Very high	61 Å²	61	40.9 Å²	40.9	50%	0.504	23%	0.23	S	C	.	.	H	α-helix	trans	-63.5	-44.4	179.5	0	0	0	0	0	112.1	Q701 D702 L703 S707 G708	Q701-A705 PolarHBondContact O-N 3.36Å; D702-A705 PolarHBondContact O-N 3.45Å; L703-A705 VanDerWaalsContact C-N 3.34Å; L703-A705 PolarHBondContact O-N 3Å; A705-S707 VanDerWaalsContact C-N 3.32Å; A705-S707 PolarHBondContact O-N 3.4Å; A705-G708 PolarHBondContact O-N 2.94Å
706	R	87.4	Confident	90.7	Very high	145 Å²	145	40 Å²	40	55%	0.547	24%	0.242	S	C	.	.	H	α-helix	trans	-65.9	-35	177	-71.2	178.2	-175.7	-131	-3.6	112.8	A658 F660 D702 L703 G708	A658-R706 PolarHBondContact O-NH2 3.03Å; F660-R706 PolarHBondContact O-NH1 3.22Å; D702-R706 WeakPolarHBondContact O-CG 3.46Å; D702-R706 PolarHBondContact O-N 2.77Å; L703-R706 PolarHBondContact O-N 2.97Å; R706-G708 PolarHBondContact O-N 3.25Å
707	S	87.8	Confident	90.3	Very high	49 Å²	49	47.9 Å²	47.9	34%	0.343	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-3.8	177.7	-51.5	0	0	0	0	113.2	L703 C704 A705 Y709	L703-S707 WeakPolarHBondContact O-CB 3.26Å; L703-S707 PolarHBondContact O-N 2.99Å; L703-S707 PolarHBondContact O-OG 3.41Å; C704-S707 PolarHBondContact O-N 2.89Å; A705-S707 VanDerWaalsContact C-N 3.32Å; A705-S707 PolarHBondContact O-N 3.4Å; S707-Y709 VanDerWaalsContact C-N 3.32Å; S707-Y709 VanDerWaalsContact CB-CE2 3.43Å; S707-Y709 PolarHBondContact O-N 2.73Å
708	G	89.9	Confident	89.9	Confident	66 Å²	66	48.8 Å²	48.8	68%	0.68	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	21.4	-179.1	0	0	0	0	0	114.4	C704 A705 R706	C704-G708 PolarHBondContact O-N 2.98Å; C704-G708 VanDerWaalsContact O-N 3.13Å; A705-G708 PolarHBondContact O-N 2.94Å; R706-G708 PolarHBondContact O-N 3.25Å
709	Y	92.7	Very high	89.5	Confident	41 Å²	41	48.5 Å²	48.5	16%	0.161	29%	0.286	C	S	.	.			trans	-86.7	131	179.2	-60.1	-37.7	0	0	0	111.8	L675 R679 C704 S707 F711 F738 L739	L675-Y709 HydrophobicContact CB-CE2 4.16Å; L675-Y709 HydrophobicContact CD1-CE2 4.48Å; R679-Y709 HydrophobicContact CG-CE1 4.24Å; C704-Y709 PolarHBondContact O-N 3.29Å; S707-Y709 VanDerWaalsContact C-N 3.32Å; S707-Y709 VanDerWaalsContact CB-CE2 3.43Å; S707-Y709 PolarHBondContact O-N 2.73Å; Y709-F711 WeakPolarHBondContact O-CD1 3.42Å; Y709-F738 AromaticContact CD1-CD1 4Å; Y709-F738 HydrophobicContact CD1-CD1 4Å; Y709-F738 HydrophobicContact CD1-CE1 4.33Å; Y709-F738 HydrophobicContact CD2-CD1 4.39Å; Y709-F738 HydrophobicContact CD2-CE1 4.43Å; Y709-F738 HydrophobicContact CE1-CE1 4.44Å; Y709-F738 AromaticContact CG-CD1 3.93Å; Y709-F738 HydrophobicContact CG-CD1 3.93Å; Y709-F738 HydrophobicContact CG-CE1 4.34Å; Y709-L739 HydrophobicContact CD2-CD1 3.8Å; Y709-L739 HydrophobicContact CG-CD1 4.07Å
710	A	93.6	Very high	88.8	Confident	47 Å²	47	52 Å²	52	39%	0.388	31%	0.308	S	S	.	.			trans	-73.7	128.7	169.6	0	0	0	0	0	110.2	Q736 F738 L739	A710-Q736 WeakPolarHBondContact CB-O 3.45Å; A710-F738 PolarHBondContact O-N 2.91Å; A710-L739 PolarHBondContact O-N 2.93Å; A710-L739 VanDerWaalsContact O-N 3.14Å
711	F	94.1	Very high	88.1	Confident	62 Å²	62	56.1 Å²	56.1	27%	0.272	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	156.6	-177.4	65.1	-93.2	0	0	0	112.4	Q701 C704 Y709 L739 L741	Q701-F711 HydrophobicContact CG-CD2 4.18Å; Q701-F711 HydrophobicContact CG-CE1 4.01Å; Q701-F711 HydrophobicContact CG-CE2 3.33Å; Q701-F711 HydrophobicContact CG-CZ 3.22Å; C704-F711 HydrophobicContact CB-CD1 3.6Å; C704-F711 HydrophobicContact CB-CE1 4.16Å; C704-F711 HydrophobicContact CB-CG 4.27Å; Y709-F711 WeakPolarHBondContact O-CD1 3.42Å; F711-L739 CarbonylContact C-O 3.52Å; F711-L739 VanDerWaalsContact CA-O 3.23Å; F711-L739 WeakPolarHBondContact CA-O 3.34Å; F711-L739 HydrophobicContact CB-CB 3.82Å; F711-L741 HydrophobicContact CD2-CD1 4.06Å
712	C	93.3	Very high	87.7	Confident	19 Å²	19	58 Å²	58	13%	0.128	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	148.5	165.2	-70.1	0	0	0	0	109	S737 L739 F740 L741	C712-S737 PolarHBondContact SG-OG 3.04Å; C712-L739 PolarHBondContact N-O 2.93Å; C712-F740 HydrophobicContact CB-CD2 3.72Å; C712-F740 HydrophobicContact CB-CE2 4.02Å; C712-F740 CarbonylContact O-C 3.52Å; C712-F740 WeakPolarHBondContact O-CA 3.17Å; C712-L741 PolarHBondContact O-N 3.14Å
713	R	93.1	Very high	87.5	Confident	45 Å²	45	56.6 Å²	56.6	17%	0.17	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.5	177	177.1	175.7	168.6	161	0.6	111.3	D698 Q701 D715 L741	D698-R713 IonicContact OD1-CZ 3.2Å; D698-R713 IonicContact OD1-NH1 2.76Å; D698-R713 PolarHBondContact OD1-NH1 3.34Å; D698-R713 IonicContact OD1-NH2 3.9Å; D698-R713 PolarHBondContact OD1-NH2 2.96Å; Q701-R713 VanDerWaalsContact OE1-CD 3.22Å; R713-D715 IonicContact CZ-OD2 2.76Å; R713-D715 IonicContact NE-OD2 2.81Å; R713-D715 PolarHBondContact NE-OD2 3.42Å; R713-D715 IonicContact NH2-OD2 2.65Å; R713-D715 PolarHBondContact NH2-OD2 3.24Å; R713-L741 CarbonylContact C-O 3.53Å; R713-L741 WeakPolarHBondContact CA-O 3.41Å; R713-L741 HydrophobicContact CB-CB 4.17Å; R713-L741 HydrophobicContact CG-CB 4.23Å
714	L	90.8	Very high	87.2	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	113.5	173.8	-167.2	162.7	0	0	0	109.9	R723 V727 F740 L741 L742 S743 A746 L751	L714-R723 HydrophobicContact CD1-CB 4.24Å; L714-R723 HydrophobicContact CD1-CG 4.37Å; L714-R723 HydrophobicContact CG-CG 4.44Å; L714-V727 HydrophobicContact CD1-CG2 4.19Å; L714-F740 HydrophobicContact CB-CE1 3.74Å; L714-F740 HydrophobicContact CB-CZ 3.73Å; L714-F740 HydrophobicContact CD1-CE1 4.35Å; L714-F740 HydrophobicContact CD1-CZ 3.9Å; L714-F740 HydrophobicContact CG-CZ 4.5Å; L714-L741 PolarHBondContact N-O 2.93Å; L714-L742 HydrophobicContact CB-CD1 4.29Å; L714-L742 HydrophobicContact CD2-CD1 3.99Å; L714-S743 PolarHBondContact O-N 3.48Å; L714-S743 VanDerWaalsContact O-N 3.12Å; L714-A746 HydrophobicContact CD2-CB 4Å; L714-L751 HydrophobicContact CD1-CD1 3.91Å; L714-L751 HydrophobicContact CD2-CD1 4.37Å
715	D	88.9	Confident	87	Confident	8 Å²	8	68.2 Å²	68.2	4%	0.043	38%	0.381	C	S	.	.			trans	-135.7	-173.8	177.7	63.7	19.1	0	0	0	112	R713 Q717 T718 A746	R713-D715 IonicContact CZ-OD2 2.76Å; R713-D715 IonicContact NE-OD2 2.81Å; R713-D715 PolarHBondContact NE-OD2 3.42Å; R713-D715 IonicContact NH2-OD2 2.65Å; R713-D715 PolarHBondContact NH2-OD2 3.24Å; D715-Q717 PolarHBondContact O-N 2.91Å; D715-Q717 PolarHBondContact OD1-N 3.45Å; D715-T718 PolarHBondContact N-OG1 3.34Å; D715-T718 WeakPolarHBondContact O-CB 3.48Å; D715-T718 PolarHBondContact O-N 3.27Å; D715-T718 PolarHBondContact O-OG1 2.97Å; D715-T718 PolarHBondContact OD1-N 3.21Å; D715-T718 VanDerWaalsContact OD1-N 3.16Å; D715-T718 PolarHBondContact OD1-OG1 3.47Å; D715-T718 VanDerWaalsContact OD1-OG1 3.08Å; D715-A746 VanDerWaalsContact C-CB 3.42Å
716	G	82.9	Confident	87	Confident	59 Å²	59	67.7 Å²	67.7	61%	0.608	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.4	-179.1	0	0	0	0	0	114.2
717	Q	83.4	Confident	87.1	Confident	166 Å²	166	60.8 Å²	60.8	78%	0.776	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-19.8	179.8	-60.5	-176.2	6.5	0	0	111.9	D715 P719	D715-Q717 PolarHBondContact O-N 2.91Å; D715-Q717 PolarHBondContact OD1-N 3.45Å; Q717-P719 WeakPolarHBondContact O-CD 3.46Å
718	T	84.8	Confident	87.1	Confident	19 Å²	19	62.6 Å²	62.6	12%	0.117	35%	0.349	C	S	.	.	S	Bend	trans	-65.9	121.7	178.3	-52.6	0	0	0	0	111.1	D715 R723 L726	D715-T718 PolarHBondContact N-OG1 3.34Å; D715-T718 WeakPolarHBondContact O-CB 3.48Å; D715-T718 PolarHBondContact O-N 3.27Å; D715-T718 PolarHBondContact O-OG1 2.97Å; D715-T718 PolarHBondContact OD1-N 3.21Å; D715-T718 VanDerWaalsContact OD1-N 3.16Å; D715-T718 PolarHBondContact OD1-OG1 3.47Å; D715-T718 VanDerWaalsContact OD1-OG1 3.08Å; T718-R723 HydrophobicContact CG2-CG 3.98Å; T718-R723 PolarHBondContact O-NE 3.45Å; T718-R723 PolarHBondContact O-NH2 3Å; T718-R723 VanDerWaalsContact O-NH2 3.07Å; T718-L726 HydrophobicContact CG2-CD1 3.92Å
719	P	82.8	Confident	87.2	Confident	64 Å²	64	61.9 Å²	61.9	42%	0.416	34%	0.336	S	S	.	.			trans	-60.4	139.3	179.7	-23.6	33.4	0	0	0	112.7	Q717 S721 Q722 R723	Q717-P719 WeakPolarHBondContact O-CD 3.46Å; P719-S721 PolarHBondContact O-N 3.26Å; P719-S721 VanDerWaalsContact O-N 3.13Å; P719-Q722 PolarHBondContact O-N 3.18Å; P719-R723 PolarHBondContact O-N 3.35Å
720	T	76.1	Confident	87.2	Confident	90 Å²	90	60 Å²	60	55%	0.552	33%	0.329	S	S	*	.	H	α-helix	trans	-53.9	-37.1	-176.6	-51.5	0	0	0	0	113.4	Q722 R723	T720-Q722 VanDerWaalsContact C-N 3.25Å; T720-Q722 PolarHBondContact O-N 3.27Å; T720-R723 PolarHBondContact O-N 3.5Å
721	S	77	Confident	87.1	Confident	87 Å²	87	59.6 Å²	59.6	61%	0.608	32%	0.32	S	S	*	.	H	α-helix	trans	-65.4	-25.2	179.2	57.2	0	0	0	0	114	P719	P719-S721 PolarHBondContact O-N 3.26Å; P719-S721 VanDerWaalsContact O-N 3.13Å
722	Q	84.1	Confident	86.9	Confident	98 Å²	98	58.6 Å²	58.6	46%	0.458	32%	0.321	S	S	.	.	H	α-helix	trans	-92.3	-24.9	-179.8	-64.6	-177.8	-0.9	0	0	112.6	P719 T720 Q724 R725 L726	P719-Q722 PolarHBondContact O-N 3.18Å; T720-Q722 VanDerWaalsContact C-N 3.25Å; T720-Q722 PolarHBondContact O-N 3.27Å; Q722-Q724 PolarHBondContact O-N 3.45Å; Q722-R725 WeakPolarHBondContact O-CB 3.13Å; Q722-R725 PolarHBondContact O-N 2.99Å; Q722-R725 VanDerWaalsContact O-N 3.1Å; Q722-L726 PolarHBondContact O-N 3.04Å; Q722-L726 VanDerWaalsContact O-N 3.1Å
723	R	84.7	Confident	86.6	Confident	54 Å²	54	62.5 Å²	62.5	20%	0.204	35%	0.346	C	S	.	.	H	α-helix	trans	-54.3	-49	-175.4	-67	-177.8	-172.2	-164.7	-0.3	112.8	L714 T718 P719 T720 R725 L726 V727	L714-R723 HydrophobicContact CD1-CB 4.24Å; L714-R723 HydrophobicContact CD1-CG 4.37Å; L714-R723 HydrophobicContact CG-CG 4.44Å; T718-R723 HydrophobicContact CG2-CG 3.98Å; T718-R723 PolarHBondContact O-NE 3.45Å; T718-R723 PolarHBondContact O-NH2 3Å; T718-R723 VanDerWaalsContact O-NH2 3.07Å; P719-R723 PolarHBondContact O-N 3.35Å; T720-R723 PolarHBondContact O-N 3.5Å; R723-R725 VanDerWaalsContact C-N 3.33Å; R723-R725 PolarHBondContact O-N 3.3Å; R723-L726 PolarHBondContact O-N 2.91Å; R723-V727 WeakPolarHBondContact O-CG2 3.45Å; R723-V727 PolarHBondContact O-N 3.07Å; R723-V727 VanDerWaalsContact O-N 3.17Å
724	Q	83.2	Confident	86.3	Confident	68 Å²	68	69.7 Å²	69.7	32%	0.318	38%	0.375	S	S	.	.	H	α-helix	trans	-65.3	-37.4	-179.2	-169.1	59.8	48.2	0	0	111.9	Q722 L726 V727 D728	Q722-Q724 PolarHBondContact O-N 3.45Å; Q724-L726 VanDerWaalsContact C-N 3.34Å; Q724-L726 PolarHBondContact O-N 2.84Å; Q724-V727 PolarHBondContact O-N 3.09Å; Q724-D728 PolarHBondContact NE2-OD1 3.23Å; Q724-D728 WeakPolarHBondContact O-CB 3.45Å; Q724-D728 PolarHBondContact O-N 2.58Å
725	R	86.6	Confident	86.1	Confident	185 Å²	185	70.9 Å²	70.9	70%	0.698	38%	0.383	S	S	*	.	H	α-helix	trans	-62.9	-40.5	177.7	-61.6	-177.8	-175	173.1	1.1	111.9	Q722 R723 A729	Q722-R725 WeakPolarHBondContact O-CB 3.13Å; Q722-R725 PolarHBondContact O-N 2.99Å; Q722-R725 VanDerWaalsContact O-N 3.1Å; R723-R725 VanDerWaalsContact C-N 3.33Å; R723-R725 PolarHBondContact O-N 3.3Å; R725-A729 WeakPolarHBondContact O-CB 3.36Å; R725-A729 PolarHBondContact O-N 2.96Å
726	L	89.5	Confident	86	Confident	49 Å²	49	78.6 Å²	78.6	26%	0.257	42%	0.419	S	S	.	.	H	α-helix	trans	-64.6	-41.4	176.4	-67.8	173.1	0	0	0	111.7	T718 Q722 R723 Q724 F730	T718-L726 HydrophobicContact CG2-CD1 3.92Å; Q722-L726 PolarHBondContact O-N 3.04Å; Q722-L726 VanDerWaalsContact O-N 3.1Å; R723-L726 PolarHBondContact O-N 2.91Å; Q724-L726 VanDerWaalsContact C-N 3.34Å; Q724-L726 PolarHBondContact O-N 2.84Å; L726-F730 WeakPolarHBondContact O-CB 3.49Å; L726-F730 PolarHBondContact O-N 2.96Å
727	V	89.3	Confident	86.4	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-65.6	-47.2	177.5	171.3	0	0	0	0	111.3	L714 R723 Q724 A729 F730 N731 F740 L751 N752 L753	L714-V727 HydrophobicContact CD1-CG2 4.19Å; R723-V727 WeakPolarHBondContact O-CG2 3.45Å; R723-V727 PolarHBondContact O-N 3.07Å; R723-V727 VanDerWaalsContact O-N 3.17Å; Q724-V727 PolarHBondContact O-N 3.09Å; V727-A729 VanDerWaalsContact C-N 3.35Å; V727-A729 PolarHBondContact O-N 2.86Å; V727-F730 PolarHBondContact O-N 3.41Å; V727-N731 WeakPolarHBondContact O-CB 3.42Å; V727-N731 PolarHBondContact O-N 3.15Å; V727-N731 PolarHBondContact O-ND2 2.71Å; V727-F740 HydrophobicContact CG2-CZ 4.32Å; V727-L751 HydrophobicContact CG2-CD2 4.26Å; V727-N752 WeakPolarHBondContact CG1-O 3.33Å; V727-L753 HydrophobicContact CG1-CD2 4.19Å; V727-L753 HydrophobicContact CG2-CD2 4.15Å
728	D	88.6	Confident	87	Confident	88 Å²	88	69.4 Å²	69.4	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-64.7	-40.8	179.3	-64.8	-20.6	0	0	0	111.3	Q724 N731 S732	Q724-D728 PolarHBondContact NE2-OD1 3.23Å; Q724-D728 WeakPolarHBondContact O-CB 3.45Å; Q724-D728 PolarHBondContact O-N 2.58Å; D728-N731 PolarHBondContact O-N 3.08Å; D728-S732 PolarHBondContact O-N 3.15Å; D728-S732 VanDerWaalsContact O-N 3.1Å
729	A	91.4	Very high	87.5	Confident	51 Å²	51	68.5 Å²	68.5	42%	0.421	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-45.2	174.2	0	0	0	0	0	111.3	R725 V727 S732 S735	R725-A729 WeakPolarHBondContact O-CB 3.36Å; R725-A729 PolarHBondContact O-N 2.96Å; V727-A729 VanDerWaalsContact C-N 3.35Å; V727-A729 PolarHBondContact O-N 2.86Å; A729-S732 WeakPolarHBondContact O-CB 3.09Å; A729-S732 PolarHBondContact O-N 3.12Å; A729-S735 VanDerWaalsContact O-CB 3.29Å; A729-S735 WeakPolarHBondContact O-CB 3.5Å; A729-S735 PolarHBondContact O-OG 3.02Å
730	F	92.8	Very high	88	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-68.6	-33.5	178.7	-178.6	-102.8	0	0	0	113.3	R686 V688 L726 V727 S732 F740 L753 A756	R686-F730 HydrophobicContact CB-CE2 4.13Å; R686-F730 HydrophobicContact CB-CZ 3.78Å; R686-F730 PolarHBondContact NH1-O 3.27Å; V688-F730 HydrophobicContact CG2-CE1 4.2Å; V688-F730 HydrophobicContact CG2-CZ 4.41Å; L726-F730 WeakPolarHBondContact O-CB 3.49Å; L726-F730 PolarHBondContact O-N 2.96Å; V727-F730 PolarHBondContact O-N 3.41Å; F730-S732 VanDerWaalsContact C-N 3.31Å; F730-F740 HydrophobicContact CB-CD2 3.72Å; F730-F740 HydrophobicContact CB-CE2 4.03Å; F730-F740 HydrophobicContact CD1-CB 4.27Å; F730-F740 AromaticContact CD1-CD2 3.9Å; F730-F740 HydrophobicContact CD1-CD2 3.9Å; F730-F740 HydrophobicContact CD1-CG 4.31Å; F730-F740 HydrophobicContact CD2-CB 3.97Å; F730-F740 AromaticContact CD2-CD2 3.81Å; F730-F740 HydrophobicContact CD2-CD2 3.81Å; F730-F740 HydrophobicContact CD2-CG 4.37Å; F730-F740 HydrophobicContact CE1-CB 4.01Å; F730-F740 HydrophobicContact CE1-CD2 4.48Å; F730-F740 HydrophobicContact CE1-CG 4.47Å; F730-F740 HydrophobicContact CE2-CB 3.7Å; F730-F740 HydrophobicContact CE2-CD2 4.42Å; F730-F740 HydrophobicContact CG-CB 4.24Å; F730-F740 AromaticContact CG-CD2 3.52Å; F730-F740 HydrophobicContact CG-CD2 3.52Å; F730-F740 HydrophobicContact CG-CE2 4.28Å; F730-F740 HydrophobicContact CG-CG 4.25Å; F730-F740 HydrophobicContact CZ-CB 3.71Å; F730-L753 HydrophobicContact CD1-CD2 4.15Å; F730-A756 HydrophobicContact CE1-CB 3.93Å; F730-A756 HydrophobicContact CZ-CB 4.09Å
731	N	91.6	Very high	88.9	Confident	39 Å²	39	61.1 Å²	61.1	21%	0.209	31%	0.311	C	S	.	.	H	α-helix	trans	-76.8	-17.2	176.8	-73	-32.6	0	0	0	113.4	V727 D728 N752 I754 G755	V727-N731 WeakPolarHBondContact O-CB 3.42Å; V727-N731 PolarHBondContact O-N 3.15Å; V727-N731 PolarHBondContact O-ND2 2.71Å; D728-N731 PolarHBondContact O-N 3.08Å; N731-N752 PolarHBondContact ND2-O 2.82Å; N731-I754 PolarHBondContact OD1-N 3.42Å; N731-G755 PolarHBondContact OD1-N 2.91Å
732	S	90.9	Very high	89.7	Confident	41 Å²	41	57 Å²	57	29%	0.287	28%	0.282	S	S	.	.	S	Bend	trans	-61.1	134.9	178.4	179.1	0	0	0	0	111	R686 D728 A729 F730 Y734 S735	R686-S732 VanDerWaalsContact CZ-O 3.29Å; R686-S732 PolarHBondContact NH1-O 3.22Å; R686-S732 PolarHBondContact NH2-O 3Å; D728-S732 PolarHBondContact O-N 3.15Å; D728-S732 VanDerWaalsContact O-N 3.1Å; A729-S732 WeakPolarHBondContact O-CB 3.09Å; A729-S732 PolarHBondContact O-N 3.12Å; F730-S732 VanDerWaalsContact C-N 3.31Å; S732-Y734 PolarHBondContact O-N 2.79Å; S732-Y734 VanDerWaalsContact O-N 3.1Å; S732-Y734 PolarHBondContact OG-N 3.23Å; S732-S735 WeakPolarHBondContact O-CB 3.34Å; S732-S735 PolarHBondContact O-N 2.95Å
