A0A5K4F1T8_SCHMA Loading...

PH domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1T8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,478 aa.

						>A0A5K4F1T8_SCHMA|A0A5K4F1T8
MSSWQRLSGYLNSKPTGPPLVNNASDIAAYFESAFKRLKGIQRHWYVFEESTLKLMAYRNQMDAAIPDKEPLKTINIHGAVFHIDPAEHNQFSIISDGKEHILQAETEDAMLLWLHVLQTRRNEAVQTSESDNSSPNDDSLTDYKLFRQNSLMKMQMSIPTRASPIISSDSNESSFNNNGSLRSRKSSSHQNLNKLIKQLSIDQMNDHQSYNNNHLLIDHTSLWISPIDHSMNTSSSSSTTSTTNYDLMRRLSYNRSNSYDSDIIKQHVNDLNIINDKSIKLLSKSNNYLINQSSSSSSSNNKIYHRNRIMNLPIEEEENEDYSILNEKLSNQINGENRSHLRTTMKVLDNLSENKCQVNNQKEELMPENNLIGNDSYLVGEINGESREVSNTDSTESDEFNQTEKENYNVISRSDNKFFNDSEISEGPQDSSERQCTGQQMSTGEYLTSQLSAKYQSSIILQNPRTFSDSDIDLENELSPNDYIRELKAQLQSALDREAYLRQMLSNREAGMREIDQKVENIENIEMKDNSSFKLPKNISPNKLRDMIEDYEQKQRILYRKNQFLITEIRELASIKYMFTDHSNKMSKYIQRLNMEGFKWRREYVKLLQACLGATQTDPHHRLMFSDYGKDRYKNLISELLDEARRKDPSLPSMIKPKTADYHVDFYGFKHSYLNETSIIHYSCQQLYDFYTRQLSGGDENFYRWTELLTQANRELTRADLEVLCRSGVPIQYREGVWRMLIHGELHQLMQIKGPLYYNGLLEEFSENTLAAQHRRQISLDLLRTMPNNVQFDNIDAPGVQKLQEVLQAYSIHNSKIGYCQGMNFIAAVALLFLRKEDAFWCLIAILERFLPENYFNSGLIDAQVDQLVLKEIVHEKLPRLSSHLKRLGIDISAVTLNWFLAVFYDSVPFETLIRIWDVFLLEGSETLFRFAVAILKRNQDMLLEQSDTISFWKCLKAATRLTNDVDGLIKTAFEELRPFPKPQLIATRRAYHYEILSKKMSIKKGYWQNVMKESPDEFIENQNHVQHKRSTKENQAVIQAITFYDNEHLWICYGDKLYSQISEVVVTSNCMQSIGYELESRVSCICAFSNEIILLGMMSKQLCAYSVIRNSKIWQIPIHDSVSDITFAYFLHDHTNKVYAGLTNGELVVIENIGFEEPRDSIYYITISFIPISSVLLAKSQLWCASGSSIFIFHAKTMDYYKQISISNNPLDVILKICLGDNGVWIAVRGSSVIELWDPDRLIRILLFNIVNETYLSRRPEEEYTFNPQRVTVILPYDNTLWIGTGMGEVLVYQIHTYQKTEKKKSLEGTIQMTRHKRSTSLKDELQLIGETTRKTLLKSTRCPSNPDVSHIPDKDPEPLFYPLRQNSLILEHAINSNYIYELQKIVRSKVAETPIRFLVMKKITDSHILIISCSTYFNDDDAVLKWKRDNNNGSIWTNEPIYVFDRESHSLRLPAYMRNSLCLQMHNKKSIIMNN
					

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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	24.2	Very low	29.2	Very low	211 Å²	211	140.6 Å²	140.6	100%	1.039	71%	0.706	S	S	*	*				0	-37.4	0	-86.3	178.6	158.2	0	0	113.1	S3 W4	M1-S3 VanDerWaalsContact C-N 3.3Å; M1-S3 PolarHBondContact O-N 3.14Å; M1-W4 PolarHBondContact O-N 3.24Å
2	S	30	Very low	29.2	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-16.8	176.5	50.9	0	0	0	0	116
3	S	25.3	Very low	29.1	Very low	80 Å²	80	136.4 Å²	136.4	56%	0.559	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-23.7	177.1	38.9	0	0	0	0	114.1	M1	M1-S3 VanDerWaalsContact C-N 3.3Å; M1-S3 PolarHBondContact O-N 3.14Å
4	W	26.9	Very low	28.9	Very low	206 Å²	206	140.3 Å²	140.3	78%	0.78	71%	0.71	S	S	*	*	H	α-helix	trans	-80.4	-27.5	179.9	-92.8	87.7	0	0	0	113.4	M1 R6 L7 S8	M1-W4 PolarHBondContact O-N 3.24Å; W4-R6 VanDerWaalsContact C-N 3.35Å; W4-R6 PolarHBondContact O-N 3.44Å; W4-L7 PolarHBondContact O-N 2.92Å; W4-S8 PolarHBondContact O-N 3.5Å
5	Q	32.9	Very low	28.7	Very low	157 Å²	157	139.2 Å²	139.2	73%	0.734	72%	0.716	S	S	*	*	H	α-helix	trans	-72.7	-21.3	176	-84.7	-179.4	-31.1	0	0	114.1	S8	Q5-S8 PolarHBondContact O-OG 3.47Å
6	R	30.9	Very low	28.7	Very low	211 Å²	211	138.9 Å²	138.9	80%	0.796	72%	0.723	S	S	*	*	H	α-helix	trans	-77.7	-27.7	174.4	-75.9	-171.4	-161.2	173	5.2	113.3	W4	W4-R6 VanDerWaalsContact C-N 3.35Å; W4-R6 PolarHBondContact O-N 3.44Å
7	L	28.3	Very low	28.6	Very low	116 Å²	116	134.1 Å²	134.1	61%	0.607	72%	0.715	S	S	*	*	H	α-helix	trans	-82.6	-28.2	179.6	-91.8	156.5	0	0	0	113	W4 G9 Y10	W4-L7 PolarHBondContact O-N 2.92Å; L7-G9 VanDerWaalsContact C-N 3.3Å; L7-G9 PolarHBondContact O-N 3.5Å; L7-Y10 PolarHBondContact O-N 3.39Å
8	S	31.2	Very low	28.6	Very low	73 Å²	73	133.4 Å²	133.4	51%	0.51	72%	0.719	S	S	.	*	H	α-helix	trans	-72	-24.5	173.1	68.4	0	0	0	0	113.1	W4 Q5	W4-S8 PolarHBondContact O-N 3.5Å; Q5-S8 PolarHBondContact O-OG 3.47Å
9	G	32.4	Very low	28.5	Very low	48 Å²	48	132.4 Å²	132.4	50%	0.495	72%	0.72	S	S	.	*	H	α-helix	trans	-68.4	-34.9	173.6	0	0	0	0	0	113.2	L7	L7-G9 VanDerWaalsContact C-N 3.3Å; L7-G9 PolarHBondContact O-N 3.5Å
10	Y	29.4	Very low	28.6	Very low	196 Å²	196	133.7 Å²	133.7	77%	0.769	73%	0.726	S	S	*	*	H	α-helix	trans	-78.8	-19.1	-177.6	-105.9	-86.6	0	0	0	114.3	L7	L7-Y10 PolarHBondContact O-N 3.39Å
11	L	30	Very low	28.7	Very low	148 Å²	148	132.3 Å²	132.3	78%	0.775	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-10.4	179.8	-78.3	165.7	0	0	0	114
12	N	29.5	Very low	29.1	Very low	150 Å²	150	128.8 Å²	128.8	80%	0.802	71%	0.707	S	S	*	*	S	Bend	trans	-110.8	2.1	-179.9	-85.8	-14.5	0	0	0	115.3	K14	N12-K14 PolarHBondContact O-N 2.95Å
13	S	27.7	Very low	29.2	Very low	76 Å²	76	129.4 Å²	129.4	53%	0.531	70%	0.702	S	S	.	*			trans	-82.9	90.9	160.1	48.1	0	0	0	0	109	P15	S13-P15 WeakPolarHBondContact O-CD 3.49Å; S13-P15 VanDerWaalsContact O-N 3.13Å
14	K	25.6	Very low	29.6	Very low	191 Å²	191	129.5 Å²	129.5	83%	0.83	71%	0.708	S	S	*	*			trans	-50.5	122.2	161	-85.6	-179.1	177.7	175.5	0	107	N12 T16	N12-K14 PolarHBondContact O-N 2.95Å; K14-T16 PolarHBondContact O-N 3.04Å
15	P	27	Very low	30	Very low	124 Å²	124	123.5 Å²	123.5	81%	0.805	70%	0.697	S	S	*	*			trans	-64.2	106.8	177	25.7	-30.6	0	0	0	106.7	S13 G17	S13-P15 WeakPolarHBondContact O-CD 3.49Å; S13-P15 VanDerWaalsContact O-N 3.13Å; P15-G17 PolarHBondContact O-N 3.45Å; P15-G17 VanDerWaalsContact O-N 3.07Å
16	T	28.6	Very low	30	Very low	135 Å²	135	120.5 Å²	120.5	83%	0.828	69%	0.687	S	S	*	*			trans	-56	114.1	166.5	44.1	0	0	0	0	106.1	K14	K14-T16 PolarHBondContact O-N 3.04Å
17	G	27	Very low	30	Very low	57 Å²	57	115.3 Å²	115.3	59%	0.588	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-51.9	153.5	175.9	0	0	0	0	0	110.8	P15	P15-G17 PolarHBondContact O-N 3.45Å; P15-G17 VanDerWaalsContact O-N 3.07Å
18	P	27.7	Very low	30	Very low	122 Å²	122	112.7 Å²	112.7	79%	0.792	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-57.3	139.9	-170.5	24.7	-32.5	0	0	0	110.4	L20	P18-L20 PolarHBondContact O-N 3.42Å
19	P	28.2	Very low	30	Very low	114 Å²	114	112 Å²	112	74%	0.74	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-61.3	138.7	-174.8	25.4	-31.8	0	0	0	110	V21	P19-V21 WeakPolarHBondContact O-CG2 3.23Å; P19-V21 PolarHBondContact O-N 2.7Å
20	L	29.3	Very low	29.9	Very low	158 Å²	158	118 Å²	118	83%	0.827	68%	0.677	S	S	*	*			trans	-53.5	101.8	177.8	-77.6	143.2	0	0	0	110.2	P18 N22	P18-L20 PolarHBondContact O-N 3.42Å; L20-N22 PolarHBondContact O-N 2.9Å
21	V	31.2	Very low	29.9	Very low	105 Å²	105	114.9 Å²	114.9	64%	0.636	67%	0.667	S	S	*	*			trans	-75.2	103.8	178.7	-177.8	0	0	0	0	108.4	P19 D26	P19-V21 WeakPolarHBondContact O-CG2 3.23Å; P19-V21 PolarHBondContact O-N 2.7Å; V21-D26 HydrophobicContact CG1-CB 4.48Å
22	N	33	Very low	29.7	Very low	136 Å²	136	114.8 Å²	114.8	73%	0.727	66%	0.663	S	S	*	*			trans	-106.3	2.6	-171.3	-88.5	-10.7	0	0	0	116	L20	L20-N22 PolarHBondContact O-N 2.9Å
23	N	31.1	Very low	29.9	Very low	114 Å²	114	111 Å²	111	61%	0.61	65%	0.648	S	S	*	*			trans	-123.9	131.4	-176.4	-73.3	-17.6	0	0	0	113.8	S25 D26	N23-S25 PolarHBondContact O-N 3.46Å; N23-S25 VanDerWaalsContact O-N 3.12Å; N23-D26 PolarHBondContact O-N 3.4Å
24	A	33.9	Very low	30	Very low	83 Å²	83	110.3 Å²	110.3	69%	0.686	65%	0.647	S	S	*	*	H	α-helix	trans	-63.7	-13.8	-174.8	0	0	0	0	0	114.9	D26 A28	A24-D26 VanDerWaalsContact C-N 3.3Å; A24-D26 PolarHBondContact O-N 3.18Å; A24-A28 PolarHBondContact O-N 3.35Å
25	S	36.1	Very low	30.1	Very low	79 Å²	79	109 Å²	109	55%	0.552	64%	0.642	S	S	*	*	H	α-helix	trans	-64.3	-34.4	175.4	54.2	0	0	0	0	112.4	N23 A28 A29	N23-S25 PolarHBondContact O-N 3.46Å; N23-S25 VanDerWaalsContact O-N 3.12Å; S25-A28 WeakPolarHBondContact O-CB 3.14Å; S25-A28 PolarHBondContact O-N 3.48Å; S25-A29 PolarHBondContact O-N 3.05Å
26	D	31.7	Very low	30.4	Very low	95 Å²	95	112 Å²	112	51%	0.508	64%	0.642	S	S	.	*	H	α-helix	trans	-81.9	-24.9	-173.4	-60.9	-12.3	0	0	0	111.7	V21 N23 A24 A28 A29 Y30	V21-D26 HydrophobicContact CG1-CB 4.48Å; N23-D26 PolarHBondContact O-N 3.4Å; A24-D26 VanDerWaalsContact C-N 3.3Å; A24-D26 PolarHBondContact O-N 3.18Å; D26-A28 VanDerWaalsContact C-N 3.32Å; D26-A29 PolarHBondContact O-N 2.97Å; D26-Y30 PolarHBondContact O-N 3.32Å
27	I	30.6	Very low	30.4	Very low	101 Å²	101	113.7 Å²	113.7	52%	0.518	63%	0.633	S	S	.	*	H	α-helix	trans	-66.1	-39.1	169.4	-61	177.3	0	0	0	109.7	Y30 F31	I27-Y30 PolarHBondContact O-N 3Å; I27-F31 HydrophobicContact CG2-CD2 3.8Å; I27-F31 HydrophobicContact CG2-CE2 3.73Å; I27-F31 WeakPolarHBondContact O-CD2 3.46Å; I27-F31 PolarHBondContact O-N 3.17Å; I27-F31 VanDerWaalsContact O-N 3.15Å
28	A	30	Very low	30.5	Very low	62 Å²	62	117.9 Å²	117.9	51%	0.512	64%	0.641	S	S	.	*	H	α-helix	trans	-65.4	-39.6	175.4	0	0	0	0	0	112.1	A24 S25 D26 F31 E32	A24-A28 PolarHBondContact O-N 3.35Å; S25-A28 WeakPolarHBondContact O-CB 3.14Å; S25-A28 PolarHBondContact O-N 3.48Å; D26-A28 VanDerWaalsContact C-N 3.32Å; A28-F31 PolarHBondContact O-N 3.37Å; A28-E32 PolarHBondContact O-N 2.89Å
29	A	31.2	Very low	31	Very low	59 Å²	59	121.9 Å²	121.9	49%	0.488	65%	0.646	S	S	.	*	H	α-helix	trans	-66.6	-37.3	176.6	0	0	0	0	0	112.9	S25 D26 F31 E32 S33	S25-A29 PolarHBondContact O-N 3.05Å; D26-A29 PolarHBondContact O-N 2.97Å; A29-F31 VanDerWaalsContact C-N 3.35Å; A29-F31 PolarHBondContact O-N 3.35Å; A29-E32 PolarHBondContact O-N 3.41Å; A29-S33 PolarHBondContact O-N 3.26Å
30	Y	29.7	Very low	31.6	Very low	174 Å²	174	119.2 Å²	119.2	68%	0.682	64%	0.64	S	S	*	*	H	α-helix	trans	-63.4	-41.3	174.5	-170	-99.8	0	0	0	111.6	D26 I27 S33 A34	D26-Y30 PolarHBondContact O-N 3.32Å; I27-Y30 PolarHBondContact O-N 3Å; Y30-S33 PolarHBondContact O-N 3.3Å; Y30-S33 PolarHBondContact O-OG 3.29Å; Y30-A34 PolarHBondContact O-N 3.06Å
31	F	28.2	Very low	32.7	Very low	129 Å²	129	118.2 Å²	118.2	57%	0.566	63%	0.634	S	S	*	*	H	α-helix	trans	-74.4	-31.2	178.9	-79.4	-67.4	0	0	0	114.1	I27 A28 A29 S33 A34	I27-F31 HydrophobicContact CG2-CD2 3.8Å; I27-F31 HydrophobicContact CG2-CE2 3.73Å; I27-F31 WeakPolarHBondContact O-CD2 3.46Å; I27-F31 PolarHBondContact O-N 3.17Å; I27-F31 VanDerWaalsContact O-N 3.15Å; A28-F31 PolarHBondContact O-N 3.37Å; A29-F31 VanDerWaalsContact C-N 3.35Å; A29-F31 PolarHBondContact O-N 3.35Å; F31-S33 VanDerWaalsContact C-N 3.32Å; F31-S33 PolarHBondContact O-N 3.24Å; F31-A34 PolarHBondContact O-N 2.81Å
32	E	27	Very low	34.4	Very low	146 Å²	146	120.4 Å²	120.4	68%	0.682	64%	0.637	S	S	*	*	H	α-helix	trans	-68	-32.9	172	-107.3	-165.2	164.8	0	0	112.5	A28 A29 A34 F35 K36	A28-E32 PolarHBondContact O-N 2.89Å; A29-E32 PolarHBondContact O-N 3.41Å; E32-A34 VanDerWaalsContact C-N 3.32Å; E32-A34 PolarHBondContact O-N 2.92Å; E32-F35 PolarHBondContact O-N 2.87Å; E32-K36 PolarHBondContact O-N 2.8Å
33	S	32.6	Very low	36.4	Very low	72 Å²	72	123.5 Å²	123.5	50%	0.503	64%	0.639	S	S	.	*	H	α-helix	trans	-68.8	-30.1	178.5	80.8	0	0	0	0	113.2	A29 Y30 F31 F35	A29-S33 PolarHBondContact O-N 3.26Å; Y30-S33 PolarHBondContact O-N 3.3Å; Y30-S33 PolarHBondContact O-OG 3.29Å; F31-S33 VanDerWaalsContact C-N 3.32Å; F31-S33 PolarHBondContact O-N 3.24Å; S33-F35 VanDerWaalsContact C-N 3.35Å
34	A	30.3	Very low	39	Very low	61 Å²	61	121 Å²	121	50%	0.504	62%	0.623	S	S	.	*	H	α-helix	trans	-69.4	-31.9	177	0	0	0	0	0	112.2	Y30 F31 E32	Y30-A34 PolarHBondContact O-N 3.06Å; F31-A34 PolarHBondContact O-N 2.81Å; E32-A34 VanDerWaalsContact C-N 3.32Å; E32-A34 PolarHBondContact O-N 2.92Å
35	F	28.3	Very low	41.4	Very low	164 Å²	164	122.3 Å²	122.3	72%	0.719	61%	0.61	S	S	*	*	H	α-helix	trans	-83.7	-13.5	179.7	-88.1	-79	0	0	0	114.9	E32 S33 R37	E32-F35 PolarHBondContact O-N 2.87Å; S33-F35 VanDerWaalsContact C-N 3.35Å; F35-R37 PolarHBondContact O-N 2.91Å
36	K	31.9	Very low	44	Very low	185 Å²	185	121.5 Å²	121.5	80%	0.804	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	6.7	173	-83.3	-175.8	178.7	170.5	0	114.9	E32 L38	E32-K36 PolarHBondContact O-N 2.8Å; K36-L38 VanDerWaalsContact C-N 3.31Å; K36-L38 PolarHBondContact O-N 3.1Å
37	R	29.8	Very low	46.6	Very low	172 Å²	172	119.5 Å²	119.5	65%	0.649	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	11.4	172.2	-83.4	-169.5	-178.5	-170	5	115.4	F35 K39 N482	F35-R37 PolarHBondContact O-N 2.91Å; R37-K39 PolarHBondContact O-N 3.05Å; R37-N482 PolarHBondContact NH2-OD1 2.76Å
38	L	29	Very low	49.4	Very low	145 Å²	145	116.1 Å²	116.1	76%	0.759	57%	0.568	S	S	*	*			trans	-73.4	81.8	166.3	-72.5	162.3	0	0	0	109.2	K36 G40	K36-L38 VanDerWaalsContact C-N 3.31Å; K36-L38 PolarHBondContact O-N 3.1Å; L38-G40 PolarHBondContact O-N 3.21Å
39	K	37.7	Very low	52.1	Low	205 Å²	205	116.5 Å²	116.5	89%	0.891	56%	0.559	S	S	*	*			trans	-53	109.3	158.1	-84.9	-175.2	175.4	-178.9	0	105.9	R37 I41	R37-K39 PolarHBondContact O-N 3.05Å; K39-I41 PolarHBondContact O-N 2.72Å
40	G	41.3	Very low	54.3	Low	59 Å²	59	119.1 Å²	119.1	61%	0.608	56%	0.562	S	S	*	*			trans	-49	134.2	-176.1	0	0	0	0	0	110.9	L38 Q42	L38-G40 PolarHBondContact O-N 3.21Å; G40-Q42 PolarHBondContact O-N 2.81Å
41	I	53	Low	56.6	Low	137 Å²	137	115.7 Å²	115.7	70%	0.703	56%	0.563	S	S	*	*			trans	-57.5	109.8	179.2	-63.1	165.2	0	0	0	107.9	K39	K39-I41 PolarHBondContact O-N 2.72Å
42	Q	66.6	Low	59.2	Low	150 Å²	150	112.2 Å²	112.2	70%	0.701	55%	0.552	S	S	*	*			trans	-93.2	116.2	177.6	-73.9	179.3	-11.1	0	0	109.3	G40 H44	G40-Q42 PolarHBondContact O-N 2.81Å; Q42-H44 VanDerWaalsContact CB-CE1 3.45Å; Q42-H44 WeakPolarHBondContact CB-CE1 3.44Å; Q42-H44 PolarHBondContact O-N 3.01Å; Q42-H44 PolarHBondContact O-ND1 3.02Å
43	R	74.8	Confident	62	Low	202 Å²	202	106.9 Å²	106.9	76%	0.762	53%	0.528	S	S	*	.			trans	-69.6	122.8	173.8	-75.1	-177.7	170.8	-153.7	-12.8	109.7	E106	R43-E106 IonicContact CZ-OE1 3.65Å; R43-E106 IonicContact NH1-OE1 3.7Å; R43-E106 IonicContact NH2-OE1 3.44Å; R43-E106 PolarHBondContact NH2-OE1 2.88Å; R43-E106 VanDerWaalsContact NH2-OE1 3.07Å
44	H	84.7	Confident	64.7	Low	60 Å²	60	107.5 Å²	107.5	28%	0.278	52%	0.522	S	S	.	.			trans	-124.8	147.5	176.3	-67.7	88.8	0	0	0	109	Q42 Y46 A57 Y58	Q42-H44 VanDerWaalsContact CB-CE1 3.45Å; Q42-H44 WeakPolarHBondContact CB-CE1 3.44Å; Q42-H44 PolarHBondContact O-N 3.01Å; Q42-H44 PolarHBondContact O-ND1 3.02Å; H44-Y46 HydrophobicContact CB-CD2 4.35Å; H44-Y46 HydrophobicContact CB-CE2 3.71Å; H44-Y46 WeakPolarHBondContact O-CD2 3.05Å; H44-A57 HydrophobicContact CB-CB 4.41Å; H44-Y58 CarbonylContact C-O 3.6Å; H44-Y58 WeakPolarHBondContact CA-O 3.33Å
45	W	85.1	Confident	67.6	Low	112 Å²	112	104.8 Å²	104.8	42%	0.424	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	114.5	175.2	-169.7	-92	0	0	0	109.9	A57 Y58 Q61	W45-A57 CarbonylContact O-C 3.6Å; W45-Y58 PolarHBondContact N-O 3.17Å; W45-Y58 PolarHBondContact O-N 2.91Å; W45-Q61 HydrophobicContact CD2-CB 3.74Å; W45-Q61 HydrophobicContact CD2-CG 4.29Å; W45-Q61 HydrophobicContact CE3-CB 4.04Å; W45-Q61 HydrophobicContact CG-CB 4.21Å; W45-Q61 HydrophobicContact CH2-CB 4.25Å; W45-Q61 HydrophobicContact CH2-CG 4.23Å; W45-Q61 HydrophobicContact CZ2-CB 3.98Å; W45-Q61 HydrophobicContact CZ2-CG 3.68Å; W45-Q61 HydrophobicContact CZ3-CB 4.28Å
46	Y	90.5	Very high	70.6	Confident	61 Å²	61	98.2 Å²	98.2	24%	0.239	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.2	-177	-69.6	-90.8	0	0	0	111.4	H44 L55 M56 A57 L103	H44-Y46 HydrophobicContact CB-CD2 4.35Å; H44-Y46 HydrophobicContact CB-CE2 3.71Å; H44-Y46 WeakPolarHBondContact O-CD2 3.05Å; Y46-L55 HydrophobicContact CD1-CD2 4.23Å; Y46-L55 HydrophobicContact CD1-CG 4.06Å; Y46-M56 CarbonylContact C-O 3.55Å; Y46-M56 WeakPolarHBondContact CA-O 3.46Å; Y46-A57 HydrophobicContact CD1-CB 3.75Å; Y46-A57 HydrophobicContact CE1-CB 3.44Å; Y46-A57 VanDerWaalsContact CE1-CB 3.44Å; Y46-L103 HydrophobicContact CE1-CD2 4.02Å; Y46-L103 HydrophobicContact CE2-CD2 4.06Å; Y46-L103 WeakPolarHBondContact OH-CD2 3.16Å
47	V	87.3	Confident	73.3	Confident	53 Å²	53	89.4 Å²	89.4	32%	0.321	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125	175.1	-179	0	0	0	0	108.2	M56 Y58 A64	V47-M56 PolarHBondContact N-O 2.95Å; V47-M56 PolarHBondContact O-N 3.32Å; V47-Y58 HydrophobicContact CB-CE2 4.3Å; V47-Y58 HydrophobicContact CG2-CD2 4.2Å; V47-Y58 HydrophobicContact CG2-CE2 4.28Å; V47-A64 HydrophobicContact CG2-CB 3.9Å
48	F	89	Confident	76.2	Confident	30 Å²	30	82.3 Å²	82.3	13%	0.132	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	118.3	174.3	179.2	-110.1	0	0	0	109.5	E50 L53 L55 I77 W114 L118 R121	F48-E50 HydrophobicContact CD1-CG 4Å; F48-E50 HydrophobicContact CE1-CB 4.42Å; F48-E50 HydrophobicContact CE1-CG 3.92Å; F48-L53 HydrophobicContact CZ-CD2 3.94Å; F48-L55 HydrophobicContact CB-CD1 3.9Å; F48-L55 HydrophobicContact CD2-CB 4.39Å; F48-L55 HydrophobicContact CD2-CD1 4.42Å; F48-I77 HydrophobicContact CD2-CG1 4.29Å; F48-I77 HydrophobicContact CE2-CB 4.16Å; F48-I77 HydrophobicContact CE2-CG1 3.75Å; F48-W114 HydrophobicContact CB-CZ3 4.24Å; F48-L118 HydrophobicContact CB-CD2 4.38Å; F48-L118 HydrophobicContact CD2-CD2 3.52Å; F48-L118 HydrophobicContact CE2-CD2 3.85Å; F48-L118 HydrophobicContact CG-CD2 3.88Å; F48-L118 HydrophobicContact CZ-CD2 4.45Å; F48-R121 HydrophobicContact CE1-CB 3.97Å; F48-R121 HydrophobicContact CE1-CG 3.79Å; F48-R121 HydrophobicContact CZ-CB 3.81Å; F48-R121 HydrophobicContact CZ-CG 4.18Å
49	E	85.8	Confident	78.6	Confident	71 Å²	71	84.3 Å²	84.3	33%	0.332	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	111	175.9	-178.9	-178.5	-143	0	0	109.6	S51 T52 L53 K54 M56	E49-S51 VanDerWaalsContact C-N 3.34Å; E49-S51 VanDerWaalsContact CG-OG 3.24Å; E49-S51 WeakPolarHBondContact CG-OG 3.18Å; E49-S51 PolarHBondContact O-N 3.13Å; E49-S51 PolarHBondContact OE1-OG 2.71Å; E49-T52 HydrophobicContact CG-CG2 4.39Å; E49-T52 PolarHBondContact O-N 3.3Å; E49-T52 VanDerWaalsContact OE2-CG2 3.23Å; E49-T52 WeakPolarHBondContact OE2-CG2 3.41Å; E49-T52 PolarHBondContact OE2-OG1 3.08Å; E49-L53 WeakPolarHBondContact O-CA 3.3Å; E49-L53 PolarHBondContact O-N 3.18Å; E49-K54 PolarHBondContact N-O 3.47Å; E49-K54 PolarHBondContact O-N 3.25Å; E49-M56 HydrophobicContact CB-CE 3.72Å; E49-M56 HydrophobicContact CG-CE 4.45Å
50	E	78.9	Confident	80.7	Confident	114 Å²	114	77.7 Å²	77.7	53%	0.533	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-32.1	-173.7	-55	-173.3	171.8	0	0	113	F48 T52 R121	F48-E50 HydrophobicContact CD1-CG 4Å; F48-E50 HydrophobicContact CE1-CB 4.42Å; F48-E50 HydrophobicContact CE1-CG 3.92Å; E50-T52 VanDerWaalsContact C-N 3.32Å; E50-T52 PolarHBondContact O-N 2.84Å; E50-R121 VanDerWaalsContact CD-CZ 3.45Å; E50-R121 IonicContact OE1-CZ 3.29Å; E50-R121 VanDerWaalsContact OE1-CZ 3.28Å; E50-R121 IonicContact OE1-NH1 2.67Å; E50-R121 PolarHBondContact OE1-NH1 2.99Å; E50-R121 IonicContact OE1-NH2 2.86Å; E50-R121 PolarHBondContact OE1-NH2 3.36Å; E50-R121 IonicContact OE2-CZ 3.19Å; E50-R121 IonicContact OE2-NH1 3.83Å; E50-R121 PolarHBondContact OE2-NH1 2.87Å; E50-R121 IonicContact OE2-NH2 2.63Å; E50-R121 PolarHBondContact OE2-NH2 2.84Å
51	S	76.4	Confident	82.4	Confident	101 Å²	101	80.7 Å²	80.7	71%	0.706	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-33.6	-179.4	55.9	0	0	0	0	112.5	E49	E49-S51 VanDerWaalsContact C-N 3.34Å; E49-S51 VanDerWaalsContact CG-OG 3.24Å; E49-S51 WeakPolarHBondContact CG-OG 3.18Å; E49-S51 PolarHBondContact O-N 3.13Å; E49-S51 PolarHBondContact OE1-OG 2.71Å
52	T	82.7	Confident	83.7	Confident	56 Å²	56	81.3 Å²	81.3	34%	0.344	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-8.1	-177.9	65.8	0	0	0	0	113.2	E49 E50 K54	E49-T52 HydrophobicContact CG-CG2 4.39Å; E49-T52 PolarHBondContact O-N 3.3Å; E49-T52 VanDerWaalsContact OE2-CG2 3.23Å; E49-T52 WeakPolarHBondContact OE2-CG2 3.41Å; E49-T52 PolarHBondContact OE2-OG1 3.08Å; E50-T52 VanDerWaalsContact C-N 3.32Å; E50-T52 PolarHBondContact O-N 2.84Å; T52-K54 PolarHBondContact O-N 3.14Å; T52-K54 WeakPolarHBondContact OG1-CB 3.48Å
53	L	86.7	Confident	84.5	Confident	34 Å²	34	76.1 Å²	76.1	18%	0.178	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	37.1	-172.5	-64.8	158.9	0	0	0	112.4	F48 E49 I77 R121 A125	F48-L53 HydrophobicContact CZ-CD2 3.94Å; E49-L53 WeakPolarHBondContact O-CA 3.3Å; E49-L53 PolarHBondContact O-N 3.18Å; L53-I77 VanDerWaalsContact O-CB 3.32Å; L53-I77 WeakPolarHBondContact O-CB 3.24Å; L53-I77 PolarHBondContact O-N 2.88Å; L53-R121 HydrophobicContact CD2-CB 4.23Å; L53-A125 HydrophobicContact CD1-CB 3.24Å; L53-A125 HydrophobicContact CD2-CB 4.18Å; L53-A125 HydrophobicContact CG-CB 4.35Å
54	K	88.9	Confident	84.6	Confident	86 Å²	86	67.9 Å²	67.9	37%	0.374	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	133.4	-179.6	-71.1	172.4	-178	-179.7	0	110.7	E49 T52 T74 I75	E49-K54 PolarHBondContact N-O 3.47Å; E49-K54 PolarHBondContact O-N 3.25Å; T52-K54 PolarHBondContact O-N 3.14Å; T52-K54 WeakPolarHBondContact OG1-CB 3.48Å; K54-T74 HydrophobicContact CB-CG2 3.71Å; K54-T74 HydrophobicContact CD-CG2 3.77Å; K54-T74 HydrophobicContact CG-CG2 3.95Å; K54-I75 CarbonylContact C-O 3.57Å; K54-I75 WeakPolarHBondContact CA-O 3.27Å
55	L	91.9	Very high	84.3	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	112.5	171	-174.7	67.7	0	0	0	108.9	Y46 F48 T74 I75 I77 I94 L103 W114 L118	Y46-L55 HydrophobicContact CD1-CD2 4.23Å; Y46-L55 HydrophobicContact CD1-CG 4.06Å; F48-L55 HydrophobicContact CB-CD1 3.9Å; F48-L55 HydrophobicContact CD2-CB 4.39Å; F48-L55 HydrophobicContact CD2-CD1 4.42Å; L55-T74 CarbonylContact O-C 3.59Å; L55-T74 WeakPolarHBondContact O-CA 3.48Å; L55-I75 HydrophobicContact CB-CB 4.27Å; L55-I75 HydrophobicContact CD2-CD1 4.43Å; L55-I75 PolarHBondContact N-O 2.95Å; L55-I75 PolarHBondContact O-N 2.91Å; L55-I77 HydrophobicContact CB-CD1 4.23Å; L55-I77 HydrophobicContact CB-CG1 4.34Å; L55-I94 HydrophobicContact CD2-CD1 4.06Å; L55-L103 HydrophobicContact CD2-CD1 4.33Å; L55-W114 HydrophobicContact CD1-CH2 4.17Å; L55-W114 HydrophobicContact CD1-CZ3 3.69Å; L55-L118 HydrophobicContact CD1-CD2 4.45Å; L55-L118 HydrophobicContact CD2-CD1 4.12Å
56	M	90	Very high	84.1	Confident	26 Å²	26	67.7 Å²	67.7	13%	0.128	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.3	-174.1	-68.3	-170.7	-71.2	0	0	111.3	Y46 V47 E49 Y58 P71 K73 T74	Y46-M56 CarbonylContact C-O 3.55Å; Y46-M56 WeakPolarHBondContact CA-O 3.46Å; V47-M56 PolarHBondContact N-O 2.95Å; V47-M56 PolarHBondContact O-N 3.32Å; E49-M56 HydrophobicContact CB-CE 3.72Å; E49-M56 HydrophobicContact CG-CE 4.45Å; M56-Y58 HydrophobicContact CB-CE2 3.76Å; M56-P71 HydrophobicContact CB-CB 3.81Å; M56-P71 HydrophobicContact CB-CG 4.33Å; M56-P71 HydrophobicContact CG-CB 4.15Å; M56-P71 HydrophobicContact CG-CG 4.1Å; M56-P71 HydrophobicContact SD-CB 4.3Å; M56-P71 HydrophobicContact SD-CG 3.9Å; M56-K73 CarbonylContact C-O 3.52Å; M56-K73 WeakPolarHBondContact CA-O 3.19Å; M56-T74 HydrophobicContact CG-CG2 4.04Å
57	A	88.5	Confident	83.4	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.8	-179.8	0	0	0	0	0	111	H44 W45 Y46 P71 L72 K73	H44-A57 HydrophobicContact CB-CB 4.41Å; W45-A57 CarbonylContact O-C 3.6Å; Y46-A57 HydrophobicContact CD1-CB 3.75Å; Y46-A57 HydrophobicContact CE1-CB 3.44Å; Y46-A57 VanDerWaalsContact CE1-CB 3.44Å; A57-P71 CarbonylContact O-C 3.37Å; A57-L72 WeakPolarHBondContact O-CB 3.48Å; A57-L72 PolarHBondContact O-N 2.71Å; A57-K73 HydrophobicContact CB-CB 3.87Å; A57-K73 PolarHBondContact N-O 3.23Å
58	Y	91.3	Very high	83	Confident	23 Å²	23	75.6 Å²	75.6	9%	0.09	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	163.4	176	-64.5	-89.6	0	0	0	110	H44 W45 V47 M56 N60 D63 A64 K69 P71	H44-Y58 CarbonylContact C-O 3.6Å; H44-Y58 WeakPolarHBondContact CA-O 3.33Å; W45-Y58 PolarHBondContact N-O 3.17Å; W45-Y58 PolarHBondContact O-N 2.91Å; V47-Y58 HydrophobicContact CB-CE2 4.3Å; V47-Y58 HydrophobicContact CG2-CD2 4.2Å; V47-Y58 HydrophobicContact CG2-CE2 4.28Å; M56-Y58 HydrophobicContact CB-CE2 3.76Å; Y58-N60 VanDerWaalsContact C-N 3.32Å; Y58-N60 PolarHBondContact O-N 2.8Å; Y58-D63 HydrophobicContact CD1-CB 4.41Å; Y58-A64 HydrophobicContact CD1-CB 4.19Å; Y58-A64 HydrophobicContact CD2-CB 3.56Å; Y58-A64 HydrophobicContact CE2-CB 4.09Å; Y58-A64 HydrophobicContact CG-CB 3.62Å; Y58-K69 HydrophobicContact CE1-CB 4.43Å; Y58-K69 HydrophobicContact CE1-CG 4.48Å; Y58-K69 WeakPolarHBondContact CE1-O 3.38Å; Y58-P71 HydrophobicContact CE1-CB 4.09Å; Y58-P71 HydrophobicContact CE2-CB 4.24Å
59	R	80.3	Confident	82.6	Confident	188 Å²	188	79.1 Å²	79.1	71%	0.709	42%	0.415	S	S	*	.	S	Bend	trans	-69.1	-35.8	-178.5	-159.7	178.8	178.7	-178.1	-0.3	111.7	D63 L72	R59-D63 WeakPolarHBondContact CB-OD2 3.17Å; R59-L72 HydrophobicContact CB-CD1 3.99Å
60	N	81.6	Confident	82.6	Confident	66 Å²	66	83.8 Å²	83.8	35%	0.353	44%	0.437	S	S	.	.	S	Bend	trans	-157.4	173.7	179.2	58.3	47.9	0	0	0	109.4	Y58 M62 D63 A64	Y58-N60 VanDerWaalsContact C-N 3.32Å; Y58-N60 PolarHBondContact O-N 2.8Å; N60-M62 VanDerWaalsContact C-N 3.27Å; N60-M62 PolarHBondContact O-N 3.03Å; N60-M62 PolarHBondContact OD1-N 2.66Å; N60-M62 VanDerWaalsContact OD1-N 3.08Å; N60-D63 PolarHBondContact O-N 3.33Å; N60-D63 PolarHBondContact OD1-N 3.47Å; N60-A64 PolarHBondContact O-N 2.73Å
61	Q	77	Confident	83	Confident	121 Å²	121	80.3 Å²	80.3	57%	0.565	42%	0.424	S	S	*	.	H	α-helix	trans	-61.6	-32.9	179.6	-173.9	179.3	8.3	0	0	113.2	W45 A64 A65	W45-Q61 HydrophobicContact CD2-CB 3.74Å; W45-Q61 HydrophobicContact CD2-CG 4.29Å; W45-Q61 HydrophobicContact CE3-CB 4.04Å; W45-Q61 HydrophobicContact CG-CB 4.21Å; W45-Q61 HydrophobicContact CH2-CB 4.25Å; W45-Q61 HydrophobicContact CH2-CG 4.23Å; W45-Q61 HydrophobicContact CZ2-CB 3.98Å; W45-Q61 HydrophobicContact CZ2-CG 3.68Å; W45-Q61 HydrophobicContact CZ3-CB 4.28Å; Q61-A64 PolarHBondContact O-N 2.95Å; Q61-A65 PolarHBondContact O-N 2.78Å; Q61-A65 VanDerWaalsContact O-N 3.14Å
62	M	80	Confident	83.3	Confident	151 Å²	151	80.6 Å²	80.6	74%	0.744	42%	0.417	S	S	*	.	H	α-helix	trans	-68.6	-40.2	-180	-66.4	-142.4	-87.6	0	0	111.6	N60 A64 A65 I66	N60-M62 VanDerWaalsContact C-N 3.27Å; N60-M62 PolarHBondContact O-N 3.03Å; N60-M62 PolarHBondContact OD1-N 2.66Å; N60-M62 VanDerWaalsContact OD1-N 3.08Å; M62-A64 VanDerWaalsContact C-N 3.27Å; M62-A64 PolarHBondContact O-N 3.22Å; M62-A65 PolarHBondContact O-N 3.47Å; M62-A65 VanDerWaalsContact O-N 3.11Å; M62-I66 WeakPolarHBondContact O-CG1 3.26Å; M62-I66 PolarHBondContact O-N 3.23Å
63	D	83	Confident	83.5	Confident	40 Å²	40	82.5 Å²	82.5	21%	0.214	42%	0.42	C	S	.	.	H	α-helix	trans	-61.7	-37.3	174.7	-76.2	-1.9	0	0	0	111.6	Y58 R59 N60 A65 K69	Y58-D63 HydrophobicContact CD1-CB 4.41Å; R59-D63 WeakPolarHBondContact CB-OD2 3.17Å; N60-D63 PolarHBondContact O-N 3.33Å; N60-D63 PolarHBondContact OD1-N 3.47Å; D63-A65 VanDerWaalsContact C-N 3.29Å; D63-A65 PolarHBondContact O-N 3.1Å; D63-K69 WeakPolarHBondContact O-CB 3.08Å; D63-K69 WeakPolarHBondContact O-CG 3.15Å
64	A	78.1	Confident	83.6	Confident	29 Å²	29	84 Å²	84	24%	0.24	43%	0.431	C	S	.	.	H	α-helix	trans	-71.2	-23.2	176.4	0	0	0	0	0	113.5	V47 Y58 N60 Q61 M62	V47-A64 HydrophobicContact CG2-CB 3.9Å; Y58-A64 HydrophobicContact CD1-CB 4.19Å; Y58-A64 HydrophobicContact CD2-CB 3.56Å; Y58-A64 HydrophobicContact CE2-CB 4.09Å; Y58-A64 HydrophobicContact CG-CB 3.62Å; N60-A64 PolarHBondContact O-N 2.73Å; Q61-A64 PolarHBondContact O-N 2.95Å; M62-A64 VanDerWaalsContact C-N 3.27Å; M62-A64 PolarHBondContact O-N 3.22Å
65	A	77.7	Confident	83.6	Confident	78 Å²	78	80 Å²	80	65%	0.645	41%	0.414	S	S	*	.	H	α-helix	trans	-86.3	-13.5	179.6	0	0	0	0	0	113.4	Q61 M62 D63 P67	Q61-A65 PolarHBondContact O-N 2.78Å; Q61-A65 VanDerWaalsContact O-N 3.14Å; M62-A65 PolarHBondContact O-N 3.47Å; M62-A65 VanDerWaalsContact O-N 3.11Å; D63-A65 VanDerWaalsContact C-N 3.29Å; D63-A65 PolarHBondContact O-N 3.1Å; A65-P67 WeakPolarHBondContact O-CD 3.03Å
66	I	81.1	Confident	83.5	Confident	91 Å²	91	82.3 Å²	82.3	47%	0.467	43%	0.426	S	S	.	.	S	Bend	trans	-77	118.2	176.8	-64.3	165.9	0	0	0	108.6	M62 D68 K69	M62-I66 WeakPolarHBondContact O-CG1 3.26Å; M62-I66 PolarHBondContact O-N 3.23Å; I66-D68 PolarHBondContact O-N 2.99Å; I66-K69 HydrophobicContact CB-CB 4.08Å; I66-K69 HydrophobicContact CG2-CB 4.22Å; I66-K69 WeakPolarHBondContact O-CB 3.25Å; I66-K69 PolarHBondContact O-N 3.17Å
67	P	76.1	Confident	83.5	Confident	110 Å²	110	81.1 Å²	81.1	71%	0.714	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	138.7	175.3	-20.1	31.4	0	0	0	110.9	A65 K69	A65-P67 WeakPolarHBondContact O-CD 3.03Å; P67-K69 PolarHBondContact O-N 3.09Å
68	D	78.2	Confident	83.1	Confident	169 Å²	169	85 Å²	85	90%	0.904	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	15.4	-180	-50.7	-37.9	0	0	0	116.1	I66 E70	I66-D68 PolarHBondContact O-N 2.99Å; D68-E70 PolarHBondContact O-N 2.81Å
69	K	81.7	Confident	82.6	Confident	104 Å²	104	86.7 Å²	86.7	45%	0.452	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-72.4	123.5	171.1	-170.7	65.8	176.5	179.6	0	110.5	Y58 D63 I66 P67	Y58-K69 HydrophobicContact CE1-CB 4.43Å; Y58-K69 HydrophobicContact CE1-CG 4.48Å; Y58-K69 WeakPolarHBondContact CE1-O 3.38Å; D63-K69 WeakPolarHBondContact O-CB 3.08Å; D63-K69 WeakPolarHBondContact O-CG 3.15Å; I66-K69 HydrophobicContact CB-CB 4.08Å; I66-K69 HydrophobicContact CG2-CB 4.22Å; I66-K69 WeakPolarHBondContact O-CB 3.25Å; I66-K69 PolarHBondContact O-N 3.17Å; P67-K69 PolarHBondContact O-N 3.09Å
70	E	83.9	Confident	82.9	Confident	170 Å²	170	77.8 Å²	77.8	79%	0.794	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-65.5	131.8	176.3	-70.8	-171.2	162.7	0	0	111.8	D68	D68-E70 PolarHBondContact O-N 2.81Å
71	P	87.2	Confident	83	Confident	40 Å²	40	78.6 Å²	78.6	26%	0.26	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-71.6	144.5	175.9	30.8	-35.7	0	0	0	111.2	M56 A57 Y58 K73 T74	M56-P71 HydrophobicContact CB-CB 3.81Å; M56-P71 HydrophobicContact CB-CG 4.33Å; M56-P71 HydrophobicContact CG-CB 4.15Å; M56-P71 HydrophobicContact CG-CG 4.1Å; M56-P71 HydrophobicContact SD-CB 4.3Å; M56-P71 HydrophobicContact SD-CG 3.9Å; A57-P71 CarbonylContact O-C 3.37Å; Y58-P71 HydrophobicContact CE1-CB 4.09Å; Y58-P71 HydrophobicContact CE2-CB 4.24Å; P71-K73 VanDerWaalsContact C-N 3.26Å; P71-K73 PolarHBondContact O-N 2.69Å; P71-T74 VanDerWaalsContact CG-OG1 3.31Å; P71-T74 WeakPolarHBondContact CG-OG1 3.24Å
72	L	84.3	Confident	83.6	Confident	108 Å²	108	73.9 Å²	73.9	57%	0.565	41%	0.414	S	S	*	.	S	Bend	trans	-64.5	-32.8	176.2	-65.3	168.7	0	0	0	112.3	A57 R59	A57-L72 WeakPolarHBondContact O-CB 3.48Å; A57-L72 PolarHBondContact O-N 2.71Å; R59-L72 HydrophobicContact CB-CD1 3.99Å
73	K	85.8	Confident	83.8	Confident	95 Å²	95	71.9 Å²	71.9	41%	0.413	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	138.6	-179.3	-156.4	176.2	-170.8	-170.9	0	109.7	M56 A57 P71 H101	M56-K73 CarbonylContact C-O 3.52Å; M56-K73 WeakPolarHBondContact CA-O 3.19Å; A57-K73 HydrophobicContact CB-CB 3.87Å; A57-K73 PolarHBondContact N-O 3.23Å; P71-K73 VanDerWaalsContact C-N 3.26Å; P71-K73 PolarHBondContact O-N 2.69Å; K73-H101 WeakPolarHBondContact CE-CE1 3.41Å; K73-H101 WeakPolarHBondContact CE-ND1 3.19Å; K73-H101 PolarHBondContact NZ-ND1 3.4Å
74	T	88.2	Confident	83.5	Confident	66 Å²	66	73.5 Å²	73.5	41%	0.405	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129	177.5	-53.4	0	0	0	0	109.1	K54 L55 M56 P71	K54-T74 HydrophobicContact CB-CG2 3.71Å; K54-T74 HydrophobicContact CD-CG2 3.77Å; K54-T74 HydrophobicContact CG-CG2 3.95Å; L55-T74 CarbonylContact O-C 3.59Å; L55-T74 WeakPolarHBondContact O-CA 3.48Å; M56-T74 HydrophobicContact CG-CG2 4.04Å; P71-T74 VanDerWaalsContact CG-OG1 3.31Å; P71-T74 WeakPolarHBondContact CG-OG1 3.24Å
75	I	89.8	Confident	83.4	Confident	3 Å²	3	75.8 Å²	75.8	2%	0.015	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.7	-178.8	-49.8	176.9	0	0	0	107.5	K54 L55 I77 I94 H101	K54-I75 CarbonylContact C-O 3.57Å; K54-I75 WeakPolarHBondContact CA-O 3.27Å; L55-I75 HydrophobicContact CB-CB 4.27Å; L55-I75 HydrophobicContact CD2-CD1 4.43Å; L55-I75 PolarHBondContact N-O 2.95Å; L55-I75 PolarHBondContact O-N 2.91Å; I75-I77 HydrophobicContact CG2-CD1 4.36Å; I75-I94 HydrophobicContact CG2-CG2 4.1Å; I75-H101 HydrophobicContact CD1-CB 3.83Å; I75-H101 VanDerWaalsContact CD1-ND1 3.32Å; I75-H101 WeakPolarHBondContact CD1-ND1 3.22Å
76	N	89.5	Confident	83	Confident	51 Å²	51	78 Å²	78	27%	0.273	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	130.4	177.1	-171	-10.7	0	0	0	109.9	H78 S96	N76-H78 WeakPolarHBondContact OD1-CB 3.41Å; N76-H78 PolarHBondContact OD1-N 2.92Å; N76-S96 VanDerWaalsContact O-CB 3.3Å; N76-S96 WeakPolarHBondContact O-CB 3.43Å; N76-S96 PolarHBondContact O-OG 2.77Å
77	I	91.1	Very high	82.2	Confident	0 Å²	0	77 Å²	77	0%	0	43%	0.433	C	S	.	.			trans	-95.1	-18.1	-178.1	-59	-56.3	0	0	0	112.1	F48 L53 L55 I75 G79 A80 F82 I94 L118 R122	F48-I77 HydrophobicContact CD2-CG1 4.29Å; F48-I77 HydrophobicContact CE2-CB 4.16Å; F48-I77 HydrophobicContact CE2-CG1 3.75Å; L53-I77 VanDerWaalsContact O-CB 3.32Å; L53-I77 WeakPolarHBondContact O-CB 3.24Å; L53-I77 PolarHBondContact O-N 2.88Å; L55-I77 HydrophobicContact CB-CD1 4.23Å; L55-I77 HydrophobicContact CB-CG1 4.34Å; I75-I77 HydrophobicContact CG2-CD1 4.36Å; I77-G79 PolarHBondContact O-N 3.11Å; I77-A80 HydrophobicContact CD1-CB 4.37Å; I77-A80 PolarHBondContact O-N 3.39Å; I77-F82 HydrophobicContact CD1-CZ 4.44Å; I77-F82 HydrophobicContact CG2-CZ 4.11Å; I77-I94 HydrophobicContact CD1-CG2 4.4Å; I77-L118 HydrophobicContact CD1-CD2 4.49Å; I77-L118 HydrophobicContact CG1-CD2 4.35Å; I77-R122 HydrophobicContact CG2-CB 3.83Å; I77-R122 VanDerWaalsContact O-CG 3.27Å; I77-R122 WeakPolarHBondContact O-CG 3.37Å
78	H	80.3	Confident	82	Confident	81 Å²	81	76.9 Å²	76.9	38%	0.375	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.7	-171.1	-165.2	68	0	0	0	114.5	N76 A125	N76-H78 WeakPolarHBondContact OD1-CB 3.41Å; N76-H78 PolarHBondContact OD1-N 2.92Å; H78-A125 WeakPolarHBondContact ND1-CB 3.42Å
79	G	79.3	Confident	81.8	Confident	59 Å²	59	76.1 Å²	76.1	61%	0.608	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	13.3	176.1	0	0	0	0	0	114.5	I77	I77-G79 PolarHBondContact O-N 3.11Å
80	A	87.3	Confident	81.8	Confident	1 Å²	1	73.1 Å²	73.1	1%	0.008	40%	0.402	C	S	.	.			trans	-72.9	142	-170.4	0	0	0	0	0	113.1	I77 F82 I94 I95 R122	I77-A80 HydrophobicContact CD1-CB 4.37Å; I77-A80 PolarHBondContact O-N 3.39Å; A80-F82 HydrophobicContact CB-CE2 4.32Å; A80-F82 HydrophobicContact CB-CZ 4.22Å; A80-I94 HydrophobicContact CB-CG2 3.75Å; A80-I95 CarbonylContact C-O 3.42Å; A80-I95 VanDerWaalsContact CA-O 3.28Å; A80-I95 WeakPolarHBondContact CA-O 3.09Å; A80-R122 WeakPolarHBondContact O-CD 3.46Å; A80-R122 PolarHBondContact O-NH1 2.83Å
81	V	84.4	Confident	81.9	Confident	83 Å²	83	67.5 Å²	67.5	50%	0.503	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132.5	171.6	-176.8	0	0	0	0	108.5	I95	V81-I95 HydrophobicContact CB-CB 4.42Å; V81-I95 PolarHBondContact N-O 2.72Å; V81-I95 PolarHBondContact O-N 2.84Å
82	F	89.8	Confident	82	Confident	23 Å²	23	66.1 Å²	66.1	10%	0.101	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133.8	-176.2	-57.4	-92.6	0	0	0	109.7	I77 A80 S93 I94 L115 L118 Q119	I77-F82 HydrophobicContact CD1-CZ 4.44Å; I77-F82 HydrophobicContact CG2-CZ 4.11Å; A80-F82 HydrophobicContact CB-CE2 4.32Å; A80-F82 HydrophobicContact CB-CZ 4.22Å; F82-S93 CarbonylContact C-O 3.24Å; F82-S93 WeakPolarHBondContact CA-O 3.36Å; F82-I94 HydrophobicContact CD1-CD1 4.33Å; F82-I94 HydrophobicContact CD1-CG1 3.87Å; F82-I94 HydrophobicContact CD1-CG2 4.3Å; F82-I94 HydrophobicContact CE1-CD1 3.99Å; F82-I94 HydrophobicContact CE1-CG1 4Å; F82-I94 HydrophobicContact CE1-CG2 4.06Å; F82-L115 HydrophobicContact CB-CD2 3.84Å; F82-L115 HydrophobicContact CD1-CD2 3.99Å; F82-L115 HydrophobicContact CG-CD2 4.25Å; F82-L118 HydrophobicContact CE1-CB 3.65Å; F82-L118 HydrophobicContact CE1-CD1 4.13Å; F82-L118 HydrophobicContact CZ-CB 3.67Å; F82-Q119 HydrophobicContact CB-CG 4.31Å; F82-Q119 HydrophobicContact CD2-CG 3.37Å; F82-Q119 HydrophobicContact CE2-CB 4.43Å; F82-Q119 HydrophobicContact CE2-CG 3.7Å; F82-Q119 HydrophobicContact CG-CG 3.82Å; F82-Q119 HydrophobicContact CZ-CG 4.4Å
83	H	82.4	Confident	82.2	Confident	108 Å²	108	61.3 Å²	61.3	50%	0.5	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144.3	179.4	-172.9	58.3	0	0	0	110.8	F92 S93	H83-F92 CarbonylContact O-C 3.53Å; H83-F92 WeakPolarHBondContact O-CA 3.37Å; H83-F92 WeakPolarHBondContact O-CB 3.36Å; H83-S93 PolarHBondContact N-O 2.91Å; H83-S93 PolarHBondContact O-N 3.22Å
84	I	78.5	Confident	82.4	Confident	74 Å²	74	56.8 Å²	56.8	38%	0.379	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.3	175.6	-51.7	174.2	0	0	0	105.9	P86 F92 M111 L115	I84-P86 WeakPolarHBondContact O-CD 3.29Å; I84-F92 HydrophobicContact CG1-CB 4.48Å; I84-M111 HydrophobicContact CG2-CE 4.42Å; I84-L115 HydrophobicContact CD1-CD1 3.44Å; I84-L115 VanDerWaalsContact CD1-CD1 3.44Å; I84-L115 HydrophobicContact CG1-CD1 3.62Å
85	D	74.4	Confident	82.3	Confident	77 Å²	77	56.7 Å²	56.7	41%	0.412	32%	0.318	S	S	.	.			trans	-89.5	114.4	170.6	-169.5	-22.3	0	0	0	108.3	A87 E88	D85-A87 PolarHBondContact O-N 3.31Å; D85-A87 VanDerWaalsContact O-N 3.13Å; D85-A87 WeakPolarHBondContact OD1-CB 3.42Å; D85-A87 PolarHBondContact OD1-N 2.79Å; D85-E88 PolarHBondContact O-N 2.85Å
86	P	69.6	Low	82.1	Confident	124 Å²	124	56.7 Å²	56.7	81%	0.805	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.4	-179.4	25.7	-33	0	0	0	113.7	I84	I84-P86 WeakPolarHBondContact O-CD 3.29Å
87	A	64.9	Low	81.7	Confident	72 Å²	72	59.8 Å²	59.8	60%	0.595	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-26	176.4	0	0	0	0	0	113.2	D85	D85-A87 PolarHBondContact O-N 3.31Å; D85-A87 VanDerWaalsContact O-N 3.13Å; D85-A87 WeakPolarHBondContact OD1-CB 3.42Å; D85-A87 PolarHBondContact OD1-N 2.79Å