733	P	85.8	Confident	90	Very high	101 Å²	101	52.8 Å²	52.8	66%	0.656	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.9	175.8	24.8	-33	0	0	0	112.6	R686	R686-P733 PolarHBondContact NH2-O 3.17Å
734	Y	86.9	Confident	89.9	Confident	197 Å²	197	50.6 Å²	50.6	77%	0.773	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	8.5	178.5	-51.5	-73.8	0	0	0	114.2	S732 Q736	S732-Y734 PolarHBondContact O-N 2.79Å; S732-Y734 VanDerWaalsContact O-N 3.1Å; S732-Y734 PolarHBondContact OG-N 3.23Å; Y734-Q736 PolarHBondContact O-N 2.87Å
735	S	87.9	Confident	89.5	Confident	25 Å²	25	54.8 Å²	54.8	18%	0.175	27%	0.273	C	S	.	.			trans	-60	133.6	175.4	-174.5	0	0	0	0	111	A729 S732 S737	A729-S735 VanDerWaalsContact O-CB 3.29Å; A729-S735 WeakPolarHBondContact O-CB 3.5Å; A729-S735 PolarHBondContact O-OG 3.02Å; S732-S735 WeakPolarHBondContact O-CB 3.34Å; S732-S735 PolarHBondContact O-N 2.95Å; S735-S737 VanDerWaalsContact C-N 3.35Å; S735-S737 PolarHBondContact OG-N 3.34Å
736	Q	86.6	Confident	88.5	Confident	170 Å²	170	46.5 Å²	46.5	79%	0.794	24%	0.244	S	C	*	.			trans	-84.2	-15	171.2	-62.4	-63.6	-28.7	0	0	112.1	A710 Y734 F738	A710-Q736 WeakPolarHBondContact CB-O 3.45Å; Y734-Q736 PolarHBondContact O-N 2.87Å; Q736-F738 PolarHBondContact O-N 3.07Å
737	S	91.4	Very high	87.1	Confident	22 Å²	22	44.4 Å²	44.4	15%	0.154	23%	0.234	C	C	.	.			trans	-75.3	116.4	-177.8	-53.7	0	0	0	0	110.7	C712 S735	C712-S737 PolarHBondContact SG-OG 3.04Å; S735-S737 VanDerWaalsContact C-N 3.35Å; S735-S737 PolarHBondContact OG-N 3.34Å
738	F	94.3	Very high	85.7	Confident	9 Å²	9	45.6 Å²	45.6	4%	0.039	25%	0.247	C	C	.	.			trans	-76.3	-38.6	173.7	174.1	-126.6	0	0	0	111.4	L675 I678 R679 D685 R686 V687 Y709 A710 Q736	L675-F738 HydrophobicContact CD2-CE1 4.32Å; I678-F738 HydrophobicContact CB-CZ 4.46Å; I678-F738 HydrophobicContact CG2-CE2 4.06Å; I678-F738 HydrophobicContact CG2-CZ 4.09Å; R679-F738 HydrophobicContact CB-CE1 4.42Å; R679-F738 HydrophobicContact CB-CZ 4.07Å; D685-F738 WeakPolarHBondContact O-CD2 3.49Å; D685-F738 WeakPolarHBondContact O-CE2 3.44Å; R686-F738 WeakPolarHBondContact CA-O 3.19Å; V687-F738 HydrophobicContact CG2-CE2 3.99Å; V687-F738 HydrophobicContact CG2-CZ 3.86Å; V687-F738 PolarHBondContact N-O 3.41Å; Y709-F738 AromaticContact CD1-CD1 4Å; Y709-F738 HydrophobicContact CD1-CD1 4Å; Y709-F738 HydrophobicContact CD1-CE1 4.33Å; Y709-F738 HydrophobicContact CD2-CD1 4.39Å; Y709-F738 HydrophobicContact CD2-CE1 4.43Å; Y709-F738 HydrophobicContact CE1-CE1 4.44Å; Y709-F738 AromaticContact CG-CD1 3.93Å; Y709-F738 HydrophobicContact CG-CD1 3.93Å; Y709-F738 HydrophobicContact CG-CE1 4.34Å; A710-F738 PolarHBondContact O-N 2.91Å; Q736-F738 PolarHBondContact O-N 3.07Å
739	L	95.3	Very high	84.3	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	145.1	-173.1	-74	155.9	0	0	0	112.6	L675 V687 L689 C704 Y709 A710 F711 C712	L675-L739 HydrophobicContact CD1-CD1 4.28Å; L675-L739 HydrophobicContact CD1-CD2 4.4Å; L675-L739 HydrophobicContact CD2-CD2 3.72Å; V687-L739 HydrophobicContact CB-CD2 3.65Å; V687-L739 HydrophobicContact CG1-CD2 4.08Å; V687-L739 HydrophobicContact CG2-CD2 4.42Å; V687-L739 CarbonylContact O-C 3.6Å; V687-L739 WeakPolarHBondContact O-CA 3.5Å; L689-L739 HydrophobicContact CD1-CD2 3.71Å; L689-L739 HydrophobicContact CG-CD2 4.02Å; C704-L739 HydrophobicContact CB-CD1 4.33Å; C704-L739 WeakPolarHBondContact SG-CD1 2.89Å; Y709-L739 HydrophobicContact CD2-CD1 3.8Å; Y709-L739 HydrophobicContact CG-CD1 4.07Å; A710-L739 PolarHBondContact O-N 2.93Å; A710-L739 VanDerWaalsContact O-N 3.14Å; F711-L739 CarbonylContact C-O 3.52Å; F711-L739 VanDerWaalsContact CA-O 3.23Å; F711-L739 WeakPolarHBondContact CA-O 3.34Å; F711-L739 HydrophobicContact CB-CB 3.82Å; C712-L739 PolarHBondContact N-O 2.93Å
740	F	95.2	Very high	82.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	108.1	169.5	-164.9	-79.4	0	0	0	109.9	V687 V688 L689 C712 L714 V727 F730 L742 L753	V687-F740 PolarHBondContact O-N 3.26Å; V688-F740 CarbonylContact C-O 3.55Å; V688-F740 WeakPolarHBondContact CA-O 3.42Å; V688-F740 HydrophobicContact CG2-CB 4.18Å; L689-F740 PolarHBondContact N-O 2.9Å; C712-F740 HydrophobicContact CB-CD2 3.72Å; C712-F740 HydrophobicContact CB-CE2 4.02Å; C712-F740 CarbonylContact O-C 3.52Å; C712-F740 WeakPolarHBondContact O-CA 3.17Å; L714-F740 HydrophobicContact CB-CE1 3.74Å; L714-F740 HydrophobicContact CB-CZ 3.73Å; L714-F740 HydrophobicContact CD1-CE1 4.35Å; L714-F740 HydrophobicContact CD1-CZ 3.9Å; L714-F740 HydrophobicContact CG-CZ 4.5Å; V727-F740 HydrophobicContact CG2-CZ 4.32Å; F730-F740 HydrophobicContact CB-CD2 3.72Å; F730-F740 HydrophobicContact CB-CE2 4.03Å; F730-F740 HydrophobicContact CD1-CB 4.27Å; F730-F740 AromaticContact CD1-CD2 3.9Å; F730-F740 HydrophobicContact CD1-CD2 3.9Å; F730-F740 HydrophobicContact CD1-CG 4.31Å; F730-F740 HydrophobicContact CD2-CB 3.97Å; F730-F740 AromaticContact CD2-CD2 3.81Å; F730-F740 HydrophobicContact CD2-CD2 3.81Å; F730-F740 HydrophobicContact CD2-CG 4.37Å; F730-F740 HydrophobicContact CE1-CB 4.01Å; F730-F740 HydrophobicContact CE1-CD2 4.48Å; F730-F740 HydrophobicContact CE1-CG 4.47Å; F730-F740 HydrophobicContact CE2-CB 3.7Å; F730-F740 HydrophobicContact CE2-CD2 4.42Å; F730-F740 HydrophobicContact CG-CB 4.24Å; F730-F740 AromaticContact CG-CD2 3.52Å; F730-F740 HydrophobicContact CG-CD2 3.52Å; F730-F740 HydrophobicContact CG-CE2 4.28Å; F730-F740 HydrophobicContact CG-CG 4.25Å; F730-F740 HydrophobicContact CZ-CB 3.71Å; F740-L742 HydrophobicContact CD1-CB 4.22Å; F740-L742 HydrophobicContact CE1-CB 4.32Å; F740-L742 HydrophobicContact CE1-CD1 4.2Å; F740-L753 HydrophobicContact CD1-CD1 4.19Å; F740-L753 HydrophobicContact CD1-CD2 4.33Å; F740-L753 HydrophobicContact CD2-CD2 4.42Å; F740-L753 HydrophobicContact CE1-CD1 4.19Å; F740-L753 HydrophobicContact CE1-CD2 4.12Å; F740-L753 HydrophobicContact CE2-CD2 4.2Å; F740-L753 HydrophobicContact CG-CD2 4.47Å; F740-L753 HydrophobicContact CZ-CD2 4.05Å
741	L	94.8	Very high	82.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	118	177.4	-53.3	-176.2	0	0	0	109.2	L689 L697 Q701 F711 C712 R713 L714	L689-L741 HydrophobicContact CB-CD2 3.79Å; L689-L741 HydrophobicContact CD1-CD2 3.6Å; L689-L741 HydrophobicContact CG-CD2 4.28Å; L697-L741 HydrophobicContact CD2-CB 4.3Å; Q701-L741 HydrophobicContact CB-CD1 3.93Å; Q701-L741 HydrophobicContact CG-CD1 4.19Å; F711-L741 HydrophobicContact CD2-CD1 4.06Å; C712-L741 PolarHBondContact O-N 3.14Å; R713-L741 CarbonylContact C-O 3.53Å; R713-L741 WeakPolarHBondContact CA-O 3.41Å; R713-L741 HydrophobicContact CB-CB 4.17Å; R713-L741 HydrophobicContact CG-CB 4.23Å; L714-L741 PolarHBondContact N-O 2.93Å
742	L	93	Very high	81.9	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.4	-176.6	-178.8	65.6	0	0	0	110.5	V688 L689 V690 S691 L714 F740 L751 L753	V688-L742 HydrophobicContact CG1-CB 4.25Å; V688-L742 HydrophobicContact CG1-CD2 4.46Å; L689-L742 PolarHBondContact O-N 2.84Å; V690-L742 VanDerWaalsContact CA-O 3.32Å; V690-L742 WeakPolarHBondContact CA-O 3.3Å; V690-L742 HydrophobicContact CG2-CB 4.42Å; V690-L742 HydrophobicContact CG2-CD2 4.33Å; S691-L742 PolarHBondContact N-O 2.89Å; S691-L742 VanDerWaalsContact N-O 3.07Å; L714-L742 HydrophobicContact CB-CD1 4.29Å; L714-L742 HydrophobicContact CD2-CD1 3.99Å; F740-L742 HydrophobicContact CD1-CB 4.22Å; F740-L742 HydrophobicContact CE1-CB 4.32Å; F740-L742 HydrophobicContact CE1-CD1 4.2Å; L742-L751 HydrophobicContact CD1-CD1 4.4Å; L742-L753 HydrophobicContact CD2-CD1 4.04Å
743	S	90.8	Very high	81.8	Confident	8 Å²	8	40.9 Å²	40.9	6%	0.056	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	128.8	164.4	174	0	0	0	0	110.3	S691 L714 K745 A746 G747	S691-S743 CarbonylContact O-C 3.59Å; S691-S743 VanDerWaalsContact O-CA 3.26Å; S691-S743 WeakPolarHBondContact O-CA 3.34Å; L714-S743 PolarHBondContact O-N 3.48Å; L714-S743 VanDerWaalsContact O-N 3.12Å; S743-K745 PolarHBondContact O-N 2.98Å; S743-K745 VanDerWaalsContact O-N 3.11Å; S743-A746 CarbonylContact O-C 3.53Å; S743-A746 PolarHBondContact O-N 3.24Å; S743-G747 PolarHBondContact O-N 3.34Å
744	S	81.6	Confident	82.1	Confident	8 Å²	8	38.1 Å²	38.1	6%	0.056	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-37.8	-178.4	-42.7	0	0	0	0	112.7	V690 S691 N692	V690-S744 WeakPolarHBondContact CG1-OG 3.32Å; S691-S744 PolarHBondContact O-N 3.46Å; S691-S744 PolarHBondContact O-OG 2.9Å; N692-S744 WeakPolarHBondContact OD1-CB 3.07Å; N692-S744 PolarHBondContact OD1-OG 3.07Å
745	K	74.9	Confident	82.2	Confident	157 Å²	157	29.9 Å²	29.9	68%	0.683	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-33.1	177.9	-63.8	-177	-178.9	178.4	0	113.1	S743 G747	S743-K745 PolarHBondContact O-N 2.98Å; S743-K745 VanDerWaalsContact O-N 3.11Å; K745-G747 VanDerWaalsContact C-N 3.33Å
746	A	66.9	Low	82.5	Confident	11 Å²	11	28.7 Å²	28.7	9%	0.091	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-23.8	177	0	0	0	0	0	112.4	L714 D715 S743 G748	L714-A746 HydrophobicContact CD2-CB 4Å; D715-A746 VanDerWaalsContact C-CB 3.42Å; S743-A746 CarbonylContact O-C 3.53Å; S743-A746 PolarHBondContact O-N 3.24Å; A746-G748 PolarHBondContact O-N 3.46Å
747	G	58.4	Low	82.8	Confident	4 Å²	4	20.7 Å²	20.7	4%	0.041	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	24.1	170.8	0	0	0	0	0	115.2	S743 K745 R777	S743-G747 PolarHBondContact O-N 3.34Å; K745-G747 VanDerWaalsContact C-N 3.33Å; G747-R777 PolarHBondContact O-NE 2.94Å; G747-R777 VanDerWaalsContact O-NE 3.13Å; G747-R777 PolarHBondContact O-NH2 3.32Å
748	G	60.2	Low	83	Confident	26 Å²	26	19.6 Å²	19.6	27%	0.268	12%	0.117	S	C	.	.			trans	-53.7	-179.1	179.3	0	0	0	0	0	114.2	A746 G750 R777	A746-G748 PolarHBondContact O-N 3.46Å; G748-G750 PolarHBondContact O-N 2.9Å; G748-R777 PolarHBondContact O-NH2 2.74Å
749	V	59.3	Low	83	Confident	34 Å²	34	19.2 Å²	19.2	21%	0.206	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-41.5	119	-163.4	-165.9	0	0	0	0	113.2	L394 E460	L394-V749 HydrophobicContact CD1-CB 3.81Å; L394-V749 HydrophobicContact CD1-CG1 3.34Å; L394-V749 HydrophobicContact CD2-CB 4.36Å; L394-V749 HydrophobicContact CD2-CG1 4.17Å; L394-V749 WeakPolarHBondContact CD2-O 3.41Å; L394-V749 HydrophobicContact CG-CB 4.25Å; L394-V749 HydrophobicContact CG-CG1 4.17Å; E460-V749 HydrophobicContact CG-CG1 3.93Å; E460-V749 HydrophobicContact CG-CG2 4.16Å; E460-V749 WeakPolarHBondContact OE1-CG1 3.46Å
750	G	63	Low	83	Confident	18 Å²	18	19.2 Å²	19.2	19%	0.186	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	112.1	-10.2	157.2	0	0	0	0	0	118	G748 R777 R780	G748-G750 PolarHBondContact O-N 2.9Å; G750-R777 VanDerWaalsContact N-NH1 3.16Å; G750-R780 PolarHBondContact O-NH1 2.94Å
751	L	77.9	Confident	83	Confident	17 Å²	17	19.2 Å²	19.2	9%	0.089	12%	0.116	C	C	.	.			trans	-64	147.4	-177.8	-56.5	-176.7	0	0	0	112.4	L714 V727 L742 R777 R780	L714-L751 HydrophobicContact CD1-CD1 3.91Å; L714-L751 HydrophobicContact CD2-CD1 4.37Å; V727-L751 HydrophobicContact CG2-CD2 4.26Å; L742-L751 HydrophobicContact CD1-CD1 4.4Å; L751-R777 WeakPolarHBondContact O-CD 3.41Å; L751-R780 PolarHBondContact O-NH1 3.06Å; L751-R780 VanDerWaalsContact O-NH1 3.12Å
752	N	85.6	Confident	83	Confident	51 Å²	51	19.2 Å²	19.2	27%	0.273	12%	0.116	S	C	.	.			trans	-126.6	110	178.6	-167.1	31	0	0	0	109.2	V727 N731 I754	V727-N752 WeakPolarHBondContact CG1-O 3.33Å; N731-N752 PolarHBondContact ND2-O 2.82Å; N752-I754 VanDerWaalsContact OD1-CG2 3.28Å; N752-I754 WeakPolarHBondContact OD1-CG2 3.45Å
753	L	89.1	Confident	83	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.116	C	C	.	.			trans	-117	44.7	-174.8	-65.1	172.9	0	0	0	111	V688 V727 F730 F740 L742 G755 A756 R777 V778	V688-L753 HydrophobicContact CG1-CD1 4.22Å; V688-L753 HydrophobicContact CG2-CB 4.36Å; V688-L753 HydrophobicContact CG2-CD1 4.2Å; V727-L753 HydrophobicContact CG1-CD2 4.19Å; V727-L753 HydrophobicContact CG2-CD2 4.15Å; F730-L753 HydrophobicContact CD1-CD2 4.15Å; F740-L753 HydrophobicContact CD1-CD1 4.19Å; F740-L753 HydrophobicContact CD1-CD2 4.33Å; F740-L753 HydrophobicContact CD2-CD2 4.42Å; F740-L753 HydrophobicContact CE1-CD1 4.19Å; F740-L753 HydrophobicContact CE1-CD2 4.12Å; F740-L753 HydrophobicContact CE2-CD2 4.2Å; F740-L753 HydrophobicContact CG-CD2 4.47Å; F740-L753 HydrophobicContact CZ-CD2 4.05Å; L742-L753 HydrophobicContact CD2-CD1 4.04Å; L753-G755 PolarHBondContact O-N 3.01Å; L753-A756 PolarHBondContact O-N 3.21Å; L753-R777 HydrophobicContact CD1-CB 4.35Å; L753-R777 PolarHBondContact N-O 3.29Å; L753-V778 HydrophobicContact CB-CG2 4.12Å
754	I	90.4	Very high	82.9	Confident	43 Å²	43	18.9 Å²	18.9	22%	0.221	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.7	-179	54.8	165.4	0	0	0	114	N731 N752 A756 R780 Q783	N731-I754 PolarHBondContact OD1-N 3.42Å; N752-I754 VanDerWaalsContact OD1-CG2 3.28Å; N752-I754 WeakPolarHBondContact OD1-CG2 3.45Å; I754-A756 PolarHBondContact O-N 3.1Å; I754-R780 HydrophobicContact CG2-CB 4.3Å; I754-Q783 HydrophobicContact CG2-CB 4.41Å; I754-Q783 PolarHBondContact O-NE2 2.99Å
755	G	89.8	Confident	83.1	Confident	23 Å²	23	19.7 Å²	19.7	24%	0.237	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.5	174.2	0	0	0	0	0	114	N731 L753	N731-G755 PolarHBondContact OD1-N 2.91Å; L753-G755 PolarHBondContact O-N 3.01Å
756	A	93.6	Very high	83.5	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.008	10%	0.099	C	C	.	.			trans	-94.2	145	176.8	0	0	0	0	0	112.3	R686 V688 F730 L753 I754 V778 Q783	R686-A756 WeakPolarHBondContact O-CA 3.29Å; V688-A756 HydrophobicContact CG2-CB 3.5Å; F730-A756 HydrophobicContact CE1-CB 3.93Å; F730-A756 HydrophobicContact CZ-CB 4.09Å; L753-A756 PolarHBondContact O-N 3.21Å; I754-A756 PolarHBondContact O-N 3.1Å; A756-V778 HydrophobicContact CB-CG1 4.15Å; A756-V778 HydrophobicContact CB-CG2 4.43Å; A756-V778 WeakPolarHBondContact O-CG1 3.22Å; A756-Q783 PolarHBondContact O-NE2 3.42Å
757	S	93.5	Very high	84	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.007	11%	0.112	C	C	.	.	S	Bend	trans	-105.1	-23	170.2	47.9	0	0	0	0	112	D685 R686 V787 H788	D685-S757 VanDerWaalsContact CB-OG 3.28Å; D685-S757 WeakPolarHBondContact CB-OG 2.86Å; D685-S757 PolarHBondContact OD1-OG 2.69Å; D685-S757 PolarHBondContact OD2-OG 3.44Å; R686-S757 PolarHBondContact O-N 3.25Å; R686-S757 VanDerWaalsContact O-N 3.09Å; S757-V787 CarbonylContact O-C 3.6Å; S757-V787 VanDerWaalsContact O-CA 3.23Å; S757-V787 WeakPolarHBondContact O-CA 3.33Å; S757-H788 PolarHBondContact O-N 3.24Å
758	H	94.8	Very high	85	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.4	179.7	-62.1	-88.6	0	0	0	110.4	I678 D685 R686 V687 V688 H788 Y790 Y914	I678-H758 HydrophobicContact CD1-CB 4.14Å; D685-H758 IonicContact OD2-CD2 3.62Å; D685-H758 IonicContact OD2-NE2 3.41Å; D685-H758 PolarHBondContact OD2-NE2 2.9Å; R686-H758 PolarHBondContact O-N 3Å; V687-H758 CarbonylContact C-O 3.57Å; V687-H758 WeakPolarHBondContact CA-O 3.46Å; V687-H758 HydrophobicContact CB-CB 4.33Å; V687-H758 HydrophobicContact CG1-CB 4.11Å; V687-H758 HydrophobicContact CG2-CB 4.01Å; V688-H758 PolarHBondContact N-O 2.93Å; H758-H788 CarbonylContact C-O 3.39Å; H758-H788 WeakPolarHBondContact CA-O 3.43Å; H758-H788 AromaticContact CE1-CD2 3.67Å; H758-H788 AromaticContact CE1-CG 3.77Å; H758-H788 WeakPolarHBondContact ND1-CB 3.41Å; H758-H788 AromaticContact ND1-CG 3.82Å; H758-Y790 HydrophobicContact CB-CE2 4.48Å; H758-Y790 AromaticContact ND1-CE2 3.56Å; H758-Y914 AromaticContact CE1-CD2 3.67Å; H758-Y914 AromaticContact CE1-CE2 3.51Å; H758-Y914 AromaticContact CE1-CZ 3.95Å
759	L	95.2	Very high	85.7	Confident	0 Å²	0	20 Å²	20	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.9	172.3	178	157.3	0	0	0	109.2	V688 V690 L761 M775 V778 H788 I789 Y790	V688-L759 WeakPolarHBondContact O-CA 3.45Å; V690-L759 HydrophobicContact CG2-CD1 4.39Å; V690-L759 HydrophobicContact CG2-CG 4.28Å; L759-L761 HydrophobicContact CD2-CD2 3.52Å; L759-L761 HydrophobicContact CD2-CG 3.69Å; L759-M775 HydrophobicContact CD2-CG 4.36Å; L759-V778 HydrophobicContact CB-CG2 4.31Å; L759-V778 HydrophobicContact CD1-CB 4.11Å; L759-V778 HydrophobicContact CD1-CG2 3.62Å; L759-V778 HydrophobicContact CG-CG2 4.5Å; L759-H788 PolarHBondContact N-O 3.28Å; L759-I789 HydrophobicContact CD2-CG2 4.21Å; L759-I789 CarbonylContact O-C 3.59Å; L759-I789 WeakPolarHBondContact O-CA 3.18Å; L759-Y790 PolarHBondContact O-N 3.16Å