88	E	72.3	Confident	81.1	Confident	106 Å²	106	63 Å²	63	50%	0.495	37%	0.368	S	S	.	.	S	Bend	trans	-108.9	114.8	-170.2	-67.7	-69.1	171.1	0	0	111.6	D85 N90 Q91	D85-E88 PolarHBondContact O-N 2.85Å; E88-N90 PolarHBondContact O-N 2.81Å; E88-Q91 HydrophobicContact CB-CB 3.93Å; E88-Q91 VanDerWaalsContact CB-OE1 3.3Å; E88-Q91 PolarHBondContact O-N 2.8Å
89	H	73.3	Confident	80.9	Confident	154 Å²	154	66.1 Å²	66.1	71%	0.713	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	127.6	-171.6	-73.2	61.3	0	0	0	112.2	Q91 Q104	H89-Q91 PolarHBondContact O-N 3.34Å; H89-Q104 PolarHBondContact O-NE2 2.89Å
90	N	82.4	Confident	81.3	Confident	41 Å²	41	68.7 Å²	68.7	22%	0.219	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	60	20.1	-179.8	-52.7	-21.1	0	0	0	114.6	E88 Q104 A105 E108	E88-N90 PolarHBondContact O-N 2.81Å; N90-Q104 CarbonylContact O-C 3.57Å; N90-Q104 WeakPolarHBondContact O-CA 3.48Å; N90-A105 WeakPolarHBondContact CB-O 3.41Å; N90-A105 PolarHBondContact O-N 2.8Å; N90-E108 VanDerWaalsContact OD1-CA 3.23Å; N90-E108 WeakPolarHBondContact OD1-CA 3.34Å; N90-E108 VanDerWaalsContact OD1-CB 3.31Å; N90-E108 WeakPolarHBondContact OD1-CB 3.12Å; N90-E108 PolarHBondContact OD1-N 2.74Å
91	Q	85.4	Confident	81.2	Confident	52 Å²	52	69.4 Å²	69.4	24%	0.243	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	140.8	-178	-158.9	174.4	33.4	0	0	111.8	E88 H89 I102 L103 Q104	E88-Q91 HydrophobicContact CB-CB 3.93Å; E88-Q91 VanDerWaalsContact CB-OE1 3.3Å; E88-Q91 PolarHBondContact O-N 2.8Å; H89-Q91 PolarHBondContact O-N 3.34Å; Q91-I102 VanDerWaalsContact CD-CG2 3.41Å; Q91-I102 HydrophobicContact CG-CG2 3.56Å; Q91-L103 CarbonylContact C-O 3.57Å; Q91-L103 WeakPolarHBondContact CA-O 3.32Å; Q91-L103 VanDerWaalsContact CG-O 3.32Å; Q91-L103 WeakPolarHBondContact CG-O 3.4Å; Q91-Q104 HydrophobicContact CB-CG 4.42Å; Q91-Q104 HydrophobicContact CG-CB 4.31Å
92	F	89.8	Confident	81.3	Confident	10 Å²	10	70.4 Å²	70.4	4%	0.044	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	150.4	176.4	65.9	-76.5	0	0	0	110.1	H83 I84 I94 L103 M111 W114 L115	H83-F92 CarbonylContact O-C 3.53Å; H83-F92 WeakPolarHBondContact O-CA 3.37Å; H83-F92 WeakPolarHBondContact O-CB 3.36Å; I84-F92 HydrophobicContact CG1-CB 4.48Å; F92-I94 HydrophobicContact CD2-CG1 4.13Å; F92-I94 HydrophobicContact CE2-CD1 3.97Å; F92-I94 HydrophobicContact CE2-CG1 3.96Å; F92-L103 HydrophobicContact CD1-CB 4.3Å; F92-L103 HydrophobicContact CE1-CB 3.85Å; F92-L103 HydrophobicContact CE2-CB 4.22Å; F92-L103 HydrophobicContact CE2-CD1 3.99Å; F92-L103 HydrophobicContact CZ-CB 3.81Å; F92-L103 HydrophobicContact CZ-CD1 3.92Å; F92-L103 PolarHBondContact N-O 3.41Å; F92-L103 PolarHBondContact O-N 3.2Å; F92-L103 VanDerWaalsContact O-O 3.05Å; F92-M111 HydrophobicContact CB-CG 4.37Å; F92-M111 HydrophobicContact CB-SD 4.31Å; F92-M111 HydrophobicContact CD1-CG 3.62Å; F92-M111 HydrophobicContact CD1-SD 4.25Å; F92-M111 HydrophobicContact CE1-CG 4.23Å; F92-M111 HydrophobicContact CG-CG 4.24Å; F92-W114 HydrophobicContact CZ-CB 4.3Å; F92-L115 HydrophobicContact CB-CD1 4.08Å; F92-L115 HydrophobicContact CB-CD2 4.22Å; F92-L115 HydrophobicContact CB-CG 4.39Å; F92-L115 HydrophobicContact CD2-CD2 3.67Å; F92-L115 HydrophobicContact CD2-CG 3.98Å; F92-L115 HydrophobicContact CE2-CD2 4.31Å; F92-L115 HydrophobicContact CE2-CG 4.43Å; F92-L115 HydrophobicContact CG-CD1 4.29Å; F92-L115 HydrophobicContact CG-CD2 4.16Å; F92-L115 HydrophobicContact CG-CG 4.17Å
93	S	88.1	Confident	81.3	Confident	7 Å²	7	70.2 Å²	70.2	5%	0.049	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.9	176.8	80.2	0	0	0	0	112.2	F82 H83 E100 H101	F82-S93 CarbonylContact C-O 3.24Å; F82-S93 WeakPolarHBondContact CA-O 3.36Å; H83-S93 PolarHBondContact N-O 2.91Å; H83-S93 PolarHBondContact O-N 3.22Å; S93-E100 VanDerWaalsContact CB-OE1 3.26Å; S93-E100 WeakPolarHBondContact CB-OE1 3.48Å; S93-E100 PolarHBondContact OG-OE1 2.68Å; S93-H101 CarbonylContact C-O 3.6Å; S93-H101 WeakPolarHBondContact CA-O 3.15Å
94	I	90.9	Very high	81.4	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	114.3	173.4	-51.3	-178.5	0	0	0	107.4	L55 I75 I77 A80 F82 F92 H101 L103 L118	L55-I94 HydrophobicContact CD2-CD1 4.06Å; I75-I94 HydrophobicContact CG2-CG2 4.1Å; I77-I94 HydrophobicContact CD1-CG2 4.4Å; A80-I94 HydrophobicContact CB-CG2 3.75Å; F82-I94 HydrophobicContact CD1-CD1 4.33Å; F82-I94 HydrophobicContact CD1-CG1 3.87Å; F82-I94 HydrophobicContact CD1-CG2 4.3Å; F82-I94 HydrophobicContact CE1-CD1 3.99Å; F82-I94 HydrophobicContact CE1-CG1 4Å; F82-I94 HydrophobicContact CE1-CG2 4.06Å; F92-I94 HydrophobicContact CD2-CG1 4.13Å; F92-I94 HydrophobicContact CE2-CD1 3.97Å; F92-I94 HydrophobicContact CE2-CG1 3.96Å; I94-H101 HydrophobicContact CB-CB 4.42Å; I94-H101 PolarHBondContact N-O 2.82Å; I94-H101 WeakPolarHBondContact O-CB 3.31Å; I94-H101 PolarHBondContact O-CD2 2.88Å; I94-H101 PolarHBondContact O-N 2.67Å; I94-L103 HydrophobicContact CD1-CD1 3.65Å; I94-L103 HydrophobicContact CG1-CD1 4.22Å; I94-L118 HydrophobicContact CD1-CD1 4.08Å
95	I	85.7	Confident	81.6	Confident	65 Å²	65	67 Å²	67	33%	0.333	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	110.4	175	-56.7	169.8	0	0	0	107.8	A80 V81 K99 E100	A80-I95 CarbonylContact C-O 3.42Å; A80-I95 VanDerWaalsContact CA-O 3.28Å; A80-I95 WeakPolarHBondContact CA-O 3.09Å; V81-I95 HydrophobicContact CB-CB 4.42Å; V81-I95 PolarHBondContact N-O 2.72Å; V81-I95 PolarHBondContact O-N 2.84Å; I95-K99 CarbonylContact C-O 3.48Å; I95-K99 WeakPolarHBondContact CA-O 3.37Å; I95-E100 HydrophobicContact CG1-CB 4.11Å; I95-E100 HydrophobicContact CG1-CG 3.95Å
96	S	85.5	Confident	81.9	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.014	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.9	175.8	-178.1	0	0	0	0	110.1	N76 G98 K99	N76-S96 VanDerWaalsContact O-CB 3.3Å; N76-S96 WeakPolarHBondContact O-CB 3.43Å; N76-S96 PolarHBondContact O-OG 2.77Å; S96-G98 PolarHBondContact O-N 2.78Å; S96-G98 VanDerWaalsContact O-N 3.12Å; S96-K99 PolarHBondContact N-O 3.3Å; S96-K99 PolarHBondContact O-N 2.86Å; S96-K99 VanDerWaalsContact O-O 3.1Å
97	D	80.7	Confident	82.3	Confident	116 Å²	116	67.7 Å²	67.7	62%	0.62	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	36.3	176.2	-50.9	-51.8	0	0	0	113.2	K99	D97-K99 PolarHBondContact O-N 2.74Å
98	G	78.1	Confident	82.9	Confident	69 Å²	69	69.9 Å²	69.9	71%	0.711	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	3.7	-177.7	0	0	0	0	0	115.4	S96	S96-G98 PolarHBondContact O-N 2.78Å; S96-G98 VanDerWaalsContact O-N 3.12Å
99	K	77.1	Confident	83.2	Confident	145 Å²	145	70.1 Å²	70.1	63%	0.63	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.4	177.1	-68.4	177.8	-177.6	170.8	0	110.5	I95 S96 D97 H101	I95-K99 CarbonylContact C-O 3.48Å; I95-K99 WeakPolarHBondContact CA-O 3.37Å; S96-K99 PolarHBondContact N-O 3.3Å; S96-K99 PolarHBondContact O-N 2.86Å; S96-K99 VanDerWaalsContact O-O 3.1Å; D97-K99 PolarHBondContact O-N 2.74Å; K99-H101 PolarHBondContact O-CD2 3.2Å; K99-H101 VanDerWaalsContact O-CD2 3.29Å
100	E	86.6	Confident	83.7	Confident	113 Å²	113	64.1 Å²	64.1	53%	0.528	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	127.5	173.7	-175.4	171.6	-155.2	0	0	110.7	S93 I95 I102	S93-E100 VanDerWaalsContact CB-OE1 3.26Å; S93-E100 WeakPolarHBondContact CB-OE1 3.48Å; S93-E100 PolarHBondContact OG-OE1 2.68Å; I95-E100 HydrophobicContact CG1-CB 4.11Å; I95-E100 HydrophobicContact CG1-CG 3.95Å; E100-I102 HydrophobicContact CG-CG1 4.25Å
101	H	85.1	Confident	84.1	Confident	17 Å²	17	62.7 Å²	62.7	8%	0.079	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	101.9	179.9	-61.9	-116.8	0	0	0	109	K73 I75 S93 I94 K99	K73-H101 WeakPolarHBondContact CE-CE1 3.41Å; K73-H101 WeakPolarHBondContact CE-ND1 3.19Å; K73-H101 PolarHBondContact NZ-ND1 3.4Å; I75-H101 HydrophobicContact CD1-CB 3.83Å; I75-H101 VanDerWaalsContact CD1-ND1 3.32Å; I75-H101 WeakPolarHBondContact CD1-ND1 3.22Å; S93-H101 CarbonylContact C-O 3.6Å; S93-H101 WeakPolarHBondContact CA-O 3.15Å; I94-H101 HydrophobicContact CB-CB 4.42Å; I94-H101 PolarHBondContact N-O 2.82Å; I94-H101 WeakPolarHBondContact O-CB 3.31Å; I94-H101 PolarHBondContact O-CD2 2.88Å; I94-H101 PolarHBondContact O-N 2.67Å; K99-H101 PolarHBondContact O-CD2 3.2Å; K99-H101 VanDerWaalsContact O-CD2 3.29Å
102	I	87.6	Confident	83.9	Confident	103 Å²	103	64.1 Å²	64.1	53%	0.528	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.1	177.5	-50.6	174.2	0	0	0	109	Q91 E100	Q91-I102 VanDerWaalsContact CD-CG2 3.41Å; Q91-I102 HydrophobicContact CG-CG2 3.56Å; E100-I102 HydrophobicContact CG-CG1 4.25Å
103	L	88.2	Confident	83.7	Confident	19 Å²	19	69.1 Å²	69.1	10%	0.099	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.8	-178.1	-61.8	176.7	0	0	0	109.5	Y46 L55 Q91 F92 I94	Y46-L103 HydrophobicContact CE1-CD2 4.02Å; Y46-L103 HydrophobicContact CE2-CD2 4.06Å; Y46-L103 WeakPolarHBondContact OH-CD2 3.16Å; L55-L103 HydrophobicContact CD2-CD1 4.33Å; Q91-L103 CarbonylContact C-O 3.57Å; Q91-L103 WeakPolarHBondContact CA-O 3.32Å; Q91-L103 VanDerWaalsContact CG-O 3.32Å; Q91-L103 WeakPolarHBondContact CG-O 3.4Å; F92-L103 HydrophobicContact CD1-CB 4.3Å; F92-L103 HydrophobicContact CE1-CB 3.85Å; F92-L103 HydrophobicContact CE2-CB 4.22Å; F92-L103 HydrophobicContact CE2-CD1 3.99Å; F92-L103 HydrophobicContact CZ-CB 3.81Å; F92-L103 HydrophobicContact CZ-CD1 3.92Å; F92-L103 PolarHBondContact N-O 3.41Å; F92-L103 PolarHBondContact O-N 3.2Å; F92-L103 VanDerWaalsContact O-O 3.05Å; I94-L103 HydrophobicContact CD1-CD1 3.65Å; I94-L103 HydrophobicContact CG1-CD1 4.22Å
104	Q	85	Confident	83.8	Confident	98 Å²	98	73 Å²	73	46%	0.458	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.2	175.7	-168.5	176.5	15.8	0	0	109	H89 N90 Q91	H89-Q104 PolarHBondContact O-NE2 2.89Å; N90-Q104 CarbonylContact O-C 3.57Å; N90-Q104 WeakPolarHBondContact O-CA 3.48Å; Q91-Q104 HydrophobicContact CB-CG 4.42Å; Q91-Q104 HydrophobicContact CG-CB 4.31Å
105	A	84	Confident	83.7	Confident	17 Å²	17	73.3 Å²	73.3	14%	0.14	39%	0.385	C	S	.	.			trans	-83.4	157	176.3	0	0	0	0	0	110.8	N90 T107 A110 M111	N90-A105 WeakPolarHBondContact CB-O 3.41Å; N90-A105 PolarHBondContact O-N 2.8Å; A105-T107 VanDerWaalsContact C-N 3.32Å; A105-T107 PolarHBondContact O-N 2.98Å; A105-A110 HydrophobicContact CB-CB 4.19Å; A105-M111 HydrophobicContact CB-CB 3.7Å
106	E	78.8	Confident	83.6	Confident	145 Å²	145	76 Å²	76	68%	0.678	40%	0.396	S	S	*	.	S	Bend	trans	-70.4	-30.5	-179.7	-169.9	156.9	-136.8	0	0	112.5	R43	R43-E106 IonicContact CZ-OE1 3.65Å; R43-E106 IonicContact NH1-OE1 3.7Å; R43-E106 IonicContact NH2-OE1 3.44Å; R43-E106 PolarHBondContact NH2-OE1 2.88Å; R43-E106 VanDerWaalsContact NH2-OE1 3.07Å
107	T	79.6	Confident	83.6	Confident	70 Å²	70	78.6 Å²	78.6	43%	0.429	41%	0.411	S	S	.	.	S	Bend	trans	-135.5	157.2	175.6	64	0	0	0	0	110.7	A105 D109 A110 M111	A105-T107 VanDerWaalsContact C-N 3.32Å; A105-T107 PolarHBondContact O-N 2.98Å; T107-D109 VanDerWaalsContact C-N 3.3Å; T107-D109 PolarHBondContact O-N 3.15Å; T107-A110 PolarHBondContact O-N 2.98Å; T107-A110 VanDerWaalsContact OG1-CB 3.28Å; T107-A110 WeakPolarHBondContact OG1-CB 3.36Å; T107-A110 PolarHBondContact OG1-N 3.08Å; T107-A110 VanDerWaalsContact OG1-N 3.15Å; T107-M111 PolarHBondContact O-N 2.86Å
108	E	76.7	Confident	84.2	Confident	119 Å²	119	73 Å²	73	56%	0.556	38%	0.382	S	S	*	.	H	α-helix	trans	-60.2	-42.6	175.4	-168.7	178.7	176.2	0	0	111	N90 A110 M111 L112	N90-E108 VanDerWaalsContact OD1-CA 3.23Å; N90-E108 WeakPolarHBondContact OD1-CA 3.34Å; N90-E108 VanDerWaalsContact OD1-CB 3.31Å; N90-E108 WeakPolarHBondContact OD1-CB 3.12Å; N90-E108 PolarHBondContact OD1-N 2.74Å; E108-A110 VanDerWaalsContact C-N 3.3Å; E108-A110 PolarHBondContact O-N 3.04Å; E108-M111 HydrophobicContact CG-CE 4.2Å; E108-M111 WeakPolarHBondContact O-CB 3.4Å; E108-M111 PolarHBondContact O-N 3.07Å; E108-M111 VanDerWaalsContact O-N 3.09Å; E108-L112 HydrophobicContact CG-CD1 4.22Å; E108-L112 WeakPolarHBondContact O-CG 3.41Å; E108-L112 PolarHBondContact O-N 2.75Å
109	D	78.7	Confident	84.6	Confident	111 Å²	111	73 Å²	73	59%	0.594	36%	0.363	S	S	*	.	H	α-helix	trans	-57.7	-42.3	175.3	-65.4	-31.1	0	0	0	111.8	T107 L112 L113	T107-D109 VanDerWaalsContact C-N 3.3Å; T107-D109 PolarHBondContact O-N 3.15Å; D109-L112 PolarHBondContact O-N 3.41Å; D109-L113 VanDerWaalsContact O-CB 3.25Å; D109-L113 WeakPolarHBondContact O-CB 3.43Å; D109-L113 PolarHBondContact O-N 2.65Å
110	A	83.2	Confident	85	Confident	27 Å²	27	68.4 Å²	68.4	22%	0.223	35%	0.347	C	S	.	.	H	α-helix	trans	-65.8	-41.3	176.2	0	0	0	0	0	111.3	A105 T107 E108 L113 W114	A105-A110 HydrophobicContact CB-CB 4.19Å; T107-A110 PolarHBondContact O-N 2.98Å; T107-A110 VanDerWaalsContact OG1-CB 3.28Å; T107-A110 WeakPolarHBondContact OG1-CB 3.36Å; T107-A110 PolarHBondContact OG1-N 3.08Å; T107-A110 VanDerWaalsContact OG1-N 3.15Å; E108-A110 VanDerWaalsContact C-N 3.3Å; E108-A110 PolarHBondContact O-N 3.04Å; A110-L113 PolarHBondContact O-N 3.24Å; A110-W114 WeakPolarHBondContact O-CB 3.33Å; A110-W114 PolarHBondContact O-N 2.95Å
111	M	90.4	Very high	84.8	Confident	11 Å²	11	66.2 Å²	66.2	5%	0.054	33%	0.334	C	S	.	.	H	α-helix	trans	-58	-51.4	174.9	176.9	-178.7	72	0	0	111.1	I84 F92 A105 T107 E108 L113 W114 L115	I84-M111 HydrophobicContact CG2-CE 4.42Å; F92-M111 HydrophobicContact CB-CG 4.37Å; F92-M111 HydrophobicContact CB-SD 4.31Å; F92-M111 HydrophobicContact CD1-CG 3.62Å; F92-M111 HydrophobicContact CD1-SD 4.25Å; F92-M111 HydrophobicContact CE1-CG 4.23Å; F92-M111 HydrophobicContact CG-CG 4.24Å; A105-M111 HydrophobicContact CB-CB 3.7Å; T107-M111 PolarHBondContact O-N 2.86Å; E108-M111 HydrophobicContact CG-CE 4.2Å; E108-M111 WeakPolarHBondContact O-CB 3.4Å; E108-M111 PolarHBondContact O-N 3.07Å; E108-M111 VanDerWaalsContact O-N 3.09Å; M111-L113 VanDerWaalsContact C-N 3.33Å; M111-L113 PolarHBondContact O-N 3.16Å; M111-W114 PolarHBondContact O-N 3.47Å; M111-L115 HydrophobicContact CG-CD1 3.82Å; M111-L115 WeakPolarHBondContact O-CB 3.06Å; M111-L115 WeakPolarHBondContact O-CG 3.32Å; M111-L115 PolarHBondContact O-N 3.09Å
112	L	82	Confident	85	Confident	83 Å²	83	68.1 Å²	68.1	44%	0.435	34%	0.34	S	S	.	.	H	α-helix	trans	-63.9	-39.5	-178.6	-68.3	174.1	0	0	0	111.5	E108 D109 H116	E108-L112 HydrophobicContact CG-CD1 4.22Å; E108-L112 WeakPolarHBondContact O-CG 3.41Å; E108-L112 PolarHBondContact O-N 2.75Å; D109-L112 PolarHBondContact O-N 3.41Å; L112-H116 VanDerWaalsContact O-CB 3.27Å; L112-H116 WeakPolarHBondContact O-CB 3.31Å; L112-H116 PolarHBondContact O-N 2.5Å
113	L	85.1	Confident	84.7	Confident	115 Å²	115	66.5 Å²	66.5	60%	0.602	33%	0.333	S	S	*	.	H	α-helix	trans	-62.4	-48.7	174.9	-168.6	80.5	0	0	0	111.6	D109 A110 M111 H116 V117	D109-L113 VanDerWaalsContact O-CB 3.25Å; D109-L113 WeakPolarHBondContact O-CB 3.43Å; D109-L113 PolarHBondContact O-N 2.65Å; A110-L113 PolarHBondContact O-N 3.24Å; M111-L113 VanDerWaalsContact C-N 3.33Å; M111-L113 PolarHBondContact O-N 3.16Å; L113-H116 PolarHBondContact O-N 3.07Å; L113-V117 WeakPolarHBondContact O-CG2 3.49Å; L113-V117 PolarHBondContact O-N 3.47Å
114	W	90.3	Very high	84.2	Confident	88 Å²	88	70.2 Å²	70.2	33%	0.333	35%	0.35	S	S	.	.	H	α-helix	trans	-61	-46.2	177.9	-87.4	107.7	0	0	0	111.9	F48 L55 F92 A110 M111 H116 V117 L118	F48-W114 HydrophobicContact CB-CZ3 4.24Å; L55-W114 HydrophobicContact CD1-CH2 4.17Å; L55-W114 HydrophobicContact CD1-CZ3 3.69Å; F92-W114 HydrophobicContact CZ-CB 4.3Å; A110-W114 WeakPolarHBondContact O-CB 3.33Å; A110-W114 PolarHBondContact O-N 2.95Å; M111-W114 PolarHBondContact O-N 3.47Å; W114-H116 PolarHBondContact O-N 3.41Å; W114-V117 PolarHBondContact O-N 2.93Å; W114-L118 HydrophobicContact CE3-CD1 3.94Å; W114-L118 HydrophobicContact CE3-CD2 4.39Å; W114-L118 HydrophobicContact CE3-CG 4.1Å; W114-L118 HydrophobicContact CZ3-CD2 4.44Å; W114-L118 WeakPolarHBondContact O-CB 3.28Å; W114-L118 VanDerWaalsContact O-CG 3.24Å; W114-L118 WeakPolarHBondContact O-CG 2.9Å; W114-L118 PolarHBondContact O-N 2.91Å
115	L	89	Confident	83.7	Confident	7 Å²	7	65.9 Å²	65.9	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-46.1	177.1	-80.5	164.9	0	0	0	111.7	F82 I84 F92 M111 Q119	F82-L115 HydrophobicContact CB-CD2 3.84Å; F82-L115 HydrophobicContact CD1-CD2 3.99Å; F82-L115 HydrophobicContact CG-CD2 4.25Å; I84-L115 HydrophobicContact CD1-CD1 3.44Å; I84-L115 VanDerWaalsContact CD1-CD1 3.44Å; I84-L115 HydrophobicContact CG1-CD1 3.62Å; F92-L115 HydrophobicContact CB-CD1 4.08Å; F92-L115 HydrophobicContact CB-CD2 4.22Å; F92-L115 HydrophobicContact CB-CG 4.39Å; F92-L115 HydrophobicContact CD2-CD2 3.67Å; F92-L115 HydrophobicContact CD2-CG 3.98Å; F92-L115 HydrophobicContact CE2-CD2 4.31Å; F92-L115 HydrophobicContact CE2-CG 4.43Å; F92-L115 HydrophobicContact CG-CD1 4.29Å; F92-L115 HydrophobicContact CG-CD2 4.16Å; F92-L115 HydrophobicContact CG-CG 4.17Å; M111-L115 HydrophobicContact CG-CD1 3.82Å; M111-L115 WeakPolarHBondContact O-CB 3.06Å; M111-L115 WeakPolarHBondContact O-CG 3.32Å; M111-L115 PolarHBondContact O-N 3.09Å; L115-Q119 WeakPolarHBondContact O-CB 3.16Å; L115-Q119 WeakPolarHBondContact O-CG 3.07Å; L115-Q119 PolarHBondContact O-N 2.76Å
116	H	84.2	Confident	83	Confident	122 Å²	122	67.2 Å²	67.2	57%	0.565	34%	0.337	S	S	*	.	H	α-helix	trans	-61.6	-48.9	179.2	-178.6	65.9	0	0	0	111.9	L112 L113 W114 T120	L112-H116 VanDerWaalsContact O-CB 3.27Å; L112-H116 WeakPolarHBondContact O-CB 3.31Å; L112-H116 PolarHBondContact O-N 2.5Å; L113-H116 PolarHBondContact O-N 3.07Å; W114-H116 PolarHBondContact O-N 3.41Å; H116-T120 VanDerWaalsContact O-CB 3.31Å; H116-T120 WeakPolarHBondContact O-CB 3.36Å; H116-T120 PolarHBondContact O-N 2.87Å; H116-T120 PolarHBondContact O-OG1 2.84Å
117	V	86.3	Confident	82.3	Confident	55 Å²	55	66.8 Å²	66.8	33%	0.333	34%	0.335	S	S	.	.	H	α-helix	trans	-64.2	-50.8	-179.2	173	0	0	0	0	111	L113 W114 Q119 T120 R121	L113-V117 WeakPolarHBondContact O-CG2 3.49Å; L113-V117 PolarHBondContact O-N 3.47Å; W114-V117 PolarHBondContact O-N 2.93Å; V117-Q119 PolarHBondContact O-N 2.8Å; V117-T120 PolarHBondContact O-N 3.38Å; V117-R121 HydrophobicContact CG1-CG 4.45Å; V117-R121 WeakPolarHBondContact O-CG 3.42Å; V117-R121 PolarHBondContact O-N 2.88Å
118	L	91.3	Very high	81.5	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.4	-39.6	-176.6	-66.3	174.2	0	0	0	112.3	F48 L55 I77 F82 I94 W114 R122	F48-L118 HydrophobicContact CB-CD2 4.38Å; F48-L118 HydrophobicContact CD2-CD2 3.52Å; F48-L118 HydrophobicContact CE2-CD2 3.85Å; F48-L118 HydrophobicContact CG-CD2 3.88Å; F48-L118 HydrophobicContact CZ-CD2 4.45Å; L55-L118 HydrophobicContact CD1-CD2 4.45Å; L55-L118 HydrophobicContact CD2-CD1 4.12Å; I77-L118 HydrophobicContact CD1-CD2 4.49Å; I77-L118 HydrophobicContact CG1-CD2 4.35Å; F82-L118 HydrophobicContact CE1-CB 3.65Å; F82-L118 HydrophobicContact CE1-CD1 4.13Å; F82-L118 HydrophobicContact CZ-CB 3.67Å; I94-L118 HydrophobicContact CD1-CD1 4.08Å; W114-L118 HydrophobicContact CE3-CD1 3.94Å; W114-L118 HydrophobicContact CE3-CD2 4.39Å; W114-L118 HydrophobicContact CE3-CG 4.1Å; W114-L118 HydrophobicContact CZ3-CD2 4.44Å; W114-L118 WeakPolarHBondContact O-CB 3.28Å; W114-L118 VanDerWaalsContact O-CG 3.24Å; W114-L118 WeakPolarHBondContact O-CG 2.9Å; W114-L118 PolarHBondContact O-N 2.91Å; L118-R122 WeakPolarHBondContact O-CB 3.48Å; L118-R122 PolarHBondContact O-N 3.44Å
119	Q	87.8	Confident	80.5	Confident	69 Å²	69	64.1 Å²	64.1	32%	0.322	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-42.2	174.7	-75.9	177.3	-1.4	0	0	111.9	F82 L115 V117 R122 N123	F82-Q119 HydrophobicContact CB-CG 4.31Å; F82-Q119 HydrophobicContact CD2-CG 3.37Å; F82-Q119 HydrophobicContact CE2-CB 4.43Å; F82-Q119 HydrophobicContact CE2-CG 3.7Å; F82-Q119 HydrophobicContact CG-CG 3.82Å; F82-Q119 HydrophobicContact CZ-CG 4.4Å; L115-Q119 WeakPolarHBondContact O-CB 3.16Å; L115-Q119 WeakPolarHBondContact O-CG 3.07Å; L115-Q119 PolarHBondContact O-N 2.76Å; V117-Q119 PolarHBondContact O-N 2.8Å; Q119-R122 PolarHBondContact O-N 3.21Å; Q119-N123 WeakPolarHBondContact O-CB 3.29Å; Q119-N123 PolarHBondContact O-N 3.13Å; Q119-N123 PolarHBondContact O-ND2 2.84Å; Q119-N123 PolarHBondContact O-OD1 2.69Å
120	T	84.6	Confident	78.7	Confident	48 Å²	48	65.6 Å²	65.6	29%	0.294	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-48.5	178.9	-58.5	0	0	0	0	110.5	H116 V117 R122 N123 E124	H116-T120 VanDerWaalsContact O-CB 3.31Å; H116-T120 WeakPolarHBondContact O-CB 3.36Å; H116-T120 PolarHBondContact O-N 2.87Å; H116-T120 PolarHBondContact O-OG1 2.84Å; V117-T120 PolarHBondContact O-N 3.38Å; T120-R122 PolarHBondContact O-N 2.89Å; T120-N123 WeakPolarHBondContact O-CB 3.41Å; T120-N123 PolarHBondContact O-N 2.91Å; T120-N123 VanDerWaalsContact O-N 3.09Å; T120-E124 WeakPolarHBondContact O-CG 3.43Å; T120-E124 PolarHBondContact O-N 3.18Å
121	R	83.1	Confident	76.7	Confident	66 Å²	66	68.6 Å²	68.6	25%	0.249	35%	0.351	C	S	.	.	H	α-helix	trans	-66	-35.9	179.1	-61.7	-51.2	-170.5	96.5	10	113.5	F48 E50 L53 V117 E124 A125	F48-R121 HydrophobicContact CE1-CB 3.97Å; F48-R121 HydrophobicContact CE1-CG 3.79Å; F48-R121 HydrophobicContact CZ-CB 3.81Å; F48-R121 HydrophobicContact CZ-CG 4.18Å; E50-R121 VanDerWaalsContact CD-CZ 3.45Å; E50-R121 IonicContact OE1-CZ 3.29Å; E50-R121 VanDerWaalsContact OE1-CZ 3.28Å; E50-R121 IonicContact OE1-NH1 2.67Å; E50-R121 PolarHBondContact OE1-NH1 2.99Å; E50-R121 IonicContact OE1-NH2 2.86Å; E50-R121 PolarHBondContact OE1-NH2 3.36Å; E50-R121 IonicContact OE2-CZ 3.19Å; E50-R121 IonicContact OE2-NH1 3.83Å; E50-R121 PolarHBondContact OE2-NH1 2.87Å; E50-R121 IonicContact OE2-NH2 2.63Å; E50-R121 PolarHBondContact OE2-NH2 2.84Å; L53-R121 HydrophobicContact CD2-CB 4.23Å; V117-R121 HydrophobicContact CG1-CG 4.45Å; V117-R121 WeakPolarHBondContact O-CG 3.42Å; V117-R121 PolarHBondContact O-N 2.88Å; R121-E124 WeakPolarHBondContact CD-OE2 3.31Å; R121-E124 IonicContact NE-OE2 2.72Å; R121-A125 WeakPolarHBondContact O-CB 3.37Å; R121-A125 PolarHBondContact O-N 2.84Å; R121-A125 VanDerWaalsContact O-N 3.12Å
122	R	88.7	Confident	74.2	Confident	58 Å²	58	74.6 Å²	74.6	22%	0.219	38%	0.384	C	S	.	.	H	α-helix	trans	-58.9	-48.9	169	179.9	-161.7	68.8	-178.1	0.4	110.9	I77 A80 L118 Q119 T120 E124 A125 V126	I77-R122 HydrophobicContact CG2-CB 3.83Å; I77-R122 VanDerWaalsContact O-CG 3.27Å; I77-R122 WeakPolarHBondContact O-CG 3.37Å; A80-R122 WeakPolarHBondContact O-CD 3.46Å; A80-R122 PolarHBondContact O-NH1 2.83Å; L118-R122 WeakPolarHBondContact O-CB 3.48Å; L118-R122 PolarHBondContact O-N 3.44Å; Q119-R122 PolarHBondContact O-N 3.21Å; T120-R122 PolarHBondContact O-N 2.89Å; R122-E124 PolarHBondContact O-N 2.87Å; R122-A125 PolarHBondContact O-N 3.44Å; R122-V126 HydrophobicContact CG-CG2 4.44Å; R122-V126 WeakPolarHBondContact O-CG2 3.42Å; R122-V126 PolarHBondContact O-N 3.46Å
123	N	81.4	Confident	71.9	Confident	69 Å²	69	77.5 Å²	77.5	37%	0.369	40%	0.4	S	S	.	.	H	α-helix	trans	-63.8	-41.9	-175.6	-66.8	-16.6	0	0	0	111.6	Q119 T120 A125 V126 Q127	Q119-N123 WeakPolarHBondContact O-CB 3.29Å; Q119-N123 PolarHBondContact O-N 3.13Å; Q119-N123 PolarHBondContact O-ND2 2.84Å; Q119-N123 PolarHBondContact O-OD1 2.69Å; T120-N123 WeakPolarHBondContact O-CB 3.41Å; T120-N123 PolarHBondContact O-N 2.91Å; T120-N123 VanDerWaalsContact O-N 3.09Å; N123-A125 VanDerWaalsContact C-N 3.35Å; N123-A125 PolarHBondContact O-N 2.86Å; N123-V126 PolarHBondContact O-N 2.96Å; N123-Q127 WeakPolarHBondContact O-CG 3.39Å; N123-Q127 PolarHBondContact O-N 3.35Å
124	E	78.5	Confident	69.3	Low	96 Å²	96	77.5 Å²	77.5	45%	0.449	41%	0.41	S	S	.	.	H	α-helix	trans	-58.5	-46.2	174	-72.3	171.2	177.5	0	0	111.4	T120 R121 R122 V126 Q127 T128	T120-E124 WeakPolarHBondContact O-CG 3.43Å; T120-E124 PolarHBondContact O-N 3.18Å; R121-E124 WeakPolarHBondContact CD-OE2 3.31Å; R121-E124 IonicContact NE-OE2 2.72Å; R122-E124 PolarHBondContact O-N 2.87Å; E124-V126 VanDerWaalsContact C-N 3.33Å; E124-V126 PolarHBondContact O-N 2.82Å; E124-Q127 PolarHBondContact O-N 2.75Å; E124-Q127 VanDerWaalsContact O-N 3.15Å; E124-T128 PolarHBondContact O-N 3.37Å; E124-T128 PolarHBondContact O-OG1 3.49Å
125	A	73.7	Confident	66.4	Low	7 Å²	7	78.4 Å²	78.4	6%	0.058	43%	0.429	C	S	.	.	H	α-helix	trans	-63.1	-37.7	179.3	0	0	0	0	0	113.5	L53 H78 R121 R122 N123 T128 S129	L53-A125 HydrophobicContact CD1-CB 3.24Å; L53-A125 HydrophobicContact CD2-CB 4.18Å; L53-A125 HydrophobicContact CG-CB 4.35Å; H78-A125 WeakPolarHBondContact ND1-CB 3.42Å; R121-A125 WeakPolarHBondContact O-CB 3.37Å; R121-A125 PolarHBondContact O-N 2.84Å; R121-A125 VanDerWaalsContact O-N 3.12Å; R122-A125 PolarHBondContact O-N 3.44Å; N123-A125 VanDerWaalsContact C-N 3.35Å; N123-A125 PolarHBondContact O-N 2.86Å; A125-T128 WeakPolarHBondContact CA-OG1 3.44Å; A125-T128 PolarHBondContact O-OG1 2.79Å; A125-S129 PolarHBondContact O-N 2.93Å; A125-S129 PolarHBondContact O-OG 3.4Å
126	V	69.6	Low	64	Low	46 Å²	46	83.3 Å²	83.3	28%	0.279	46%	0.461	S	S	.	.	H	α-helix	trans	-68.6	-35.6	175.5	173.2	0	0	0	0	111.1	R122 N123 E124 S129 E130	R122-V126 HydrophobicContact CG-CG2 4.44Å; R122-V126 WeakPolarHBondContact O-CG2 3.42Å; R122-V126 PolarHBondContact O-N 3.46Å; N123-V126 PolarHBondContact O-N 2.96Å; E124-V126 VanDerWaalsContact C-N 3.33Å; E124-V126 PolarHBondContact O-N 2.82Å; V126-S129 PolarHBondContact O-OG 2.84Å; V126-S129 VanDerWaalsContact O-OG 3.05Å; V126-E130 PolarHBondContact O-N 3.36Å
127	Q	63.2	Low	61.4	Low	136 Å²	136	85.4 Å²	85.4	64%	0.636	48%	0.477	S	S	*	.	H	α-helix	trans	-69.9	-39.4	175.7	-72.7	179.5	4.7	0	0	112.2	N123 E124 S129 E130	N123-Q127 WeakPolarHBondContact O-CG 3.39Å; N123-Q127 PolarHBondContact O-N 3.35Å; E124-Q127 PolarHBondContact O-N 2.75Å; E124-Q127 VanDerWaalsContact O-N 3.15Å; Q127-S129 VanDerWaalsContact C-N 3.34Å; Q127-S129 PolarHBondContact O-N 3.36Å; Q127-E130 PolarHBondContact O-N 3.12Å
128	T	64.5	Low	58.7	Low	87 Å²	87	89.2 Å²	89.2	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-31.7	177.3	46.3	0	0	0	0	113.4	E124 A125 E130 S131	E124-T128 PolarHBondContact O-N 3.37Å; E124-T128 PolarHBondContact O-OG1 3.49Å; A125-T128 WeakPolarHBondContact CA-OG1 3.44Å; A125-T128 PolarHBondContact O-OG1 2.79Å; T128-E130 VanDerWaalsContact C-N 3.29Å; T128-E130 PolarHBondContact O-N 3.31Å; T128-S131 PolarHBondContact O-N 2.8Å; T128-S131 PolarHBondContact O-OG 2.8Å
129	S	54	Low	55.9	Low	46 Å²	46	97.7 Å²	97.7	32%	0.322	54%	0.541	S	S	.	.	H	α-helix	trans	-76.2	-17.4	177.5	61.6	0	0	0	0	113.3	A125 V126 Q127 N133	A125-S129 PolarHBondContact O-N 2.93Å; A125-S129 PolarHBondContact O-OG 3.4Å; V126-S129 PolarHBondContact O-OG 2.84Å; V126-S129 VanDerWaalsContact O-OG 3.05Å; Q127-S129 VanDerWaalsContact C-N 3.34Å; Q127-S129 PolarHBondContact O-N 3.36Å; S129-N133 PolarHBondContact O-ND2 2.97Å
130	E	42.5	Very low	53.1	Low	141 Å²	141	98.6 Å²	98.6	66%	0.659	55%	0.554	S	S	*	*	H	α-helix	trans	-78.3	-23	172.9	-74.5	-176	172	0	0	112.9	V126 Q127 T128	V126-E130 PolarHBondContact O-N 3.36Å; Q127-E130 PolarHBondContact O-N 3.12Å; T128-E130 VanDerWaalsContact C-N 3.29Å; T128-E130 PolarHBondContact O-N 3.31Å
131	S	41.4	Very low	50.4	Low	90 Å²	90	102.9 Å²	102.9	63%	0.629	58%	0.575	S	S	*	*	H	α-helix	trans	-83	-24	179.7	50.5	0	0	0	0	115.5	T128	T128-S131 PolarHBondContact O-N 2.8Å; T128-S131 PolarHBondContact O-OG 2.8Å
132	D	37.2	Very low	47.9	Very low	138 Å²	138	105 Å²	105	74%	0.738	60%	0.595	S	S	*	*	S	Bend	trans	-101.2	7.4	-169.5	-81	-12.5	0	0	0	115.9	S134	D132-S134 PolarHBondContact O-N 3.41Å
133	N	33.6	Very low	45.2	Very low	143 Å²	143	108.1 Å²	108.1	77%	0.765	62%	0.616	S	S	*	*			trans	-94.6	75.5	-179.3	-77.4	-46.3	0	0	0	113.1	S129	S129-N133 PolarHBondContact O-ND2 2.97Å
134	S	29.4	Very low	42.9	Very low	116 Å²	116	113.5 Å²	113.5	81%	0.811	63%	0.633	S	S	*	*			trans	-114.7	73.4	156.7	69.2	0	0	0	0	110.7	D132	D132-S134 PolarHBondContact O-N 3.41Å
135	S	30.3	Very low	40.6	Very low	106 Å²	106	116.3 Å²	116.3	74%	0.741	64%	0.643	S	S	*	*			trans	-160.4	119.9	156.7	-167.7	0	0	0	0	109.7
136	P	37.6	Very low	38.5	Very low	110 Å²	110	121 Å²	121	71%	0.714	67%	0.667	S	S	*	*			trans	-90.9	119.1	175.6	33	-24.6	0	0	0	108.8
137	N	30.5	Very low	36.7	Very low	166 Å²	166	127.4 Å²	127.4	89%	0.888	69%	0.691	S	S	*	*			trans	156.7	86.5	151.5	-80.6	-15.8	0	0	0	108.5
138	D	29.3	Very low	35.1	Very low	135 Å²	135	129 Å²	129	72%	0.722	69%	0.692	S	S	*	*			trans	-158.8	110.1	146.1	-140.7	-13	0	0	0	110.1	S140	D138-S140 VanDerWaalsContact C-N 3.25Å; D138-S140 PolarHBondContact O-N 2.8Å; D138-S140 VanDerWaalsContact O-N 3.07Å
139	D	32.9	Very low	33.5	Very low	179 Å²	179	131.5 Å²	131.5	96%	0.957	70%	0.697	S	S	*	*			trans	-84.6	50.8	-172.3	-89	-26.4	0	0	0	112.4
140	S	28.1	Very low	32.6	Very low	87 Å²	87	135.2 Å²	135.2	61%	0.608	71%	0.713	S	S	*	*			trans	-132.5	54.4	171.3	67	0	0	0	0	112.9	D138 T142	D138-S140 VanDerWaalsContact C-N 3.25Å; D138-S140 PolarHBondContact O-N 2.8Å; D138-S140 VanDerWaalsContact O-N 3.07Å; S140-T142 PolarHBondContact O-N 3.31Å
141	L	28.2	Very low	32.1	Very low	138 Å²	138	132.5 Å²	132.5	72%	0.723	71%	0.71	S	S	*	*			trans	-94.5	90.2	174	-100.2	120.6	0	0	0	111.8	K145	L141-K145 HydrophobicContact CD2-CD 4.17Å
142	T	32	Very low	31.4	Very low	110 Å²	110	134.1 Å²	134.1	68%	0.675	71%	0.711	S	S	*	*			trans	-61.1	145.1	175	-14.9	0	0	0	0	113.1	S140 Y144	S140-T142 PolarHBondContact O-N 3.31Å; T142-Y144 PolarHBondContact O-N 2.75Å
143	D	32.2	Very low	31.2	Very low	124 Å²	124	135 Å²	135	66%	0.663	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-5.6	-15.4	173.3	-70	-33.8	0	0	0	123.3	K145 L146	D143-K145 PolarHBondContact O-N 3.45Å; D143-L146 PolarHBondContact O-N 3.34Å
144	Y	31.2	Very low	31	Very low	183 Å²	183	137.3 Å²	137.3	72%	0.718	72%	0.716	S	S	*	*	H	α-helix	trans	-68.8	-30.2	-175.7	-94.5	-85.5	0	0	0	114.5	T142	T142-Y144 PolarHBondContact O-N 2.75Å
145	K	30.3	Very low	30.9	Very low	154 Å²	154	140.2 Å²	140.2	67%	0.67	72%	0.719	S	S	*	*	H	α-helix	trans	-74.9	-27.6	175	-83.5	-174.8	178.5	175.5	0	113	L141 D143 F147 R148 Q149	L141-K145 HydrophobicContact CD2-CD 4.17Å; D143-K145 PolarHBondContact O-N 3.45Å; K145-F147 VanDerWaalsContact C-N 3.31Å; K145-F147 PolarHBondContact O-N 3.49Å; K145-R148 PolarHBondContact O-N 3.3Å; K145-Q149 PolarHBondContact O-N 2.52Å
146	L	30.7	Very low	30.6	Very low	107 Å²	107	143.4 Å²	143.4	56%	0.56	72%	0.722	S	S	*	*	H	α-helix	trans	-69	-31.6	179.7	-160.7	71.5	0	0	0	111.6	D143	D143-L146 PolarHBondContact O-N 3.34Å
147	F	32.1	Very low	29.9	Very low	180 Å²	180	145.9 Å²	145.9	79%	0.789	73%	0.726	S	S	*	*	H	α-helix	trans	-71.8	-28.6	176.1	-115.8	-84.8	0	0	0	113.7	K145	K145-F147 VanDerWaalsContact C-N 3.31Å; K145-F147 PolarHBondContact O-N 3.49Å
148	R	29.6	Very low	29.7	Very low	169 Å²	169	143.1 Å²	143.1	64%	0.638	72%	0.72	S	S	*	*	H	α-helix	trans	-81.3	-36	176.9	-120.9	-169.7	-165.5	-166.9	7.4	113.1	K145 N150 S151 L152	K145-R148 PolarHBondContact O-N 3.3Å; R148-N150 PolarHBondContact O-N 3.36Å; R148-S151 PolarHBondContact O-N 2.78Å; R148-S151 VanDerWaalsContact O-N 3.14Å; R148-L152 PolarHBondContact O-N 3.33Å
149	Q	31.1	Very low	29.4	Very low	139 Å²	139	144.2 Å²	144.2	65%	0.65	72%	0.724	S	S	*	*	H	α-helix	trans	-60.5	-32.4	177.3	-94.1	-175.1	-18.7	0	0	112.3	K145 S151 M153	K145-Q149 PolarHBondContact O-N 2.52Å; Q149-S151 VanDerWaalsContact C-N 3.34Å; Q149-S151 PolarHBondContact O-N 3.11Å; Q149-M153 PolarHBondContact O-N 2.88Å
150	N	34.5	Very low	29.1	Very low	124 Å²	124	141.6 Å²	141.6	66%	0.663	72%	0.717	S	S	*	*	H	α-helix	trans	-73.9	-17.5	178.1	-77.8	-24.5	0	0	0	114.8	R148	R148-N150 PolarHBondContact O-N 3.36Å
151	S	31.1	Very low	28.8	Very low	84 Å²	84	143.9 Å²	143.9	59%	0.587	73%	0.727	S	S	*	*	H	α-helix	trans	-91.8	-30.1	175.7	89.3	0	0	0	0	113.5	R148 Q149	R148-S151 PolarHBondContact O-N 2.78Å; R148-S151 VanDerWaalsContact O-N 3.14Å; Q149-S151 VanDerWaalsContact C-N 3.34Å; Q149-S151 PolarHBondContact O-N 3.11Å
152	L	28.1	Very low	28.5	Very low	125 Å²	125	149.4 Å²	149.4	65%	0.654	74%	0.739	S	S	*	*	H	α-helix	trans	-85.8	-24.4	-178.1	-95.2	154.1	0	0	0	114.4	R148 K154 M155	R148-L152 PolarHBondContact O-N 3.33Å; L152-K154 PolarHBondContact O-N 2.88Å; L152-K154 VanDerWaalsContact O-N 3.09Å; L152-M155 PolarHBondContact O-N 3.43Å
153	M	31.6	Very low	28.1	Very low	156 Å²	156	148.7 Å²	148.7	77%	0.768	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-6	176.5	-120	-174.8	177.9	0	0	114.1	Q149	Q149-M153 PolarHBondContact O-N 2.88Å
154	K	30.4	Very low	27.6	Very low	191 Å²	191	148 Å²	148	83%	0.83	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	1.6	176.5	-89.3	-176.5	176.1	179	0	115.8	L152	L152-K154 PolarHBondContact O-N 2.88Å; L152-K154 VanDerWaalsContact O-N 3.09Å
155	M	26.9	Very low	27.4	Very low	178 Å²	178	145.4 Å²	145.4	88%	0.877	75%	0.754	S	S	*	*	S	Bend	trans	-121.2	11.6	179.6	-97.7	-167.4	155	0	0	117	L152	L152-M155 PolarHBondContact O-N 3.43Å
156	Q	24.6	Very low	27	Very low	173 Å²	173	146.1 Å²	146.1	81%	0.808	76%	0.763	S	S	*	*			trans	-136.2	79.9	169	-80.3	179.7	-33.6	0	0	111.3
157	M	23	Very low	26.6	Very low	161 Å²	161	148.6 Å²	148.6	79%	0.793	78%	0.776	S	S	*	*			trans	-130.2	99.7	157.7	-78.9	-66	157.1	0	0	108.5
158	S	26	Very low	26.2	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	78%	0.776	S	S	*	*			trans	-58.1	128.9	167.7	42.9	0	0	0	0	110.6	P160	S158-P160 VanDerWaalsContact O-CD 3.24Å; S158-P160 WeakPolarHBondContact O-CD 3.34Å
159	I	23.4	Very low	25.8	Very low	157 Å²	157	141.9 Å²	141.9	81%	0.805	78%	0.777	S	S	*	*			trans	-58.4	111.9	-178.5	-59.1	162.5	0	0	0	110.4	T161	I159-T161 PolarHBondContact O-N 3.47Å
160	P	25	Very low	25.6	Very low	124 Å²	124	142.4 Å²	142.4	81%	0.805	78%	0.784	S	S	*	*			trans	-83.2	115.6	176	-1.2	19.7	0	0	0	109.8	S158 R162	S158-P160 VanDerWaalsContact O-CD 3.24Å; S158-P160 WeakPolarHBondContact O-CD 3.34Å; P160-R162 PolarHBondContact O-N 3.1Å
161	T	23.8	Very low	24.9	Very low	136 Å²	136	140.8 Å²	140.8	83%	0.834	78%	0.783	S	S	*	*			trans	-80.4	114.9	175.2	-7.6	0	0	0	0	109.3	I159 A163	I159-T161 PolarHBondContact O-N 3.47Å; T161-A163 PolarHBondContact O-N 2.76Å
162	R	21.1	Very low	24.6	Very low	254 Å²	254	143 Å²	143	96%	0.958	79%	0.788	S	S	*	*			trans	-63.8	109.8	178.5	-173.1	177.9	-179.8	179.2	0.1	110.6	P160	P160-R162 PolarHBondContact O-N 3.1Å
163	A	23.5	Very low	24.3	Very low	94 Å²	94	144.9 Å²	144.9	78%	0.777	79%	0.794	S	S	*	*			trans	-118.8	140.2	167.4	0	0	0	0	0	109.9	T161	T161-A163 PolarHBondContact O-N 2.76Å
164	S	22.1	Very low	23.8	Very low	111 Å²	111	142.1 Å²	142.1	78%	0.776	79%	0.79	S	S	*	*			trans	-68	150.4	-163.2	-24.4	0	0	0	0	114.6
165	P	26.5	Very low	23.4	Very low	128 Å²	128	137.7 Å²	137.7	83%	0.831	78%	0.782	S	S	*	*			trans	-89.2	132.1	-176.4	34	-28.8	0	0	0	111.9
166	I	22.2	Very low	23.2	Very low	168 Å²	168	139.7 Å²	139.7	86%	0.862	79%	0.787	S	S	*	*			trans	-115.4	134.2	167.8	-63.9	175	0	0	0	108.1
167	I	22.1	Very low	23.1	Very low	159 Å²	159	138.1 Å²	138.1	82%	0.815	78%	0.784	S	S	*	*			trans	-60.6	142.2	-176.2	-64	151.6	0	0	0	113.1
168	S	23.5	Very low	23.1	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	78%	0.777	S	S	*	*			trans	-170.2	127.6	133.9	54.4	0	0	0	0	111.8
169	S	20.9	Very low	22.9	Very low	95 Å²	95	139.2 Å²	139.2	66%	0.664	78%	0.784	S	S	*	*			trans	-57.5	150.2	162.7	53.1	0	0	0	0	112
170	D	26.6	Very low	22.8	Very low	150 Å²	150	134.8 Å²	134.8	80%	0.802	78%	0.778	S	S	*	*				-179.9	140.8	113.8	-87.4	-5.8	0	0	0	112.1
171	S	21.5	Very low	22.8	Very low	91 Å²	91	134.4 Å²	134.4	64%	0.636	78%	0.778	S	S	*	*			trans	-60.8	144.8	173.5	50.5	0	0	0	0	114.1
172	N	23.7	Very low	22.6	Very low	131 Å²	131	135.9 Å²	135.9	70%	0.701	78%	0.78	S	S	*	*				163.7	126.6	114.5	-84.9	-21.5	0	0	0	113.3
173	E	22.3	Very low	22.7	Very low	164 Å²	164	134.4 Å²	134.4	77%	0.766	77%	0.774	S	S	*	*			trans	60.1	120.1	130.2	-63.7	-171.2	149.8	0	0	122
174	S	21.6	Very low	22.7	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	77%	0.774	S	S	*	*				83.6	107.4	123.8	75.3	0	0	0	0	118.7
175	S	21.1	Very low	22.6	Very low	97 Å²	97	140.4 Å²	140.4	68%	0.678	78%	0.777	S	S	*	*			trans	44.1	105.3	131.2	62	0	0	0	0	117.6
176	F	21.9	Very low	22.5	Very low	221 Å²	221	142.3 Å²	142.3	97%	0.969	77%	0.772	S	S	*	*			trans	-146.3	128.7	134.6	-103.7	-76.3	0	0	0	111.9
177	N	22.5	Very low	22.6	Very low	140 Å²	140	140.2 Å²	140.2	75%	0.749	77%	0.772	S	S	*	*			trans	-85.4	159.7	-177.9	-133.3	-8.2	0	0	0	110.4
178	N	23.4	Very low	22.7	Very low	123 Å²	123	137.9 Å²	137.9	66%	0.658	77%	0.77	S	S	*	*			trans	77.2	100.8	155.8	-68.4	-20.7	0	0	0	120
179	N	22.7	Very low	22.8	Very low	169 Å²	169	137.5 Å²	137.5	90%	0.904	77%	0.768	S	S	*	*				41	85.8	111.3	-67.9	-13.7	0	0	0	116.6
180	G	21.8	Very low	23.1	Very low	65 Å²	65	141.6 Å²	141.6	67%	0.67	78%	0.776	S	S	*	*			trans	-145.1	102.5	166.6	0	0	0	0	0	110.5	L182	G180-L182 PolarHBondContact O-N 3.46Å
181	S	23.4	Very low	23.2	Very low	116 Å²	116	142.8 Å²	142.8	81%	0.811	78%	0.777	S	S	*	*			trans	-32.1	124.6	166.5	177.1	0	0	0	0	114.1
182	L	21.5	Very low	23.6	Very low	166 Å²	166	145.2 Å²	145.2	87%	0.869	78%	0.782	S	S	*	*			trans	-134.4	85.9	161.6	-101	131.8	0	0	0	110.7	G180	G180-L182 PolarHBondContact O-N 3.46Å
183	R	22.1	Very low	23.8	Very low	223 Å²	223	145.6 Å²	145.6	84%	0.842	78%	0.784	S	S	*	*			trans	10.7	111.2	135.7	-89.7	175.8	166	174.6	-3.2	116.3
184	S	23	Very low	24.1	Very low	112 Å²	112	143.8 Å²	143.8	78%	0.783	78%	0.779	S	S	*	*			trans	-24.3	125.5	141.8	50.9	0	0	0	0	115.3
185	R	20.9	Very low	24.6	Very low	219 Å²	219	146.9 Å²	146.9	83%	0.826	78%	0.78	S	S	*	*			trans	-144.3	111.1	148.9	-107.5	-173.2	171.6	166.7	-2.1	111.3
186	K	24.2	Very low	25	Very low	169 Å²	169	149 Å²	149	74%	0.735	78%	0.783	S	S	*	*			trans	79	84.8	139.6	-62.2	-179.3	176.7	-170.1	0	118.1