760	V	96	Very high	86.6	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	116.9	177.4	-178.2	0	0	0	0	109	L671 L674 V687 V688 L689 V690 Y762 Y790 L792	L671-V760 HydrophobicContact CD1-CG1 4.16Å; L671-V760 HydrophobicContact CD1-CG2 4.45Å; L674-V760 HydrophobicContact CD2-CG2 4.03Å; V687-V760 HydrophobicContact CG1-CG2 4.09Å; V688-V760 PolarHBondContact O-N 3.09Å; L689-V760 HydrophobicContact CD2-CB 3.65Å; L689-V760 HydrophobicContact CD2-CG1 4.05Å; L689-V760 HydrophobicContact CD2-CG2 4.19Å; V690-V760 PolarHBondContact N-O 2.92Å; V760-Y762 PolarHBondContact O-N 3.05Å; V760-Y790 CarbonylContact C-O 3.58Å; V760-Y790 WeakPolarHBondContact CA-O 3.12Å; V760-Y790 HydrophobicContact CG2-CD2 3.97Å; V760-L792 HydrophobicContact CG1-CD1 3.81Å; V760-L792 HydrophobicContact CG1-CG 3.98Å
761	L	94.9	Very high	87.6	Confident	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	102.1	167.7	-58.8	-174.6	0	0	0	107.8	V690 L759 D771 A774 M775 Y790 R791 L792	V690-L761 HydrophobicContact CB-CD2 3.7Å; V690-L761 HydrophobicContact CG1-CD2 4.02Å; V690-L761 HydrophobicContact CG2-CD2 4.02Å; L759-L761 HydrophobicContact CD2-CD2 3.52Å; L759-L761 HydrophobicContact CD2-CG 3.69Å; L761-D771 HydrophobicContact CD1-CB 4.03Å; L761-A774 HydrophobicContact CD2-CB 4.34Å; L761-M775 HydrophobicContact CD1-CG 4.24Å; L761-M775 HydrophobicContact CD1-SD 4.34Å; L761-Y790 PolarHBondContact N-O 3.36Å; L761-R791 HydrophobicContact CB-CG 4.49Å; L761-R791 HydrophobicContact CD1-CG 4Å; L761-L792 PolarHBondContact O-N 3.11Å
762	Y	95.2	Very high	87.6	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.124	C	C	.	.			trans	-73.1	-36.1	-176	-170.3	-93.2	0	0	0	112.4	N621 K667 L671 V690 T696 L700 V760 L792	N621-Y762 HydrophobicContact CB-CE1 3.96Å; N621-Y762 PolarHBondContact O-OH 3.34Å; K667-Y762 HydrophobicContact CB-CE2 4.07Å; K667-Y762 PolarHBondContact NZ-O 3.22Å; L671-Y762 HydrophobicContact CD2-CD2 3.95Å; L671-Y762 HydrophobicContact CD2-CE2 3.95Å; V690-Y762 PolarHBondContact O-N 2.97Å; T696-Y762 HydrophobicContact CG2-CD1 3.51Å; T696-Y762 HydrophobicContact CG2-CE1 3.56Å; T696-Y762 HydrophobicContact CG2-CG 4.45Å; L700-Y762 HydrophobicContact CD1-CD2 4.37Å; L700-Y762 HydrophobicContact CD1-CG 4.25Å; L700-Y762 HydrophobicContact CD2-CD2 4.19Å; L700-Y762 HydrophobicContact CD2-CE2 4.01Å; V760-Y762 PolarHBondContact O-N 3.05Å; Y762-L792 HydrophobicContact CD2-CD1 4.04Å; Y762-L792 HydrophobicContact CE2-CD1 4.47Å
763	D	91.9	Very high	87.3	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	12%	0.12	C	C	.	.	S	Bend	trans	-139.8	148.9	177.3	66.4	-79.8	0	0	0	111.3	S691 N692 Y693	S691-D763 WeakPolarHBondContact CA-OD1 3.37Å; S691-D763 WeakPolarHBondContact CB-OD1 3.45Å; S691-D763 PolarHBondContact OG-OD1 3.19Å; N692-D763 WeakPolarHBondContact CB-OD2 3.25Å; N692-D763 VanDerWaalsContact CG-OD2 3.31Å; N692-D763 PolarHBondContact N-OD1 3.32Å; N692-D763 PolarHBondContact N-OD2 3.25Å; N692-D763 VanDerWaalsContact N-OD2 3.12Å; N692-D763 PolarHBondContact ND2-O 2.95Å; N692-D763 PolarHBondContact ND2-OD2 3.45Å; Y693-D763 WeakPolarHBondContact CD2-OD2 3.43Å; Y693-D763 WeakPolarHBondContact CE2-OD2 3.45Å
764	I	88.4	Confident	87.1	Confident	1 Å²	1	22 Å²	22	1%	0.005	12%	0.123	C	C	.	.			trans	-98.7	147.8	-176.5	59.8	166.8	0	0	0	112.5	K617 L793 E799 I802 F803	K617-I764 PolarHBondContact NZ-O 3.13Å; I764-L793 HydrophobicContact CD1-CD2 3.66Å; I764-L793 HydrophobicContact CG1-CD2 4.08Å; I764-L793 HydrophobicContact CG2-CD2 3.72Å; I764-E799 VanDerWaalsContact CD1-O 3.23Å; I764-E799 WeakPolarHBondContact CD1-O 3.3Å; I764-I802 HydrophobicContact CD1-CB 3.75Å; I764-I802 HydrophobicContact CD1-CG2 3.61Å; I764-I802 HydrophobicContact CG1-CG2 4.13Å; I764-F803 HydrophobicContact CD1-CB 3.98Å
765	D	85.9	Confident	86.9	Confident	24 Å²	24	20.3 Å²	20.3	13%	0.128	11%	0.114	C	C	.	.			trans	-93.7	160.5	172.2	-156.9	-9.5	0	0	0	111.3	N692 N767 N770 Q806	N692-D765 PolarHBondContact ND2-N 2.84Å; D765-N767 PolarHBondContact O-N 3.09Å; D765-N770 HydrophobicContact CB-CB 4.41Å; D765-N770 PolarHBondContact OD2-ND2 3.48Å; D765-Q806 VanDerWaalsContact O-CD 3.23Å; D765-Q806 PolarHBondContact O-NE2 2.88Å
766	W	82.8	Confident	86.4	Confident	82 Å²	82	20.1 Å²	20.1	31%	0.311	11%	0.11	S	C	.	.	S	Bend	trans	-67.3	-29.1	171.3	-68.8	89.2	0	0	0	112.2	I613 P768 I802 F828 L836	I613-W766 HydrophobicContact CD1-CZ2 4.17Å; I613-W766 HydrophobicContact CG2-CZ2 3.94Å; W766-P768 VanDerWaalsContact O-CD 3.3Å; W766-P768 WeakPolarHBondContact O-CD 3.49Å; W766-I802 HydrophobicContact CD2-CD1 4.45Å; W766-I802 HydrophobicContact CD2-CG1 4.23Å; W766-I802 HydrophobicContact CD2-CG2 4.22Å; W766-I802 HydrophobicContact CE3-CG1 4.22Å; W766-I802 HydrophobicContact CE3-CG2 4.3Å; W766-I802 HydrophobicContact CG-CG2 4.5Å; W766-I802 HydrophobicContact CH2-CD1 4.37Å; W766-I802 HydrophobicContact CH2-CG1 3.87Å; W766-I802 HydrophobicContact CZ2-CD1 3.8Å; W766-I802 HydrophobicContact CZ2-CG1 3.81Å; W766-I802 HydrophobicContact CZ3-CG1 4.05Å; W766-F828 HydrophobicContact CH2-CE1 4.1Å; W766-F828 AromaticContact CH2-CZ 3.84Å; W766-F828 HydrophobicContact CH2-CZ 3.84Å; W766-F828 HydrophobicContact CZ2-CZ 4.42Å; W766-F828 HydrophobicContact CZ3-CE1 4.06Å; W766-F828 HydrophobicContact CZ3-CZ 4.1Å; W766-L836 HydrophobicContact CH2-CD1 3.5Å; W766-L836 HydrophobicContact CH2-CD2 4.32Å; W766-L836 HydrophobicContact CZ2-CD1 4.47Å; W766-L836 HydrophobicContact CZ3-CD1 4.14Å
767	N	78.6	Confident	86	Confident	66 Å²	66	20.4 Å²	20.4	35%	0.353	11%	0.111	S	C	.	.	S	Bend	trans	-93.9	108.7	178.3	-176.1	7.8	0	0	0	110.9	D765 A769 N770	D765-N767 PolarHBondContact O-N 3.09Å; N767-A769 PolarHBondContact O-N 3.15Å; N767-A769 VanDerWaalsContact O-N 3.08Å; N767-A769 WeakPolarHBondContact OD1-CB 3.13Å; N767-A769 PolarHBondContact OD1-N 3.25Å; N767-A769 VanDerWaalsContact OD1-N 3.11Å; N767-N770 PolarHBondContact O-N 3.02Å; N767-N770 VanDerWaalsContact O-N 3.14Å
768	P	77.9	Confident	85.8	Confident	8 Å²	8	20.4 Å²	20.4	5%	0.052	11%	0.111	C	C	.	.	H	α-helix	trans	-57.9	-25.1	178.6	16.1	-27	0	0	0	114.3	W766 N770 D771 I772 Q806 Q810	W766-P768 VanDerWaalsContact O-CD 3.3Å; W766-P768 WeakPolarHBondContact O-CD 3.49Å; P768-N770 PolarHBondContact O-N 2.96Å; P768-D771 PolarHBondContact O-N 3.41Å; P768-I772 WeakPolarHBondContact O-CG1 3.45Å; P768-I772 PolarHBondContact O-N 3.16Å; P768-I772 VanDerWaalsContact O-N 3.08Å; P768-Q806 HydrophobicContact CB-CB 4.29Å; P768-Q806 HydrophobicContact CB-CG 4.45Å; P768-Q806 HydrophobicContact CG-CB 4.49Å; P768-Q810 HydrophobicContact CB-CG 3.53Å; P768-Q810 HydrophobicContact CG-CG 3.69Å
769	A	75.1	Confident	85.4	Confident	48 Å²	48	21 Å²	21	40%	0.397	11%	0.113	S	C	.	.	H	α-helix	trans	-63.7	-30.8	-179.6	0	0	0	0	0	112.5	N767 Q773	N767-A769 PolarHBondContact O-N 3.15Å; N767-A769 VanDerWaalsContact O-N 3.08Å; N767-A769 WeakPolarHBondContact OD1-CB 3.13Å; N767-A769 PolarHBondContact OD1-N 3.25Å; N767-A769 VanDerWaalsContact OD1-N 3.11Å; A769-Q773 VanDerWaalsContact O-CB 3.22Å; A769-Q773 WeakPolarHBondContact O-CB 3.35Å; A769-Q773 PolarHBondContact O-N 2.9Å
770	N	78.9	Confident	85	Confident	45 Å²	45	24.4 Å²	24.4	24%	0.241	13%	0.126	C	C	.	.	H	α-helix	trans	-68.9	-41.8	179.1	-67.8	-17.5	0	0	0	110.9	D765 N767 P768 Q773 A774	D765-N770 HydrophobicContact CB-CB 4.41Å; D765-N770 PolarHBondContact OD2-ND2 3.48Å; N767-N770 PolarHBondContact O-N 3.02Å; N767-N770 VanDerWaalsContact O-N 3.14Å; P768-N770 PolarHBondContact O-N 2.96Å; N770-Q773 PolarHBondContact O-N 3.29Å; N770-A774 PolarHBondContact O-N 2.89Å
771	D	83.2	Confident	84.2	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-67.9	-44.6	178.1	-62.4	-8.6	0	0	0	110.8	L761 P768 Q773 A774 M775 Q806	L761-D771 HydrophobicContact CD1-CB 4.03Å; P768-D771 PolarHBondContact O-N 3.41Å; D771-Q773 VanDerWaalsContact C-N 3.28Å; D771-Q773 PolarHBondContact O-N 3.13Å; D771-A774 PolarHBondContact O-N 3.21Å; D771-A774 VanDerWaalsContact O-N 3.16Å; D771-M775 WeakPolarHBondContact O-CG 3.38Å; D771-M775 PolarHBondContact O-N 3.22Å; D771-Q806 PolarHBondContact OD2-NE2 3Å
772	I	79.5	Confident	83.6	Confident	66 Å²	66	30.3 Å²	30.3	34%	0.338	17%	0.166	S	C	.	.	H	α-helix	trans	-58.2	-42.7	173.7	-67.3	166.9	0	0	0	111.1	P768 A774 M775 A776 Q810	P768-I772 WeakPolarHBondContact O-CG1 3.45Å; P768-I772 PolarHBondContact O-N 3.16Å; P768-I772 VanDerWaalsContact O-N 3.08Å; I772-A774 VanDerWaalsContact C-N 3.31Å; I772-A774 PolarHBondContact O-N 3.39Å; I772-M775 VanDerWaalsContact CA-CE 3.47Å; I772-M775 HydrophobicContact CB-CE 4.2Å; I772-M775 HydrophobicContact CG1-CE 3.81Å; I772-M775 PolarHBondContact O-N 3.14Å; I772-A776 WeakPolarHBondContact O-CB 3.29Å; I772-A776 PolarHBondContact O-N 3.34Å; I772-Q810 VanDerWaalsContact CD1-NE2 3.34Å
773	Q	78.9	Confident	83.3	Confident	42 Å²	42	31.1 Å²	31.1	20%	0.196	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-38.2	178.7	-175.1	176.4	61.5	0	0	112	M356 A769 N770 D771 R777	M356-Q773 HydrophobicContact CE-CG 4.28Å; M356-Q773 HydrophobicContact SD-CG 4.44Å; A769-Q773 VanDerWaalsContact O-CB 3.22Å; A769-Q773 WeakPolarHBondContact O-CB 3.35Å; A769-Q773 PolarHBondContact O-N 2.9Å; N770-Q773 PolarHBondContact O-N 3.29Å; D771-Q773 VanDerWaalsContact C-N 3.28Å; D771-Q773 PolarHBondContact O-N 3.13Å; Q773-R777 WeakPolarHBondContact O-CG 3.29Å
774	A	84	Confident	83.1	Confident	6 Å²	6	40.3 Å²	40.3	5%	0.05	21%	0.21	C	C	.	.	H	α-helix	trans	-66.3	-46.1	175.2	0	0	0	0	0	111.7	V690 L761 N770 D771 I772 A776 R777	V690-A774 HydrophobicContact CG1-CB 4.07Å; V690-A774 HydrophobicContact CG2-CB 4.44Å; L761-A774 HydrophobicContact CD2-CB 4.34Å; N770-A774 PolarHBondContact O-N 2.89Å; D771-A774 PolarHBondContact O-N 3.21Å; D771-A774 VanDerWaalsContact O-N 3.16Å; I772-A774 VanDerWaalsContact C-N 3.31Å; I772-A774 PolarHBondContact O-N 3.39Å; A774-A776 VanDerWaalsContact C-N 3.31Å; A774-A776 PolarHBondContact O-N 2.88Å; A774-R777 VanDerWaalsContact O-CB 3.27Å; A774-R777 WeakPolarHBondContact O-CB 3.31Å; A774-R777 WeakPolarHBondContact O-CG 3.33Å; A774-R777 PolarHBondContact O-N 3.43Å
775	M	86	Confident	83.2	Confident	7 Å²	7	44 Å²	44	3%	0.034	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-41.9	176.4	-67.4	-175.5	-63.6	0	0	112.1	L759 L761 D771 I772 R777 V778 W779 I789 R791	L759-M775 HydrophobicContact CD2-CG 4.36Å; L761-M775 HydrophobicContact CD1-CG 4.24Å; L761-M775 HydrophobicContact CD1-SD 4.34Å; D771-M775 WeakPolarHBondContact O-CG 3.38Å; D771-M775 PolarHBondContact O-N 3.22Å; I772-M775 VanDerWaalsContact CA-CE 3.47Å; I772-M775 HydrophobicContact CB-CE 4.2Å; I772-M775 HydrophobicContact CG1-CE 3.81Å; I772-M775 PolarHBondContact O-N 3.14Å; M775-R777 PolarHBondContact O-N 3.46Å; M775-V778 PolarHBondContact O-N 2.87Å; M775-W779 PolarHBondContact O-N 3.02Å; M775-I789 HydrophobicContact CB-CD1 3.84Å; M775-I789 HydrophobicContact CG-CD1 3.82Å; M775-I789 HydrophobicContact CG-CG2 4.04Å; M775-I789 HydrophobicContact SD-CD1 3.9Å; M775-I789 HydrophobicContact SD-CG2 3.63Å; M775-R791 VanDerWaalsContact CE-NH2 3.33Å; M775-R791 PolarHBondContact SD-NH2 2.97Å; M775-R791 VanDerWaalsContact SD-NH2 3.43Å
776	A	80.7	Confident	83.5	Confident	19 Å²	19	45.6 Å²	45.6	16%	0.157	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-3.9	177.7	0	0	0	0	0	114.5	I772 A774	I772-A776 WeakPolarHBondContact O-CB 3.29Å; I772-A776 PolarHBondContact O-N 3.34Å; A774-A776 VanDerWaalsContact C-N 3.31Å; A774-A776 PolarHBondContact O-N 2.88Å
777	R	84.6	Confident	84	Confident	7 Å²	7	41.7 Å²	41.7	3%	0.026	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-30.3	172.9	-57.8	-58.5	179.5	-149.5	-10	112.9	G747 G748 G750 L751 L753 Q773 A774 M775	G747-R777 PolarHBondContact O-NE 2.94Å; G747-R777 VanDerWaalsContact O-NE 3.13Å; G747-R777 PolarHBondContact O-NH2 3.32Å; G748-R777 PolarHBondContact O-NH2 2.74Å; G750-R777 VanDerWaalsContact N-NH1 3.16Å; L751-R777 WeakPolarHBondContact O-CD 3.41Å; L753-R777 HydrophobicContact CD1-CB 4.35Å; L753-R777 PolarHBondContact N-O 3.29Å; Q773-R777 WeakPolarHBondContact O-CG 3.29Å; A774-R777 VanDerWaalsContact O-CB 3.27Å; A774-R777 WeakPolarHBondContact O-CB 3.31Å; A774-R777 WeakPolarHBondContact O-CG 3.33Å; A774-R777 PolarHBondContact O-N 3.43Å; M775-R777 PolarHBondContact O-N 3.46Å
778	V	88.9	Confident	84.7	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.006	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-45.1	-177.5	177.1	0	0	0	0	110.7	V688 L753 A756 L759 M775 R780 Q783 V787	V688-V778 HydrophobicContact CB-CG2 4.2Å; V688-V778 HydrophobicContact CG2-CG2 3.84Å; L753-V778 HydrophobicContact CB-CG2 4.12Å; A756-V778 HydrophobicContact CB-CG1 4.15Å; A756-V778 HydrophobicContact CB-CG2 4.43Å; A756-V778 WeakPolarHBondContact O-CG1 3.22Å; L759-V778 HydrophobicContact CB-CG2 4.31Å; L759-V778 HydrophobicContact CD1-CB 4.11Å; L759-V778 HydrophobicContact CD1-CG2 3.62Å; L759-V778 HydrophobicContact CG-CG2 4.5Å; M775-V778 PolarHBondContact O-N 2.87Å; V778-R780 PolarHBondContact O-N 3.36Å; V778-R780 VanDerWaalsContact O-N 3.14Å; V778-Q783 PolarHBondContact O-NE2 3.16Å; V778-V787 HydrophobicContact CG1-CG1 3.93Å; V778-V787 HydrophobicContact CG1-CG2 4.37Å
779	W	87.6	Confident	85.5	Confident	14 Å²	14	39.2 Å²	39.2	5%	0.053	21%	0.207	C	C	.	.	S	Bend	trans	-87.3	83.6	176.3	-165.6	61.5	0	0	0	110.6	N564 L567 P568 R570 M775 V787 I930	N564-W779 HydrophobicContact CB-CH2 4.16Å; N564-W779 VanDerWaalsContact CG-CH2 3.44Å; N564-W779 WeakPolarHBondContact OD1-CH2 2.91Å; N564-W779 WeakPolarHBondContact OD1-CZ3 3.39Å; L567-W779 HydrophobicContact CB-CZ2 3.96Å; L567-W779 HydrophobicContact CD1-CD2 3.84Å; L567-W779 HydrophobicContact CD1-CE3 4.1Å; L567-W779 HydrophobicContact CD1-CG 4.41Å; L567-W779 HydrophobicContact CD1-CH2 4.35Å; L567-W779 HydrophobicContact CD1-CZ2 4.04Å; L567-W779 HydrophobicContact CD1-CZ3 4.34Å; P568-W779 PolarHBondContact O-NE1 3.43Å; R570-W779 HydrophobicContact CB-CD2 4.19Å; R570-W779 HydrophobicContact CB-CG 4.41Å; R570-W779 HydrophobicContact CB-CZ2 4.01Å; R570-W779 HydrophobicContact CG-CD2 4.35Å; R570-W779 HydrophobicContact CG-CG 4.32Å; M775-W779 PolarHBondContact O-N 3.02Å; W779-V787 HydrophobicContact CB-CG1 4.48Å; W779-I930 HydrophobicContact CH2-CG2 3.85Å; W779-I930 HydrophobicContact CZ2-CG2 4.29Å
780	R	85	Confident	86.4	Confident	71 Å²	71	36.9 Å²	36.9	27%	0.268	19%	0.188	S	C	.	.	S	Bend	trans	-146	162.8	-173.9	-165.8	166.5	-178	-167.3	-2.1	111.1	G750 L751 I754 V778 G782 Q783	G750-R780 PolarHBondContact O-NH1 2.94Å; L751-R780 PolarHBondContact O-NH1 3.06Å; L751-R780 VanDerWaalsContact O-NH1 3.12Å; I754-R780 HydrophobicContact CG2-CB 4.3Å; V778-R780 PolarHBondContact O-N 3.36Å; V778-R780 VanDerWaalsContact O-N 3.14Å; R780-G782 PolarHBondContact O-N 3.32Å; R780-Q783 WeakPolarHBondContact O-CB 3.42Å; R780-Q783 PolarHBondContact O-N 3.44Å
781	D	79.9	Confident	87.2	Confident	87 Å²	87	35.3 Å²	35.3	47%	0.465	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	130.2	176.3	-170.9	31	0	0	0	111.7
782	G	83.4	Confident	87.7	Confident	37 Å²	37	35.1 Å²	35.1	38%	0.381	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	101.4	-13.1	-168.9	0	0	0	0	0	114.7	R780	R780-G782 PolarHBondContact O-N 3.32Å
783	Q	88.2	Confident	88.4	Confident	18 Å²	18	32 Å²	32	8%	0.084	16%	0.162	C	C	.	.			trans	-65.4	134.4	169.7	-177.3	56.4	-90.5	0	0	110.5	P568 I754 A756 V778 R780 K785 V787	P568-Q783 WeakPolarHBondContact CD-O 3.06Å; P568-Q783 HydrophobicContact CG-CG 4.12Å; P568-Q783 WeakPolarHBondContact CG-O 3.47Å; I754-Q783 HydrophobicContact CG2-CB 4.41Å; I754-Q783 PolarHBondContact O-NE2 2.99Å; A756-Q783 PolarHBondContact O-NE2 3.42Å; V778-Q783 PolarHBondContact O-NE2 3.16Å; R780-Q783 WeakPolarHBondContact O-CB 3.42Å; R780-Q783 PolarHBondContact O-N 3.44Å; Q783-K785 WeakPolarHBondContact CG-O 3.5Å; Q783-V787 HydrophobicContact CG-CG2 3.59Å
784	K	88.4	Confident	89.1	Confident	193 Å²	193	30 Å²	30	84%	0.839	15%	0.153	S	C	*	.			trans	-117.9	-20.8	-178.3	-62.9	-177.1	-178.6	-179	0	113.2