187	S	24.1	Very low	25.3	Very low	123 Å²	123	144.7 Å²	144.7	86%	0.86	77%	0.769	S	S	*	*			trans	-79.7	111.6	139.7	47.3	0	0	0	0	109.3
188	S	24.3	Very low	25.7	Very low	111 Å²	111	147.3 Å²	147.3	78%	0.776	77%	0.774	S	S	*	*			trans	-122.7	80.3	171.4	58.2	0	0	0	0	109.1
189	S	25.6	Very low	25.9	Very low	105 Å²	105	149.2 Å²	149.2	73%	0.734	78%	0.779	S	S	*	*			trans	-155.4	26.3	171.8	52.8	0	0	0	0	113.8
190	H	27.4	Very low	26	Very low	181 Å²	181	149.4 Å²	149.4	84%	0.838	78%	0.779	S	S	*	*			trans	-119.3	24.4	178.4	-87.7	4.4	0	0	0	115.5
191	Q	29	Very low	26	Very low	175 Å²	175	150.9 Å²	150.9	82%	0.818	78%	0.779	S	S	*	*	S	Bend	trans	-107.8	4.1	176.4	-79.7	-169.6	-11.5	0	0	116.6
192	N	29.6	Very low	26	Very low	142 Å²	142	152.2 Å²	152.2	76%	0.759	78%	0.775	S	S	*	*	S	Bend	trans	-105.4	-5.5	177.4	-84.5	-8.4	0	0	0	116.1
193	L	26.9	Very low	26.2	Very low	138 Å²	138	151.2 Å²	151.2	72%	0.723	77%	0.771	S	S	*	*	S	Bend	trans	-87.8	-31	176.1	-145.7	83	0	0	0	113.1	K195 L196	L193-K195 VanDerWaalsContact C-N 3.3Å; L193-K195 PolarHBondContact O-N 3.06Å; L193-L196 PolarHBondContact O-N 2.85Å
194	N	30.3	Very low	26.3	Very low	126 Å²	126	149.5 Å²	149.5	67%	0.674	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-2.3	-179.6	-79.4	-10.2	0	0	0	114.8
195	K	32.1	Very low	26.1	Very low	163 Å²	163	152.3 Å²	152.3	71%	0.709	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-16.7	169.9	-94.6	-175.7	175.1	179.8	0	113.7	L193	L193-K195 VanDerWaalsContact C-N 3.3Å; L193-K195 PolarHBondContact O-N 3.06Å
196	L	27.6	Very low	26.2	Very low	142 Å²	142	147.8 Å²	147.8	74%	0.743	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-21.8	179.7	-130.4	92.3	0	0	0	113.7	L193	L193-L196 PolarHBondContact O-N 2.85Å
197	I	29.1	Very low	26.2	Very low	130 Å²	130	147.9 Å²	147.9	67%	0.667	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-85.3	-15.2	-177.2	-64.3	177.1	0	0	0	112.7
198	K	30.5	Very low	26.1	Very low	195 Å²	195	150.4 Å²	150.4	85%	0.848	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-90.4	8.1	177.8	-98	-173.1	177.8	-176.3	0	115.5
199	Q	28.6	Very low	26	Very low	163 Å²	163	153.2 Å²	153.2	76%	0.762	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-121.7	17.2	-174.8	-133.6	167.3	-0.9	0	0	115.1
200	L	23.9	Very low	25.8	Very low	174 Å²	174	154 Å²	154	91%	0.911	78%	0.78	S	S	*	*	S	Bend	trans	-135	42	172.2	-72.5	170.5	0	0	0	111.8
201	S	22.1	Very low	25.5	Very low	95 Å²	95	155.7 Å²	155.7	66%	0.664	78%	0.781	S	S	*	*			trans	-124.9	137.4	164.1	-177	0	0	0	0	107.6
202	I	23.9	Very low	25.3	Very low	145 Å²	145	155 Å²	155	74%	0.744	78%	0.782	S	S	*	*			trans	89.2	89.6	177.4	-48	161.9	0	0	0	112.9
203	D	24.6	Very low	24.9	Very low	144 Å²	144	154.2 Å²	154.2	77%	0.77	78%	0.779	S	S	*	*				-174.9	136.4	109.8	-96.5	-30.6	0	0	0	113.3
204	Q	23.7	Very low	24.8	Very low	187 Å²	187	155 Å²	155	87%	0.874	78%	0.784	S	S	*	*			trans	84.5	81.8	159.8	-62.2	178.9	4.6	0	0	119
205	M	19.4	Very low	24.4	Very low	171 Å²	171	157.5 Å²	157.5	84%	0.842	79%	0.791	S	S	*	*			trans	-73.9	157.1	147.2	-67.5	-179.3	78	0	0	111.2
206	N	23.3	Very low	24	Very low	125 Å²	125	157.3 Å²	157.3	67%	0.668	80%	0.796	S	S	*	*			trans	92.1	97.4	164.5	-61.1	-12.9	0	0	0	116.7
207	D	23.7	Very low	23.7	Very low	171 Å²	171	157.5 Å²	157.5	91%	0.914	80%	0.797	S	S	*	*				-152.5	111.3	122.7	-94.1	-28.7	0	0	0	110.5
208	H	22.1	Very low	23.4	Very low	176 Å²	176	158.6 Å²	158.6	82%	0.815	80%	0.803	S	S	*	*			trans	-73.6	119.1	172	-81.1	-89.6	0	0	0	109.8
209	Q	21.6	Very low	23	Very low	170 Å²	170	156.2 Å²	156.2	79%	0.794	80%	0.8	S	S	*	*			trans	-141.2	107.3	147.7	-76.3	-156.1	-10.9	0	0	111	Y211	Q209-Y211 PolarHBondContact O-N 3.47Å
210	S	22	Very low	22.7	Very low	121 Å²	121	156.5 Å²	156.5	85%	0.846	80%	0.801	S	S	*	*			trans	-57.1	112.7	169.1	52	0	0	0	0	111.1
211	Y	22.3	Very low	22.5	Very low	216 Å²	216	154.5 Å²	154.5	85%	0.847	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-91.5	118.4	169.6	-99.5	-90.9	0	0	0	110.2	Q209	Q209-Y211 PolarHBondContact O-N 3.47Å
212	N	23.3	Very low	22.5	Very low	160 Å²	160	155 Å²	155	86%	0.856	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-66.1	134.6	178.2	-102.2	-23.5	0	0	0	112.2	N214	N212-N214 PolarHBondContact O-N 3.3Å
213	N	21.8	Very low	22.4	Very low	127 Å²	127	155.4 Å²	155.4	68%	0.679	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-54.8	123.2	170.3	-75.3	-24.1	0	0	0	112.6
214	N	24.4	Very low	22.3	Very low	155 Å²	155	160 Å²	160	83%	0.829	81%	0.809	S	S	*	*			trans	-122.5	102.9	155.5	-88.3	-23.7	0	0	0	108.3	N212 L216	N212-N214 PolarHBondContact O-N 3.3Å; N214-L216 PolarHBondContact O-N 2.99Å
215	H	23.4	Very low	22.1	Very low	177 Å²	177	159.2 Å²	159.2	82%	0.819	81%	0.809	S	S	*	*			trans	-55	116.1	170.7	-98.5	-92.3	0	0	0	110.8
216	L	23.1	Very low	22.2	Very low	159 Å²	159	155.8 Å²	155.8	83%	0.832	80%	0.802	S	S	*	*			trans	-106.6	102.1	163.6	-97.6	142.6	0	0	0	107.9	N214 I218	N214-L216 PolarHBondContact O-N 2.99Å; L216-I218 PolarHBondContact O-N 2.92Å
217	L	21.6	Very low	22.2	Very low	146 Å²	146	156 Å²	156	76%	0.764	81%	0.81	S	S	*	*			trans	-61.4	121	163.1	-106.7	86.2	0	0	0	108.2
218	I	23.1	Very low	22.2	Very low	154 Å²	154	154.6 Å²	154.6	79%	0.79	80%	0.801	S	S	*	*			trans	-94.6	101.2	173.4	-63.7	171.4	0	0	0	107	L216	L216-I218 PolarHBondContact O-N 2.92Å
219	D	20.2	Very low	22.2	Very low	144 Å²	144	153.8 Å²	153.8	77%	0.77	80%	0.803	S	S	*	*			trans	-84.1	137.7	165.6	-100.3	-29.5	0	0	0	110.5
220	H	22.2	Very low	22.3	Very low	169 Å²	169	154.2 Å²	154.2	78%	0.782	80%	0.804	S	S	*	*			trans	-59.2	133.1	-177.3	-71.3	-99.7	0	0	0	113.2
221	T	21.7	Very low	22.3	Very low	133 Å²	133	153.5 Å²	153.5	82%	0.816	80%	0.8	S	S	*	*			trans	179	133.5	130.7	27.5	0	0	0	0	112.1
222	S	21.5	Very low	22.4	Very low	104 Å²	104	151.9 Å²	151.9	73%	0.727	80%	0.802	S	S	*	*			trans	61.9	96.3	148.1	59	0	0	0	0	120.7
223	L	22.1	Very low	22.5	Very low	155 Å²	155	152 Å²	152	81%	0.812	80%	0.802	S	S	*	*			trans	-144.4	107.3	157.9	-75.3	174.4	0	0	0	112.2
224	W	20.9	Very low	22.5	Very low	240 Å²	240	152.6 Å²	152.6	91%	0.909	81%	0.811	S	S	*	*				79	109.7	106.6	-78.8	52.8	0	0	0	116.1
225	I	20.5	Very low	22.5	Very low	170 Å²	170	150.8 Å²	150.8	87%	0.872	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-97.4	117.7	169.6	-63.1	171.8	0	0	0	108.1
226	S	20.6	Very low	22.4	Very low	100 Å²	100	148 Å²	148	70%	0.699	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-83.6	136.8	173.5	37.2	0	0	0	0	111.3
227	P	24.1	Very low	22.5	Very low	128 Å²	128	146.2 Å²	146.2	83%	0.831	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-80.5	140.8	177.5	-3.5	21.7	0	0	0	112
228	I	24.5	Very low	22.5	Very low	143 Å²	143	144.3 Å²	144.3	73%	0.733	81%	0.811	S	S	*	*			trans	-84.3	114.2	-177.5	-65.5	166.1	0	0	0	109.7	H230	I228-H230 PolarHBondContact O-N 3.1Å
229	D	21.9	Very low	22.4	Very low	158 Å²	158	141.6 Å²	141.6	85%	0.845	81%	0.805	S	S	*	*			trans	-72.9	109.9	171.5	-89.4	-32.9	0	0	0	110.8	S231	D229-S231 PolarHBondContact O-N 2.91Å
230	H	23.2	Very low	22.5	Very low	179 Å²	179	140.8 Å²	140.8	83%	0.829	81%	0.805	S	S	*	*			trans	-84.8	92.9	165.7	-78.2	-69.9	0	0	0	109.8	I228	I228-H230 PolarHBondContact O-N 3.1Å
231	S	22.7	Very low	22.5	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	80%	0.804	S	S	*	*			trans	-99	103.7	167.6	55.5	0	0	0	0	110.2	D229	D229-S231 PolarHBondContact O-N 2.91Å
232	M	23	Very low	22.5	Very low	181 Å²	181	137.2 Å²	137.2	89%	0.892	80%	0.8	S	S	*	*			trans	-99.8	106.2	163.1	-78.5	-140.6	159	0	0	108.9	T234	M232-T234 PolarHBondContact O-N 2.83Å
233	N	25.2	Very low	22.5	Very low	163 Å²	163	139.2 Å²	139.2	87%	0.872	81%	0.808	S	S	*	*			trans	-77	103.3	170.2	-92.6	-18	0	0	0	109.6
234	T	22.2	Very low	22.4	Very low	140 Å²	140	137.9 Å²	137.9	86%	0.859	81%	0.807	S	S	*	*			trans	-83	108.7	164.2	46.6	0	0	0	0	108.8	M232	M232-T234 PolarHBondContact O-N 2.83Å
235	S	24.2	Very low	22.5	Very low	116 Å²	116	134 Å²	134	81%	0.811	80%	0.804	S	S	*	*			trans	-90.1	114.1	169.3	35	0	0	0	0	109.3
236	S	21.4	Very low	22.5	Very low	120 Å²	120	135.9 Å²	135.9	84%	0.839	80%	0.801	S	S	*	*			trans	-51.3	130.4	168.1	50.8	0	0	0	0	112.3
237	S	24.9	Very low	22.5	Very low	121 Å²	121	137.7 Å²	137.7	85%	0.846	80%	0.803	S	S	*	*			trans	-146.5	138.1	148.4	56.5	0	0	0	0	110.9
238	S	22.2	Very low	22.4	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	81%	0.805	S	S	*	*			trans	-85.2	143.6	-162.7	46.2	0	0	0	0	113.3
239	S	20.9	Very low	22.3	Very low	96 Å²	96	141.2 Å²	141.2	67%	0.671	81%	0.812	S	S	*	*			trans	48.2	115.6	140.2	63.7	0	0	0	0	119.3
240	T	23.6	Very low	22.2	Very low	127 Å²	127	144 Å²	144	78%	0.779	81%	0.811	S	S	*	*				174.3	123.6	105	31.8	0	0	0	0	112
241	T	22	Very low	22.1	Very low	123 Å²	123	145.4 Å²	145.4	76%	0.755	81%	0.809	S	S	*	*			trans	41.5	108.9	144.1	55	0	0	0	0	121.7
242	S	20	Very low	22.1	Very low	105 Å²	105	146.4 Å²	146.4	73%	0.734	81%	0.805	S	S	*	*				48.6	106.5	128.8	65.2	0	0	0	0	119.7
243	T	22.7	Very low	21.9	Very low	145 Å²	145	142.9 Å²	142.9	89%	0.89	80%	0.798	S	S	*	*				-170.2	133.6	112.8	10.1	0	0	0	0	110.7
244	T	20.6	Very low	21.9	Very low	128 Å²	128	146 Å²	146	79%	0.785	80%	0.799	S	S	*	*			trans	-64.1	126.4	173.3	46.4	0	0	0	0	111.9
245	N	22.8	Very low	21.9	Very low	159 Å²	159	146.6 Å²	146.6	85%	0.85	80%	0.797	S	S	*	*				-171.6	138.2	121.6	-113.1	-26.6	0	0	0	112.2
246	Y	20	Very low	21.8	Very low	209 Å²	209	152.4 Å²	152.4	82%	0.82	80%	0.801	S	S	*	*			trans	-62.7	162	179.2	-92	-104.8	0	0	0	113.1
247	D	20.8	Very low	22	Very low	137 Å²	137	152.2 Å²	152.2	73%	0.733	80%	0.8	S	S	*	*			trans	98.6	118.6	153.2	-66.3	-22.3	0	0	0	119.9
248	L	22.3	Very low	21.9	Very low	166 Å²	166	153.4 Å²	153.4	87%	0.869	80%	0.797	S	S	*	*			trans	86.9	61.3	147.6	-64.4	157.1	0	0	0	118	R250	L248-R250 PolarHBondContact O-N 2.85Å
249	M	20.9	Very low	22	Very low	180 Å²	180	153.5 Å²	153.5	89%	0.887	80%	0.797	S	S	*	*			trans	-92.3	89	155.7	-92	-119.7	-93.4	0	0	112	L252	M249-L252 HydrophobicContact SD-CD1 4.38Å
250	R	20.6	Very low	22.2	Very low	215 Å²	215	160.2 Å²	160.2	81%	0.811	81%	0.81	S	S	*	*			trans	-107.6	125.7	151	-149.8	-174.5	-156.7	-171.7	7.7	106.7	L248	L248-R250 PolarHBondContact O-N 2.85Å
251	R	21.2	Very low	22.3	Very low	210 Å²	210	160.8 Å²	160.8	79%	0.792	81%	0.808	S	S	*	*			trans	89.2	103.3	164.1	-54.1	176.9	174.8	173.6	-1.8	118.1
252	L	21.7	Very low	22.7	Very low	127 Å²	127	158.8 Å²	158.8	67%	0.665	80%	0.799	S	S	*	*			trans	-141.1	99.6	144.4	-69.3	173.3	0	0	0	105.8	M249	M249-L252 HydrophobicContact SD-CD1 4.38Å
253	S	20.6	Very low	23.3	Very low	107 Å²	107	158.5 Å²	158.5	75%	0.748	79%	0.789	S	S	*	*				30.7	83.8	81.4	71	0	0	0	0	114.1
254	Y	24.6	Very low	23.7	Very low	230 Å²	230	158 Å²	158	90%	0.902	78%	0.78	S	S	*	*			trans	-90.2	119.1	164.2	-100	-86.6	0	0	0	110.5
255	N	22.1	Very low	24.2	Very low	152 Å²	152	158.1 Å²	158.1	81%	0.813	77%	0.774	S	S	*	*			trans	-76.7	155.8	173.9	-97.8	-39.8	0	0	0	112
256	R	21.8	Very low	24.5	Very low	238 Å²	238	157.5 Å²	157.5	90%	0.898	76%	0.764	S	S	*	*			trans	-45.3	144.6	171.9	-65.7	168.9	170.5	177.9	-3.8	115.1
257	S	25.1	Very low	25	Very low	115 Å²	115	154.3 Å²	154.3	80%	0.804	76%	0.756	S	S	*	*			trans	-156.7	104.9	141.9	54.5	0	0	0	0	112.1
258	N	23.4	Very low	25.4	Very low	147 Å²	147	154.4 Å²	154.4	79%	0.786	75%	0.752	S	S	*	*			trans	14	137.4	148.6	-64.8	-15	0	0	0	123.6
259	S	24.5	Very low	25.8	Very low	107 Å²	107	150.4 Å²	150.4	75%	0.748	73%	0.734	S	S	*	*			trans	54.9	101.3	143.5	73.5	0	0	0	0	119.5
260	Y	24.3	Very low	26.3	Very low	238 Å²	238	147 Å²	147	93%	0.933	72%	0.72	S	S	*	*			trans	-128	121.7	144.2	-91.7	-86.2	0	0	0	109.1
261	D	27	Very low	26.8	Very low	139 Å²	139	141.8 Å²	141.8	74%	0.743	71%	0.708	S	S	*	*			trans	-50.8	132.5	-176.7	-103.8	-42.1	0	0	0	113.3	D263	D261-D263 PolarHBondContact O-N 2.94Å; D261-D263 VanDerWaalsContact O-N 3.12Å
262	S	29.8	Very low	27.1	Very low	80 Å²	80	137.5 Å²	137.5	56%	0.559	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	9.4	-177.7	73.2	0	0	0	0	114.8
263	D	32.1	Very low	27.5	Very low	100 Å²	100	136.7 Å²	136.7	54%	0.535	70%	0.697	S	S	.	*	H	α-helix	trans	-91.5	-10.7	-171.3	-73.4	-15	0	0	0	114.2	D261	D261-D263 PolarHBondContact O-N 2.94Å; D261-D263 VanDerWaalsContact O-N 3.12Å
264	I	31.4	Very low	28	Very low	134 Å²	134	138 Å²	138	69%	0.687	69%	0.693	S	S	*	*	H	α-helix	trans	-79.8	-28.5	174	-61.6	177.2	0	0	0	111.6
265	I	31	Very low	28.2	Very low	131 Å²	131	132.8 Å²	132.8	67%	0.672	68%	0.68	S	S	*	*	H	α-helix	trans	-74.7	-29.2	178.5	-62.8	178	0	0	0	111.3	Q267 V269	I265-Q267 VanDerWaalsContact C-N 3.35Å; I265-Q267 PolarHBondContact O-N 2.86Å; I265-V269 WeakPolarHBondContact O-CG2 3.41Å
266	K	30.4	Very low	28.5	Very low	145 Å²	145	130.8 Å²	130.8	63%	0.63	67%	0.67	S	S	*	*	H	α-helix	trans	-72.6	-26	176.9	-78.5	-178.6	178.5	171.9	0	113.6
267	Q	29.6	Very low	28.9	Very low	142 Å²	142	126.4 Å²	126.4	66%	0.664	66%	0.664	S	S	*	*	H	α-helix	trans	-80.3	-33.4	179.8	-140.1	167.6	0.9	0	0	112.1	I265 V269 N270	I265-Q267 VanDerWaalsContact C-N 3.35Å; I265-Q267 PolarHBondContact O-N 2.86Å; Q267-V269 PolarHBondContact O-N 3.13Å; Q267-N270 PolarHBondContact O-N 3.4Å
268	H	28.2	Very low	29.1	Very low	140 Å²	140	129.6 Å²	129.6	65%	0.648	66%	0.663	S	S	*	*	H	α-helix	trans	-73.8	-21.5	176.9	-109.1	46.9	0	0	0	114.7
269	V	32.3	Very low	29.3	Very low	82 Å²	82	125.8 Å²	125.8	50%	0.497	65%	0.648	S	S	.	*	H	α-helix	trans	-79.1	-26.4	175.4	175.5	0	0	0	0	112	I265 Q267	I265-V269 WeakPolarHBondContact O-CG2 3.41Å; Q267-V269 PolarHBondContact O-N 3.13Å
270	N	30.9	Very low	29.5	Very low	108 Å²	108	127.2 Å²	127.2	58%	0.578	65%	0.646	S	S	*	*	H	α-helix	trans	-80.5	-28.4	178.2	-80.8	-11.6	0	0	0	113.7	Q267 L272 N273	Q267-N270 PolarHBondContact O-N 3.4Å; N270-L272 VanDerWaalsContact C-N 3.32Å; N270-L272 PolarHBondContact O-N 2.94Å; N270-N273 PolarHBondContact O-N 3.01Å
271	D	30	Very low	29.7	Very low	105 Å²	105	124.8 Å²	124.8	56%	0.561	64%	0.64	S	S	*	*	H	α-helix	trans	-74.5	-23.3	177.3	-73	-18.4	0	0	0	112.9
272	L	28.8	Very low	29.7	Very low	120 Å²	120	125.5 Å²	125.5	63%	0.628	64%	0.643	S	S	*	*	H	α-helix	trans	-79.3	-19.8	175.8	-80.2	164.6	0	0	0	113.7	N270	N270-L272 VanDerWaalsContact C-N 3.32Å; N270-L272 PolarHBondContact O-N 2.94Å
273	N	30.5	Very low	29.5	Very low	111 Å²	111	129 Å²	129	59%	0.594	66%	0.655	S	S	*	*	H	α-helix	trans	-86.6	-11.2	179	-81.6	-20.1	0	0	0	114.4	N270	N270-N273 PolarHBondContact O-N 3.01Å
274	I	31.2	Very low	29.2	Very low	133 Å²	133	129.1 Å²	129.1	68%	0.682	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-14.3	177.4	-63.7	177	0	0	0	112.4
275	I	28.6	Very low	29	Very low	122 Å²	122	132.2 Å²	132.2	63%	0.626	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-23.5	-178.5	-63.7	178.7	0	0	0	112.9	D277	I275-D277 PolarHBondContact O-N 2.91Å
276	N	28.3	Very low	28.7	Very low	110 Å²	110	130.4 Å²	130.4	59%	0.588	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-13.2	-176.5	-94.1	-3.9	0	0	0	115.8
277	D	29.4	Very low	28.4	Very low	145 Å²	145	131.3 Å²	131.3	78%	0.775	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-5.4	-175.4	-104.4	-8.9	0	0	0	115.6	I275	I275-D277 PolarHBondContact O-N 2.91Å
278	K	29.7	Very low	28.1	Very low	183 Å²	183	131.3 Å²	131.3	80%	0.796	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-14.1	178.4	-80.3	-173.7	177.8	176.6	0	115.5
279	S	27.6	Very low	27.9	Very low	67 Å²	67	136 Å²	136	47%	0.469	70%	0.701	S	S	.	*	S	Bend	trans	-89.8	-19.7	-179.1	38.6	0	0	0	0	114
280	I	27.8	Very low	27.5	Very low	136 Å²	136	139.1 Å²	139.1	70%	0.697	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-14.6	-176.9	-63.1	179.3	0	0	0	113.5
281	K	28.5	Very low	27.1	Very low	187 Å²	187	141 Å²	141	81%	0.813	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-4	179.6	-95.5	-179.1	179.9	172	0	116.6
282	L	27.4	Very low	26.7	Very low	155 Å²	155	143.1 Å²	143.1	81%	0.812	73%	0.734	S	S	*	*	S	Bend	trans	-102.8	-8.8	-178.3	-92	157.8	0	0	0	115.2
283	L	25.7	Very low	26.3	Very low	153 Å²	153	146.7 Å²	146.7	80%	0.801	75%	0.747	S	S	*	*	S	Bend	trans	-101.5	6.1	-177.5	-82.3	156.6	0	0	0	115
284	S	26.2	Very low	25.9	Very low	102 Å²	102	146.3 Å²	146.3	71%	0.713	75%	0.753	S	S	*	*	S	Bend	trans	-97.6	20.5	-179.3	76.5	0	0	0	0	115.3
285	K	26.8	Very low	25.4	Very low	200 Å²	200	145.7 Å²	145.7	87%	0.87	76%	0.761	S	S	*	*	S	Bend	trans	-132.8	14.7	-177.2	-97.2	-171.5	179.6	-178.7	0	118.2
286	S	24.4	Very low	25.1	Very low	92 Å²	92	145 Å²	145	64%	0.643	77%	0.767	S	S	*	*	S	Bend	trans	-144.7	75.6	175.9	55.6	0	0	0	0	112
287	N	24.1	Very low	24.7	Very low	164 Å²	164	145.8 Å²	145.8	88%	0.877	78%	0.781	S	S	*	*			trans	-155.7	36	164.2	-101.4	-12.1	0	0	0	113.5
288	N	23.6	Very low	24.4	Very low	143 Å²	143	144.2 Å²	144.2	77%	0.765	78%	0.781	S	S	*	*			trans	-113.3	78.2	169.3	-83.9	-17.1	0	0	0	110.4
289	Y	24.4	Very low	23.9	Very low	238 Å²	238	140.8 Å²	140.8	93%	0.933	78%	0.781	S	S	*	*			trans	-135.1	93.6	151.5	-84.9	-74.9	0	0	0	107.9
290	L	24	Very low	23.7	Very low	148 Å²	148	142.9 Å²	142.9	78%	0.775	80%	0.795	S	S	*	*			trans	-58.9	128.6	175.1	-91.7	100.8	0	0	0	111.4
291	I	21.6	Very low	23.4	Very low	148 Å²	148	143 Å²	143	76%	0.759	80%	0.797	S	S	*	*				19	103.9	119.8	-51.1	176.2	0	0	0	114.3
292	N	21.5	Very low	23.2	Very low	149 Å²	149	141.6 Å²	141.6	80%	0.797	80%	0.798	S	S	*	*			trans	-172	100.2	140.9	-96.6	-23.9	0	0	0	108.1
293	Q	21.9	Very low	23	Very low	194 Å²	194	142.4 Å²	142.4	91%	0.907	80%	0.795	S	S	*	*			trans	-163.3	101	143.5	-107.1	161.8	48.8	0	0	109.7	S295	Q293-S295 PolarHBondContact O-N 2.88Å
294	S	21.8	Very low	22.8	Very low	103 Å²	103	141.7 Å²	141.7	72%	0.72	79%	0.791	S	S	*	*			trans	-45.5	124	166.2	43.8	0	0	0	0	112.9	S296	S294-S296 PolarHBondContact O-N 3.39Å
295	S	20.6	Very low	22.6	Very low	120 Å²	120	147.1 Å²	147.1	84%	0.839	80%	0.797	S	S	*	*			trans	2.8	103.1	140.7	54	0	0	0	0	116.2	Q293	Q293-S295 PolarHBondContact O-N 2.88Å
296	S	21.8	Very low	22.4	Very low	109 Å²	109	145.2 Å²	145.2	76%	0.762	79%	0.791	S	S	*	*			trans	-126.7	111.3	152	55.4	0	0	0	0	108.8	S294	S294-S296 PolarHBondContact O-N 3.39Å
297	S	20.6	Very low	22.2	Very low	125 Å²	125	152.2 Å²	152.2	87%	0.874	80%	0.804	S	S	*	*			trans	-58.9	123	170.3	48.2	0	0	0	0	111.1
298	S	21.8	Very low	22.1	Very low	112 Å²	112	150.9 Å²	150.9	78%	0.783	80%	0.796	S	S	*	*			trans	-128.6	98.9	160.1	50	0	0	0	0	109.1
299	S	20.5	Very low	22	Very low	112 Å²	112	155.7 Å²	155.7	78%	0.783	80%	0.804	S	S	*	*			trans	-62.6	124.7	171	44.4	0	0	0	0	110.7
300	S	22.5	Very low	21.9	Very low	111 Å²	111	151.5 Å²	151.5	78%	0.776	80%	0.796	S	S	*	*			trans	-121	103.8	164.7	29.1	0	0	0	0	108.8	N302	S300-N302 PolarHBondContact O-N 2.61Å
301	N	21.9	Very low	21.8	Very low	139 Å²	139	150 Å²	150	74%	0.743	79%	0.787	S	S	*	*			trans	-62.7	102.6	179.9	-76.9	-44.7	0	0	0	112	K303	N301-K303 PolarHBondContact O-N 2.88Å
302	N	24.2	Very low	21.9	Very low	156 Å²	156	150.4 Å²	150.4	83%	0.834	79%	0.79	S	S	*	*			trans	-88.8	89.2	162.7	-82.9	-18.8	0	0	0	109.6	S300 I304	S300-N302 PolarHBondContact O-N 2.61Å; N302-I304 PolarHBondContact O-N 3.41Å; N302-I304 VanDerWaalsContact O-N 3.16Å
303	K	23.2	Very low	21.8	Very low	172 Å²	172	149.2 Å²	149.2	75%	0.748	78%	0.783	S	S	*	*			trans	-65.4	107.8	172.2	-79.3	-179.6	175.2	176.5	0	110.1	N301 Y305	N301-K303 PolarHBondContact O-N 2.88Å; K303-Y305 PolarHBondContact O-N 3.48Å
304	I	21.6	Very low	21.8	Very low	139 Å²	139	146 Å²	146	71%	0.713	78%	0.78	S	S	*	*			trans	-62.9	105.1	170.6	-63.5	163.2	0	0	0	108.7	N302 H306	N302-I304 PolarHBondContact O-N 3.41Å; N302-I304 VanDerWaalsContact O-N 3.16Å; I304-H306 PolarHBondContact O-N 2.71Å
305	Y	22.4	Very low	21.8	Very low	215 Å²	215	147.8 Å²	147.8	84%	0.843	78%	0.779	S	S	*	*			trans	-84.7	96.5	164.2	-90.2	-85.8	0	0	0	108.5	K303 R307	K303-Y305 PolarHBondContact O-N 3.48Å; Y305-R307 PolarHBondContact O-N 3.25Å
306	H	21.2	Very low	21.8	Very low	161 Å²	161	150.9 Å²	150.9	75%	0.745	78%	0.781	S	S	*	*			trans	-62.5	101	163.5	-84.5	-81.9	0	0	0	109.3	I304	I304-H306 PolarHBondContact O-N 2.71Å
307	R	20.6	Very low	21.9	Very low	238 Å²	238	153.5 Å²	153.5	90%	0.898	78%	0.781	S	S	*	*			trans	-114.6	92.9	161.1	-146.7	173.7	-171.2	155.2	1	107.5	Y305 R309	Y305-R307 PolarHBondContact O-N 3.25Å; R307-R309 PolarHBondContact O-N 2.82Å
308	N	23.1	Very low	22	Very low	136 Å²	136	153.7 Å²	153.7	73%	0.727	77%	0.768	S	S	*	*			trans	-50.5	108.5	173.6	-73.9	-20.5	0	0	0	110.4
309	R	20.7	Very low	22.1	Very low	244 Å²	244	153.2 Å²	153.2	92%	0.921	75%	0.753	S	S	*	*			trans	-126.3	91.1	151.7	-92.1	-172.7	175	178.5	-1.9	106.1	R307	R307-R309 PolarHBondContact O-N 2.82Å
310	I	23.3	Very low	22.3	Very low	150 Å²	150	154.1 Å²	154.1	77%	0.769	75%	0.749	S	S	*	*			trans	-64.7	132.2	172.1	-69.4	172.5	0	0	0	107.6	N312	I310-N312 PolarHBondContact O-N 3.3Å
311	M	21.6	Very low	22.6	Very low	117 Å²	117	154.9 Å²	154.9	58%	0.576	74%	0.74	S	S	*	*			trans	-64	116.1	176.5	-72.9	-102.1	-78.5	0	0	110.4	L313 F1268	M311-L313 VanDerWaalsContact C-N 3.27Å; M311-L313 PolarHBondContact O-N 2.93Å; M311-F1268 HydrophobicContact CE-CB 3.49Å; M311-F1268 VanDerWaalsContact CE-CB 3.49Å; M311-F1268 HydrophobicContact CE-CG 4.13Å
312	N	22.7	Very low	23	Very low	157 Å²	157	155.5 Å²	155.5	84%	0.84	74%	0.744	S	S	*	*			trans	-73.9	86	159.5	-73.6	-4.8	0	0	0	108.1	I310	I310-N312 PolarHBondContact O-N 3.3Å
313	L	20.1	Very low	23.1	Very low	124 Å²	124	156.2 Å²	156.2	65%	0.649	74%	0.736	S	S	*	*			trans	-64	140.6	144.3	-83.3	143.5	0	0	0	106.5	M311 I315	M311-L313 VanDerWaalsContact C-N 3.27Å; M311-L313 PolarHBondContact O-N 2.93Å; L313-I315 PolarHBondContact O-N 3.46Å
314	P	21.8	Very low	23.4	Very low	127 Å²	127	152.4 Å²	152.4	83%	0.825	73%	0.731	S	S	*	*			trans	-70.3	84	179	30.2	-31	0	0	0	107.8
315	I	21.4	Very low	23.9	Very low	140 Å²	140	152.3 Å²	152.3	72%	0.718	73%	0.73	S	S	*	*			trans	-72.4	123.6	160.8	-62.5	173.8	0	0	0	103.9	L313 E317	L313-I315 PolarHBondContact O-N 3.46Å; I315-E317 VanDerWaalsContact C-N 3.32Å; I315-E317 PolarHBondContact O-N 2.78Å
316	E	21.4	Very low	24.2	Very low	185 Å²	185	147.1 Å²	147.1	86%	0.864	72%	0.717	S	S	*	*			trans	-51.9	100.7	167.3	-66.4	176.6	157.2	0	0	107.2	E318	E316-E318 VanDerWaalsContact C-N 3.33Å; E316-E318 PolarHBondContact O-N 2.87Å
317	E	22.8	Very low	24.5	Very low	164 Å²	164	144.4 Å²	144.4	77%	0.766	71%	0.708	S	S	*	*			trans	-67.1	96.1	176.7	-74.4	-178	168.7	0	0	106.9	I315 E319	I315-E317 VanDerWaalsContact C-N 3.32Å; I315-E317 PolarHBondContact O-N 2.78Å; E317-E319 VanDerWaalsContact C-N 3.27Å; E317-E319 PolarHBondContact O-N 2.82Å
318	E	23.1	Very low	25.1	Very low	128 Å²	128	140.4 Å²	140.4	60%	0.598	70%	0.699	S	S	*	*			trans	-62.9	98.5	156.3	-74.6	-157.3	119.3	0	0	107.3	E316 N320 K1005	E316-E318 VanDerWaalsContact C-N 3.33Å; E316-E318 PolarHBondContact O-N 2.87Å; E318-N320 PolarHBondContact O-N 2.83Å; E318-K1005 IonicContact OE1-NZ 3.45Å; E318-K1005 PolarHBondContact OE1-NZ 3.24Å
319	E	24.2	Very low	25.6	Very low	102 Å²	102	141.7 Å²	141.7	48%	0.477	70%	0.699	S	S	.	*			trans	-50.8	100.5	172.4	-67.5	173.6	162.5	0	0	110.3	E317	E317-E319 VanDerWaalsContact C-N 3.27Å; E317-E319 PolarHBondContact O-N 2.82Å
320	N	24.9	Very low	26	Very low	131 Å²	131	134.5 Å²	134.5	70%	0.701	68%	0.678	S	S	*	*			trans	-100.9	89.8	165.1	-83	-40.7	0	0	0	107.4	E318 D322	E318-N320 PolarHBondContact O-N 2.83Å; N320-D322 PolarHBondContact O-N 2.83Å; N320-D322 VanDerWaalsContact O-N 3.11Å
321	E	28.3	Very low	26.2	Very low	127 Å²	127	131 Å²	131	59%	0.593	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-67.2	-2.2	-173.5	-77.2	-171.6	146.5	0	0	115.8	Y323 S324 Y1008	E321-Y323 PolarHBondContact O-N 2.74Å; E321-Y323 VanDerWaalsContact O-N 3.12Å; E321-S324 PolarHBondContact O-N 2.78Å; E321-Y1008 PolarHBondContact OE1-OH 3.43Å
322	D	29.8	Very low	26.8	Very low	152 Å²	152	132.1 Å²	132.1	81%	0.813	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-72.9	-5.4	-176.5	-78.6	-22.3	0	0	0	114.9	N320	N320-D322 PolarHBondContact O-N 2.83Å; N320-D322 VanDerWaalsContact O-N 3.11Å
323	Y	27.3	Very low	27.2	Very low	172 Å²	172	133 Å²	133	68%	0.675	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-93.3	-7.2	177.9	-88.7	-82.2	0	0	0	115.4	E321	E321-Y323 PolarHBondContact O-N 2.74Å; E321-Y323 VanDerWaalsContact O-N 3.12Å
324	S	28.9	Very low	27.6	Very low	92 Å²	92	133.1 Å²	133.1	64%	0.643	67%	0.674	S	S	*	*	H	α-helix	trans	-69.3	-40.2	179.8	175.9	0	0	0	0	112.6	E321 L326	E321-S324 PolarHBondContact O-N 2.78Å; S324-L326 VanDerWaalsContact C-N 3.34Å; S324-L326 PolarHBondContact O-N 3.46Å
325	I	32.3	Very low	27.8	Very low	136 Å²	136	134.8 Å²	134.8	70%	0.697	68%	0.676	S	S	*	*	H	α-helix	trans	-75.3	-24	-176.3	-60.5	173.8	0	0	0	112.1
326	L	28.2	Very low	28.2	Very low	106 Å²	106	131.7 Å²	131.7	56%	0.555	68%	0.678	S	S	*	*	H	α-helix	trans	-80.1	-32.6	179.3	-132.8	89.8	0	0	0	112.6	S324 K329 L330	S324-L326 VanDerWaalsContact C-N 3.34Å; S324-L326 PolarHBondContact O-N 3.46Å; L326-K329 PolarHBondContact O-N 3.16Å; L326-L330 PolarHBondContact O-N 3.45Å; L326-L330 VanDerWaalsContact O-N 3.08Å
327	N	27.8	Very low	28.8	Very low	104 Å²	104	130.9 Å²	130.9	56%	0.556	68%	0.675	S	S	*	*	H	α-helix	trans	-73.9	-28.6	-177	-89.3	-20	0	0	0	113.5	K329 L330 S331	N327-K329 VanDerWaalsContact C-N 3.32Å; N327-K329 PolarHBondContact O-N 3.08Å; N327-L330 PolarHBondContact O-N 3.08Å; N327-S331 WeakPolarHBondContact O-CB 3.45Å; N327-S331 PolarHBondContact O-N 2.84Å; N327-S331 PolarHBondContact O-OG 2.8Å
328	E	32.5	Very low	29.2	Very low	154 Å²	154	129.5 Å²	129.5	72%	0.72	67%	0.673	S	S	*	*	H	α-helix	trans	-73	-26.3	176	-132.5	-176.5	-173.5	0	0	112.6
329	K	33.8	Very low	29.5	Very low	164 Å²	164	134.8 Å²	134.8	71%	0.713	69%	0.687	S	S	*	*	H	α-helix	trans	-81.8	-31.8	171.4	-78.8	-175.1	177.4	176.4	0	112.9	L326 N327	L326-K329 PolarHBondContact O-N 3.16Å; N327-K329 VanDerWaalsContact C-N 3.32Å; N327-K329 PolarHBondContact O-N 3.08Å
330	L	29	Very low	30.1	Very low	93 Å²	93	133.7 Å²	133.7	49%	0.487	69%	0.691	S	S	.	*	H	α-helix	trans	-78.5	-29.5	178.4	-116.2	83.5	0	0	0	113.4	L326 N327 N332 Q333 I334	L326-L330 PolarHBondContact O-N 3.45Å; L326-L330 VanDerWaalsContact O-N 3.08Å; N327-L330 PolarHBondContact O-N 3.08Å; L330-N332 PolarHBondContact O-N 3.06Å; L330-Q333 PolarHBondContact O-N 3.4Å; L330-I334 HydrophobicContact CD2-CD1 4.2Å; L330-I334 HydrophobicContact CG-CD1 4.45Å
331	S	29.2	Very low	30.4	Very low	75 Å²	75	134 Å²	134	52%	0.524	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69	-20.3	-179	70.3	0	0	0	0	113.7	N327	N327-S331 WeakPolarHBondContact O-CB 3.45Å; N327-S331 PolarHBondContact O-N 2.84Å; N327-S331 PolarHBondContact O-OG 2.8Å
332	N	32.9	Very low	30.4	Very low	141 Å²	141	134.1 Å²	134.1	75%	0.754	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-0.6	179.5	-75.9	-22.4	0	0	0	114.7	L330	L330-N332 PolarHBondContact O-N 3.06Å
333	Q	32.3	Very low	30.5	Very low	177 Å²	177	137 Å²	137	83%	0.827	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	2.4	179.2	-81.7	-169.8	-21.1	0	0	115.6	L330	L330-Q333 PolarHBondContact O-N 3.4Å
334	I	26.8	Very low	30.9	Very low	126 Å²	126	133.2 Å²	133.2	65%	0.646	69%	0.686	S	S	*	*			trans	-113.7	46.3	-178.4	-48	177.1	0	0	0	111.5	L330	L330-I334 HydrophobicContact CD2-CD1 4.2Å; L330-I334 HydrophobicContact CG-CD1 4.45Å
335	N	27.8	Very low	30.9	Very low	161 Å²	161	133.2 Å²	133.2	86%	0.861	68%	0.682	S	S	*	*	S	Bend	trans	-123.9	99.1	162.7	-85.5	-28.4	0	0	0	107.7
336	G	29.5	Very low	30.6	Very low	75 Å²	75	134.1 Å²	134.1	77%	0.773	69%	0.685	S	S	*	*	S	Bend	trans	177.8	-86.4	179.9	0	0	0	0	0	116.6
337	E	32.7	Very low	30.8	Very low	168 Å²	168	137.4 Å²	137.4	79%	0.785	70%	0.695	S	S	*	*	S	Bend	trans	-125.7	-0.8	-146.9	-69.9	-172	149.6	0	0	118	R339 S340	E337-R339 PolarHBondContact O-N 2.97Å; E337-S340 PolarHBondContact O-OG 2.81Å
338	N	31.4	Very low	31	Very low	136 Å²	136	137.1 Å²	137.1	73%	0.727	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	11.6	-176.3	-80.8	-21.8	0	0	0	116.5
339	R	30.2	Very low	30.8	Very low	239 Å²	239	136.7 Å²	136.7	90%	0.902	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-16.9	173.2	-96	-174.7	177.6	179.1	1.4	114.6	E337	E337-R339 PolarHBondContact O-N 2.97Å
340	S	35.9	Very low	30.6	Very low	79 Å²	79	135.4 Å²	135.4	55%	0.552	70%	0.699	S	S	*	*	S	Bend	trans	-88	-31.9	-178.9	56.3	0	0	0	0	113.1	E337 L342 R343	E337-S340 PolarHBondContact O-OG 2.81Å; S340-L342 PolarHBondContact O-N 2.75Å; S340-R343 PolarHBondContact O-N 3.39Å
341	H	32.5	Very low	30.6	Very low	138 Å²	138	137.8 Å²	137.8	64%	0.639	71%	0.713	S	S	*	*	H	α-helix	trans	-73.7	-25.6	-176	-91.2	-54.7	0	0	0	115.2	R343 T344 T345	H341-R343 VanDerWaalsContact C-N 3.3Å; H341-R343 PolarHBondContact O-N 3.1Å; H341-T344 PolarHBondContact O-N 2.73Å; H341-T345 PolarHBondContact O-OG1 2.85Å
342	L	28.1	Very low	30.4	Very low	128 Å²	128	141.5 Å²	141.5	67%	0.67	73%	0.726	S	S	*	*	H	α-helix	trans	-74.8	-14.6	178.7	-79.5	163.5	0	0	0	114.1	S340	S340-L342 PolarHBondContact O-N 2.75Å
343	R	31.1	Very low	30	Very low	214 Å²	214	139.7 Å²	139.7	81%	0.808	73%	0.725	S	S	*	*	H	α-helix	trans	-85.3	-21.1	174.1	-93.8	-175.8	176.2	174.4	-0.3	113.6	S340 H341	S340-R343 PolarHBondContact O-N 3.39Å; H341-R343 VanDerWaalsContact C-N 3.3Å; H341-R343 PolarHBondContact O-N 3.1Å
344	T	35.8	Very low	29.6	Very low	92 Å²	92	139.8 Å²	139.8	56%	0.564	73%	0.725	S	S	*	*	H	α-helix	trans	-84.9	-34.1	-177.9	-42.8	0	0	0	0	111.5	H341 K347	H341-T344 PolarHBondContact O-N 2.73Å; T344-K347 PolarHBondContact O-N 2.91Å
345	T	28.8	Very low	29.5	Very low	91 Å²	91	141.7 Å²	141.7	56%	0.558	74%	0.736	S	S	*	*	H	α-helix	trans	-74.3	-26.6	178.7	23.2	0	0	0	0	114.1	H341 K347	H341-T345 PolarHBondContact O-OG1 2.85Å; T345-K347 VanDerWaalsContact C-N 3.3Å; T345-K347 PolarHBondContact O-N 3.35Å
346	M	26.7	Very low	29.2	Very low	156 Å²	156	143.6 Å²	143.6	77%	0.768	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-7.2	174.9	-86.9	176.8	76.3	0	0	114.6
347	K	31.6	Very low	28.8	Very low	174 Å²	174	145.3 Å²	145.3	76%	0.757	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-7.9	173.6	-88.6	-170.8	174.3	-173.8	0	114.5	T344 T345	T344-K347 PolarHBondContact O-N 2.91Å; T345-K347 VanDerWaalsContact C-N 3.3Å; T345-K347 PolarHBondContact O-N 3.35Å
348	V	33.1	Very low	28.3	Very low	98 Å²	98	145.9 Å²	145.9	59%	0.594	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-17	-179.4	-179.6	0	0	0	0	112
349	L	26.9	Very low	27.7	Very low	145 Å²	145	145.6 Å²	145.6	76%	0.759	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-7.1	-178	-85.3	157.6	0	0	0	115.4
350	D	29.4	Very low	27.3	Very low	137 Å²	137	142 Å²	142	73%	0.733	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	3.1	175.9	-81.2	-14.9	0	0	0	114.2
351	N	29.6	Very low	26.6	Very low	144 Å²	144	145 Å²	145	77%	0.77	75%	0.75	S	S	*	*	S	Bend	trans	-117.5	20.6	-177.3	-90.8	-10.3	0	0	0	115.3
352	L	24.7	Very low	26	Very low	153 Å²	153	146.4 Å²	146.4	80%	0.801	76%	0.757	S	S	*	*			trans	-122.8	33.7	176.3	-69.6	173.5	0	0	0	113.3
353	S	24.2	Very low	25.8	Very low	103 Å²	103	148.9 Å²	148.9	72%	0.72	76%	0.762	S	S	*	*	S	Bend	trans	-114.9	47.7	170.4	70.1	0	0	0	0	112
354	E	25	Very low	25.2	Very low	179 Å²	179	147.6 Å²	147.6	84%	0.836	77%	0.765	S	S	*	*			trans	-168.1	87.4	165.5	-113.1	170.7	-151.4	0	0	109.7
355	N	25.1	Very low	24.5	Very low	165 Å²	165	151.9 Å²	151.9	88%	0.882	78%	0.779	S	S	*	*			trans	-152.5	84.1	156.3	-94.8	-30.4	0	0	0	109.2
356	K	21.8	Very low	24.2	Very low	202 Å²	202	155.4 Å²	155.4	88%	0.878	79%	0.793	S	S	*	*			trans	-75	129.6	155.1	-77.1	177.1	173.3	175.2	0	108.1
357	C	19.9	Very low	23.9	Very low	110 Å²	110	156.2 Å²	156.2	74%	0.743	80%	0.797	S	S	*	*			trans	175.5	104.6	142.9	-100.3	0	0	0	0	107.8
358	Q	22.2	Very low	23.6	Very low	181 Å²	181	153.6 Å²	153.6	85%	0.846	80%	0.798	S	S	*	*				88.2	110	93.2	-89.3	-172.4	-11.7	0	0	112.8	N360	Q358-N360 PolarHBondContact O-N 2.87Å
359	V	19.5	Very low	23	Very low	130 Å²	130	157.1 Å²	157.1	79%	0.788	81%	0.808	S	S	*	*			trans	-54	121.2	168.6	175.9	0	0	0	0	109.8
360	N	21.6	Very low	22.9	Very low	163 Å²	163	156.8 Å²	156.8	87%	0.872	81%	0.807	S	S	*	*			trans	-120.4	109.2	162.1	-99.9	-15.2	0	0	0	109.1	Q358	Q358-N360 PolarHBondContact O-N 2.87Å
361	N	20.4	Very low	22.6	Very low	141 Å²	141	156.1 Å²	156.1	75%	0.754	80%	0.803	S	S	*	*			trans	-58.5	133.7	159.3	-69.3	-35.7	0	0	0	109
362	Q	20.7	Very low	22.3	Very low	168 Å²	168	158.1 Å²	158.1	79%	0.785	81%	0.813	S	S	*	*				172.5	136.6	126.4	-96	175.2	28.3	0	0	112.8
363	K	22.7	Very low	22.3	Very low	181 Å²	181	157.9 Å²	157.9	79%	0.787	81%	0.811	S	S	*	*			trans	89.9	98.3	147.9	-71.4	173.9	179.4	-171.6	0	119.4
364	E	20	Very low	22.4	Very low	187 Å²	187	156.5 Å²	156.5	87%	0.874	81%	0.813	S	S	*	*				-21.9	128	128.5	-63.8	168.2	149	0	0	113.6
365	E	21.1	Very low	22.4	Very low	181 Å²	181	154.9 Å²	154.9	85%	0.846	81%	0.81	S	S	*	*			trans	-157.1	119.9	144	-117.4	169	-161.3	0	0	110.8
366	L	21.9	Very low	22.4	Very low	165 Å²	165	155.4 Å²	155.4	86%	0.864	81%	0.813	S	S	*	*			trans	-16.8	128	169.9	-67.8	108.8	0	0	0	118.6
367	M	20.5	Very low	22.5	Very low	173 Å²	173	149.9 Å²	149.9	85%	0.852	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-74.7	139.5	162.2	-75.4	-84.6	106.3	0	0	110.7
368	P	25.7	Very low	22.7	Very low	119 Å²	119	155 Å²	155	77%	0.773	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-88.6	127.9	-171.7	33.6	-31.7	0	0	0	112.6
369	E	20.9	Very low	22.7	Very low	173 Å²	173	154.8 Å²	154.8	81%	0.808	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-76.7	131	156.4	-70.7	-179.7	151.5	0	0	109.6
370	N	23.5	Very low	23	Very low	137 Å²	137	155.5 Å²	155.5	73%	0.733	81%	0.813	S	S	*	*				167	140.6	119.9	-88.8	-38	0	0	0	114.3
371	N	23.8	Very low	23.2	Very low	123 Å²	123	151.1 Å²	151.1	66%	0.658	81%	0.807	S	S	*	*			trans	79.7	92.2	148.4	-61.8	-18.2	0	0	0	119.9
372	L	23.9	Very low	23.4	Very low	186 Å²	186	153.3 Å²	153.3	97%	0.974	81%	0.812	S	S	*	*			trans	-129.2	90.9	139.5	-91.3	154.7	0	0	0	108.6
373	I	24.2	Very low	23.7	Very low	148 Å²	148	153.4 Å²	153.4	76%	0.759	82%	0.817	S	S	*	*			trans	-89.9	128.6	168.2	-66.4	169.8	0	0	0	107.3
374	G	26.6	Very low	23.9	Very low	74 Å²	74	152 Å²	152	76%	0.763	82%	0.818	S	S	*	*			trans	-165.2	75.5	173.9	0	0	0	0	0	110.1
375	N	25	Very low	24	Very low	146 Å²	146	146.9 Å²	146.9	78%	0.781	82%	0.815	S	S	*	*			trans	-72	117.8	171.7	-80.3	-22	0	0	0	109.8
376	D	25	Very low	24.2	Very low	175 Å²	175	147.7 Å²	147.7	94%	0.936	82%	0.818	S	S	*	*			trans	-117.2	119.8	158	-87.3	-29.4	0	0	0	108.5
377	S	24.1	Very low	24.3	Very low	87 Å²	87	145.3 Å²	145.3	61%	0.608	82%	0.815	S	S	*	*			trans	-137.4	147.1	-170.8	62.8	0	0	0	0	110.5
378	Y	22.6	Very low	24.4	Very low	217 Å²	217	149 Å²	149	85%	0.851	82%	0.82	S	S	*	*			trans	76.9	113	162.8	-62.4	-78.2	0	0	0	119.6
379	L	23.1	Very low	24.2	Very low	176 Å²	176	152.3 Å²	152.3	92%	0.921	83%	0.825	S	S	*	*			trans	-166.1	92.9	140.3	-103	160.9	0	0	0	109.2
380	V	25.9	Very low	24.5	Very low	145 Å²	145	150.5 Å²	150.5	88%	0.879	83%	0.826	S	S	*	*			trans	-135.4	114	161.1	178.6	0	0	0	0	107.1
381	G	25.7	Very low	24.5	Very low	71 Å²	71	148.9 Å²	148.9	73%	0.732	83%	0.825	S	S	*	*			trans	-83.5	134.1	-176.4	0	0	0	0	0	112.8
382	E	24.4	Very low	24.5	Very low	187 Å²	187	151 Å²	151	87%	0.874	84%	0.836	S	S	*	*			trans	-77.3	135.9	169.8	-68.3	173.6	144	0	0	110.5
383	I	26.5	Very low	24.6	Very low	171 Å²	171	148.6 Å²	148.6	88%	0.877	83%	0.83	S	S	*	*			trans	-115.4	118.2	168.6	-66	176.5	0	0	0	107.5
384	N	26.8	Very low	24.6	Very low	152 Å²	152	148.8 Å²	148.8	81%	0.813	83%	0.832	S	S	*	*			trans	-64.3	134.3	-175.5	-71	-36	0	0	0	113.3
385	G	23.7	Very low	24.6	Very low	78 Å²	78	150.3 Å²	150.3	80%	0.804	83%	0.831	S	S	*	*			trans	-94	131.6	163.3	0	0	0	0	0	111.1
386	E	24.6	Very low	24.4	Very low	198 Å²	198	149.9 Å²	149.9	93%	0.925	83%	0.834	S	S	*	*			trans	-104.2	122.3	164.6	-80.7	-174.6	163	0	0	109.7
387	S	23.5	Very low	24.4	Very low	115 Å²	115	151.1 Å²	151.1	80%	0.804	83%	0.834	S	S	*	*			trans	-78.7	132.8	172.1	37.8	0	0	0	0	111.7
388	R	22.4	Very low	24.3	Very low	250 Å²	250	151.9 Å²	151.9	94%	0.943	84%	0.839	S	S	*	*			trans	-128.5	116.2	161.2	-101.2	-178	174.4	162.4	0.5	110.1
389	E	22	Very low	24.4	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.883	84%	0.838	S	S	*	*			trans	-73.3	139.5	173.1	-62.9	170.8	150.2	0	0	110.7
390	V	26.5	Very low	24.3	Very low	135 Å²	135	148.1 Å²	148.1	82%	0.818	83%	0.83	S	S	*	*			trans	-136	121.3	157.7	-178.4	0	0	0	0	108.5
391	S	24.2	Very low	24.2	Very low	103 Å²	103	149.2 Å²	149.2	72%	0.72	82%	0.823	S	S	*	*			trans	-61.9	136	-179.7	51.2	0	0	0	0	114.4
392	N	24.5	Very low	24.2	Very low	167 Å²	167	152.5 Å²	152.5	89%	0.893	82%	0.824	S	S	*	*			trans	-113.1	132.4	163.5	-88.3	-22.1	0	0	0	109.7
393	T	25.4	Very low	24	Very low	136 Å²	136	152 Å²	152	83%	0.834	82%	0.821	S	S	*	*			trans	-106.1	142.7	-179.9	45.7	0	0	0	0	112.4
394	D	23.3	Very low	23.8	Very low	153 Å²	153	149.7 Å²	149.7	82%	0.818	82%	0.815	S	S	*	*			trans	-44.4	172.6	178.9	-67.6	-48.4	0	0	0	122
395	S	26.5	Very low	23.6	Very low	105 Å²	105	151.1 Å²	151.1	73%	0.734	82%	0.817	S	S	*	*			trans	92.4	106	158.2	67.1	0	0	0	0	116.1
396	T	21.6	Very low	23.6	Very low	137 Å²	137	157.3 Å²	157.3	84%	0.84	82%	0.822	S	S	*	*				53.3	102.1	51	69.1	0	0	0	0	115
397	E	24.5	Very low	23.5	Very low	202 Å²	202	156.6 Å²	156.6	94%	0.944	82%	0.819	S	S	*	*			trans	-151.6	146.6	143.9	-114	169.9	-161.5	0	0	110
398	S	21.8	Very low	23.5	Very low	102 Å²	102	158.1 Å²	158.1	71%	0.713	82%	0.818	S	S	*	*			trans	-134.8	132.3	-160.2	47.6	0	0	0	0	107.3
399	D	25.1	Very low	23.6	Very low	153 Å²	153	157.2 Å²	157.2	82%	0.818	82%	0.816	S	S	*	*			trans	-141	104.3	166.9	-76.4	-39.6	0	0	0	106.6