785	K	90.4	Very high	89.4	Confident	79 Å²	79	30 Å²	30	34%	0.343	15%	0.153	S	C	.	.	S	Bend	trans	-101.6	154.4	-179	-65.1	-176.9	172.3	-171.9	0	110.2	P568 S684 D685 Q783 V787	P568-K785 VanDerWaalsContact CB-O 3.29Å; P568-K785 WeakPolarHBondContact CB-O 3.34Å; S684-K785 PolarHBondContact O-NZ 2.77Å; S684-K785 PolarHBondContact OG-NZ 3.11Å; D685-K785 IonicContact OD1-NZ 3.47Å; D685-K785 PolarHBondContact OD1-NZ 3.47Å; Q783-K785 WeakPolarHBondContact CG-O 3.5Å; K785-V787 PolarHBondContact O-N 3.44Å
786	T	91.3	Very high	89.4	Confident	58 Å²	58	29.8 Å²	29.8	36%	0.356	15%	0.152	S	C	.	.	P	Polyproline II helix	trans	-56.6	133.3	165.5	-59	0	0	0	0	109.2	P569 L571	P569-T786 HydrophobicContact CB-CG2 4.25Å; P569-T786 WeakPolarHBondContact O-CA 3.39Å; P569-T786 WeakPolarHBondContact O-CG2 3.45Å; L571-T786 HydrophobicContact CD1-CG2 4.2Å
787	V	93	Very high	89.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	127.9	-177.8	178	0	0	0	0	110.1	P569 R570 L571 S757 V778 W779 Q783 K785 I789	P569-V787 PolarHBondContact O-N 2.81Å; R570-V787 CarbonylContact C-O 3.58Å; R570-V787 WeakPolarHBondContact CA-O 3.21Å; R570-V787 HydrophobicContact CG-CB 4.45Å; L571-V787 PolarHBondContact N-O 3.07Å; S757-V787 CarbonylContact O-C 3.6Å; S757-V787 VanDerWaalsContact O-CA 3.23Å; S757-V787 WeakPolarHBondContact O-CA 3.33Å; V778-V787 HydrophobicContact CG1-CG1 3.93Å; V778-V787 HydrophobicContact CG1-CG2 4.37Å; W779-V787 HydrophobicContact CB-CG1 4.48Å; Q783-V787 HydrophobicContact CG-CG2 3.59Å; K785-V787 PolarHBondContact O-N 3.44Å; V787-I789 HydrophobicContact CG1-CG1 4.06Å
788	H	93.9	Very high	90.2	Very high	20 Å²	20	28.8 Å²	28.8	9%	0.093	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.8	173.4	-59.6	-119	0	0	0	109.3	L571 S757 H758 L759 Y790 D912 Y914	L571-H788 VanDerWaalsContact CD1-CE1 3.41Å; L571-H788 WeakPolarHBondContact CD1-CE1 3.45Å; S757-H788 PolarHBondContact O-N 3.24Å; H758-H788 CarbonylContact C-O 3.39Å; H758-H788 WeakPolarHBondContact CA-O 3.43Å; H758-H788 AromaticContact CE1-CD2 3.67Å; H758-H788 AromaticContact CE1-CG 3.77Å; H758-H788 WeakPolarHBondContact ND1-CB 3.41Å; H758-H788 AromaticContact ND1-CG 3.82Å; L759-H788 PolarHBondContact N-O 3.28Å; H788-Y790 HydrophobicContact CB-CD2 4.48Å; H788-Y790 HydrophobicContact CB-CE1 4.5Å; H788-Y790 HydrophobicContact CB-CE2 3.61Å; H788-Y790 WeakPolarHBondContact CB-OH 3.43Å; H788-Y790 PolarHBondContact ND1-OH 3.45Å; H788-D912 IonicContact CE1-OD2 3.2Å; H788-D912 IonicContact ND1-OD2 3.97Å; H788-D912 PolarHBondContact ND1-OD2 3.42Å; H788-Y914 AromaticContact CE1-CE2 3.89Å
789	I	94.1	Very high	90.3	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.2	179.7	-62.8	-169.6	0	0	0	108	R570 L571 W573 L759 M775 V787	R570-I789 HydrophobicContact CG-CD1 3.94Å; R570-I789 HydrophobicContact CG-CG1 4.23Å; L571-I789 PolarHBondContact O-N 3Å; W573-I789 PolarHBondContact N-O 2.96Å; L759-I789 HydrophobicContact CD2-CG2 4.21Å; L759-I789 CarbonylContact O-C 3.59Å; L759-I789 WeakPolarHBondContact O-CA 3.18Å; M775-I789 HydrophobicContact CB-CD1 3.84Å; M775-I789 HydrophobicContact CG-CD1 3.82Å; M775-I789 HydrophobicContact CG-CG2 4.04Å; M775-I789 HydrophobicContact SD-CD1 3.9Å; M775-I789 HydrophobicContact SD-CG2 3.63Å; V787-I789 HydrophobicContact CG1-CG1 4.06Å
790	Y	94.9	Very high	90.5	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	122.3	179	-54.1	-78	0	0	0	110	W573 L575 L674 H758 L759 V760 L761 H788 D912 L915	W573-Y790 HydrophobicContact CB-CD1 3.73Å; W573-Y790 HydrophobicContact CB-CE1 4.27Å; W573-Y790 AromaticContact CD1-CD1 3.8Å; W573-Y790 AromaticContact CD1-CE1 3.45Å; W573-Y790 VanDerWaalsContact CD1-CE1 3.45Å; W573-Y790 AromaticContact CG-CD1 3.96Å; W573-Y790 HydrophobicContact CG-CD1 3.96Å; W573-Y790 AromaticContact CG-CE1 3.98Å; W573-Y790 HydrophobicContact CG-CE1 3.98Å; W573-Y790 CarbonylContact O-C 3.56Å; L575-Y790 HydrophobicContact CD1-CD1 4.14Å; L674-Y790 HydrophobicContact CD1-CE2 4.3Å; L674-Y790 HydrophobicContact CD2-CD1 4.43Å; L674-Y790 HydrophobicContact CD2-CD2 3.85Å; L674-Y790 HydrophobicContact CD2-CE2 4.15Å; L674-Y790 HydrophobicContact CD2-CG 3.99Å; H758-Y790 HydrophobicContact CB-CE2 4.48Å; H758-Y790 AromaticContact ND1-CE2 3.56Å; L759-Y790 PolarHBondContact O-N 3.16Å; V760-Y790 CarbonylContact C-O 3.58Å; V760-Y790 WeakPolarHBondContact CA-O 3.12Å; V760-Y790 HydrophobicContact CG2-CD2 3.97Å; L761-Y790 PolarHBondContact N-O 3.36Å; H788-Y790 HydrophobicContact CB-CD2 4.48Å; H788-Y790 HydrophobicContact CB-CE1 4.5Å; H788-Y790 HydrophobicContact CB-CE2 3.61Å; H788-Y790 WeakPolarHBondContact CB-OH 3.43Å; H788-Y790 PolarHBondContact ND1-OH 3.45Å; Y790-D912 PolarHBondContact OH-OD2 3.04Å; Y790-L915 HydrophobicContact CD1-CD1 4.34Å; Y790-L915 HydrophobicContact CD1-CD2 3.88Å; Y790-L915 HydrophobicContact CD1-CG 4.4Å; Y790-L915 HydrophobicContact CE1-CD1 3.89Å; Y790-L915 HydrophobicContact CE1-CD2 3.69Å; Y790-L915 HydrophobicContact CE1-CG 3.78Å
791	R	94.6	Very high	90.6	Very high	11 Å²	11	25.6 Å²	25.6	4%	0.042	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.6	172.5	-50	-166	-174.1	156.9	10.1	109.1	W573 L575 L761 M775	W573-R791 PolarHBondContact O-N 3.5Å; L575-R791 PolarHBondContact N-O 3.14Å; L761-R791 HydrophobicContact CB-CG 4.49Å; L761-R791 HydrophobicContact CD1-CG 4Å; M775-R791 VanDerWaalsContact CE-NH2 3.33Å; M775-R791 PolarHBondContact SD-NH2 2.97Å; M775-R791 VanDerWaalsContact SD-NH2 3.43Å
792	L	95	Very high	91.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123	-178.7	-55.1	-175.4	0	0	0	110.6	L575 K667 V670 L671 V760 L761 Y762	L575-L792 HydrophobicContact CB-CD2 4.12Å; L575-L792 HydrophobicContact CD1-CD2 3.76Å; L575-L792 HydrophobicContact CG-CD2 4.39Å; K667-L792 HydrophobicContact CD-CB 4.41Å; K667-L792 VanDerWaalsContact CE-O 3.3Å; K667-L792 WeakPolarHBondContact CE-O 3.33Å; K667-L792 HydrophobicContact CG-CB 4.43Å; K667-L792 PolarHBondContact NZ-O 3.05Å; V670-L792 HydrophobicContact CG1-CD2 4.02Å; L671-L792 HydrophobicContact CB-CD1 4.37Å; V760-L792 HydrophobicContact CG1-CD1 3.81Å; V760-L792 HydrophobicContact CG1-CG 3.98Å; L761-L792 PolarHBondContact O-N 3.11Å; Y762-L792 HydrophobicContact CD2-CD1 4.04Å; Y762-L792 HydrophobicContact CE2-CD1 4.47Å
793	L	94.5	Very high	91.3	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.8	176.1	-59	175	0	0	0	109.3	T574 L575 F576 C577 I764 E799 F803	T574-L793 HydrophobicContact CG2-CD1 3.54Å; T574-L793 HydrophobicContact CG2-CG 4.38Å; L575-L793 PolarHBondContact O-N 3.02Å; F576-L793 CarbonylContact C-O 3.55Å; F576-L793 WeakPolarHBondContact CA-O 3.44Å; F576-L793 HydrophobicContact CD1-CB 4.19Å; F576-L793 HydrophobicContact CD1-CD1 4.34Å; F576-L793 HydrophobicContact CE1-CB 4.4Å; F576-L793 HydrophobicContact CE1-CD1 3.75Å; F576-L793 HydrophobicContact CZ-CD1 4.02Å; C577-L793 WeakPolarHBondContact CB-O 3.31Å; C577-L793 PolarHBondContact N-O 3.32Å; I764-L793 HydrophobicContact CD1-CD2 3.66Å; I764-L793 HydrophobicContact CG1-CD2 4.08Å; I764-L793 HydrophobicContact CG2-CD2 3.72Å; L793-E799 HydrophobicContact CD2-CB 4.32Å; L793-F803 HydrophobicContact CD1-CB 3.86Å; L793-F803 HydrophobicContact CD1-CD1 3.94Å; L793-F803 HydrophobicContact CD1-CD2 4.14Å; L793-F803 HydrophobicContact CD1-CG 3.7Å; L793-F803 HydrophobicContact CD2-CB 4.34Å
794	T	93	Very high	91.2	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.006	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.4	170.5	-54.7	0	0	0	0	110.3	P579 K667 T797 E799	P579-T794 HydrophobicContact CB-CG2 3.67Å; P579-T794 HydrophobicContact CG-CG2 4.17Å; K667-T794 WeakPolarHBondContact CE-OG1 3.28Å; T794-T797 HydrophobicContact CG2-CG2 3.59Å; T794-T797 PolarHBondContact O-N 3.46Å; T794-T797 PolarHBondContact O-OG1 2.96Å; T794-E799 PolarHBondContact N-OE2 2.78Å; T794-E799 PolarHBondContact OG1-OE2 2.99Å
795	A	90.7	Very high	91	Very high	6 Å²	6	13.5 Å²	13.5	5%	0.05	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	137.4	-175	0	0	0	0	0	112.7	F576 C577 T797 T923	F576-A795 HydrophobicContact CB-CB 4.17Å; C577-A795 PolarHBondContact O-N 3.21Å; A795-T797 PolarHBondContact O-N 3.45Å; A795-T923 HydrophobicContact CB-CG2 4.32Å
796	G	86.4	Confident	90.5	Very high	2 Å²	2	10 Å²	10	2%	0.021	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	4.3	174.6	0	0	0	0	0	115.4	E800 L839 T840	G796-E800 PolarHBondContact N-OE2 3.41Å; G796-L839 WeakPolarHBondContact O-CA 3.46Å; G796-T840 WeakPolarHBondContact CA-O 3.45Å; G796-T840 PolarHBondContact O-N 3.03Å; G796-T840 VanDerWaalsContact O-N 3.16Å
797	T	91.1	Very high	90	Very high	4 Å²	4	7.2 Å²	7.2	3%	0.025	3%	0.032	C	C	.	.	S	Bend	trans	-103	179.6	-176.3	71.7	0	0	0	0	113.4	Y587 T794 A795 E799 E800 L839	Y587-T797 HydrophobicContact CE2-CG2 4.14Å; T794-T797 HydrophobicContact CG2-CG2 3.59Å; T794-T797 PolarHBondContact O-N 3.46Å; T794-T797 PolarHBondContact O-OG1 2.96Å; A795-T797 PolarHBondContact O-N 3.45Å; T797-E799 PolarHBondContact O-N 3.23Å; T797-E799 VanDerWaalsContact O-N 3.13Å; T797-E799 PolarHBondContact OG1-N 3.19Å; T797-E800 PolarHBondContact O-N 3.3Å; T797-E800 VanDerWaalsContact O-N 3.16Å; T797-L839 HydrophobicContact CG2-CD1 4.18Å
798	I	90.8	Very high	89.1	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-50.4	-32.4	172.6	-173	164.5	0	0	0	114	Y587 I613 L616 R801 I802 L836 F837	Y587-I798 PolarHBondContact OH-N 3.2Å; Y587-I798 VanDerWaalsContact OH-N 3.08Å; I613-I798 HydrophobicContact CB-CD1 4.26Å; I613-I798 HydrophobicContact CG1-CD1 4.09Å; I613-I798 HydrophobicContact CG2-CD1 3.97Å; L616-I798 HydrophobicContact CB-CD1 4.33Å; L616-I798 HydrophobicContact CB-CG2 3.87Å; L616-I798 HydrophobicContact CD1-CB 4.46Å; L616-I798 HydrophobicContact CD1-CD1 4.09Å; I798-R801 WeakPolarHBondContact O-CB 3.42Å; I798-R801 PolarHBondContact O-N 2.9Å; I798-I802 HydrophobicContact CG1-CD1 4.03Å; I798-I802 HydrophobicContact CG1-CG1 4.35Å; I798-I802 WeakPolarHBondContact O-CG1 3.45Å; I798-I802 PolarHBondContact O-N 2.98Å; I798-L836 HydrophobicContact CD1-CD2 3.5Å; I798-L836 VanDerWaalsContact CD1-CD2 3.5Å; I798-L836 HydrophobicContact CD1-CG 4.05Å; I798-L836 HydrophobicContact CG1-CD2 4.02Å; I798-L836 HydrophobicContact CG1-CG 4Å; I798-F837 HydrophobicContact CD1-CE1 4.41Å
799	E	91	Very high	88	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-67.6	-38.5	-178.3	-66.5	-172.9	140.7	0	0	112.1	C620 K667 I764 L793 T794 T797 R801 I802 F803	C620-E799 HydrophobicContact CB-CG 4.12Å; K667-E799 WeakPolarHBondContact CE-OE2 3.34Å; K667-E799 IonicContact NZ-OE1 2.69Å; K667-E799 PolarHBondContact NZ-OE1 2.89Å; K667-E799 IonicContact NZ-OE2 2.6Å; K667-E799 PolarHBondContact NZ-OE2 3.42Å; I764-E799 VanDerWaalsContact CD1-O 3.23Å; I764-E799 WeakPolarHBondContact CD1-O 3.3Å; L793-E799 HydrophobicContact CD2-CB 4.32Å; T794-E799 PolarHBondContact N-OE2 2.78Å; T794-E799 PolarHBondContact OG1-OE2 2.99Å; T797-E799 PolarHBondContact O-N 3.23Å; T797-E799 VanDerWaalsContact O-N 3.13Å; T797-E799 PolarHBondContact OG1-N 3.19Å; E799-R801 VanDerWaalsContact C-N 3.28Å; E799-R801 PolarHBondContact O-N 3.38Å; E799-I802 PolarHBondContact O-N 3.36Å; E799-F803 PolarHBondContact O-N 3.43Å
800	E	90.6	Very high	86.6	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-63.3	-37.3	175.8	-178.2	160.3	-162	0	0	111.5	F576 G796 T797 F803 Q804 C844 L845 T846	F576-E800 HydrophobicContact CE1-CG 3.91Å; F576-E800 WeakPolarHBondContact CE1-OE1 3.38Å; G796-E800 PolarHBondContact N-OE2 3.41Å; T797-E800 PolarHBondContact O-N 3.3Å; T797-E800 VanDerWaalsContact O-N 3.16Å; E800-F803 WeakPolarHBondContact O-CB 3.47Å; E800-F803 PolarHBondContact O-N 2.94Å; E800-Q804 VanDerWaalsContact O-CG 3.3Å; E800-Q804 WeakPolarHBondContact O-CG 3.43Å; E800-Q804 PolarHBondContact O-N 3.44Å; E800-C844 PolarHBondContact OE1-SG 3.18Å; E800-L845 HydrophobicContact CG-CB 4.47Å; E800-L845 PolarHBondContact OE1-N 3.38Å; E800-T846 WeakPolarHBondContact CG-OG1 3.39Å; E800-T846 WeakPolarHBondContact OE1-CB 3.17Å; E800-T846 PolarHBondContact OE1-N 2.84Å; E800-T846 PolarHBondContact OE1-OG1 2.79Å
801	R	88.6	Confident	84.7	Confident	20 Å²	20	14 Å²	14	8%	0.075	8%	0.076	C	C	.	.	H	α-helix	trans	-66.8	-39.8	173.9	-57	-59.2	-167.3	152.3	8.1	112.7	I798 E799 F803 Q804 R805 D835 S838	I798-R801 WeakPolarHBondContact O-CB 3.42Å; I798-R801 PolarHBondContact O-N 2.9Å; E799-R801 VanDerWaalsContact C-N 3.28Å; E799-R801 PolarHBondContact O-N 3.38Å; R801-F803 VanDerWaalsContact C-N 3.32Å; R801-Q804 PolarHBondContact O-N 3.39Å; R801-R805 WeakPolarHBondContact O-CG 3.09Å; R801-R805 PolarHBondContact O-N 3.31Å; R801-R805 VanDerWaalsContact O-N 3.14Å; R801-D835 IonicContact CZ-OD1 3.55Å; R801-D835 IonicContact CZ-OD2 3.49Å; R801-D835 IonicContact NE-OD1 3.64Å; R801-D835 IonicContact NE-OD2 3.73Å; R801-D835 IonicContact NH1-OD1 2.78Å; R801-D835 PolarHBondContact NH1-OD1 2.94Å; R801-D835 IonicContact NH1-OD2 3.38Å; R801-D835 PolarHBondContact NH1-OD2 3.05Å; R801-D835 VanDerWaalsContact NH1-OD2 3.12Å; R801-D835 IonicContact NH2-OD1 2.85Å; R801-D835 PolarHBondContact NH2-OD1 3.19Å; R801-D835 VanDerWaalsContact NH2-OD1 3.1Å; R801-S838 PolarHBondContact NH2-OG 3.48Å
802	I	88.6	Confident	82.6	Confident	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-64	-42.6	175.4	-66.3	167.5	0	0	0	109.4	K617 I764 W766 I798 E799 R805 Q806	K617-I802 HydrophobicContact CD-CD1 4.13Å; I764-I802 HydrophobicContact CD1-CB 3.75Å; I764-I802 HydrophobicContact CD1-CG2 3.61Å; I764-I802 HydrophobicContact CG1-CG2 4.13Å; W766-I802 HydrophobicContact CD2-CD1 4.45Å; W766-I802 HydrophobicContact CD2-CG1 4.23Å; W766-I802 HydrophobicContact CD2-CG2 4.22Å; W766-I802 HydrophobicContact CE3-CG1 4.22Å; W766-I802 HydrophobicContact CE3-CG2 4.3Å; W766-I802 HydrophobicContact CG-CG2 4.5Å; W766-I802 HydrophobicContact CH2-CD1 4.37Å; W766-I802 HydrophobicContact CH2-CG1 3.87Å; W766-I802 HydrophobicContact CZ2-CD1 3.8Å; W766-I802 HydrophobicContact CZ2-CG1 3.81Å; W766-I802 HydrophobicContact CZ3-CG1 4.05Å; I798-I802 HydrophobicContact CG1-CD1 4.03Å; I798-I802 HydrophobicContact CG1-CG1 4.35Å; I798-I802 WeakPolarHBondContact O-CG1 3.45Å; I798-I802 PolarHBondContact O-N 2.98Å; E799-I802 PolarHBondContact O-N 3.36Å; I802-R805 PolarHBondContact O-N 3.18Å; I802-Q806 WeakPolarHBondContact O-CG 3.44Å; I802-Q806 PolarHBondContact O-N 3.08Å
803	F	89.3	Confident	80	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.009	12%	0.123	C	C	.	.	H	α-helix	trans	-59.7	-48.3	175.7	176.9	-110.9	0	0	0	112	T574 F576 I764 L793 E799 E800 R801 R805 Q806 V807 T846 L897	T574-F803 HydrophobicContact CG2-CE1 4.18Å; T574-F803 HydrophobicContact CG2-CE2 4.18Å; T574-F803 HydrophobicContact CG2-CZ 3.88Å; F576-F803 HydrophobicContact CZ-CE1 4.5Å; I764-F803 HydrophobicContact CD1-CB 3.98Å; L793-F803 HydrophobicContact CD1-CB 3.86Å; L793-F803 HydrophobicContact CD1-CD1 3.94Å; L793-F803 HydrophobicContact CD1-CD2 4.14Å; L793-F803 HydrophobicContact CD1-CG 3.7Å; L793-F803 HydrophobicContact CD2-CB 4.34Å; E799-F803 PolarHBondContact O-N 3.43Å; E800-F803 WeakPolarHBondContact O-CB 3.47Å; E800-F803 PolarHBondContact O-N 2.94Å; R801-F803 VanDerWaalsContact C-N 3.32Å; F803-R805 PolarHBondContact O-N 3.45Å; F803-Q806 WeakPolarHBondContact O-CB 3.47Å; F803-Q806 PolarHBondContact O-N 3.45Å; F803-V807 HydrophobicContact CD1-CG2 4.49Å; F803-V807 HydrophobicContact CD2-CG2 4.3Å; F803-V807 HydrophobicContact CE1-CG2 4.09Å; F803-V807 HydrophobicContact CE2-CG2 3.88Å; F803-V807 HydrophobicContact CZ-CG2 3.77Å; F803-V807 WeakPolarHBondContact O-CG2 3.35Å; F803-V807 PolarHBondContact O-N 2.84Å; F803-T846 HydrophobicContact CE1-CG2 4.44Å; F803-L897 HydrophobicContact CE1-CD1 4.5Å; F803-L897 HydrophobicContact CZ-CD2 4.38Å
804	Q	86.1	Confident	77.3	Confident	17 Å²	17	22.1 Å²	22.1	8%	0.079	13%	0.128	C	C	.	.	H	α-helix	trans	-54.2	-41.3	175.4	-71.6	164.7	5.5	0	0	112.2	E800 R801 V807 S808 T846	E800-Q804 VanDerWaalsContact O-CG 3.3Å; E800-Q804 WeakPolarHBondContact O-CG 3.43Å; E800-Q804 PolarHBondContact O-N 3.44Å; R801-Q804 PolarHBondContact O-N 3.39Å; Q804-V807 PolarHBondContact O-N 3.4Å; Q804-S808 WeakPolarHBondContact O-CB 3.39Å; Q804-S808 PolarHBondContact O-N 2.83Å; Q804-S808 PolarHBondContact O-OG 3.39Å; Q804-T846 HydrophobicContact CG-CG2 4.09Å; Q804-T846 PolarHBondContact NE2-OG1 3.41Å