400	E	21.9	Very low	23.7	Very low	162 Å²	162	155 Å²	155	76%	0.757	81%	0.811	S	S	*	*				51	116.6	94.4	-69.9	-162	161.3	0	0	114.5
401	F	23.3	Very low	23.5	Very low	168 Å²	168	154.9 Å²	154.9	74%	0.737	81%	0.81	S	S	*	*				178.8	127	111.2	-112.8	-109.6	0	0	0	114
402	N	25.1	Very low	23.5	Very low	139 Å²	139	158.2 Å²	158.2	74%	0.743	82%	0.817	S	S	*	*			trans	80.8	113.3	140	-75.2	1.9	0	0	0	126.1
403	Q	21.3	Very low	23.4	Very low	176 Å²	176	154.9 Å²	154.9	82%	0.822	81%	0.807	S	S	*	*			trans	-73.7	178.1	157.6	-65.3	171.5	-16.3	0	0	113.6
404	T	22.4	Very low	23.3	Very low	123 Å²	123	159.9 Å²	159.9	76%	0.755	81%	0.811	S	S	*	*			trans	107.2	132.1	166.6	61.7	0	0	0	0	113.3
405	E	22.9	Very low	23.2	Very low	183 Å²	183	157.7 Å²	157.7	86%	0.855	81%	0.808	S	S	*	*			cis	-160.9	158.4	10.7	-119.5	166.1	-168.9	0	0	109.9
406	K	22.1	Very low	23.2	Very low	208 Å²	208	160 Å²	160	90%	0.904	81%	0.812	S	S	*	*			trans	-92.4	136.1	178.1	-75.4	172.9	172.1	174.2	0	110.3
407	E	22.8	Very low	23.3	Very low	183 Å²	183	161.8 Å²	161.8	86%	0.855	82%	0.816	S	S	*	*			trans	-129.1	140.4	162.4	-76.4	-166.7	155.6	0	0	113
408	N	22.9	Very low	23.2	Very low	147 Å²	147	161.2 Å²	161.2	79%	0.786	81%	0.81	S	S	*	*			trans	-71.7	146.2	-175.6	-68.6	-49.3	0	0	0	113.5
409	Y	24.8	Very low	23.2	Very low	230 Å²	230	165.1 Å²	165.1	90%	0.902	82%	0.815	S	S	*	*			trans	-140.2	136.3	149.9	-88.6	-80	0	0	0	113.2
410	N	24.4	Very low	23.2	Very low	144 Å²	144	167.8 Å²	167.8	77%	0.77	82%	0.819	S	S	*	*			trans	-80.7	144.4	-166.6	-77	-46.4	0	0	0	115.1
411	V	22.1	Very low	23.2	Very low	132 Å²	132	166.4 Å²	166.4	80%	0.8	82%	0.817	S	S	*	*			trans	16.1	117.2	133.4	-170.6	0	0	0	0	118.1
412	I	24.4	Very low	23.2	Very low	172 Å²	172	164.8 Å²	164.8	88%	0.882	82%	0.816	S	S	*	*			trans	-119.3	134.7	155.4	-64.7	174.8	0	0	0	108.7
413	S	22.5	Very low	23.1	Very low	97 Å²	97	163.1 Å²	163.1	68%	0.678	82%	0.815	S	S	*	*			trans	-104	134.7	-167.4	50.9	0	0	0	0	114.3
414	R	22.7	Very low	23.1	Very low	242 Å²	242	162.9 Å²	162.9	91%	0.913	81%	0.814	S	S	*	*			trans	34	137.6	139.3	-73.8	-177.4	171.4	176	-5.3	122.5
415	S	22.1	Very low	23.1	Very low	107 Å²	107	163.9 Å²	163.9	75%	0.748	81%	0.814	S	S	*	*			trans	131.6	132.7	151.8	55.8	0	0	0	0	109.3
416	D	26.2	Very low	23	Very low	153 Å²	153	159.2 Å²	159.2	82%	0.818	80%	0.801	S	S	*	*			cis	-151.6	135.3	14.7	-81.4	-43.9	0	0	0	108.5
417	N	23.2	Very low	23	Very low	174 Å²	174	158 Å²	158	93%	0.93	80%	0.799	S	S	*	*			trans	-115.4	112	172.1	-89.5	-19.4	0	0	0	109.4
418	K	23.3	Very low	23.2	Very low	190 Å²	190	152.6 Å²	152.6	83%	0.826	79%	0.792	S	S	*	*			trans	-133.2	123.7	164.2	-92.5	-174	176.6	176.4	0	109.4
419	F	22.2	Very low	23.7	Very low	185 Å²	185	151.5 Å²	151.5	81%	0.811	79%	0.793	S	S	*	*			trans	46.2	121.7	151.5	-74.2	-90.1	0	0	0	119.2
420	F	24.5	Very low	23.6	Very low	208 Å²	208	149.2 Å²	149.2	91%	0.912	79%	0.79	S	S	*	*				-169.6	138.2	111.2	-110.8	-82.1	0	0	0	111.4
421	N	22.5	Very low	23.8	Very low	134 Å²	134	150.3 Å²	150.3	72%	0.717	80%	0.796	S	S	*	*			trans	-82.5	158.1	166.9	-104	4	0	0	0	110.3
422	D	23.1	Very low	23.8	Very low	133 Å²	133	149.2 Å²	149.2	71%	0.711	80%	0.795	S	S	*	*			trans	78.8	110	151.4	-59.4	-24.6	0	0	0	120.6
423	S	21.9	Very low	23.9	Very low	104 Å²	104	146.5 Å²	146.5	73%	0.727	79%	0.791	S	S	*	*			trans	68.4	122.9	132.1	54.3	0	0	0	0	121.7
424	E	21.4	Very low	23.9	Very low	171 Å²	171	150.4 Å²	150.4	80%	0.799	80%	0.799	S	S	*	*			trans	89.8	110.9	139.9	-75.2	-174.9	177.3	0	0	121.1
425	I	22.9	Very low	24.1	Very low	145 Å²	145	150.5 Å²	150.5	74%	0.744	80%	0.799	S	S	*	*				91.2	118.9	126.4	-65.1	169.4	0	0	0	119.5
426	S	21.8	Very low	24.1	Very low	84 Å²	84	154.1 Å²	154.1	59%	0.587	80%	0.804	S	S	*	*			trans	93.1	116.9	138.6	-155.5	0	0	0	0	121.7
427	E	21.9	Very low	23.9	Very low	183 Å²	183	153.1 Å²	153.1	86%	0.855	81%	0.807	S	S	*	*			trans	74.1	139	137.3	-73.9	172.3	175.6	0	0	120.6
428	G	26.8	Very low	24	Very low	69 Å²	69	151.5 Å²	151.5	71%	0.711	80%	0.804	S	S	*	*			trans	-66.3	-171.6	-166.7	0	0	0	0	0	115.9
429	P	33.1	Very low	24	Very low	125 Å²	125	146.1 Å²	146.1	81%	0.812	80%	0.802	S	S	*	*				-145.5	166.1	75.7	31.8	-11.1	0	0	0	116.2
430	Q	22.5	Very low	24.2	Very low	181 Å²	181	146.1 Å²	146.1	85%	0.846	81%	0.805	S	S	*	*			trans	-18.1	129.8	155.1	-63.7	168.3	-30.7	0	0	116.1
431	D	28.4	Very low	24.2	Very low	167 Å²	167	145.8 Å²	145.8	89%	0.893	81%	0.806	S	S	*	*			trans	-138.9	104	142.5	-115.7	-19.1	0	0	0	109.8
432	S	23.2	Very low	24.2	Very low	109 Å²	109	147.3 Å²	147.3	76%	0.762	81%	0.811	S	S	*	*			trans	-80.2	115.6	170.6	45.1	0	0	0	0	109.2
433	S	26.6	Very low	24.5	Very low	115 Å²	115	145.8 Å²	145.8	80%	0.804	81%	0.811	S	S	*	*			trans	-124.2	96.1	161.7	66.7	0	0	0	0	109.7	R435	S433-R435 PolarHBondContact O-N 2.8Å
434	E	22.2	Very low	25	Very low	180 Å²	180	147.3 Å²	147.3	84%	0.841	82%	0.816	S	S	*	*			trans	-55.1	125.5	170.3	-64.3	173.4	143.5	0	0	110.9
435	R	26.5	Very low	25.6	Very low	243 Å²	243	141.6 Å²	141.6	92%	0.917	80%	0.803	S	S	*	*			trans	-121	105.4	155.4	-81.4	-170.1	-179.3	-175.9	1.4	108.5	S433 C437	S433-R435 PolarHBondContact O-N 2.8Å; R435-C437 PolarHBondContact O-N 2.8Å
436	Q	21.1	Very low	26	Very low	184 Å²	184	141.9 Å²	141.9	86%	0.86	80%	0.801	S	S	*	*			trans	-57.9	120.9	170.3	-68.1	169.1	-18.4	0	0	109.8
437	C	22.7	Very low	26.4	Very low	131 Å²	131	146.5 Å²	146.5	89%	0.885	81%	0.807	S	S	*	*			trans	-118.1	128.7	157.9	-93.5	0	0	0	0	108.4	R435	R435-C437 PolarHBondContact O-N 2.8Å
438	T	25.5	Very low	26.9	Very low	141 Å²	141	143.9 Å²	143.9	87%	0.865	80%	0.798	S	S	*	*			trans	-63.1	147.4	-165.2	41.8	0	0	0	0	114.5
439	G	23	Very low	27.2	Very low	76 Å²	76	144.8 Å²	144.8	78%	0.784	79%	0.79	S	S	*	*			trans	-57.6	137.7	-173.9	0	0	0	0	0	116.1
440	Q	25.8	Very low	27.2	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	78%	0.777	S	S	*	*			trans	-126.7	107.9	135.8	-86.1	-176.6	-15.2	0	0	106.8	M442	Q440-M442 PolarHBondContact O-N 2.83Å; Q440-M442 VanDerWaalsContact O-N 3.13Å
441	Q	24.4	Very low	27.7	Very low	201 Å²	201	140.1 Å²	140.1	94%	0.939	77%	0.766	S	S	*	*			trans	-66.4	103.5	172.2	-75.6	176.3	-26.2	0	0	108.5
442	M	24.5	Very low	27.8	Very low	165 Å²	165	138.4 Å²	138.4	81%	0.813	76%	0.756	S	S	*	*			trans	-116.2	110.4	167.4	-80.9	-83.6	-75.6	0	0	107.5	Q440 T444	Q440-M442 PolarHBondContact O-N 2.83Å; Q440-M442 VanDerWaalsContact O-N 3.13Å; M442-T444 PolarHBondContact O-N 2.93Å
443	S	28	Very low	28.2	Very low	102 Å²	102	136.6 Å²	136.6	71%	0.713	74%	0.743	S	S	*	*			trans	-60.2	117.2	-177.5	50.8	0	0	0	0	111.2	G445	S443-G445 PolarHBondContact O-N 2.9Å
444	T	32.8	Very low	28.5	Very low	135 Å²	135	135 Å²	135	83%	0.828	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	15.9	-178.2	47.5	0	0	0	0	115	M442	M442-T444 PolarHBondContact O-N 2.93Å
445	G	33.4	Very low	29	Very low	51 Å²	51	134.6 Å²	134.6	53%	0.526	73%	0.733	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.1	-27.2	-176.8	0	0	0	0	0	115.6	S443 T449	S443-G445 PolarHBondContact O-N 2.9Å; G445-T449 PolarHBondContact O-OG1 3.35Å
446	E	31.7	Very low	29	Very low	152 Å²	152	133 Å²	133	71%	0.71	73%	0.728	S	S	*	*	S	Bend	trans	-106.8	-10.2	-168.8	-69.8	-174.7	157.3	0	0	115.3	T449 S450	E446-T449 PolarHBondContact O-OG1 2.94Å; E446-S450 PolarHBondContact O-N 3.01Å
447	Y	30	Very low	29.2	Very low	180 Å²	180	132.1 Å²	132.1	71%	0.706	72%	0.724	S	S	*	*	H	α-helix	trans	-75.7	-30.1	176.2	-161.7	-99.6	0	0	0	112.8
448	L	33.1	Very low	29.4	Very low	129 Å²	129	131.1 Å²	131.1	68%	0.675	72%	0.718	S	S	*	*	H	α-helix	trans	-82.5	-25.7	179.8	-77.1	167.6	0	0	0	113.4
449	T	32.1	Very low	29.4	Very low	88 Å²	88	129.3 Å²	129.3	54%	0.54	71%	0.712	S	S	.	*	H	α-helix	trans	-80.8	-32.1	176	38.7	0	0	0	0	112.5	G445 E446 Q451 L452 S453	G445-T449 PolarHBondContact O-OG1 3.35Å; E446-T449 PolarHBondContact O-OG1 2.94Å; T449-Q451 PolarHBondContact O-N 2.71Å; T449-L452 PolarHBondContact O-N 3.48Å; T449-S453 WeakPolarHBondContact O-CB 3.4Å; T449-S453 PolarHBondContact O-N 2.87Å
450	S	33.6	Very low	29.6	Very low	78 Å²	78	133 Å²	133	55%	0.545	71%	0.712	S	S	.	*	H	α-helix	trans	-63.4	-40.8	175.8	177.4	0	0	0	0	113	E446 A454	E446-S450 PolarHBondContact O-N 3.01Å; S450-A454 PolarHBondContact O-N 3.24Å
451	Q	32.8	Very low	29.5	Very low	129 Å²	129	130.5 Å²	130.5	60%	0.603	70%	0.703	S	S	*	*	H	α-helix	trans	-74.9	-24.3	178.5	-75.6	-153.1	-3.6	0	0	114.4	T449	T449-Q451 PolarHBondContact O-N 2.71Å
452	L	30.5	Very low	29.5	Very low	131 Å²	131	128.6 Å²	128.6	69%	0.686	70%	0.698	S	S	*	*	H	α-helix	trans	-85.3	-29.3	176.5	-73.1	169.9	0	0	0	112.5	T449	T449-L452 PolarHBondContact O-N 3.48Å
453	S	31.8	Very low	29.6	Very low	72 Å²	72	128.8 Å²	128.8	50%	0.503	70%	0.697	S	S	.	*	H	α-helix	trans	-70.5	-40	173.1	162.3	0	0	0	0	112.6	T449 K455 Y456	T449-S453 WeakPolarHBondContact O-CB 3.4Å; T449-S453 PolarHBondContact O-N 2.87Å; S453-K455 PolarHBondContact O-N 3.03Å; S453-Y456 PolarHBondContact O-N 3.12Å
454	A	33.1	Very low	29.4	Very low	82 Å²	82	130.4 Å²	130.4	68%	0.678	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-13.3	-178.1	0	0	0	0	0	114.3	S450	S450-A454 PolarHBondContact O-N 3.24Å
455	K	33.4	Very low	29.1	Very low	171 Å²	171	130.1 Å²	130.1	74%	0.743	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-8.3	-179.1	-133.5	176.4	-173.2	175.9	0	114.5	S453	S453-K455 PolarHBondContact O-N 3.03Å
456	Y	26.9	Very low	28.7	Very low	210 Å²	210	138.3 Å²	138.3	82%	0.824	71%	0.714	S	S	*	*	S	Bend	trans	-131.5	17.1	-175.4	-81.7	-76.6	0	0	0	115.7	S453	S453-Y456 PolarHBondContact O-N 3.12Å
457	Q	25.2	Very low	28.4	Very low	164 Å²	164	137.5 Å²	137.5	77%	0.766	72%	0.719	S	S	*	*			trans	-133	58.5	173.1	-81	-172.3	-28.8	0	0	113.7
458	S	26	Very low	28.2	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	73%	0.727	S	S	*	*			trans	-123.6	92.7	152.9	62.4	0	0	0	0	108	I460	S458-I460 PolarHBondContact O-N 3.36Å
459	S	26.3	Very low	28	Very low	104 Å²	104	137.1 Å²	137.1	73%	0.727	73%	0.729	S	S	*	*			trans	-37.2	129.1	166.4	-36.5	0	0	0	0	110.1	I461	S459-I461 VanDerWaalsContact C-N 3.28Å; S459-I461 PolarHBondContact O-N 3.42Å
460	I	25.6	Very low	27.7	Very low	152 Å²	152	140.7 Å²	140.7	78%	0.779	75%	0.745	S	S	*	*			trans	-54	91.3	172.1	-66.5	161	0	0	0	108	S458 L462	S458-I460 PolarHBondContact O-N 3.36Å; I460-L462 VanDerWaalsContact C-N 3.35Å; I460-L462 HydrophobicContact CG2-CD1 4.23Å; I460-L462 HydrophobicContact CG2-CG 3.9Å; I460-L462 PolarHBondContact O-N 3.05Å
461	I	25.4	Very low	27.5	Very low	134 Å²	134	141.1 Å²	141.1	69%	0.687	75%	0.748	S	S	*	*			trans	-82.1	93.8	163.9	-65.7	176.3	0	0	0	104.9	S459 Q463	S459-I461 VanDerWaalsContact C-N 3.28Å; S459-I461 PolarHBondContact O-N 3.42Å; I461-Q463 HydrophobicContact CG2-CG 3.91Å; I461-Q463 PolarHBondContact O-N 3.39Å
462	L	24.6	Very low	27.4	Very low	161 Å²	161	141.9 Å²	141.9	84%	0.843	76%	0.756	S	S	*	*			trans	-59	82.4	163.7	-82.1	150.3	0	0	0	108.6	I460 N464	I460-L462 VanDerWaalsContact C-N 3.35Å; I460-L462 HydrophobicContact CG2-CD1 4.23Å; I460-L462 HydrophobicContact CG2-CG 3.9Å; I460-L462 PolarHBondContact O-N 3.05Å; L462-N464 PolarHBondContact O-N 2.75Å
463	Q	25.2	Very low	27.5	Very low	169 Å²	169	142.6 Å²	142.6	79%	0.79	76%	0.759	S	S	*	*			trans	-80.2	101.5	171.1	-102.2	176.9	8.3	0	0	109.7	I461	I461-Q463 HydrophobicContact CG2-CG 3.91Å; I461-Q463 PolarHBondContact O-N 3.39Å
464	N	24.7	Very low	27.6	Very low	137 Å²	137	146.5 Å²	146.5	73%	0.733	77%	0.774	S	S	*	*			trans	48.1	100.1	153.9	-81.6	-24.7	0	0	0	117.1	L462 R466	L462-N464 PolarHBondContact O-N 2.75Å; N464-R466 VanDerWaalsContact C-N 3.34Å; N464-R466 PolarHBondContact O-N 3.1Å
465	P	25.7	Very low	27.5	Very low	129 Å²	129	150 Å²	150	84%	0.838	78%	0.781	S	S	*	*			trans	-65	99.5	166	28.7	-28.7	0	0	0	107.4	T467	P465-T467 PolarHBondContact O-N 2.94Å; P465-T467 VanDerWaalsContact O-N 3.07Å
466	R	25.4	Very low	27.7	Very low	222 Å²	222	149.9 Å²	149.9	84%	0.838	78%	0.783	S	S	*	*			trans	-58.9	115.5	166.7	-75.9	-177.2	176.7	179.1	-1	106.4	N464 F468	N464-R466 VanDerWaalsContact C-N 3.34Å; N464-R466 PolarHBondContact O-N 3.1Å; R466-F468 PolarHBondContact O-N 2.9Å
467	T	25.2	Very low	28.5	Very low	135 Å²	135	147.4 Å²	147.4	83%	0.828	78%	0.784	S	S	*	*			trans	-37.6	103.6	170.1	48.1	0	0	0	0	110.1	P465 S469	P465-T467 PolarHBondContact O-N 2.94Å; P465-T467 VanDerWaalsContact O-N 3.07Å; T467-S469 PolarHBondContact O-N 2.83Å
468	F	26.2	Very low	29.2	Very low	197 Å²	197	149.1 Å²	149.1	86%	0.864	79%	0.792	S	S	*	*			trans	-67	109.2	163.4	-89.3	-94.4	0	0	0	106.2	R466 D470	R466-F468 PolarHBondContact O-N 2.9Å; F468-D470 PolarHBondContact O-N 3.03Å
469	S	27.8	Very low	30.3	Very low	104 Å²	104	150.3 Å²	150.3	73%	0.727	79%	0.789	S	S	*	*			trans	-70.4	111.9	164.7	50.6	0	0	0	0	107.4	T467 S471	T467-S469 PolarHBondContact O-N 2.83Å; S469-S471 PolarHBondContact O-N 2.92Å; S469-S471 VanDerWaalsContact O-N 3.08Å
470	D	27.1	Very low	31.5	Very low	164 Å²	164	148.1 Å²	148.1	88%	0.877	77%	0.774	S	S	*	*			trans	-59.5	101.9	167.2	-85.3	-32.5	0	0	0	109.8	F468	F468-D470 PolarHBondContact O-N 3.03Å
471	S	28.3	Very low	33.1	Very low	87 Å²	87	145.6 Å²	145.6	61%	0.608	77%	0.767	S	S	*	*			trans	-161.5	123.5	149.9	55.5	0	0	0	0	108.8	S469	S469-S471 PolarHBondContact O-N 2.92Å; S469-S471 VanDerWaalsContact O-N 3.08Å
472	D	31.8	Very low	34.9	Very low	145 Å²	145	143.1 Å²	143.1	78%	0.775	76%	0.756	S	S	*	*			trans	82.7	61.9	161	-45.2	-22.6	0	0	0	116.3
473	I	31.1	Very low	37.3	Very low	146 Å²	146	138.4 Å²	138.4	75%	0.749	73%	0.731	S	S	*	*			trans	-89.5	92.4	150	-60.4	176	0	0	0	106.5	L475	I473-L475 VanDerWaalsContact C-N 3.32Å; I473-L475 HydrophobicContact CG2-CD1 4.06Å; I473-L475 PolarHBondContact O-N 3.42Å
474	D	34.7	Very low	39.3	Very low	153 Å²	153	137.8 Å²	137.8	82%	0.818	72%	0.722	S	S	*	*			trans	-64.9	94.3	167	-82	-31.2	0	0	0	108.7	E476	D474-E476 PolarHBondContact O-N 2.74Å
475	L	32	Very low	41.7	Very low	156 Å²	156	134.9 Å²	134.9	82%	0.817	71%	0.706	S	S	*	*			trans	-82.3	55.7	-179.9	-153	94.2	0	0	0	111.1	I473	I473-L475 VanDerWaalsContact C-N 3.32Å; I473-L475 HydrophobicContact CG2-CD1 4.06Å; I473-L475 PolarHBondContact O-N 3.42Å
476	E	36.1	Very low	44.2	Very low	169 Å²	169	137 Å²	137	79%	0.79	70%	0.697	S	S	*	*			trans	-143.9	89	170.5	-75.5	-167.9	169.6	0	0	109.3	D474	D474-E476 PolarHBondContact O-N 2.74Å
477	N	44	Very low	46.9	Very low	157 Å²	157	131.8 Å²	131.8	84%	0.84	68%	0.683	S	S	*	*			trans	-178.3	45.8	150.7	-87.2	-35.7	0	0	0	111.4	L479	N477-L479 VanDerWaalsContact C-N 3.32Å; N477-L479 PolarHBondContact O-N 3.45Å
478	E	41	Very low	49.4	Very low	201 Å²	201	129.1 Å²	129.1	94%	0.939	66%	0.663	S	S	*	*			trans	-67.6	95.1	165.7	-76.9	-167.8	160.7	0	0	109	S480	E478-S480 PolarHBondContact O-N 2.86Å
479	L	47.9	Very low	52.1	Low	134 Å²	134	126.9 Å²	126.9	70%	0.702	65%	0.653	S	S	*	*			trans	-56.6	127.5	171.8	-88	130.6	0	0	0	109.4	N477 D483	N477-L479 VanDerWaalsContact C-N 3.32Å; N477-L479 PolarHBondContact O-N 3.45Å; L479-D483 HydrophobicContact CD2-CB 3.88Å
480	S	51	Low	54.8	Low	58 Å²	58	124.9 Å²	124.9	41%	0.406	64%	0.642	S	S	.	*			trans	-50.8	139.4	179.4	-179.4	0	0	0	0	110.6	E478 N482 D483 Y484	E478-S480 PolarHBondContact O-N 2.86Å; S480-N482 PolarHBondContact O-N 3.13Å; S480-D483 PolarHBondContact O-N 3.01Å; S480-Y484 PolarHBondContact O-N 2.78Å
481	P	60.1	Low	57.4	Low	99 Å²	99	122.2 Å²	122.2	64%	0.643	63%	0.625	S	S	*	*	H	α-helix	trans	-50.9	-26.2	177.5	-28.4	33.6	0	0	0	114.4	I485	P481-I485 WeakPolarHBondContact O-CG1 3.47Å; P481-I485 PolarHBondContact O-N 3.38Å; P481-I485 VanDerWaalsContact O-N 3.16Å
482	N	63.8	Low	60.1	Low	83 Å²	83	123.4 Å²	123.4	44%	0.444	62%	0.624	S	S	.	*	H	α-helix	trans	-68.8	-32.4	174.9	-80	-47.7	0	0	0	113.5	R37 S480 R486	R37-N482 PolarHBondContact NH2-OD1 2.76Å; S480-N482 PolarHBondContact O-N 3.13Å; N482-R486 WeakPolarHBondContact O-CB 3.36Å; N482-R486 PolarHBondContact O-N 2.91Å
483	D	73.5	Confident	62.6	Low	61 Å²	61	121.3 Å²	121.3	33%	0.326	61%	0.609	S	S	.	*	H	α-helix	trans	-74	-38.4	177.4	-66.7	-34.8	0	0	0	110.5	L479 S480 I485 R486 E487	L479-D483 HydrophobicContact CD2-CB 3.88Å; S480-D483 PolarHBondContact O-N 3.01Å; D483-I485 PolarHBondContact O-N 3.12Å; D483-R486 WeakPolarHBondContact O-CB 3.09Å; D483-R486 PolarHBondContact O-N 2.89Å; D483-R486 VanDerWaalsContact O-N 3.11Å; D483-E487 WeakPolarHBondContact O-CB 3.22Å; D483-E487 PolarHBondContact O-N 3.36Å
484	Y	68.8	Low	65.1	Low	156 Å²	156	118.1 Å²	118.1	61%	0.612	60%	0.6	S	S	*	*	H	α-helix	trans	-62.1	-42.1	173.3	-170.8	-106.6	0	0	0	112.7	S480 R486 E487 L488	S480-Y484 PolarHBondContact O-N 2.78Å; Y484-R486 VanDerWaalsContact C-N 3.3Å; Y484-R486 PolarHBondContact O-N 2.82Å; Y484-E487 WeakPolarHBondContact O-CB 3.39Å; Y484-E487 PolarHBondContact O-N 3Å; Y484-L488 HydrophobicContact CD1-CD1 3.85Å; Y484-L488 HydrophobicContact CE1-CD1 3.43Å; Y484-L488 VanDerWaalsContact CE1-CD1 3.43Å; Y484-L488 HydrophobicContact CE1-CG 4.33Å; Y484-L488 PolarHBondContact O-N 2.83Å
485	I	75.2	Confident	67.3	Low	76 Å²	76	113.6 Å²	113.6	39%	0.39	58%	0.584	S	S	.	*	H	α-helix	trans	-65.5	-35.3	174.1	-67.6	170.8	0	0	0	111.1	P481 D483 K489	P481-I485 WeakPolarHBondContact O-CG1 3.47Å; P481-I485 PolarHBondContact O-N 3.38Å; P481-I485 VanDerWaalsContact O-N 3.16Å; D483-I485 PolarHBondContact O-N 3.12Å; I485-K489 WeakPolarHBondContact O-CG 3.37Å; I485-K489 PolarHBondContact O-N 3.16Å; I485-K489 VanDerWaalsContact O-N 3.07Å
486	R	77.2	Confident	69.8	Low	173 Å²	173	110.2 Å²	110.2	65%	0.653	57%	0.566	S	S	*	*	H	α-helix	trans	-69.3	-41.3	178.1	-165.9	-178.1	-64.7	178.9	3.5	111.4	N482 D483 Y484 K489 A490	N482-R486 WeakPolarHBondContact O-CB 3.36Å; N482-R486 PolarHBondContact O-N 2.91Å; D483-R486 WeakPolarHBondContact O-CB 3.09Å; D483-R486 PolarHBondContact O-N 2.89Å; D483-R486 VanDerWaalsContact O-N 3.11Å; Y484-R486 VanDerWaalsContact C-N 3.3Å; Y484-R486 PolarHBondContact O-N 2.82Å; R486-K489 PolarHBondContact O-N 3.38Å; R486-A490 WeakPolarHBondContact O-CB 3.42Å; R486-A490 PolarHBondContact O-N 3.19Å
487	E	82.1	Confident	72.2	Confident	113 Å²	113	106.5 Å²	106.5	53%	0.528	55%	0.552	S	S	.	*	H	α-helix	trans	-57.5	-51.7	172.8	-173.7	89.3	-151.7	0	0	110.7	D483 Y484 K489 A490 Q491	D483-E487 WeakPolarHBondContact O-CB 3.22Å; D483-E487 PolarHBondContact O-N 3.36Å; Y484-E487 WeakPolarHBondContact O-CB 3.39Å; Y484-E487 PolarHBondContact O-N 3Å; E487-K489 VanDerWaalsContact C-N 3.33Å; E487-K489 PolarHBondContact O-N 2.89Å; E487-A490 PolarHBondContact O-N 2.86Å; E487-A490 VanDerWaalsContact O-N 3.13Å; E487-Q491 WeakPolarHBondContact O-CG 3.29Å; E487-Q491 PolarHBondContact O-N 2.85Å