805	R	82.6	Confident	74.7	Confident	61 Å²	61	26.1 Å²	26.1	23%	0.23	15%	0.153	C	C	.	.	H	α-helix	trans	-69.8	-38.9	176.8	-69.7	177.5	-174.3	-155.7	4.9	112.5	R801 I802 F803 V807 S808 K809 E832	R801-R805 WeakPolarHBondContact O-CG 3.09Å; R801-R805 PolarHBondContact O-N 3.31Å; R801-R805 VanDerWaalsContact O-N 3.14Å; I802-R805 PolarHBondContact O-N 3.18Å; F803-R805 PolarHBondContact O-N 3.45Å; R805-V807 VanDerWaalsContact C-N 3.33Å; R805-S808 PolarHBondContact O-N 2.82Å; R805-K809 VanDerWaalsContact O-CB 3.26Å; R805-K809 WeakPolarHBondContact O-CB 3.38Å; R805-K809 PolarHBondContact O-N 2.88Å; R805-E832 PolarHBondContact NH2-O 3.17Å
806	Q	81.4	Confident	72.1	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.019	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-46.1	173.2	-72.5	-173.9	-46.5	0	0	110.9	D765 P768 D771 I802 F803 K809 Q810	D765-Q806 VanDerWaalsContact O-CD 3.23Å; D765-Q806 PolarHBondContact O-NE2 2.88Å; P768-Q806 HydrophobicContact CB-CB 4.29Å; P768-Q806 HydrophobicContact CB-CG 4.45Å; P768-Q806 HydrophobicContact CG-CB 4.49Å; D771-Q806 PolarHBondContact OD2-NE2 3Å; I802-Q806 WeakPolarHBondContact O-CG 3.44Å; I802-Q806 PolarHBondContact O-N 3.08Å; F803-Q806 WeakPolarHBondContact O-CB 3.47Å; F803-Q806 PolarHBondContact O-N 3.45Å; Q806-K809 PolarHBondContact O-N 3.02Å; Q806-Q810 WeakPolarHBondContact O-CB 3.41Å; Q806-Q810 WeakPolarHBondContact O-CG 3.37Å; Q806-Q810 PolarHBondContact O-N 2.8Å
807	V	80.8	Confident	69.7	Low	1 Å²	1	31 Å²	31	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-45.8	178.7	176.5	0	0	0	0	110.9	F803 Q804 R805 K809 Q810 G811 L892 M894 L897	F803-V807 HydrophobicContact CD1-CG2 4.49Å; F803-V807 HydrophobicContact CD2-CG2 4.3Å; F803-V807 HydrophobicContact CE1-CG2 4.09Å; F803-V807 HydrophobicContact CE2-CG2 3.88Å; F803-V807 HydrophobicContact CZ-CG2 3.77Å; F803-V807 WeakPolarHBondContact O-CG2 3.35Å; F803-V807 PolarHBondContact O-N 2.84Å; Q804-V807 PolarHBondContact O-N 3.4Å; R805-V807 VanDerWaalsContact C-N 3.33Å; V807-K809 VanDerWaalsContact C-N 3.27Å; V807-K809 PolarHBondContact O-N 2.91Å; V807-Q810 PolarHBondContact O-N 3.12Å; V807-G811 PolarHBondContact O-N 3.43Å; V807-L892 HydrophobicContact CB-CD2 4.43Å; V807-L892 HydrophobicContact CG1-CD2 3.75Å; V807-L892 HydrophobicContact CG2-CD2 3.89Å; V807-M894 HydrophobicContact CB-SD 4.36Å; V807-M894 HydrophobicContact CG1-CG 4.37Å; V807-M894 HydrophobicContact CG1-SD 3.85Å; V807-L897 HydrophobicContact CB-CD1 4.49Å; V807-L897 HydrophobicContact CG1-CD1 3.87Å; V807-L897 HydrophobicContact CG1-CG 4.24Å; V807-L897 HydrophobicContact CG2-CD1 4.24Å
808	S	74.1	Confident	67	Low	56 Å²	56	33.1 Å²	33.1	39%	0.392	19%	0.192	S	C	.	.	H	α-helix	trans	-58.7	-42.1	175.7	-58.8	0	0	0	0	111.3	Q804 R805 L812	Q804-S808 WeakPolarHBondContact O-CB 3.39Å; Q804-S808 PolarHBondContact O-N 2.83Å; Q804-S808 PolarHBondContact O-OG 3.39Å; R805-S808 PolarHBondContact O-N 2.82Å; S808-L812 WeakPolarHBondContact O-CB 3.42Å; S808-L812 WeakPolarHBondContact O-CG 3.5Å; S808-L812 PolarHBondContact O-N 2.9Å
809	K	70.4	Confident	64.4	Low	64 Å²	64	34.3 Å²	34.3	28%	0.278	20%	0.199	S	C	.	.	H	α-helix	trans	-70.1	-38.4	178.2	-175.4	167.1	-178.7	149.4	0	113	R805 Q806 V807 L812 S813 D818	R805-K809 VanDerWaalsContact O-CB 3.26Å; R805-K809 WeakPolarHBondContact O-CB 3.38Å; R805-K809 PolarHBondContact O-N 2.88Å; Q806-K809 PolarHBondContact O-N 3.02Å; V807-K809 VanDerWaalsContact C-N 3.27Å; V807-K809 PolarHBondContact O-N 2.91Å; K809-L812 PolarHBondContact O-N 2.96Å; K809-S813 WeakPolarHBondContact O-CB 3.33Å; K809-S813 PolarHBondContact O-N 3.02Å; K809-D818 WeakPolarHBondContact CE-OD2 3.49Å; K809-D818 IonicContact NZ-OD2 3Å; K809-D818 PolarHBondContact NZ-OD2 3.25Å
810	Q	64.8	Low	61.7	Low	17 Å²	17	37.4 Å²	37.4	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-49.7	174.7	-78.2	177.3	-16.4	0	0	110.3	P768 I772 Q806 V807 L812 S813 H891 L892	P768-Q810 HydrophobicContact CB-CG 3.53Å; P768-Q810 HydrophobicContact CG-CG 3.69Å; I772-Q810 VanDerWaalsContact CD1-NE2 3.34Å; Q806-Q810 WeakPolarHBondContact O-CB 3.41Å; Q806-Q810 WeakPolarHBondContact O-CG 3.37Å; Q806-Q810 PolarHBondContact O-N 2.8Å; V807-Q810 PolarHBondContact O-N 3.12Å; Q810-L812 PolarHBondContact O-N 3.33Å; Q810-S813 WeakPolarHBondContact O-CB 3.32Å; Q810-S813 PolarHBondContact O-N 3.37Å; Q810-H891 WeakPolarHBondContact O-CB 3.11Å; Q810-L892 HydrophobicContact CB-CB 4.43Å; Q810-L892 WeakPolarHBondContact CB-O 3.34Å
811	G	55.5	Low	59.2	Low	26 Å²	26	43.4 Å²	43.4	27%	0.268	26%	0.257	S	S	.	.	H	α-helix	trans	-59.3	-31.3	176.4	0	0	0	0	0	113.4	V807 L892	V807-G811 PolarHBondContact O-N 3.43Å; G811-L892 PolarHBondContact N-O 3.19Å; G811-L892 VanDerWaalsContact N-O 3.11Å
812	L	48.8	Very low	56.8	Low	93 Å²	93	45.2 Å²	45.2	49%	0.487	28%	0.276	S	S	.	.	H	α-helix	trans	-79.1	-32.3	172.1	-69.5	169.9	0	0	0	112.9	S808 K809 Q810 G814 T815	S808-L812 WeakPolarHBondContact O-CB 3.42Å; S808-L812 WeakPolarHBondContact O-CG 3.5Å; S808-L812 PolarHBondContact O-N 2.9Å; K809-L812 PolarHBondContact O-N 2.96Å; Q810-L812 PolarHBondContact O-N 3.33Å; L812-G814 PolarHBondContact O-N 3.15Å; L812-T815 CarbonylContact O-C 3.5Å; L812-T815 WeakPolarHBondContact O-CA 3.31Å; L812-T815 PolarHBondContact O-N 2.7Å; L812-T815 PolarHBondContact O-OG1 3.39Å
813	S	40.9	Very low	54.1	Low	78 Å²	78	49.6 Å²	49.6	55%	0.545	31%	0.312	S	S	.	.	H	α-helix	trans	-61.1	-19.4	-175	-176.7	0	0	0	0	114.9	K809 Q810 T815	K809-S813 WeakPolarHBondContact O-CB 3.33Å; K809-S813 PolarHBondContact O-N 3.02Å; Q810-S813 WeakPolarHBondContact O-CB 3.32Å; Q810-S813 PolarHBondContact O-N 3.37Å; S813-T815 VanDerWaalsContact C-N 3.35Å
814	G	38.9	Very low	51.6	Low	12 Å²	12	54.9 Å²	54.9	12%	0.124	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-35.5	172.4	0	0	0	0	0	113.1	L812 Q889	L812-G814 PolarHBondContact O-N 3.15Å; G814-Q889 PolarHBondContact O-NE2 3.33Å; G814-Q889 PolarHBondContact O-OE1 3.15Å
815	T	36.6	Very low	49.6	Very low	85 Å²	85	59.3 Å²	59.3	52%	0.521	36%	0.358	S	S	.	.	S	Bend	trans	-92.3	111.6	170.6	-9.8	0	0	0	0	106.6	L812 S813 V817	L812-T815 CarbonylContact O-C 3.5Å; L812-T815 WeakPolarHBondContact O-CA 3.31Å; L812-T815 PolarHBondContact O-N 2.7Å; L812-T815 PolarHBondContact O-OG1 3.39Å; S813-T815 VanDerWaalsContact C-N 3.35Å; T815-V817 HydrophobicContact CG2-CG2 4.41Å; T815-V817 WeakPolarHBondContact O-CB 3.44Å; T815-V817 WeakPolarHBondContact O-CG2 3.48Å; T815-V817 PolarHBondContact O-N 3.31Å
816	V	37.7	Very low	47.7	Very low	52 Å²	52	62.2 Å²	62.2	32%	0.315	38%	0.382	S	S	.	.			trans	-57.9	70.9	-173.6	-174.8	0	0	0	0	113.7	V491 R528 L819	V491-V816 HydrophobicContact CG1-CG1 3.89Å; R528-V816 VanDerWaalsContact NH1-CB 3.3Å; R528-V816 PolarHBondContact NH1-O 2.92Å; V816-L819 HydrophobicContact CG1-CD1 3.86Å; V816-L819 HydrophobicContact CG1-CD2 4.13Å; V816-L819 HydrophobicContact CG1-CG 4.14Å
817	V	35.1	Very low	46.3	Very low	58 Å²	58	65.9 Å²	65.9	35%	0.352	41%	0.408	S	S	.	.			trans	-130.9	69.2	-167.4	-173.7	0	0	0	0	106.8	R528 T815	R528-V817 HydrophobicContact CG-CG2 4.5Å; T815-V817 HydrophobicContact CG2-CG2 4.41Å; T815-V817 WeakPolarHBondContact O-CB 3.44Å; T815-V817 WeakPolarHBondContact O-CG2 3.48Å; T815-V817 PolarHBondContact O-N 3.31Å
818	D	34.3	Very low	45.4	Very low	48 Å²	48	68.5 Å²	68.5	26%	0.257	42%	0.42	S	S	.	.			trans	-153.3	26.4	158.5	-107	-6.4	0	0	0	110.3	K809 G820	K809-D818 WeakPolarHBondContact CE-OD2 3.49Å; K809-D818 IonicContact NZ-OD2 3Å; K809-D818 PolarHBondContact NZ-OD2 3.25Å; D818-G820 VanDerWaalsContact C-N 3.31Å; D818-G820 PolarHBondContact O-N 3.34Å
819	L	36.5	Very low	45.4	Very low	26 Å²	26	67.9 Å²	67.9	14%	0.136	42%	0.416	C	S	.	.	S	Bend	trans	-80.7	-9.8	-176.9	-55.5	171.9	0	0	0	113.2	N493 L495 L525 V816	N493-L819 VanDerWaalsContact C-CD2 3.43Å; N493-L819 WeakPolarHBondContact O-CD2 3.46Å; L495-L819 HydrophobicContact CD1-CD1 3.82Å; L495-L819 HydrophobicContact CG-CD1 3.66Å; L525-L819 HydrophobicContact CD2-CB 3.56Å; L525-L819 HydrophobicContact CD2-CD1 3.63Å; L525-L819 HydrophobicContact CD2-CG 4.25Å; V816-L819 HydrophobicContact CG1-CD1 3.86Å; V816-L819 HydrophobicContact CG1-CD2 4.13Å; V816-L819 HydrophobicContact CG1-CG 4.14Å
820	G	34.6	Very low	45.4	Very low	65 Å²	65	68 Å²	68	67%	0.67	43%	0.425	S	S	*	.	S	Bend	trans	-114.8	-11.8	-175.5	0	0	0	0	0	115.9	D818	D818-G820 VanDerWaalsContact C-N 3.31Å; D818-G820 PolarHBondContact O-N 3.34Å
821	K	37.2	Very low	45.9	Very low	126 Å²	126	70.5 Å²	70.5	55%	0.548	44%	0.444	S	S	.	.			trans	-113	4.6	-170.5	-69.8	-172.6	176.3	-178	0	114.8	A823 E824 H825	K821-A823 PolarHBondContact O-N 3.15Å; K821-E824 PolarHBondContact O-N 3.07Å; K821-H825 PolarHBondContact O-N 2.93Å
822	A	38	Very low	46.9	Very low	58 Å²	58	73.2 Å²	73.2	48%	0.479	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-60.8	-32.4	179.4	0	0	0	0	0	113	H825	A822-H825 VanDerWaalsContact CA-CD2 3.44Å; A822-H825 WeakPolarHBondContact CA-CD2 3.5Å; A822-H825 PolarHBondContact O-CD2 3.26Å
823	A	32.2	Very low	48.3	Very low	92 Å²	92	69.1 Å²	69.1	76%	0.76	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-79.4	-15	175	0	0	0	0	0	113.8	K821	K821-A823 PolarHBondContact O-N 3.15Å
824	E	37.1	Very low	50.3	Low	114 Å²	114	72.5 Å²	72.5	53%	0.533	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-98.8	3.1	179.7	-69.5	-174.2	161.4	0	0	113.3	K821 T826 S827	K821-E824 PolarHBondContact O-N 3.07Å; E824-T826 PolarHBondContact O-N 2.83Å; E824-S827 PolarHBondContact O-N 3.17Å; E824-S827 VanDerWaalsContact O-N 3.09Å; E824-S827 PolarHBondContact O-OG 3.02Å
825	H	43.6	Very low	52.4	Low	110 Å²	110	75 Å²	75	51%	0.509	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-4.3	177.6	-71.6	-40.7	0	0	0	114.8	K821 A822	K821-H825 PolarHBondContact O-N 2.93Å; A822-H825 VanDerWaalsContact CA-CD2 3.44Å; A822-H825 WeakPolarHBondContact CA-CD2 3.5Å; A822-H825 PolarHBondContact O-CD2 3.26Å
826	T	43.3	Very low	54.7	Low	121 Å²	121	70.9 Å²	70.9	74%	0.742	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-2.7	174.4	27.7	0	0	0	0	114.4	E824	E824-T826 PolarHBondContact O-N 2.83Å
827	S	51.1	Low	56.9	Low	82 Å²	82	68.8 Å²	68.8	57%	0.573	40%	0.401	S	S	*	.			trans	-127.1	106.8	-179.5	53.9	0	0	0	0	111.6	E824	E824-S827 PolarHBondContact O-N 3.17Å; E824-S827 VanDerWaalsContact O-N 3.09Å; E824-S827 PolarHBondContact O-OG 3.02Å
828	F	62.8	Low	59.2	Low	55 Å²	55	67.4 Å²	67.4	24%	0.241	39%	0.394	C	S	.	.			trans	-79.4	142.4	165.6	-64.3	-74.6	0	0	0	109.6	I613 W766 L833	I613-F828 HydrophobicContact CD1-CE2 4.02Å; I613-F828 HydrophobicContact CD1-CZ 4.46Å; W766-F828 HydrophobicContact CH2-CE1 4.1Å; W766-F828 AromaticContact CH2-CZ 3.84Å; W766-F828 HydrophobicContact CH2-CZ 3.84Å; W766-F828 HydrophobicContact CZ2-CZ 4.42Å; W766-F828 HydrophobicContact CZ3-CE1 4.06Å; W766-F828 HydrophobicContact CZ3-CZ 4.1Å; F828-L833 HydrophobicContact CB-CD1 4.17Å; F828-L833 HydrophobicContact CB-CD2 3.58Å; F828-L833 HydrophobicContact CB-CG 3.56Å; F828-L833 HydrophobicContact CD2-CD2 3.84Å; F828-L833 HydrophobicContact CG-CD2 3.85Å; F828-L833 HydrophobicContact CG-CG 4.37Å
829	S	72.9	Confident	61.7	Low	44 Å²	44	67.6 Å²	67.6	31%	0.308	39%	0.394	S	S	.	.			trans	-68.2	156.4	169.6	69.4	0	0	0	0	111	S831 E832 L833	S829-S831 VanDerWaalsContact C-N 3.26Å; S829-S831 PolarHBondContact O-N 2.74Å; S829-S831 PolarHBondContact OG-OG 3.46Å; S829-S831 VanDerWaalsContact OG-OG 3.11Å; S829-E832 PolarHBondContact N-OE2 3.4Å; S829-E832 WeakPolarHBondContact O-CB 3.37Å; S829-E832 PolarHBondContact O-N 2.75Å; S829-E832 VanDerWaalsContact O-N 3.14Å; S829-E832 WeakPolarHBondContact OG-CB 3.48Å; S829-E832 WeakPolarHBondContact OG-CG 3.15Å; S829-E832 PolarHBondContact OG-N 2.76Å; S829-E832 PolarHBondContact OG-OE1 2.93Å; S829-L833 PolarHBondContact O-N 3.49Å
830	S	71.4	Confident	63.9	Low	67 Å²	67	68.4 Å²	68.4	47%	0.469	40%	0.4	S	S	.	.	H	α-helix	trans	-67	-26.9	-179.5	62.4	0	0	0	0	113.1	R834	S830-R834 WeakPolarHBondContact O-CG 3.4Å; S830-R834 PolarHBondContact O-N 3.43Å; S830-R834 PolarHBondContact O-NE 2.99Å
831	S	76.1	Confident	66	Low	69 Å²	69	72.8 Å²	72.8	48%	0.483	41%	0.408	S	S	.	.	H	α-helix	trans	-69.6	-44	169.1	43.5	0	0	0	0	111.4	S829 L833 R834 D835	S829-S831 VanDerWaalsContact C-N 3.26Å; S829-S831 PolarHBondContact O-N 2.74Å; S829-S831 PolarHBondContact OG-OG 3.46Å; S829-S831 VanDerWaalsContact OG-OG 3.11Å; S831-L833 PolarHBondContact O-N 2.86Å; S831-R834 WeakPolarHBondContact O-CB 3.41Å; S831-R834 PolarHBondContact O-N 3.29Å; S831-D835 PolarHBondContact O-N 3.08Å
832	E	75.6	Confident	68	Low	83 Å²	83	68.7 Å²	68.7	39%	0.388	39%	0.394	S	S	.	.	H	α-helix	trans	-63.7	-38	177	-78.8	159.4	-138.1	0	0	113.1	R805 S829 D835 L836	R805-E832 PolarHBondContact NH2-O 3.17Å; S829-E832 PolarHBondContact N-OE2 3.4Å; S829-E832 WeakPolarHBondContact O-CB 3.37Å; S829-E832 PolarHBondContact O-N 2.75Å; S829-E832 VanDerWaalsContact O-N 3.14Å; S829-E832 WeakPolarHBondContact OG-CB 3.48Å; S829-E832 WeakPolarHBondContact OG-CG 3.15Å; S829-E832 PolarHBondContact OG-N 2.76Å; S829-E832 PolarHBondContact OG-OE1 2.93Å; E832-D835 PolarHBondContact O-N 3.01Å; E832-L836 WeakPolarHBondContact O-CB 3.45Å; E832-L836 PolarHBondContact O-N 2.65Å
833	L	78.7	Confident	69.9	Low	6 Å²	6	69.4 Å²	69.4	3%	0.031	39%	0.394	C	S	.	.	H	α-helix	trans	-67.5	-37.5	175.8	-73.2	175	0	0	0	111.8	F828 S829 S831 D835 L836 F837	F828-L833 HydrophobicContact CB-CD1 4.17Å; F828-L833 HydrophobicContact CB-CD2 3.58Å; F828-L833 HydrophobicContact CB-CG 3.56Å; F828-L833 HydrophobicContact CD2-CD2 3.84Å; F828-L833 HydrophobicContact CG-CD2 3.85Å; F828-L833 HydrophobicContact CG-CG 4.37Å; S829-L833 PolarHBondContact O-N 3.49Å; S831-L833 PolarHBondContact O-N 2.86Å; L833-D835 VanDerWaalsContact C-N 3.34Å; L833-L836 PolarHBondContact O-N 3.24Å; L833-F837 HydrophobicContact CB-CE2 4.48Å; L833-F837 HydrophobicContact CD2-CE2 4.03Å; L833-F837 HydrophobicContact CD2-CZ 4.34Å; L833-F837 WeakPolarHBondContact O-CD2 3.47Å; L833-F837 PolarHBondContact O-N 3.29Å
834	R	82.4	Confident	72.4	Confident	150 Å²	150	65.1 Å²	65.1	57%	0.566	36%	0.358	S	S	*	.	H	α-helix	trans	-62.5	-43	174.1	-84.1	-177.6	-73.2	-173.3	1.2	111.8	L600 S830 S831	L600-R834 HydrophobicContact CD2-CB 4.34Å; L600-R834 HydrophobicContact CD2-CG 3.75Å; S830-R834 WeakPolarHBondContact O-CG 3.4Å; S830-R834 PolarHBondContact O-N 3.43Å; S830-R834 PolarHBondContact O-NE 2.99Å; S831-R834 WeakPolarHBondContact O-CB 3.41Å; S831-R834 PolarHBondContact O-N 3.29Å
835	D	82.9	Confident	74.7	Confident	63 Å²	63	60.4 Å²	60.4	34%	0.337	34%	0.337	S	S	.	.	H	α-helix	trans	-64.3	-42.8	175.8	-172.2	63	0	0	0	111.6	R801 S831 E832 L833 F837 S838	R801-D835 IonicContact CZ-OD1 3.55Å; R801-D835 IonicContact CZ-OD2 3.49Å; R801-D835 IonicContact NE-OD1 3.64Å; R801-D835 IonicContact NE-OD2 3.73Å; R801-D835 IonicContact NH1-OD1 2.78Å; R801-D835 PolarHBondContact NH1-OD1 2.94Å; R801-D835 IonicContact NH1-OD2 3.38Å; R801-D835 PolarHBondContact NH1-OD2 3.05Å; R801-D835 VanDerWaalsContact NH1-OD2 3.12Å; R801-D835 IonicContact NH2-OD1 2.85Å; R801-D835 PolarHBondContact NH2-OD1 3.19Å; R801-D835 VanDerWaalsContact NH2-OD1 3.1Å; S831-D835 PolarHBondContact O-N 3.08Å; E832-D835 PolarHBondContact O-N 3.01Å; L833-D835 VanDerWaalsContact C-N 3.34Å; D835-F837 PolarHBondContact O-N 3.5Å; D835-S838 PolarHBondContact O-N 3.31Å; D835-S838 PolarHBondContact O-OG 2.9Å
836	L	84.1	Confident	76.6	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.1	-36.1	-178.8	-159.5	105.5	0	0	0	114	I613 W766 I798 E832 L833 S838	I613-L836 HydrophobicContact CD1-CD2 3.86Å; I613-L836 HydrophobicContact CG1-CD2 3.7Å; W766-L836 HydrophobicContact CH2-CD1 3.5Å; W766-L836 HydrophobicContact CH2-CD2 4.32Å; W766-L836 HydrophobicContact CZ2-CD1 4.47Å; W766-L836 HydrophobicContact CZ3-CD1 4.14Å; I798-L836 HydrophobicContact CD1-CD2 3.5Å; I798-L836 VanDerWaalsContact CD1-CD2 3.5Å; I798-L836 HydrophobicContact CD1-CG 4.05Å; I798-L836 HydrophobicContact CG1-CD2 4.02Å; I798-L836 HydrophobicContact CG1-CG 4Å; E832-L836 WeakPolarHBondContact O-CB 3.45Å; E832-L836 PolarHBondContact O-N 2.65Å; L833-L836 PolarHBondContact O-N 3.24Å; L836-S838 VanDerWaalsContact C-N 3.32Å
837	F	84.1	Confident	78.6	Confident	8 Å²	8	49.9 Å²	49.9	4%	0.035	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	25.9	-179.3	-59.4	-39	0	0	0	112.9	L591 F596 C599 L600 C612 I613 L616 I798 L833 D835	L591-F837 WeakPolarHBondContact CD1-O 3.35Å; L591-F837 HydrophobicContact CD2-CB 4.02Å; L591-F837 WeakPolarHBondContact CD2-O 3.31Å; F596-F837 HydrophobicContact CD1-CD1 4.48Å; F596-F837 HydrophobicContact CD1-CG 4.41Å; F596-F837 HydrophobicContact CE1-CD1 4.25Å; F596-F837 HydrophobicContact CE1-CE1 4.3Å; C599-F837 HydrophobicContact CB-CE2 4.39Å; L600-F837 HydrophobicContact CD2-CB 4.23Å; L600-F837 HydrophobicContact CD2-CD2 3.77Å; L600-F837 HydrophobicContact CG-CD2 4.32Å; C612-F837 HydrophobicContact CB-CE1 4.41Å; C612-F837 HydrophobicContact CB-CZ 4.09Å; I613-F837 HydrophobicContact CG1-CE1 3.68Å; I613-F837 HydrophobicContact CG1-CZ 3.85Å; L616-F837 HydrophobicContact CD1-CD1 3.68Å; L616-F837 HydrophobicContact CD1-CE1 4.08Å; I798-F837 HydrophobicContact CD1-CE1 4.41Å; L833-F837 HydrophobicContact CB-CE2 4.48Å; L833-F837 HydrophobicContact CD2-CE2 4.03Å; L833-F837 HydrophobicContact CD2-CZ 4.34Å; L833-F837 WeakPolarHBondContact O-CD2 3.47Å; L833-F837 PolarHBondContact O-N 3.29Å; D835-F837 PolarHBondContact O-N 3.5Å
838	S	84.5	Confident	80.2	Confident	29 Å²	29	49.3 Å²	49.3	20%	0.203	27%	0.27	C	S	.	.			trans	-88.1	151.3	170.2	62.9	0	0	0	0	111.4	R801 D835 L836	R801-S838 PolarHBondContact NH2-OG 3.48Å; D835-S838 PolarHBondContact O-N 3.31Å; D835-S838 PolarHBondContact O-OG 2.9Å; L836-S838 VanDerWaalsContact C-N 3.32Å
839	L	85.7	Confident	81.1	Confident	52 Å²	52	51.2 Å²	51.2	27%	0.272	28%	0.282	S	S	.	.			trans	-119.8	117.2	165.5	-179.3	69	0	0	0	106.6	Y587 K588 L591 G796 T797	Y587-L839 HydrophobicContact CD1-CB 3.94Å; Y587-L839 HydrophobicContact CD1-CD1 3.91Å; Y587-L839 HydrophobicContact CD1-CD2 3.98Å; Y587-L839 HydrophobicContact CD1-CG 4.17Å; Y587-L839 HydrophobicContact CE1-CB 3.76Å; Y587-L839 HydrophobicContact CE1-CD1 3.93Å; Y587-L839 HydrophobicContact CE1-CG 4.3Å; Y587-L839 HydrophobicContact CG-CD1 4.43Å; K588-L839 HydrophobicContact CD-CD2 4.4Å; K588-L839 HydrophobicContact CG-CD2 3.72Å; L591-L839 HydrophobicContact CD1-CB 4.05Å; G796-L839 WeakPolarHBondContact O-CA 3.46Å; T797-L839 HydrophobicContact CG2-CD1 4.18Å
840	T	83.6	Confident	81.5	Confident	42 Å²	42	49.9 Å²	49.9	26%	0.258	27%	0.271	S	S	.	.			trans	-106.3	134	178.5	-52	0	0	0	0	109.2	G796 T842 L845	G796-T840 WeakPolarHBondContact CA-O 3.45Å; G796-T840 PolarHBondContact O-N 3.03Å; G796-T840 VanDerWaalsContact O-N 3.16Å; T840-T842 VanDerWaalsContact C-N 3.3Å; T840-T842 HydrophobicContact CG2-CG2 3.7Å; T840-T842 WeakPolarHBondContact CG2-OG1 3.44Å; T840-T842 PolarHBondContact O-N 3.35Å; T840-L845 HydrophobicContact CG2-CD1 4.4Å
841	D	79.5	Confident	81.8	Confident	157 Å²	157	51.7 Å²	51.7	84%	0.84	28%	0.284	S	S	*	.			trans	-90.8	67	176.2	-161.7	23.3	0	0	0	109.4
842	T	79.1	Confident	81.8	Confident	40 Å²	40	49.6 Å²	49.6	25%	0.245	27%	0.269	C	S	.	.	S	Bend	trans	-130.4	151	176.1	57	0	0	0	0	110.6	T840 C844 L845 D848	T840-T842 VanDerWaalsContact C-N 3.3Å; T840-T842 HydrophobicContact CG2-CG2 3.7Å; T840-T842 WeakPolarHBondContact CG2-OG1 3.44Å; T840-T842 PolarHBondContact O-N 3.35Å; T842-C844 VanDerWaalsContact C-N 3.3Å; T842-C844 PolarHBondContact O-N 3.45Å; T842-L845 PolarHBondContact OG1-N 3.37Å; T842-D848 WeakPolarHBondContact CB-OD2 3.3Å; T842-D848 VanDerWaalsContact CG2-OD2 3.31Å; T842-D848 WeakPolarHBondContact CG2-OD2 3.37Å; T842-D848 PolarHBondContact OG1-OD2 3.26Å
843	P	78.1	Confident	81.8	Confident	73 Å²	73	51.5 Å²	51.5	47%	0.474	29%	0.292	S	S	.	.	S	Bend	trans	-63.9	-35.4	179.9	24.5	-33.6	0	0	0	112.4	T923	P843-T923 VanDerWaalsContact O-CB 3.32Å; P843-T923 WeakPolarHBondContact O-CB 3.34Å; P843-T923 PolarHBondContact O-OG1 3.28Å
844	C	84.8	Confident	81.7	Confident	2 Å²	2	52 Å²	52	1%	0.014	30%	0.295	C	S	.	.			trans	-156.9	106.8	170.5	-179.4	0	0	0	0	110.3	E800 T842 T846 H847 D848 F924	E800-C844 PolarHBondContact OE1-SG 3.18Å; T842-C844 VanDerWaalsContact C-N 3.3Å; T842-C844 PolarHBondContact O-N 3.45Å; C844-T846 PolarHBondContact O-N 3.01Å; C844-H847 HydrophobicContact CB-CB 4.04Å; C844-H847 PolarHBondContact O-N 3.35Å; C844-H847 PolarHBondContact SG-N 2.84Å; C844-H847 VanDerWaalsContact SG-N 3.39Å; C844-D848 VanDerWaalsContact O-CG 3.3Å; C844-D848 PolarHBondContact O-N 2.96Å; C844-F924 HydrophobicContact CB-CB 3.66Å; C844-F924 HydrophobicContact CB-CD1 3.88Å; C844-F924 HydrophobicContact CB-CD2 4.16Å; C844-F924 HydrophobicContact CB-CG 3.63Å
845	L	84.1	Confident	81.1	Confident	16 Å²	16	48.4 Å²	48.4	8%	0.084	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-33.9	176	172.2	71.1	0	0	0	112.2	E800 T840 T842 H847 D848 L849	E800-L845 HydrophobicContact CG-CB 4.47Å; E800-L845 PolarHBondContact OE1-N 3.38Å; T840-L845 HydrophobicContact CG2-CD1 4.4Å; T842-L845 PolarHBondContact OG1-N 3.37Å; L845-H847 VanDerWaalsContact C-N 3.3Å; L845-H847 PolarHBondContact O-N 3.29Å; L845-D848 WeakPolarHBondContact O-CB 3.21Å; L845-D848 PolarHBondContact O-N 3.27Å; L845-L849 HydrophobicContact CD1-CG 4.33Å; L845-L849 HydrophobicContact CG-CD1 4.24Å; L845-L849 HydrophobicContact CG-CG 4.44Å; L845-L849 WeakPolarHBondContact O-CG 3.24Å; L845-L849 PolarHBondContact O-N 3.27Å
846	T	84.3	Confident	80.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.6	-40.1	-179.5	-52.2	0	0	0	0	110.9	E800 F803 Q804 C844 L850 L897 F926	E800-T846 WeakPolarHBondContact CG-OG1 3.39Å; E800-T846 WeakPolarHBondContact OE1-CB 3.17Å; E800-T846 PolarHBondContact OE1-N 2.84Å; E800-T846 PolarHBondContact OE1-OG1 2.79Å; F803-T846 HydrophobicContact CE1-CG2 4.44Å; Q804-T846 HydrophobicContact CG-CG2 4.09Å; Q804-T846 PolarHBondContact NE2-OG1 3.41Å; C844-T846 PolarHBondContact O-N 3.01Å; T846-L850 WeakPolarHBondContact O-CG 3.42Å; T846-L850 PolarHBondContact O-N 3.2Å; T846-L897 HydrophobicContact CG2-CD1 4.14Å; T846-F926 HydrophobicContact CG2-CE2 4.24Å; T846-F926 HydrophobicContact CG2-CZ 4.48Å
847	H	84.9	Confident	80	Confident	9 Å²	9	52.6 Å²	52.6	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-66.8	-42.9	173.7	-177.8	-83.3	0	0	0	111.4	C844 L845 L849 L850 S851 M856 H902 F924 F926	C844-H847 HydrophobicContact CB-CB 4.04Å; C844-H847 PolarHBondContact O-N 3.35Å; C844-H847 PolarHBondContact SG-N 2.84Å; C844-H847 VanDerWaalsContact SG-N 3.39Å; L845-H847 VanDerWaalsContact C-N 3.3Å; L845-H847 PolarHBondContact O-N 3.29Å; H847-L849 VanDerWaalsContact C-N 3.29Å; H847-L849 PolarHBondContact O-N 3.06Å; H847-L850 WeakPolarHBondContact O-CB 3.38Å; H847-L850 PolarHBondContact O-N 3.47Å; H847-S851 PolarHBondContact O-N 2.94Å; H847-M856 WeakPolarHBondContact CE1-CE 3.32Å; H847-H902 AromaticContact CD2-CE1 3.98Å; H847-H902 AromaticContact CD2-ND1 3.35Å; H847-H902 PolarHBondContact CD2-ND1 3.29Å; H847-H902 VanDerWaalsContact CD2-ND1 3.35Å; H847-H902 AromaticContact NE2-ND1 3.51Å; H847-F924 HydrophobicContact CB-CE1 4.35Å; H847-F924 HydrophobicContact CB-CE2 4.37Å; H847-F924 HydrophobicContact CB-CZ 4.03Å; H847-F924 AromaticContact CD2-CZ 3.56Å; H847-F924 AromaticContact CG-CZ 3.86Å; H847-F926 HydrophobicContact CB-CZ 4.15Å
848	D	84.6	Confident	79.1	Confident	70 Å²	70	52.7 Å²	52.7	37%	0.374	32%	0.318	S	S	.	.	H	α-helix	trans	-57.7	-42.3	177.6	-59.3	-27.7	0	0	0	111.9	T842 C844 L845 L850 S851	T842-D848 WeakPolarHBondContact CB-OD2 3.3Å; T842-D848 VanDerWaalsContact CG2-OD2 3.31Å; T842-D848 WeakPolarHBondContact CG2-OD2 3.37Å; T842-D848 PolarHBondContact OG1-OD2 3.26Å; C844-D848 VanDerWaalsContact O-CG 3.3Å; C844-D848 PolarHBondContact O-N 2.96Å; L845-D848 WeakPolarHBondContact O-CB 3.21Å; L845-D848 PolarHBondContact O-N 3.27Å; D848-L850 VanDerWaalsContact C-N 3.3Å; D848-L850 PolarHBondContact O-N 3.14Å; D848-S851 PolarHBondContact O-N 3.11Å; D848-S851 VanDerWaalsContact O-N 3.12Å; D848-S851 PolarHBondContact O-OG 3.45Å
849	L	82.3	Confident	78.2	Confident	96 Å²	96	54 Å²	54	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-67.1	-28.4	177.2	-70.6	174.7	0	0	0	113.4	L845 H847 S851	L845-L849 HydrophobicContact CD1-CG 4.33Å; L845-L849 HydrophobicContact CG-CD1 4.24Å; L845-L849 HydrophobicContact CG-CG 4.44Å; L845-L849 WeakPolarHBondContact O-CG 3.24Å; L845-L849 PolarHBondContact O-N 3.27Å; H847-L849 VanDerWaalsContact C-N 3.29Å; H847-L849 PolarHBondContact O-N 3.06Å; L849-S851 PolarHBondContact O-N 2.79Å
850	L	80	Confident	76.8	Confident	15 Å²	15	54.5 Å²	54.5	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-72.4	-21	174.4	-69.6	169.9	0	0	0	111.8	T846 H847 D848 C852 M894 L897 M898 F926	T846-L850 WeakPolarHBondContact O-CG 3.42Å; T846-L850 PolarHBondContact O-N 3.2Å; H847-L850 WeakPolarHBondContact O-CB 3.38Å; H847-L850 PolarHBondContact O-N 3.47Å; D848-L850 VanDerWaalsContact C-N 3.3Å; D848-L850 PolarHBondContact O-N 3.14Å; L850-C852 HydrophobicContact CB-CB 4.42Å; L850-C852 PolarHBondContact O-N 3.12Å; L850-M894 HydrophobicContact CD2-CB 4.36Å; L850-M894 HydrophobicContact CD2-CE 3.71Å; L850-M894 VanDerWaalsContact CD2-O 3.31Å; L850-M894 WeakPolarHBondContact CD2-O 3.34Å; L850-M894 HydrophobicContact CG-CE 4.26Å; L850-L897 HydrophobicContact CD1-CB 3.98Å; L850-M898 HydrophobicContact CB-CE 4.04Å; L850-M898 HydrophobicContact CD2-CE 4.06Å; L850-M898 HydrophobicContact CD2-CG 4.07Å; L850-M898 WeakPolarHBondContact O-CE 3.35Å; L850-F926 HydrophobicContact CD1-CZ 4.42Å
851	S	78	Confident	75.2	Confident	106 Å²	106	56 Å²	56	74%	0.741	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	38.4	-174.9	-60	0	0	0	0	112.3	H847 D848 L849	H847-S851 PolarHBondContact O-N 2.94Å; D848-S851 PolarHBondContact O-N 3.11Å; D848-S851 VanDerWaalsContact O-N 3.12Å; D848-S851 PolarHBondContact O-OG 3.45Å; L849-S851 PolarHBondContact O-N 2.79Å
852	C	77.1	Confident	73.1	Confident	25 Å²	25	55.9 Å²	55.9	17%	0.169	34%	0.344	C	S	.	.			trans	-75.5	141.6	-177.5	-172	0	0	0	0	110.9	L850	L850-C852 HydrophobicContact CB-CB 4.42Å; L850-C852 PolarHBondContact O-N 3.12Å
853	S	74.6	Confident	71.2	Confident	123 Å²	123	59.5 Å²	59.5	86%	0.86	37%	0.366	S	S	*	.			trans	-96.9	19.8	179.4	61.5	0	0	0	0	113.8
854	C	76.7	Confident	68.9	Low	15 Å²	15	65.2 Å²	65.2	10%	0.101	39%	0.386	C	S	.	.			trans	-69.6	157.4	-177	73.4	0	0	0	0	112.2	M856 N861 H902	C854-M856 PolarHBondContact O-N 3.44Å; C854-N861 WeakPolarHBondContact CB-OD1 3.17Å; C854-H902 VanDerWaalsContact SG-CB 3.59Å; C854-H902 PolarHBondContact SG-ND1 3.35Å
855	S	70.3	Confident	66.3	Low	76 Å²	76	70.4 Å²	70.4	53%	0.531	42%	0.418	S	S	.	.			trans	-74.4	-4.2	176.2	43.6	0	0	0	0	114.1	D857 S859	S855-D857 PolarHBondContact O-N 3.33Å; S855-D857 VanDerWaalsContact O-N 3.07Å; S855-D857 PolarHBondContact OG-OD1 3.08Å; S855-S859 PolarHBondContact OG-OG 3.16Å
856	M	74.8	Confident	63.5	Low	63 Å²	63	78.6 Å²	78.6	31%	0.31	46%	0.456	S	S	.	.	S	Bend	trans	54.5	23.9	178.8	-48.4	-177.5	-163.6	0	0	114.3	H847 C854 H902 F903 S904 T907 F924	H847-M856 WeakPolarHBondContact CE1-CE 3.32Å; C854-M856 PolarHBondContact O-N 3.44Å; M856-H902 CarbonylContact C-O 3.59Å; M856-H902 WeakPolarHBondContact CA-O 3.42Å; M856-F903 CarbonylContact O-C 3.58Å; M856-F903 WeakPolarHBondContact O-CA 3.34Å; M856-S904 PolarHBondContact O-N 3.43Å; M856-T907 WeakPolarHBondContact O-CG2 3.35Å; M856-F924 HydrophobicContact CG-CE2 4.38Å; M856-F924 HydrophobicContact SD-CE2 4.11Å
857	D	70.1	Confident	60.9	Low	88 Å²	88	88.1 Å²	88.1	47%	0.471	50%	0.5	S	S	.	.	B	Isolated β-bridge	trans	-104.8	5.9	-179.3	65.6	-15.1	0	0	0	113.1	S855 S859 H902 T907	S855-D857 PolarHBondContact O-N 3.33Å; S855-D857 VanDerWaalsContact O-N 3.07Å; S855-D857 PolarHBondContact OG-OD1 3.08Å; D857-S859 VanDerWaalsContact C-N 3.32Å; D857-S859 WeakPolarHBondContact OD1-CB 2.97Å; D857-S859 PolarHBondContact OD1-N 2.94Å; D857-S859 VanDerWaalsContact OD1-N 3.15Å; D857-S859 PolarHBondContact OD1-OG 3.4Å; D857-H902 PolarHBondContact N-O 3.45Å; D857-T907 HydrophobicContact CB-CG2 4.38Å
858	G	63.5	Low	58.1	Low	10 Å²	10	92.1 Å²	92.1	10%	0.103	54%	0.535	C	S	.	.	S	Bend	trans	81.5	3.1	-176.2	0	0	0	0	0	115.1	R901 H902 F903	G858-R901 WeakPolarHBondContact O-CD 3.49Å; G858-H902 WeakPolarHBondContact CA-O 3.26Å; G858-H902 PolarHBondContact N-O 3.18Å; G858-F903 VanDerWaalsContact CA-CE1 3.43Å
859	S	66.9	Low	55.2	Low	56 Å²	56	98 Å²	98	39%	0.392	56%	0.56	S	S	.	*			trans	-64.1	144.3	170	60	0	0	0	0	110.8	S855 D857 N861	S855-S859 PolarHBondContact OG-OG 3.16Å; D857-S859 VanDerWaalsContact C-N 3.32Å; D857-S859 WeakPolarHBondContact OD1-CB 2.97Å; D857-S859 PolarHBondContact OD1-N 2.94Å; D857-S859 VanDerWaalsContact OD1-N 3.15Å; D857-S859 PolarHBondContact OD1-OG 3.4Å; S859-N861 PolarHBondContact O-N 3.01Å
860	A	56	Low	52.7	Low	63 Å²	63	101.9 Å²	101.9	52%	0.521	58%	0.581	S	S	.	*			trans	-70.6	130.9	174.6	0	0	0	0	0	108.5	D862	A860-D862 PolarHBondContact O-N 3.08Å
861	N	49.9	Very low	50	Low	72 Å²	72	107.2 Å²	107.2	39%	0.385	61%	0.613	S	S	.	*			trans	-66.1	103.8	166.1	-74.3	-31.2	0	0	0	107.4	C854 S859 V863	C854-N861 WeakPolarHBondContact CB-OD1 3.17Å; S859-N861 PolarHBondContact O-N 3.01Å; N861-V863 PolarHBondContact O-N 3.21Å
862	D	36	Very low	47.6	Very low	155 Å²	155	108.2 Å²	108.2	83%	0.829	62%	0.617	S	S	*	*			trans	-66.3	85.9	168.3	-77.5	-30.2	0	0	0	108.6	A860 E864	A860-D862 PolarHBondContact O-N 3.08Å; D862-E864 PolarHBondContact O-N 3.26Å
863	V	38.5	Very low	45.2	Very low	117 Å²	117	114.7 Å²	114.7	71%	0.709	65%	0.65	S	S	*	*			trans	-84.6	99.9	157.7	-177.3	0	0	0	0	105.3	N861 V865	N861-V863 PolarHBondContact O-N 3.21Å; V863-V865 PolarHBondContact O-N 3.49Å
864	E	28.8	Very low	42.9	Very low	192 Å²	192	119.6 Å²	119.6	90%	0.897	65%	0.65	S	S	*	*			trans	-50.4	120.4	173.3	-68.3	179.1	166.7	0	0	109.9	D862	D862-E864 PolarHBondContact O-N 3.26Å
865	V	30.1	Very low	40.7	Very low	111 Å²	111	125.2 Å²	125.2	67%	0.673	69%	0.686	S	S	*	*			trans	-119.9	116.9	166.5	-179.6	0	0	0	0	105.8	V863 E867	V863-V865 PolarHBondContact O-N 3.49Å; V865-E867 PolarHBondContact O-N 3.49Å
866	E	27.3	Very low	38.9	Very low	189 Å²	189	126.5 Å²	126.5	88%	0.883	69%	0.694	S	S	*	*			trans	-51.4	125.6	173.6	-70.4	-178.8	149.3	0	0	110.5	A868	E866-A868 PolarHBondContact O-N 3.43Å
867	E	27.7	Very low	37.1	Very low	199 Å²	199	129.3 Å²	129.3	93%	0.93	71%	0.706	S	S	*	*			trans	-68	107.4	173	-72.3	-176.1	149.9	0	0	109.7	V865	V865-E867 PolarHBondContact O-N 3.49Å
868	A	27.3	Very low	35.3	Very low	93 Å²	93	131.7 Å²	131.7	77%	0.769	72%	0.718	S	S	*	*			trans	-93.9	129.5	166.7	0	0	0	0	0	110	E866	E866-A868 PolarHBondContact O-N 3.43Å
869	E	24.3	Very low	33.7	Very low	194 Å²	194	134.5 Å²	134.5	91%	0.907	75%	0.747	S	S	*	*			trans	-51.3	134.6	-175.5	-66.8	-179.4	146.4	0	0	114.3	V871	E869-V871 PolarHBondContact O-N 3.47Å
870	L	28.2	Very low	31.7	Very low	178 Å²	178	143.8 Å²	143.8	93%	0.932	77%	0.774	S	S	*	*			trans	-80.9	111.8	178	-75.4	160.2	0	0	0	111.8
871	V	24.5	Very low	30.6	Very low	126 Å²	126	149.6 Å²	149.6	76%	0.764	79%	0.79	S	S	*	*			trans	-90.4	138.4	163.4	-179.2	0	0	0	0	109	E869 D873	E869-V871 PolarHBondContact O-N 3.47Å; V871-D873 PolarHBondContact O-N 3.35Å
872	P	26.3	Very low	29.6	Very low	128 Å²	128	149.1 Å²	149.1	83%	0.831	80%	0.803	S	S	*	*			trans	-75.6	109.5	-173.2	28.6	-33	0	0	0	111.8
873	D	26.7	Very low	29.1	Very low	161 Å²	161	149.8 Å²	149.8	86%	0.861	81%	0.806	S	S	*	*			trans	-98.5	141.3	-178.3	-132.4	-8.6	0	0	0	113.3	V871	V871-D873 PolarHBondContact O-N 3.35Å
874	R	26.3	Very low	29.2	Very low	226 Å²	226	155.8 Å²	155.8	85%	0.853	82%	0.816	S	S	*	*			trans	-73.2	143	175.6	-76.7	179.4	176.1	-172.3	-0.5	110	C876	R874-C876 PolarHBondContact O-N 2.88Å
875	P	31.4	Very low	29.3	Very low	132 Å²	132	158.2 Å²	158.2	86%	0.857	82%	0.817	S	S	*	*			trans	-70.4	100.3	-176.8	27.9	-32.2	0	0	0	111.1
876	C	31.5	Very low	29.2	Very low	103 Å²	103	156.2 Å²	156.2	70%	0.696	82%	0.819	S	S	*	*			trans	-91.1	127.8	174.5	151.4	0	0	0	0	109.8	R874 L878	R874-C876 PolarHBondContact O-N 2.88Å; C876-L878 PolarHBondContact O-N 3.27Å; C876-L878 VanDerWaalsContact O-N 3.12Å
877	Q	37.8	Very low	29.5	Very low	123 Å²	123	152.4 Å²	152.4	58%	0.575	82%	0.819	S	S	*	*	S	Bend	trans	-76.6	91.9	175.9	-68.7	177.1	-17.9	0	0	109.7
878	L	33.3	Very low	29.6	Very low	138 Å²	138	147.2 Å²	147.2	72%	0.723	81%	0.811	S	S	*	*	S	Bend	trans	70.5	97.3	164	-55.2	168.3	0	0	0	117	C876	C876-L878 PolarHBondContact O-N 3.27Å; C876-L878 VanDerWaalsContact O-N 3.12Å
879	G	29.2	Very low	30	Very low	69 Å²	69	147.7 Å²	147.7	71%	0.711	80%	0.797	S	S	*	*			trans	79	96.5	135.9	0	0	0	0	0	118.9
880	R	25.9	Very low	30.8	Very low	251 Å²	251	146.2 Å²	146.2	95%	0.947	79%	0.787	S	S	*	*			trans	-100.5	115	137.3	-85.5	-171.8	173.9	-163.7	-2.1	107.2	G882	R880-G882 PolarHBondContact O-N 3.45Å
881	Q	32.5	Very low	31.7	Very low	184 Å²	184	140 Å²	140	86%	0.86	75%	0.754	S	S	*	*			trans	-83.6	102.8	167.6	-78	-167.2	6.9	0	0	108.6
882	G	29.1	Very low	33	Very low	63 Å²	63	134.8 Å²	134.8	65%	0.649	72%	0.722	S	S	*	*			trans	-169	42.9	173.3	0	0	0	0	0	109.7	R880	R880-G882 PolarHBondContact O-N 3.45Å
883	D	24.9	Very low	34.7	Very low	168 Å²	168	129.9 Å²	129.9	90%	0.898	69%	0.69	S	S	*	*	S	Bend	trans	-174.2	138	144.1	-93.5	-28.9	0	0	0	109.9
884	R	39.8	Very low	36.5	Very low	243 Å²	243	125.1 Å²	125.1	92%	0.917	66%	0.663	S	S	*	*	S	Bend	trans	-71.3	141.7	-169.9	-75.2	172.2	167.7	174.5	-3.9	111.2
885	R	32.3	Very low	38.2	Very low	243 Å²	243	117.9 Å²	117.9	92%	0.917	65%	0.647	S	S	*	*			trans	76.2	78.4	170.8	-59.7	-177.5	178.8	-166.2	-0	116
886	G	27.1	Very low	40.1	Very low	69 Å²	69	113.4 Å²	113.4	71%	0.711	62%	0.615	S	S	*	*			trans	-148.4	129.2	164.9	0	0	0	0	0	110.5	A888	G886-A888 PolarHBondContact O-N 3.45Å
887	A	34.3	Very low	42.2	Very low	109 Å²	109	108.5 Å²	108.5	90%	0.901	58%	0.582	S	S	*	*			trans	-37.7	100.7	-170.5	0	0	0	0	0	115.6
888	A	29.8	Very low	44	Very low	90 Å²	90	106.4 Å²	106.4	74%	0.744	57%	0.573	S	S	*	*			trans	-97.9	118.3	166.7	0	0	0	0	0	108.8	G886	G886-A888 PolarHBondContact O-N 3.45Å
889	Q	35.6	Very low	46.1	Very low	103 Å²	103	107.3 Å²	107.3	48%	0.481	57%	0.574	S	S	.	*			trans	45.3	105	164.8	-66	173.5	-25.2	0	0	117.1	G814 H891	G814-Q889 PolarHBondContact O-NE2 3.33Å; G814-Q889 PolarHBondContact O-OE1 3.15Å; Q889-H891 PolarHBondContact O-N 2.64Å
890	K	40	Very low	48.7	Very low	163 Å²	163	105.1 Å²	105.1	71%	0.709	54%	0.544	S	S	*	.			trans	-72	71.2	169.8	-66.7	-175	-177.8	-176.5	0	112.2	E561 E896	E561-K890 WeakPolarHBondContact OE1-CD 3.34Å; E561-K890 WeakPolarHBondContact OE1-CG 3.42Å; K890-E896 WeakPolarHBondContact CA-OE1 3.35Å
891	H	47.3	Very low	51.5	Low	49 Å²	49	98.6 Å²	98.6	23%	0.227	52%	0.519	C	S	.	.			trans	-103.6	125.5	162.7	-72.9	-69.6	0	0	0	108.3	Q810 Q889 S893 E896	Q810-H891 WeakPolarHBondContact O-CB 3.11Å; Q889-H891 PolarHBondContact O-N 2.64Å; H891-S893 PolarHBondContact O-N 2.63Å; H891-E896 VanDerWaalsContact C-OE2 3.32Å
892	L	51.1	Low	54.2	Low	16 Å²	16	90.1 Å²	90.1	8%	0.084	48%	0.48	C	S	.	.			trans	-47	103.5	179.6	-135.9	161.5	0	0	0	110	V807 Q810 G811 E896 L897 W900	V807-L892 HydrophobicContact CB-CD2 4.43Å; V807-L892 HydrophobicContact CG1-CD2 3.75Å; V807-L892 HydrophobicContact CG2-CD2 3.89Å; Q810-L892 HydrophobicContact CB-CB 4.43Å; Q810-L892 WeakPolarHBondContact CB-O 3.34Å; G811-L892 PolarHBondContact N-O 3.19Å; G811-L892 VanDerWaalsContact N-O 3.11Å; L892-E896 WeakPolarHBondContact CA-OE2 3.35Å; L892-E896 PolarHBondContact N-OE2 3.01Å; L892-L897 HydrophobicContact CD2-CD1 4.49Å; L892-L897 HydrophobicContact CD2-CD2 3.58Å; L892-L897 HydrophobicContact CD2-CG 3.67Å; L892-W900 HydrophobicContact CD1-CH2 3.39Å; L892-W900 HydrophobicContact CD1-CZ2 3.3Å; L892-W900 HydrophobicContact CD2-CH2 4.38Å; L892-W900 HydrophobicContact CD2-CZ2 3.95Å; L892-W900 HydrophobicContact CG-CH2 4.13Å; L892-W900 HydrophobicContact CG-CZ2 3.57Å
893	S	61.9	Low	56.9	Low	25 Å²	25	87.2 Å²	87.2	18%	0.175	45%	0.449	C	S	.	.			trans	-110.9	165.6	177	71.1	0	0	0	0	109.1	H891 S895 E896 L897	H891-S893 PolarHBondContact O-N 2.63Å; S893-S895 PolarHBondContact O-N 2.98Å; S893-S895 PolarHBondContact OG-OG 3.36Å; S893-E896 PolarHBondContact O-N 3.07Å; S893-E896 PolarHBondContact OG-N 2.65Å; S893-L897 PolarHBondContact O-N 3.12Å; S893-L897 VanDerWaalsContact O-N 3.1Å
894	M	65.3	Low	59.7	Low	60 Å²	60	80.2 Å²	80.2	30%	0.296	41%	0.413	S	S	.	.	H	α-helix	trans	-59.8	-29.6	177.3	-67.9	-62	-72.1	0	0	112.1	V807 L850 L897	V807-M894 HydrophobicContact CB-SD 4.36Å; V807-M894 HydrophobicContact CG1-CG 4.37Å; V807-M894 HydrophobicContact CG1-SD 3.85Å; L850-M894 HydrophobicContact CD2-CB 4.36Å; L850-M894 HydrophobicContact CD2-CE 3.71Å; L850-M894 VanDerWaalsContact CD2-O 3.31Å; L850-M894 WeakPolarHBondContact CD2-O 3.34Å; L850-M894 HydrophobicContact CG-CE 4.26Å; M894-L897 HydrophobicContact SD-CD1 4.03Å
895	S	62.9	Low	61.2	Low	74 Å²	74	69.6 Å²	69.6	52%	0.517	38%	0.379	S	S	.	.	H	α-helix	trans	-76.2	-28.6	174.2	51.2	0	0	0	0	113.1	S893 M898	S893-S895 PolarHBondContact O-N 2.98Å; S893-S895 PolarHBondContact OG-OG 3.36Å; S895-M898 WeakPolarHBondContact O-CB 3.46Å; S895-M898 PolarHBondContact O-N 3.07Å
896	E	70	Confident	63.1	Low	38 Å²	38	65.2 Å²	65.2	18%	0.178	38%	0.375	C	S	.	.	H	α-helix	trans	-69.8	-35.9	172	-71.9	-173	178.8	0	0	111.8	K890 H891 L892 S893 M898 Q899 W900	K890-E896 WeakPolarHBondContact CA-OE1 3.35Å; H891-E896 VanDerWaalsContact C-OE2 3.32Å; L892-E896 WeakPolarHBondContact CA-OE2 3.35Å; L892-E896 PolarHBondContact N-OE2 3.01Å; S893-E896 PolarHBondContact O-N 3.07Å; S893-E896 PolarHBondContact OG-N 2.65Å; E896-M898 PolarHBondContact O-N 2.83Å; E896-Q899 WeakPolarHBondContact O-CA 3.37Å; E896-Q899 WeakPolarHBondContact O-CB 3.42Å; E896-Q899 PolarHBondContact O-N 2.95Å; E896-W900 PolarHBondContact O-N 3.31Å; E896-W900 PolarHBondContact O-NE1 2.85Å
897	L	76.8	Confident	65	Low	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-57.8	-30.2	173.4	-76.4	177.3	0	0	0	112.4	F803 V807 T846 L850 L892 S893 M894 Q899 W900 H902	F803-L897 HydrophobicContact CE1-CD1 4.5Å; F803-L897 HydrophobicContact CZ-CD2 4.38Å; V807-L897 HydrophobicContact CB-CD1 4.49Å; V807-L897 HydrophobicContact CG1-CD1 3.87Å; V807-L897 HydrophobicContact CG1-CG 4.24Å; V807-L897 HydrophobicContact CG2-CD1 4.24Å; T846-L897 HydrophobicContact CG2-CD1 4.14Å; L850-L897 HydrophobicContact CD1-CB 3.98Å; L892-L897 HydrophobicContact CD2-CD1 4.49Å; L892-L897 HydrophobicContact CD2-CD2 3.58Å; L892-L897 HydrophobicContact CD2-CG 3.67Å; S893-L897 PolarHBondContact O-N 3.12Å; S893-L897 VanDerWaalsContact O-N 3.1Å; M894-L897 HydrophobicContact SD-CD1 4.03Å; L897-Q899 VanDerWaalsContact C-N 3.26Å; L897-Q899 PolarHBondContact O-N 3.48Å; L897-W900 HydrophobicContact CD2-CD2 4.22Å; L897-W900 HydrophobicContact CD2-CE3 4.23Å; L897-W900 HydrophobicContact CD2-CZ3 4.47Å; L897-W900 WeakPolarHBondContact O-CB 3.33Å; L897-W900 PolarHBondContact O-N 3.5Å; L897-H902 PolarHBondContact O-NE2 3.32Å
898	M	74.3	Confident	66.3	Low	80 Å²	80	65.8 Å²	65.8	39%	0.394	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.3	174.1	-65.5	-173	161.4	0	0	113.5	L850 S895 E896 W900	L850-M898 HydrophobicContact CB-CE 4.04Å; L850-M898 HydrophobicContact CD2-CE 4.06Å; L850-M898 HydrophobicContact CD2-CG 4.07Å; L850-M898 WeakPolarHBondContact O-CE 3.35Å; S895-M898 WeakPolarHBondContact O-CB 3.46Å; S895-M898 PolarHBondContact O-N 3.07Å; E896-M898 PolarHBondContact O-N 2.83Å; M898-W900 VanDerWaalsContact C-N 3.33Å
899	Q	77.1	Confident	68.5	Low	156 Å²	156	65.4 Å²	65.4	73%	0.729	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-11.3	178.3	-59.1	172.4	7.8	0	0	112.2	E896 L897	E896-Q899 WeakPolarHBondContact O-CA 3.37Å; E896-Q899 WeakPolarHBondContact O-CB 3.42Å; E896-Q899 PolarHBondContact O-N 2.95Å; L897-Q899 VanDerWaalsContact C-N 3.26Å; L897-Q899 PolarHBondContact O-N 3.48Å
900	W	84.4	Confident	70.3	Confident	24 Å²	24	60.5 Å²	60.5	9%	0.091	31%	0.307	C	S	.	.	S	Bend	trans	-76.2	157	177.4	-69.9	25.3	0	0	0	109.7	L892 E896 L897 M898 H902 F926 Q927 T928	L892-W900 HydrophobicContact CD1-CH2 3.39Å; L892-W900 HydrophobicContact CD1-CZ2 3.3Å; L892-W900 HydrophobicContact CD2-CH2 4.38Å; L892-W900 HydrophobicContact CD2-CZ2 3.95Å; L892-W900 HydrophobicContact CG-CH2 4.13Å; L892-W900 HydrophobicContact CG-CZ2 3.57Å; E896-W900 PolarHBondContact O-N 3.31Å; E896-W900 PolarHBondContact O-NE1 2.85Å; L897-W900 HydrophobicContact CD2-CD2 4.22Å; L897-W900 HydrophobicContact CD2-CE3 4.23Å; L897-W900 HydrophobicContact CD2-CZ3 4.47Å; L897-W900 WeakPolarHBondContact O-CB 3.33Å; L897-W900 PolarHBondContact O-N 3.5Å; M898-W900 VanDerWaalsContact C-N 3.33Å; W900-H902 PolarHBondContact O-CD2 2.85Å; W900-H902 PolarHBondContact O-NE2 3.2Å; W900-F926 HydrophobicContact CE3-CB 3.73Å; W900-F926 HydrophobicContact CZ3-CB 4.35Å; W900-Q927 WeakPolarHBondContact CB-O 3.22Å; W900-T928 HydrophobicContact CD2-CG2 3.89Å; W900-T928 HydrophobicContact CE3-CG2 4Å; W900-T928 HydrophobicContact CH2-CG2 3.57Å; W900-T928 HydrophobicContact CZ2-CG2 3.4Å; W900-T928 VanDerWaalsContact CZ2-CG2 3.4Å; W900-T928 HydrophobicContact CZ3-CG2 3.89Å
901	R	85.6	Confident	72	Confident	113 Å²	113	56.9 Å²	56.9	43%	0.426	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.2	173.2	-66.8	176.7	-179.8	-174.7	-2.2	109.3	G858 F903 F926 Q927	G858-R901 WeakPolarHBondContact O-CD 3.49Å; R901-F903 HydrophobicContact CB-CD2 4.39Å; R901-F903 HydrophobicContact CB-CE2 3.6Å; R901-F903 HydrophobicContact CB-CZ 4.16Å; R901-F926 WeakPolarHBondContact O-CA 3.22Å; R901-Q927 HydrophobicContact CB-CB 4.25Å; R901-Q927 PolarHBondContact N-O 3.11Å; R901-Q927 PolarHBondContact O-N 3.42Å
902	H	88.4	Confident	73.6	Confident	6 Å²	6	54.8 Å²	54.8	3%	0.028	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.3	-174.4	-67.9	-174.3	0	0	0	108.1	H847 C854 M856 D857 G858 L897 W900 F924 F926	H847-H902 AromaticContact CD2-CE1 3.98Å; H847-H902 AromaticContact CD2-ND1 3.35Å; H847-H902 PolarHBondContact CD2-ND1 3.29Å; H847-H902 VanDerWaalsContact CD2-ND1 3.35Å; H847-H902 AromaticContact NE2-ND1 3.51Å; C854-H902 VanDerWaalsContact SG-CB 3.59Å; C854-H902 PolarHBondContact SG-ND1 3.35Å; M856-H902 CarbonylContact C-O 3.59Å; M856-H902 WeakPolarHBondContact CA-O 3.42Å; D857-H902 PolarHBondContact N-O 3.45Å; G858-H902 WeakPolarHBondContact CA-O 3.26Å; G858-H902 PolarHBondContact N-O 3.18Å; L897-H902 PolarHBondContact O-NE2 3.32Å; W900-H902 PolarHBondContact O-CD2 2.85Å; W900-H902 PolarHBondContact O-NE2 3.2Å; H902-F924 HydrophobicContact CB-CE1 4.45Å; H902-F924 HydrophobicContact CB-CZ 3.78Å; H902-F926 AromaticContact CD2-CD1 3.31Å; H902-F926 WeakPolarHBondContact CD2-CD1 3.31Å; H902-F926 AromaticContact CD2-CE1 3.48Å; H902-F926 VanDerWaalsContact CD2-CE1 3.48Å; H902-F926 WeakPolarHBondContact CD2-CE1 3.4Å; H902-F926 AromaticContact CE1-CE1 3.81Å; H902-F926 AromaticContact CG-CD1 3.99Å; H902-F926 AromaticContact CG-CE1 3.85Å; H902-F926 AromaticContact NE2-CD1 3.62Å; H902-F926 AromaticContact NE2-CE1 3.46Å; H902-F926 WeakPolarHBondContact NE2-CE1 3.1Å
903	F	85.3	Confident	75.1	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.009	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.3	-179.7	-62.4	-95.8	0	0	0	109.7	W573 M856 G858 R901 F910 F924 A925 Q927	W573-F903 HydrophobicContact CH2-CD2 4.28Å; W573-F903 AromaticContact CH2-CE2 3.87Å; W573-F903 HydrophobicContact CH2-CE2 3.87Å; W573-F903 HydrophobicContact CH2-CZ 4.13Å; W573-F903 AromaticContact CZ3-CD2 3.85Å; W573-F903 HydrophobicContact CZ3-CD2 3.85Å; W573-F903 AromaticContact CZ3-CE2 3.83Å; W573-F903 HydrophobicContact CZ3-CE2 3.83Å; W573-F903 HydrophobicContact CZ3-CZ 4.49Å; M856-F903 CarbonylContact O-C 3.58Å; M856-F903 WeakPolarHBondContact O-CA 3.34Å; G858-F903 VanDerWaalsContact CA-CE1 3.43Å; R901-F903 HydrophobicContact CB-CD2 4.39Å; R901-F903 HydrophobicContact CB-CE2 3.6Å; R901-F903 HydrophobicContact CB-CZ 4.16Å; F903-F910 HydrophobicContact CB-CD1 3.61Å; F903-F910 HydrophobicContact CB-CE1 3.54Å; F903-F910 HydrophobicContact CD1-CD1 4.03Å; F903-F910 AromaticContact CG-CD1 3.88Å; F903-F910 HydrophobicContact CG-CD1 3.88Å; F903-F910 HydrophobicContact CG-CE1 4.33Å; F903-F924 CarbonylContact O-C 3.11Å; F903-F924 WeakPolarHBondContact O-CA 3.43Å; F903-F924 WeakPolarHBondContact O-CD2 3.34Å; F903-F924 WeakPolarHBondContact O-CG 3.48Å; F903-A925 HydrophobicContact CB-CB 4.29Å; F903-A925 PolarHBondContact N-O 3.29Å; F903-A925 PolarHBondContact O-N 3.42Å; F903-Q927 HydrophobicContact CD2-CB 4.28Å; F903-Q927 HydrophobicContact CE2-CB 3.67Å
904	S	84.6	Confident	76.4	Confident	21 Å²	21	57.5 Å²	57.5	15%	0.147	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	148.6	167.7	-179.8	0	0	0	0	110.6	M856 D906 T907	M856-S904 PolarHBondContact O-N 3.43Å; S904-D906 PolarHBondContact O-N 3.33Å; S904-D906 VanDerWaalsContact O-N 3.12Å; S904-D906 PolarHBondContact OG-N 3.3Å; S904-T907 WeakPolarHBondContact O-CB 3.44Å; S904-T907 WeakPolarHBondContact O-CG2 3.48Å; S904-T907 PolarHBondContact O-N 3.05Å; S904-T907 VanDerWaalsContact O-N 3.07Å; S904-T907 PolarHBondContact O-OG1 3.24Å
905	G	71.6	Confident	77.3	Confident	20 Å²	20	54.6 Å²	54.6	21%	0.206	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.1	171.3	0	0	0	0	0	114	T907 I922 T923	G905-T907 VanDerWaalsContact C-N 3.3Å; G905-I922 WeakPolarHBondContact CA-O 3.36Å; G905-T923 WeakPolarHBondContact CA-O 3.49Å; G905-T923 PolarHBondContact N-O 3.09Å
906	D	71.4	Confident	78.4	Confident	152 Å²	152	53.3 Å²	53.3	81%	0.813	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-3.6	177.6	-60.5	-40.3	0	0	0	113.8	S904	S904-D906 PolarHBondContact O-N 3.33Å; S904-D906 VanDerWaalsContact O-N 3.12Å; S904-D906 PolarHBondContact OG-N 3.3Å
907	T	66.6	Low	79	Confident	24 Å²	24	56 Å²	56	15%	0.147	29%	0.292	C	S	.	.	S	Bend	trans	-70.6	147.4	179.4	53.1	0	0	0	0	112.5	M856 D857 S904 G905 T909	M856-T907 WeakPolarHBondContact O-CG2 3.35Å; D857-T907 HydrophobicContact CB-CG2 4.38Å; S904-T907 WeakPolarHBondContact O-CB 3.44Å; S904-T907 WeakPolarHBondContact O-CG2 3.48Å; S904-T907 PolarHBondContact O-N 3.05Å; S904-T907 VanDerWaalsContact O-N 3.07Å; S904-T907 PolarHBondContact O-OG1 3.24Å; G905-T907 VanDerWaalsContact C-N 3.3Å; T907-T909 PolarHBondContact O-N 3.23Å
908	H	62.7	Low	79.3	Confident	166 Å²	166	56 Å²	56	77%	0.769	29%	0.292	S	S	*	.	S	Bend	trans	-68.6	-30.8	-177.1	-80.6	-75.6	0	0	0	113.6	R919	H908-R919 PolarHBondContact O-NH1 3.46Å
909	T	74.6	Confident	79.8	Confident	81 Å²	81	57.9 Å²	57.9	50%	0.497	30%	0.295	S	S	.	.			trans	-153.3	137	-178.9	55.5	0	0	0	0	111.9	T907 S911 D916	T907-T909 PolarHBondContact O-N 3.23Å; T909-S911 PolarHBondContact O-N 3.48Å; T909-D916 WeakPolarHBondContact CA-OD1 3.05Å
910	F	74.4	Confident	80.1	Confident	1 Å²	1	54.6 Å²	54.6	0%	0.004	29%	0.289	C	S	.	.			trans	-82.4	5.8	173.6	-73	-73.8	0	0	0	113.4	W573 F903 D912 L915 D916 R919 I922 A925	W573-F910 HydrophobicContact CH2-CB 4.26Å; W573-F910 WeakPolarHBondContact CH2-O 3.45Å; W573-F910 HydrophobicContact CZ3-CD1 4.47Å; F903-F910 HydrophobicContact CB-CD1 3.61Å; F903-F910 HydrophobicContact CB-CE1 3.54Å; F903-F910 HydrophobicContact CD1-CD1 4.03Å; F903-F910 AromaticContact CG-CD1 3.88Å; F903-F910 HydrophobicContact CG-CD1 3.88Å; F903-F910 HydrophobicContact CG-CE1 4.33Å; F910-D912 PolarHBondContact O-N 3.16Å; F910-L915 HydrophobicContact CB-CB 4.22Å; F910-L915 HydrophobicContact CD2-CB 4.38Å; F910-D916 PolarHBondContact N-OD1 2.94Å; F910-R919 HydrophobicContact CD2-CB 4.23Å; F910-R919 HydrophobicContact CE2-CB 3.68Å; F910-I922 HydrophobicContact CZ-CB 4.35Å; F910-I922 HydrophobicContact CZ-CG2 4Å; F910-A925 HydrophobicContact CD1-CB 4.31Å; F910-A925 HydrophobicContact CE1-CB 3.96Å
911	S	75.6	Confident	80.3	Confident	86 Å²	86	55.9 Å²	55.9	60%	0.601	30%	0.296	S	S	*	.	S	Bend	trans	62.1	-8.5	-172.2	-50.4	0	0	0	0	115.6	T909	T909-S911 PolarHBondContact O-N 3.48Å
912	D	81.2	Confident	80.5	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.032	28%	0.277	C	S	.	.			trans	-106.9	112.9	170.6	-175.5	-21.5	0	0	0	109.1	W573 H788 Y790 F910 Y914 L915 D916	W573-D912 HydrophobicContact CZ2-CB 3.61Å; W573-D912 PolarHBondContact NE1-OD2 3.27Å; W573-D912 VanDerWaalsContact NE1-OD2 3.13Å; H788-D912 IonicContact CE1-OD2 3.2Å; H788-D912 IonicContact ND1-OD2 3.97Å; H788-D912 PolarHBondContact ND1-OD2 3.42Å; Y790-D912 PolarHBondContact OH-OD2 3.04Å; F910-D912 PolarHBondContact O-N 3.16Å; D912-Y914 PolarHBondContact O-N 3.2Å; D912-Y914 VanDerWaalsContact O-N 3.13Å; D912-Y914 WeakPolarHBondContact OD1-CB 3.32Å; D912-Y914 WeakPolarHBondContact OD1-CD2 3.43Å; D912-Y914 PolarHBondContact OD1-N 3.02Å; D912-L915 HydrophobicContact CB-CB 4.43Å; D912-L915 HydrophobicContact CB-CD1 4.24Å; D912-L915 HydrophobicContact CB-CG 4.36Å; D912-L915 PolarHBondContact O-N 2.98Å; D912-D916 PolarHBondContact O-N 3.16Å
913	P	82.9	Confident	80.6	Confident	70 Å²	70	51.8 Å²	51.8	46%	0.455	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.4	-174.4	28.3	-36.3	0	0	0	113.2	L681 H917	L681-P913 HydrophobicContact CD1-CB 4.12Å; P913-H917 PolarHBondContact O-ND1 2.69Å
914	Y	87.8	Confident	80.8	Confident	27 Å²	27	51.9 Å²	51.9	11%	0.106	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-35.9	175.6	-52.7	-65.1	0	0	0	111.3	I678 L681 S682 H758 H788 D912	I678-Y914 HydrophobicContact CB-CD1 4.44Å; I678-Y914 HydrophobicContact CG1-CD1 3.83Å; I678-Y914 HydrophobicContact CG1-CE1 4.41Å; I678-Y914 HydrophobicContact CG1-CG 4.13Å; L681-Y914 HydrophobicContact CB-CD1 4.26Å; L681-Y914 HydrophobicContact CB-CE1 3.85Å; L681-Y914 HydrophobicContact CD1-CD1 3.76Å; L681-Y914 HydrophobicContact CD1-CE1 4.08Å; S682-Y914 PolarHBondContact OG-OH 2.87Å; H758-Y914 AromaticContact CE1-CD2 3.67Å; H758-Y914 AromaticContact CE1-CE2 3.51Å; H758-Y914 AromaticContact CE1-CZ 3.95Å; H788-Y914 AromaticContact CE1-CE2 3.89Å; D912-Y914 PolarHBondContact O-N 3.2Å; D912-Y914 VanDerWaalsContact O-N 3.13Å; D912-Y914 WeakPolarHBondContact OD1-CB 3.32Å; D912-Y914 WeakPolarHBondContact OD1-CD2 3.43Å; D912-Y914 PolarHBondContact OD1-N 3.02Å
915	L	86.1	Confident	81.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-27.5	-177.2	-70.4	178.9	0	0	0	113.7	W573 L575 L674 Y790 F910 D912 H917 A918 R919 I922	W573-L915 HydrophobicContact CD2-CD1 3.47Å; W573-L915 VanDerWaalsContact CD2-CD1 3.47Å; W573-L915 HydrophobicContact CE3-CD1 3.74Å; W573-L915 HydrophobicContact CG-CD1 3.86Å; W573-L915 HydrophobicContact CH2-CD1 4.26Å; W573-L915 HydrophobicContact CZ2-CD1 3.98Å; W573-L915 HydrophobicContact CZ3-CD1 4.12Å; L575-L915 HydrophobicContact CD1-CD2 3.56Å; L575-L915 HydrophobicContact CD2-CD1 3.99Å; L575-L915 HydrophobicContact CD2-CD2 4.31Å; L674-L915 HydrophobicContact CD1-CD2 4.14Å; Y790-L915 HydrophobicContact CD1-CD1 4.34Å; Y790-L915 HydrophobicContact CD1-CD2 3.88Å; Y790-L915 HydrophobicContact CD1-CG 4.4Å; Y790-L915 HydrophobicContact CE1-CD1 3.89Å; Y790-L915 HydrophobicContact CE1-CD2 3.69Å; Y790-L915 HydrophobicContact CE1-CG 3.78Å; F910-L915 HydrophobicContact CB-CB 4.22Å; F910-L915 HydrophobicContact CD2-CB 4.38Å; D912-L915 HydrophobicContact CB-CB 4.43Å; D912-L915 HydrophobicContact CB-CD1 4.24Å; D912-L915 HydrophobicContact CB-CG 4.36Å; D912-L915 PolarHBondContact O-N 2.98Å; L915-H917 PolarHBondContact O-N 3.1Å; L915-H917 VanDerWaalsContact O-N 3.07Å; L915-A918 PolarHBondContact O-N 3.12Å; L915-R919 PolarHBondContact O-N 3.45Å; L915-I922 HydrophobicContact CD2-CD1 4.49Å
916	D	84.2	Confident	82	Confident	47 Å²	47	50 Å²	50	25%	0.251	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.9	179	-73.5	-24.7	0	0	0	112.7	T909 F910 D912 R919	T909-D916 WeakPolarHBondContact CA-OD1 3.05Å; F910-D916 PolarHBondContact N-OD1 2.94Å; D912-D916 PolarHBondContact O-N 3.16Å; D916-R919 WeakPolarHBondContact O-CD 3.42Å; D916-R919 WeakPolarHBondContact O-CG 3.35Å
917	H	83.1	Confident	82.9	Confident	93 Å²	93	43.2 Å²	43.2	43%	0.431	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-29.3	175.3	-69.9	77.5	0	0	0	113.5	A677 P913 L915	A677-H917 HydrophobicContact CB-CB 3.82Å; P913-H917 PolarHBondContact O-ND1 2.69Å; L915-H917 PolarHBondContact O-N 3.1Å; L915-H917 VanDerWaalsContact O-N 3.07Å
918	A	83.6	Confident	83.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	4.6	-177.3	0	0	0	0	0	113.2	V670 D673 L915 S920 H921 I922	V670-A918 HydrophobicContact CG1-CB 4.2Å; D673-A918 HydrophobicContact CB-CB 3.82Å; L915-A918 PolarHBondContact O-N 3.12Å; A918-S920 VanDerWaalsContact C-N 3.28Å; A918-S920 PolarHBondContact O-N 3.24Å; A918-S920 VanDerWaalsContact O-N 3.17Å; A918-H921 PolarHBondContact O-N 3.49Å; A918-H921 VanDerWaalsContact O-N 3.12Å; A918-I922 HydrophobicContact CB-CD1 4.32Å
919	R	83.8	Confident	85	Confident	120 Å²	120	38.5 Å²	38.5	45%	0.453	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-55.9	-36.5	-169.3	70.9	-179	-173.1	163.6	2.7	114.6	H908 F910 L915 D916 H921 I922	H908-R919 PolarHBondContact O-NH1 3.46Å; F910-R919 HydrophobicContact CD2-CB 4.23Å; F910-R919 HydrophobicContact CE2-CB 3.68Å; L915-R919 PolarHBondContact O-N 3.45Å; D916-R919 WeakPolarHBondContact O-CD 3.42Å; D916-R919 WeakPolarHBondContact O-CG 3.35Å; R919-H921 PolarHBondContact O-N 3.08Å; R919-I922 PolarHBondContact O-N 3.19Å; R919-I922 VanDerWaalsContact O-N 3.08Å
920	S	84.3	Confident	85.3	Confident	87 Å²	87	36.9 Å²	36.9	61%	0.608	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-63.1	-15.1	-176.7	44.5	0	0	0	0	113.4	A918	A918-S920 VanDerWaalsContact C-N 3.28Å; A918-S920 PolarHBondContact O-N 3.24Å; A918-S920 VanDerWaalsContact O-N 3.17Å
921	H	88.2	Confident	85	Confident	52 Å²	52	39.9 Å²	39.9	24%	0.241	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-111.1	2.4	-177.1	-56	-53.1	0	0	0	112.7	C577 T578 V670 D673 A918 R919	C577-H921 WeakPolarHBondContact CA-O 3.49Å; T578-H921 PolarHBondContact N-O 3.38Å; T578-H921 PolarHBondContact OG1-O 2.67Å; V670-H921 HydrophobicContact CG2-CB 3.55Å; D673-H921 IonicContact OD2-CD2 3.12Å; D673-H921 PolarHBondContact OD2-CD2 3.27Å; D673-H921 IonicContact OD2-NE2 2.69Å; A918-H921 PolarHBondContact O-N 3.49Å; A918-H921 VanDerWaalsContact O-N 3.12Å; R919-H921 PolarHBondContact O-N 3.08Å
922	I	90.1	Very high	84.2	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122	-179.1	-60.5	170	0	0	0	108.6	L575 F576 V670 G905 F910 L915 A918 R919 F924	L575-I922 HydrophobicContact CD1-CD1 4.33Å; L575-I922 HydrophobicContact CD2-CD1 4.43Å; F576-I922 CarbonylContact O-C 3.55Å; F576-I922 WeakPolarHBondContact O-CA 3.48Å; V670-I922 HydrophobicContact CG1-CD1 4.34Å; V670-I922 HydrophobicContact CG1-CG1 4.34Å; V670-I922 HydrophobicContact CG2-CG1 3.95Å; G905-I922 WeakPolarHBondContact CA-O 3.36Å; F910-I922 HydrophobicContact CZ-CB 4.35Å; F910-I922 HydrophobicContact CZ-CG2 4Å; L915-I922 HydrophobicContact CD2-CD1 4.49Å; A918-I922 HydrophobicContact CB-CD1 4.32Å; R919-I922 PolarHBondContact O-N 3.19Å; R919-I922 VanDerWaalsContact O-N 3.08Å; I922-F924 WeakPolarHBondContact CG2-O 3.27Å
923	T	89.6	Confident	82.1	Confident	28 Å²	28	46 Å²	46	17%	0.172	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-35	176.2	55.4	0	0	0	0	112.2	F576 T578 A795 P843 G905	F576-T923 WeakPolarHBondContact CB-OG1 3.48Å; F576-T923 PolarHBondContact O-N 3.17Å; F576-T923 PolarHBondContact O-OG1 3.03Å; T578-T923 HydrophobicContact CG2-CG2 4.42Å; T578-T923 WeakPolarHBondContact OG1-CG2 3.28Å; A795-T923 HydrophobicContact CB-CG2 4.32Å; P843-T923 VanDerWaalsContact O-CB 3.32Å; P843-T923 WeakPolarHBondContact O-CB 3.34Å; P843-T923 PolarHBondContact O-OG1 3.28Å; G905-T923 WeakPolarHBondContact CA-O 3.49Å; G905-T923 PolarHBondContact N-O 3.09Å
924	F	90.4	Very high	79.8	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	154.7	-175.6	-164.3	-90.6	0	0	0	110.4	F576 C844 H847 M856 H902 F903 I922 F926	F576-F924 HydrophobicContact CB-CB 4.24Å; F576-F924 WeakPolarHBondContact CB-O 3.19Å; F576-F924 HydrophobicContact CD2-CB 4.01Å; F576-F924 AromaticContact CD2-CD1 3.98Å; F576-F924 HydrophobicContact CD2-CD1 3.98Å; F576-F924 WeakPolarHBondContact CD2-O 3.43Å; F576-F924 HydrophobicContact CE2-CD1 4.12Å; F576-F924 HydrophobicContact CG-CB 4.42Å; F576-F924 PolarHBondContact N-O 3.26Å; C844-F924 HydrophobicContact CB-CB 3.66Å; C844-F924 HydrophobicContact CB-CD1 3.88Å; C844-F924 HydrophobicContact CB-CD2 4.16Å; C844-F924 HydrophobicContact CB-CG 3.63Å; H847-F924 HydrophobicContact CB-CE1 4.35Å; H847-F924 HydrophobicContact CB-CE2 4.37Å; H847-F924 HydrophobicContact CB-CZ 4.03Å; H847-F924 AromaticContact CD2-CZ 3.56Å; H847-F924 AromaticContact CG-CZ 3.86Å; M856-F924 HydrophobicContact CG-CE2 4.38Å; M856-F924 HydrophobicContact SD-CE2 4.11Å; H902-F924 HydrophobicContact CB-CE1 4.45Å; H902-F924 HydrophobicContact CB-CZ 3.78Å; F903-F924 CarbonylContact O-C 3.11Å; F903-F924 WeakPolarHBondContact O-CA 3.43Å; F903-F924 WeakPolarHBondContact O-CD2 3.34Å; F903-F924 WeakPolarHBondContact O-CG 3.48Å; I922-F924 WeakPolarHBondContact CG2-O 3.27Å; F924-F926 HydrophobicContact CD1-CD2 4.44Å; F924-F926 HydrophobicContact CD1-CE1 4.49Å; F924-F926 HydrophobicContact CD1-CE2 4.2Å; F924-F926 HydrophobicContact CD1-CZ 4.22Å; F924-F926 AromaticContact CE1-CD1 3.74Å; F924-F926 HydrophobicContact CE1-CD1 3.74Å; F924-F926 HydrophobicContact CE1-CD2 4.2Å; F924-F926 AromaticContact CE1-CE1 3.45Å; F924-F926 HydrophobicContact CE1-CE1 3.45Å; F924-F926 VanDerWaalsContact CE1-CE1 3.45Å; F924-F926 AromaticContact CE1-CE2 3.89Å; F924-F926 HydrophobicContact CE1-CE2 3.89Å; F924-F926 HydrophobicContact CE1-CG 4.08Å; F924-F926 AromaticContact CE1-CZ 3.51Å; F924-F926 HydrophobicContact CE1-CZ 3.51Å; F924-F926 HydrophobicContact CZ-CE1 4.05Å; F924-F926 HydrophobicContact CZ-CZ 4.29Å
925	A	90.3	Very high	76.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	138.7	172	0	0	0	0	0	112.5	W573 T574 L575 F903 F910	W573-A925 HydrophobicContact CE3-CB 4.2Å; W573-A925 HydrophobicContact CZ3-CB 4.24Å; T574-A925 CarbonylContact O-C 3.26Å; T574-A925 VanDerWaalsContact O-CA 3.25Å; T574-A925 WeakPolarHBondContact O-CA 3.39Å; L575-A925 HydrophobicContact CD2-CB 3.69Å; F903-A925 HydrophobicContact CB-CB 4.29Å; F903-A925 PolarHBondContact N-O 3.29Å; F903-A925 PolarHBondContact O-N 3.42Å; F910-A925 HydrophobicContact CD1-CB 4.31Å; F910-A925 HydrophobicContact CE1-CB 3.96Å
926	F	90.4	Very high	74.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.5	163.7	-62.7	-73.4	0	0	0	109.9	W573 T574 F576 T846 H847 L850 W900 R901 H902 F924	W573-F926 WeakPolarHBondContact CA-O 3.47Å; T574-F926 PolarHBondContact N-O 2.98Å; T574-F926 PolarHBondContact O-N 2.92Å; F576-F926 AromaticContact CE2-CD2 3.45Å; F576-F926 HydrophobicContact CE2-CD2 3.45Å; F576-F926 VanDerWaalsContact CE2-CD2 3.45Å; F576-F926 AromaticContact CE2-CE2 3.48Å; F576-F926 HydrophobicContact CE2-CE2 3.48Å; F576-F926 VanDerWaalsContact CE2-CE2 3.48Å; F576-F926 AromaticContact CZ-CD2 3.93Å; F576-F926 HydrophobicContact CZ-CD2 3.93Å; F576-F926 AromaticContact CZ-CE2 3.7Å; F576-F926 HydrophobicContact CZ-CE2 3.7Å; T846-F926 HydrophobicContact CG2-CE2 4.24Å; T846-F926 HydrophobicContact CG2-CZ 4.48Å; H847-F926 HydrophobicContact CB-CZ 4.15Å; L850-F926 HydrophobicContact CD1-CZ 4.42Å; W900-F926 HydrophobicContact CE3-CB 3.73Å; W900-F926 HydrophobicContact CZ3-CB 4.35Å; R901-F926 WeakPolarHBondContact O-CA 3.22Å; H902-F926 AromaticContact CD2-CD1 3.31Å; H902-F926 WeakPolarHBondContact CD2-CD1 3.31Å; H902-F926 AromaticContact CD2-CE1 3.48Å; H902-F926 VanDerWaalsContact CD2-CE1 3.48Å; H902-F926 WeakPolarHBondContact CD2-CE1 3.4Å; H902-F926 AromaticContact CE1-CE1 3.81Å; H902-F926 AromaticContact CG-CD1 3.99Å; H902-F926 AromaticContact CG-CE1 3.85Å; H902-F926 AromaticContact NE2-CD1 3.62Å; H902-F926 AromaticContact NE2-CE1 3.46Å; H902-F926 WeakPolarHBondContact NE2-CE1 3.1Å; F924-F926 HydrophobicContact CD1-CD2 4.44Å; F924-F926 HydrophobicContact CD1-CE1 4.49Å; F924-F926 HydrophobicContact CD1-CE2 4.2Å; F924-F926 HydrophobicContact CD1-CZ 4.22Å; F924-F926 AromaticContact CE1-CD1 3.74Å; F924-F926 HydrophobicContact CE1-CD1 3.74Å; F924-F926 HydrophobicContact CE1-CD2 4.2Å; F924-F926 AromaticContact CE1-CE1 3.45Å; F924-F926 HydrophobicContact CE1-CE1 3.45Å; F924-F926 VanDerWaalsContact CE1-CE1 3.45Å; F924-F926 AromaticContact CE1-CE2 3.89Å; F924-F926 HydrophobicContact CE1-CE2 3.89Å; F924-F926 HydrophobicContact CE1-CG 4.08Å; F924-F926 AromaticContact CE1-CZ 3.51Å; F924-F926 HydrophobicContact CE1-CZ 3.51Å; F924-F926 HydrophobicContact CZ-CE1 4.05Å; F924-F926 HydrophobicContact CZ-CZ 4.29Å
927	Q	90.6	Very high	71.4	Confident	11 Å²	11	70 Å²	70	5%	0.051	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.1	176.2	-168.4	-162.4	37.3	0	0	111.2	D572 W573 W900 R901 F903	D572-Q927 WeakPolarHBondContact O-CA 3.42Å; W573-Q927 HydrophobicContact CD2-CB 4.25Å; W573-Q927 HydrophobicContact CD2-CG 3.92Å; W573-Q927 HydrophobicContact CE3-CB 3.77Å; W573-Q927 HydrophobicContact CE3-CG 3.94Å; W573-Q927 HydrophobicContact CH2-CB 3.87Å; W573-Q927 VanDerWaalsContact CH2-CD 3.44Å; W573-Q927 HydrophobicContact CH2-CG 3.68Å; W573-Q927 HydrophobicContact CZ2-CB 4.39Å; W573-Q927 VanDerWaalsContact CZ2-CD 3.45Å; W573-Q927 HydrophobicContact CZ2-CG 3.71Å; W573-Q927 HydrophobicContact CZ3-CB 3.57Å; W573-Q927 HydrophobicContact CZ3-CG 3.83Å; W900-Q927 WeakPolarHBondContact CB-O 3.22Å; R901-Q927 HydrophobicContact CB-CB 4.25Å; R901-Q927 PolarHBondContact N-O 3.11Å; R901-Q927 PolarHBondContact O-N 3.42Å; F903-Q927 HydrophobicContact CD2-CB 4.28Å; F903-Q927 HydrophobicContact CE2-CB 3.67Å
928	T	88.6	Confident	70.8	Confident	33 Å²	33	68.9 Å²	68.9	20%	0.202	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.2	161.5	-172.2	0	0	0	0	110.8	D572 W900	D572-T928 HydrophobicContact CB-CG2 3.66Å; D572-T928 PolarHBondContact N-O 3.2Å; D572-T928 PolarHBondContact O-N 2.65Å; W900-T928 HydrophobicContact CD2-CG2 3.89Å; W900-T928 HydrophobicContact CE3-CG2 4Å; W900-T928 HydrophobicContact CH2-CG2 3.57Å; W900-T928 HydrophobicContact CZ2-CG2 3.4Å; W900-T928 VanDerWaalsContact CZ2-CG2 3.4Å; W900-T928 HydrophobicContact CZ3-CG2 3.89Å
929	T	84.9	Confident	70.2	Confident	57 Å²	57	72.5 Å²	72.5	35%	0.35	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.3	177.4	-54.5	0	0	0	0	108.9	L571	L571-T929 HydrophobicContact CD2-CG2 3.67Å; L571-T929 WeakPolarHBondContact CD2-OG1 3.08Å
930	I	80.9	Confident	69.4	Low	48 Å²	48	69.9 Å²	69.9	25%	0.246	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	93	168.3	-52.1	-173.1	0	0	0	107	P569 R570 W779	P569-I930 WeakPolarHBondContact CA-O 3.45Å; R570-I930 HydrophobicContact CB-CB 4.34Å; R570-I930 VanDerWaalsContact CZ-CD1 3.46Å; R570-I930 PolarHBondContact N-O 3.2Å; R570-I930 PolarHBondContact O-N 3.44Å; W779-I930 HydrophobicContact CH2-CG2 3.85Å; W779-I930 HydrophobicContact CZ2-CG2 4.29Å
931	S	68.7	Low	68.5	Low	63 Å²	63	68.9 Å²	68.9	44%	0.441	38%	0.375	S	S	.	.			trans	-128.7	147.3	172	56.2	0	0	0	0	109.2
932	H	59.6	Low	67.3	Low	108 Å²	108	69.9 Å²	69.9	50%	0.5	38%	0.383	S	S	.	.			trans	-85.8	112.1	159.5	-148.6	-72.1	0	0	0	107
933	T	36.6	Very low	65.8	Low	114 Å²	114	74.3 Å²	74.3	70%	0.699	41%	0.407	S	S	*	.			trans	-68.6	123.4	151.4	30.8	0	0	0	0	105.8	S935	T933-S935 PolarHBondContact O-N 3.5Å
934	P	34.1	Very low	64.1	Low	107 Å²	107	77.6 Å²	77.6	70%	0.695	42%	0.424	S	S	*	.			trans	-61.1	114	166	-7.5	21.9	0	0	0	105.7	E936	P934-E936 PolarHBondContact O-N 3.12Å
935	S	27.6	Very low	62.1	Low	89 Å²	89	83.2 Å²	83.2	62%	0.622	46%	0.455	S	S	*	.			trans	-59	110.8	153.4	52	0	0	0	0	104.8	T933 Q937	T933-S935 PolarHBondContact O-N 3.5Å; S935-Q937 PolarHBondContact O-N 3.48Å
936	E	28	Very low	59.7	Low	196 Å²	196	90.2 Å²	90.2	92%	0.916	49%	0.493	S	S	*	.			trans	-49	117.3	171.1	-72	180	149.2	0	0	107.8	P934	P934-E936 PolarHBondContact O-N 3.12Å
937	Q	27.1	Very low	57	Low	256 Å²	256	98.4 Å²	98.4	100%	1.196	54%	0.538	S	S	*	.			trans	-112.5	0	165.8	-86.3	-169.5	-7.2	0	0	108.1	S935	S935-Q937 PolarHBondContact O-N 3.48Å

Retrieved 937 of 937 residues in 522.3 ms (Link to these results)

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