488	L	78.8	Confident	74	Confident	80 Å²	80	107.8 Å²	107.8	42%	0.419	55%	0.545	S	S	.	.	H	α-helix	trans	-60.8	-39.8	178.6	-83	166.6	0	0	0	112.7	Y484 Q491 L492	Y484-L488 HydrophobicContact CD1-CD1 3.85Å; Y484-L488 HydrophobicContact CE1-CD1 3.43Å; Y484-L488 VanDerWaalsContact CE1-CD1 3.43Å; Y484-L488 HydrophobicContact CE1-CG 4.33Å; Y484-L488 PolarHBondContact O-N 2.83Å; L488-Q491 PolarHBondContact O-N 2.84Å; L488-L492 PolarHBondContact O-N 3.49Å
489	K	82.4	Confident	75.9	Confident	150 Å²	150	102.4 Å²	102.4	65%	0.652	52%	0.52	S	S	*	.	H	α-helix	trans	-65.4	-40.4	174.7	-78	-173.6	177.2	-169.8	0	112.3	I485 R486 E487 L492 Q493	I485-K489 WeakPolarHBondContact O-CG 3.37Å; I485-K489 PolarHBondContact O-N 3.16Å; I485-K489 VanDerWaalsContact O-N 3.07Å; R486-K489 PolarHBondContact O-N 3.38Å; E487-K489 VanDerWaalsContact C-N 3.33Å; E487-K489 PolarHBondContact O-N 2.89Å; K489-L492 PolarHBondContact O-N 3.25Å; K489-Q493 PolarHBondContact O-N 3.25Å
490	A	83.1	Confident	77.6	Confident	61 Å²	61	98.9 Å²	98.9	50%	0.504	51%	0.51	S	S	.	.	H	α-helix	trans	-65.7	-40	176.6	0	0	0	0	0	111.8	R486 E487 Q493 S494	R486-A490 WeakPolarHBondContact O-CB 3.42Å; R486-A490 PolarHBondContact O-N 3.19Å; E487-A490 PolarHBondContact O-N 2.86Å; E487-A490 VanDerWaalsContact O-N 3.13Å; A490-Q493 PolarHBondContact O-N 3.47Å; A490-S494 WeakPolarHBondContact O-CB 3.49Å; A490-S494 PolarHBondContact O-N 2.95Å
491	Q	83.5	Confident	79.2	Confident	109 Å²	109	103.1 Å²	103.1	51%	0.509	52%	0.518	S	S	.	.	H	α-helix	trans	-64.8	-41.3	175.6	-71.2	179.6	10	0	0	112	E487 L488 S494 A495	E487-Q491 WeakPolarHBondContact O-CG 3.29Å; E487-Q491 PolarHBondContact O-N 2.85Å; L488-Q491 PolarHBondContact O-N 2.84Å; Q491-S494 PolarHBondContact O-N 2.83Å; Q491-A495 WeakPolarHBondContact O-CB 3.37Å; Q491-A495 PolarHBondContact O-N 2.82Å
492	L	83.7	Confident	80.3	Confident	112 Å²	112	102 Å²	102	59%	0.586	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-43.8	175.6	-177.2	64.2	0	0	0	111.9	L488 K489 A495 L496	L488-L492 PolarHBondContact O-N 3.49Å; K489-L492 PolarHBondContact O-N 3.25Å; L492-A495 PolarHBondContact O-N 2.87Å; L492-L496 HydrophobicContact CG-CD1 4.38Å; L492-L496 WeakPolarHBondContact O-CG 3.27Å; L492-L496 PolarHBondContact O-N 2.81Å
493	Q	85.4	Confident	81	Confident	101 Å²	101	106 Å²	106	47%	0.472	52%	0.515	S	S	.	.	H	α-helix	trans	-63.5	-44.4	178.3	-170.1	61.3	44	0	0	111.5	K489 A490 A495 L496 D497	K489-Q493 PolarHBondContact O-N 3.25Å; A490-Q493 PolarHBondContact O-N 3.47Å; Q493-A495 VanDerWaalsContact C-N 3.29Å; Q493-A495 PolarHBondContact O-N 2.67Å; Q493-L496 PolarHBondContact O-N 2.9Å; Q493-D497 PolarHBondContact NE2-OD1 2.87Å; Q493-D497 VanDerWaalsContact O-CG 3.24Å; Q493-D497 PolarHBondContact O-N 3.09Å
494	S	83.8	Confident	81.4	Confident	79 Å²	79	108.8 Å²	108.8	55%	0.552	53%	0.526	S	S	*	.	H	α-helix	trans	-60.2	-37.6	175.7	-177.6	0	0	0	0	112.6	A490 Q491 R498	A490-S494 WeakPolarHBondContact O-CB 3.49Å; A490-S494 PolarHBondContact O-N 2.95Å; Q491-S494 PolarHBondContact O-N 2.83Å; S494-R498 WeakPolarHBondContact O-CB 3.23Å; S494-R498 PolarHBondContact O-N 3.26Å
495	A	79.2	Confident	81.9	Confident	57 Å²	57	104.2 Å²	104.2	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-67.2	-41.3	175.5	0	0	0	0	0	112.5	Q491 L492 Q493 R498 E499	Q491-A495 WeakPolarHBondContact O-CB 3.37Å; Q491-A495 PolarHBondContact O-N 2.82Å; L492-A495 PolarHBondContact O-N 2.87Å; Q493-A495 VanDerWaalsContact C-N 3.29Å; Q493-A495 PolarHBondContact O-N 2.67Å; A495-R498 PolarHBondContact O-N 2.81Å; A495-E499 PolarHBondContact O-N 2.85Å
496	L	85.4	Confident	81.9	Confident	85 Å²	85	105.5 Å²	105.5	45%	0.445	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-43.5	176	-72.9	169.5	0	0	0	111.9	L492 Q493 R498 E499 A500	L492-L496 HydrophobicContact CG-CD1 4.38Å; L492-L496 WeakPolarHBondContact O-CG 3.27Å; L492-L496 PolarHBondContact O-N 2.81Å; Q493-L496 PolarHBondContact O-N 2.9Å; L496-R498 VanDerWaalsContact C-N 3.29Å; L496-R498 PolarHBondContact O-N 3.49Å; L496-E499 PolarHBondContact O-N 3.36Å; L496-A500 PolarHBondContact O-N 3.43Å
497	D	86.6	Confident	82.1	Confident	92 Å²	92	100.2 Å²	100.2	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-38.2	177.2	-64.1	-17.4	0	0	0	111	Q493 A500 Y501	Q493-D497 PolarHBondContact NE2-OD1 2.87Å; Q493-D497 VanDerWaalsContact O-CG 3.24Å; Q493-D497 PolarHBondContact O-N 3.09Å; D497-A500 PolarHBondContact O-N 3.36Å; D497-Y501 WeakPolarHBondContact O-CB 3.26Å; D497-Y501 PolarHBondContact O-N 3.45Å
498	R	81.1	Confident	82	Confident	184 Å²	184	99.8 Å²	99.8	69%	0.694	51%	0.509	S	S	*	.	H	α-helix	trans	-66	-39.5	174.8	-171.9	173.7	-175.6	146.5	0.9	112.3	S494 A495 L496 L502	S494-R498 WeakPolarHBondContact O-CB 3.23Å; S494-R498 PolarHBondContact O-N 3.26Å; A495-R498 PolarHBondContact O-N 2.81Å; L496-R498 VanDerWaalsContact C-N 3.29Å; L496-R498 PolarHBondContact O-N 3.49Å; R498-L502 HydrophobicContact CG-CD1 4.36Å; R498-L502 VanDerWaalsContact O-CG 3.28Å; R498-L502 WeakPolarHBondContact O-CG 3.41Å; R498-L502 PolarHBondContact O-N 2.94Å
499	E	82.1	Confident	82	Confident	88 Å²	88	102.7 Å²	102.7	41%	0.411	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-46	174.9	-169.2	-170.2	161.1	0	0	111.3	A495 L496 Y501 L502 R503	A495-E499 PolarHBondContact O-N 2.85Å; L496-E499 PolarHBondContact O-N 3.36Å; E499-Y501 VanDerWaalsContact C-N 3.34Å; E499-Y501 PolarHBondContact O-N 2.81Å; E499-L502 PolarHBondContact O-N 2.76Å; E499-R503 WeakPolarHBondContact O-CG 3.26Å; E499-R503 PolarHBondContact O-N 2.8Å; E499-R503 IonicContact OE1-CZ 3.77Å; E499-R503 VanDerWaalsContact OE1-CZ 3.22Å; E499-R503 IonicContact OE1-NE 2.7Å; E499-R503 PolarHBondContact OE1-NE 3.39Å; E499-R503 VanDerWaalsContact OE1-NE 3.07Å; E499-R503 IonicContact OE1-NH2 3.71Å; E499-R503 PolarHBondContact OE1-NH2 2.82Å
500	A	82.2	Confident	81.7	Confident	60 Å²	60	100.9 Å²	100.9	50%	0.496	51%	0.508	S	S	.	.	H	α-helix	trans	-59	-44.5	177.8	0	0	0	0	0	111.8	L496 D497 L502 R503 Q504	L496-A500 PolarHBondContact O-N 3.43Å; D497-A500 PolarHBondContact O-N 3.36Å; A500-L502 PolarHBondContact O-N 2.81Å; A500-R503 PolarHBondContact O-N 2.86Å; A500-Q504 PolarHBondContact O-N 2.9Å
501	Y	84.7	Confident	81.4	Confident	147 Å²	147	100.1 Å²	100.1	58%	0.576	50%	0.502	S	S	*	.	H	α-helix	trans	-60.7	-43.7	175.2	178.1	-104.8	0	0	0	112.6	D497 E499 Q504 M505	D497-Y501 WeakPolarHBondContact O-CB 3.26Å; D497-Y501 PolarHBondContact O-N 3.45Å; E499-Y501 VanDerWaalsContact C-N 3.34Å; E499-Y501 PolarHBondContact O-N 2.81Å; Y501-Q504 PolarHBondContact O-N 2.85Å; Y501-M505 HydrophobicContact CD1-CE 3.96Å; Y501-M505 HydrophobicContact CE1-CE 3.41Å; Y501-M505 VanDerWaalsContact CE1-CE 3.41Å; Y501-M505 PolarHBondContact O-N 2.82Å
502	L	82.9	Confident	81.2	Confident	76 Å²	76	96.2 Å²	96.2	40%	0.398	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-39.8	177.6	-72.4	170.3	0	0	0	112.1	R498 E499 A500 M505 L506	R498-L502 HydrophobicContact CG-CD1 4.36Å; R498-L502 VanDerWaalsContact O-CG 3.28Å; R498-L502 WeakPolarHBondContact O-CG 3.41Å; R498-L502 PolarHBondContact O-N 2.94Å; E499-L502 PolarHBondContact O-N 2.76Å; A500-L502 PolarHBondContact O-N 2.81Å; L502-M505 HydrophobicContact CD2-CE 3.89Å; L502-M505 PolarHBondContact O-N 2.89Å; L502-L506 WeakPolarHBondContact O-CG 3.49Å; L502-L506 PolarHBondContact O-N 2.97Å
503	R	79.7	Confident	80.6	Confident	165 Å²	165	96.4 Å²	96.4	62%	0.623	49%	0.49	S	S	*	.	H	α-helix	trans	-63	-42.6	175.3	-73.1	-174.5	-176.6	-159.6	2.5	112	E499 A500 M505 L506 S507	E499-R503 WeakPolarHBondContact O-CG 3.26Å; E499-R503 PolarHBondContact O-N 2.8Å; E499-R503 IonicContact OE1-CZ 3.77Å; E499-R503 VanDerWaalsContact OE1-CZ 3.22Å; E499-R503 IonicContact OE1-NE 2.7Å; E499-R503 PolarHBondContact OE1-NE 3.39Å; E499-R503 VanDerWaalsContact OE1-NE 3.07Å; E499-R503 IonicContact OE1-NH2 3.71Å; E499-R503 PolarHBondContact OE1-NH2 2.82Å; A500-R503 PolarHBondContact O-N 2.86Å; R503-M505 VanDerWaalsContact C-N 3.34Å; R503-M505 PolarHBondContact O-N 2.88Å; R503-L506 PolarHBondContact O-N 3Å; R503-S507 PolarHBondContact O-N 3.37Å
504	Q	82.2	Confident	80.1	Confident	121 Å²	121	99.5 Å²	99.5	57%	0.565	50%	0.498	S	S	*	.	H	α-helix	trans	-62.9	-41.7	175.3	-171.5	-179.5	8.8	0	0	111.7	A500 Y501 L506 S507 N508	A500-Q504 PolarHBondContact O-N 2.9Å; Y501-Q504 PolarHBondContact O-N 2.85Å; Q504-L506 PolarHBondContact O-N 3.12Å; Q504-S507 PolarHBondContact O-N 2.86Å; Q504-N508 PolarHBondContact O-N 3.32Å
505	M	79.7	Confident	79.9	Confident	60 Å²	60	100.7 Å²	100.7	30%	0.296	50%	0.495	S	S	.	.	H	α-helix	trans	-64.9	-38.7	178.4	-155.2	-160.6	-43.1	0	0	112.4	Y501 L502 R503 R509	Y501-M505 HydrophobicContact CD1-CE 3.96Å; Y501-M505 HydrophobicContact CE1-CE 3.41Å; Y501-M505 VanDerWaalsContact CE1-CE 3.41Å; Y501-M505 PolarHBondContact O-N 2.82Å; L502-M505 HydrophobicContact CD2-CE 3.89Å; L502-M505 PolarHBondContact O-N 2.89Å; R503-M505 VanDerWaalsContact C-N 3.34Å; R503-M505 PolarHBondContact O-N 2.88Å; M505-R509 PolarHBondContact O-N 2.8Å
506	L	75.1	Confident	79.6	Confident	102 Å²	102	102.8 Å²	102.8	53%	0.534	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-46.8	173.5	-77.6	167.4	0	0	0	111.3	L502 R503 Q504 N508 R509 E510	L502-L506 WeakPolarHBondContact O-CG 3.49Å; L502-L506 PolarHBondContact O-N 2.97Å; R503-L506 PolarHBondContact O-N 3Å; Q504-L506 PolarHBondContact O-N 3.12Å; L506-N508 VanDerWaalsContact C-N 3.32Å; L506-N508 PolarHBondContact O-N 2.79Å; L506-R509 PolarHBondContact O-N 3.11Å; L506-R509 VanDerWaalsContact O-N 3.1Å; L506-E510 WeakPolarHBondContact O-CG 3.29Å; L506-E510 PolarHBondContact O-N 3.26Å
507	S	81.5	Confident	79.1	Confident	62 Å²	62	103.4 Å²	103.4	43%	0.434	50%	0.5	S	S	.	.	H	α-helix	trans	-58.3	-42.4	176.2	-178.6	0	0	0	0	112.4	R503 Q504 R509 E510 A511	R503-S507 PolarHBondContact O-N 3.37Å; Q504-S507 PolarHBondContact O-N 2.86Å; S507-R509 VanDerWaalsContact C-N 3.35Å; S507-E510 PolarHBondContact O-N 2.79Å; S507-A511 PolarHBondContact O-N 3.33Å
508	N	79.2	Confident	78.6	Confident	105 Å²	105	104.9 Å²	104.9	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-65.6	-37.5	176.5	-72.1	-12.1	0	0	0	112.1	Q504 L506 A511 G512	Q504-N508 PolarHBondContact O-N 3.32Å; L506-N508 VanDerWaalsContact C-N 3.32Å; L506-N508 PolarHBondContact O-N 2.79Å; N508-A511 PolarHBondContact O-N 3.33Å; N508-G512 PolarHBondContact O-N 3.34Å
509	R	78	Confident	78.5	Confident	140 Å²	140	101.3 Å²	101.3	53%	0.528	49%	0.494	S	S	.	.	H	α-helix	trans	-68.8	-40.4	175.5	-82.1	-177.3	161.7	152	-9.4	112.4	M505 L506 S507 A511 G512 M513	M505-R509 PolarHBondContact O-N 2.8Å; L506-R509 PolarHBondContact O-N 3.11Å; L506-R509 VanDerWaalsContact O-N 3.1Å; S507-R509 VanDerWaalsContact C-N 3.35Å; R509-A511 VanDerWaalsContact C-N 3.33Å; R509-G512 PolarHBondContact O-N 3.49Å; R509-M513 WeakPolarHBondContact O-CB 3.38Å; R509-M513 PolarHBondContact O-N 2.78Å
510	E	77.1	Confident	78	Confident	112 Å²	112	100.3 Å²	100.3	52%	0.523	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-36.8	174.4	-73.3	177.9	175.2	0	0	112	L506 S507 M513 R514	L506-E510 WeakPolarHBondContact O-CG 3.29Å; L506-E510 PolarHBondContact O-N 3.26Å; S507-E510 PolarHBondContact O-N 2.79Å; E510-M513 PolarHBondContact O-N 3.13Å; E510-R514 WeakPolarHBondContact O-CG 3.47Å; E510-R514 PolarHBondContact O-N 2.83Å
511	A	77.3	Confident	77.6	Confident	45 Å²	45	102.8 Å²	102.8	37%	0.372	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-45.5	172	0	0	0	0	0	112	S507 N508 R509 M513 R514 E515	S507-A511 PolarHBondContact O-N 3.33Å; N508-A511 PolarHBondContact O-N 3.33Å; R509-A511 VanDerWaalsContact C-N 3.33Å; A511-M513 VanDerWaalsContact C-N 3.32Å; A511-M513 PolarHBondContact O-N 2.6Å; A511-R514 PolarHBondContact O-N 3.05Å; A511-E515 PolarHBondContact O-N 3.18Å
512	G	77.7	Confident	77.1	Confident	27 Å²	27	100 Å²	100	28%	0.278	49%	0.49	S	S	.	.	H	α-helix	trans	-63.8	-36	176.1	0	0	0	0	0	113.1	N508 R509 E515 I516	N508-G512 PolarHBondContact O-N 3.34Å; R509-G512 PolarHBondContact O-N 3.49Å; G512-E515 PolarHBondContact O-N 3.2Å; G512-I516 WeakPolarHBondContact O-CG1 3.42Å; G512-I516 PolarHBondContact O-N 3.17Å; G512-I516 VanDerWaalsContact O-N 3.08Å
513	M	72.1	Confident	76.4	Confident	116 Å²	116	101 Å²	101	57%	0.571	50%	0.495	S	S	*	.	H	α-helix	trans	-67.4	-42.8	176	-162.6	150	62.5	0	0	111.4	R509 E510 A511 E515 I516 D517	R509-M513 WeakPolarHBondContact O-CB 3.38Å; R509-M513 PolarHBondContact O-N 2.78Å; E510-M513 PolarHBondContact O-N 3.13Å; A511-M513 VanDerWaalsContact C-N 3.32Å; A511-M513 PolarHBondContact O-N 2.6Å; M513-E515 VanDerWaalsContact C-N 3.32Å; M513-E515 PolarHBondContact O-N 3.48Å; M513-I516 PolarHBondContact O-N 3.31Å; M513-I516 VanDerWaalsContact O-N 3.16Å; M513-D517 PolarHBondContact O-N 3.26Å
514	R	75.2	Confident	75.6	Confident	167 Å²	167	98.7 Å²	98.7	63%	0.63	49%	0.491	S	S	*	.	H	α-helix	trans	-59.5	-39.1	172.5	-77.1	-172.4	-74.1	-175.8	-3.5	112.9	E510 A511 I516 D517 Q518	E510-R514 WeakPolarHBondContact O-CG 3.47Å; E510-R514 PolarHBondContact O-N 2.83Å; A511-R514 PolarHBondContact O-N 3.05Å; R514-I516 VanDerWaalsContact C-N 3.34Å; R514-D517 PolarHBondContact O-N 3.47Å; R514-Q518 WeakPolarHBondContact O-CB 3.32Å; R514-Q518 PolarHBondContact O-N 3.11Å
515	E	79.1	Confident	74.7	Confident	104 Å²	104	97.1 Å²	97.1	49%	0.486	49%	0.486	S	S	.	.	H	α-helix	trans	-66	-38	176.5	-162.7	-164.4	153.9	0	0	111.9	A511 G512 M513 K519	A511-E515 PolarHBondContact O-N 3.18Å; G512-E515 PolarHBondContact O-N 3.2Å; M513-E515 VanDerWaalsContact C-N 3.32Å; M513-E515 PolarHBondContact O-N 3.48Å; E515-K519 WeakPolarHBondContact O-CG 3.32Å; E515-K519 PolarHBondContact O-N 2.9Å; E515-K519 VanDerWaalsContact OE1-CE 3.31Å; E515-K519 WeakPolarHBondContact OE1-CE 3.31Å; E515-K519 IonicContact OE1-NZ 3.69Å; E515-K519 PolarHBondContact OE1-NZ 3.04Å
516	I	72.6	Confident	73.8	Confident	100 Å²	100	99.1 Å²	99.1	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-45.5	174.8	-68.8	168	0	0	0	110.3	G512 M513 R514 Q518 K519 V520	G512-I516 WeakPolarHBondContact O-CG1 3.42Å; G512-I516 PolarHBondContact O-N 3.17Å; G512-I516 VanDerWaalsContact O-N 3.08Å; M513-I516 PolarHBondContact O-N 3.31Å; M513-I516 VanDerWaalsContact O-N 3.16Å; R514-I516 VanDerWaalsContact C-N 3.34Å; I516-Q518 VanDerWaalsContact C-N 3.27Å; I516-Q518 PolarHBondContact O-N 2.65Å; I516-K519 WeakPolarHBondContact O-CB 3.25Å; I516-K519 PolarHBondContact O-N 2.82Å; I516-V520 HydrophobicContact CG2-CG2 4.28Å; I516-V520 WeakPolarHBondContact O-CG2 3.41Å; I516-V520 PolarHBondContact O-N 2.91Å
517	D	74.9	Confident	72.8	Confident	98 Å²	98	100.6 Å²	100.6	52%	0.524	50%	0.502	S	S	.	.	H	α-helix	trans	-58.8	-41.7	177.6	-69.6	-24	0	0	0	111	M513 R514 K519 V520 E521	M513-D517 PolarHBondContact O-N 3.26Å; R514-D517 PolarHBondContact O-N 3.47Å; D517-K519 VanDerWaalsContact C-N 3.34Å; D517-K519 PolarHBondContact O-N 3.5Å; D517-V520 PolarHBondContact O-N 2.89Å; D517-E521 WeakPolarHBondContact O-CB 3.06Å; D517-E521 PolarHBondContact O-N 3.31Å
518	Q	75.6	Confident	71.5	Confident	123 Å²	123	104.4 Å²	104.4	58%	0.575	51%	0.514	S	S	*	.	H	α-helix	trans	-65.4	-35.9	176	-144.8	172.1	25.4	0	0	112.5	R514 I516 N522	R514-Q518 WeakPolarHBondContact O-CB 3.32Å; R514-Q518 PolarHBondContact O-N 3.11Å; I516-Q518 VanDerWaalsContact C-N 3.27Å; I516-Q518 PolarHBondContact O-N 2.65Å; Q518-N522 WeakPolarHBondContact O-CB 3.4Å; Q518-N522 PolarHBondContact O-N 3Å; Q518-N522 PolarHBondContact O-ND2 2.9Å; Q518-N522 VanDerWaalsContact O-ND2 3.11Å
519	K	79.1	Confident	70.2	Confident	109 Å²	109	108.3 Å²	108.3	47%	0.474	53%	0.526	S	S	.	.	H	α-helix	trans	-69.4	-39.5	173.6	-75.9	173.6	-173.5	164.5	0	111.9	E515 I516 D517 N522 I523	E515-K519 WeakPolarHBondContact O-CG 3.32Å; E515-K519 PolarHBondContact O-N 2.9Å; E515-K519 VanDerWaalsContact OE1-CE 3.31Å; E515-K519 WeakPolarHBondContact OE1-CE 3.31Å; E515-K519 IonicContact OE1-NZ 3.69Å; E515-K519 PolarHBondContact OE1-NZ 3.04Å; I516-K519 WeakPolarHBondContact O-CB 3.25Å; I516-K519 PolarHBondContact O-N 2.82Å; D517-K519 VanDerWaalsContact C-N 3.34Å; D517-K519 PolarHBondContact O-N 3.5Å; K519-N522 PolarHBondContact O-N 2.84Å; K519-I523 VanDerWaalsContact O-CG1 3.28Å; K519-I523 WeakPolarHBondContact O-CG1 3.37Å; K519-I523 PolarHBondContact O-N 3.1Å
520	V	71.7	Confident	68.6	Low	67 Å²	67	106.9 Å²	106.9	41%	0.406	53%	0.529	S	S	.	.	H	α-helix	trans	-64.6	-46.1	176	172.8	0	0	0	0	110	I516 D517 N522 I523 E524	I516-V520 HydrophobicContact CG2-CG2 4.28Å; I516-V520 WeakPolarHBondContact O-CG2 3.41Å; I516-V520 PolarHBondContact O-N 2.91Å; D517-V520 PolarHBondContact O-N 2.89Å; V520-N522 VanDerWaalsContact C-N 3.31Å; V520-N522 PolarHBondContact O-N 3.46Å; V520-I523 PolarHBondContact O-N 3.32Å; V520-I523 VanDerWaalsContact O-N 3.09Å; V520-E524 HydrophobicContact CG1-CG 4.47Å; V520-E524 PolarHBondContact O-N 2.99Å
521	E	73.6	Confident	66.9	Low	113 Å²	113	108 Å²	108	53%	0.528	54%	0.539	S	S	.	.	H	α-helix	trans	-60.5	-39.5	175.7	-171.1	-179.4	-173.9	0	0	111.9	D517 E524 N525	D517-E521 WeakPolarHBondContact O-CB 3.06Å; D517-E521 PolarHBondContact O-N 3.31Å; E521-E524 PolarHBondContact O-N 3.15Å; E521-N525 VanDerWaalsContact O-CB 3.3Å; E521-N525 WeakPolarHBondContact O-CB 3.47Å; E521-N525 VanDerWaalsContact O-CG 3.24Å; E521-N525 PolarHBondContact O-N 2.6Å; E521-N525 PolarHBondContact O-ND2 2.98Å; E521-N525 VanDerWaalsContact O-ND2 3.08Å
522	N	74.2	Confident	65.2	Low	89 Å²	89	110.1 Å²	110.1	48%	0.476	55%	0.551	S	S	.	*	H	α-helix	trans	-64.7	-38.8	173.9	-75.7	-29.6	0	0	0	112.7	Q518 K519 V520 N525 I526	Q518-N522 WeakPolarHBondContact O-CB 3.4Å; Q518-N522 PolarHBondContact O-N 3Å; Q518-N522 PolarHBondContact O-ND2 2.9Å; Q518-N522 VanDerWaalsContact O-ND2 3.11Å; K519-N522 PolarHBondContact O-N 2.84Å; V520-N522 VanDerWaalsContact C-N 3.31Å; V520-N522 PolarHBondContact O-N 3.46Å; N522-N525 PolarHBondContact O-N 2.84Å; N522-I526 VanDerWaalsContact O-CG1 3.26Å; N522-I526 WeakPolarHBondContact O-CG1 3.29Å; N522-I526 PolarHBondContact O-N 3.04Å
523	I	68.1	Low	63.6	Low	95 Å²	95	113.2 Å²	113.2	49%	0.487	57%	0.568	S	S	.	*	H	α-helix	trans	-67.6	-45.3	176.2	-68.9	164.8	0	0	0	110.2	K519 V520 N525 I526 E527	K519-I523 VanDerWaalsContact O-CG1 3.28Å; K519-I523 WeakPolarHBondContact O-CG1 3.37Å; K519-I523 PolarHBondContact O-N 3.1Å; V520-I523 PolarHBondContact O-N 3.32Å; V520-I523 VanDerWaalsContact O-N 3.09Å; I523-N525 VanDerWaalsContact C-N 3.28Å; I523-N525 PolarHBondContact O-N 2.88Å; I523-I526 PolarHBondContact O-N 3.09Å; I523-I526 VanDerWaalsContact O-N 3.1Å; I523-E527 PolarHBondContact O-N 2.83Å
524	E	63.1	Low	62.1	Low	117 Å²	117	117.1 Å²	117.1	55%	0.547	58%	0.582	S	S	.	*	H	α-helix	trans	-61	-38.3	176	-72.3	-174.7	166	0	0	111.4	V520 E521 I526 E527 M528	V520-E524 HydrophobicContact CG1-CG 4.47Å; V520-E524 PolarHBondContact O-N 2.99Å; E521-E524 PolarHBondContact O-N 3.15Å; E524-I526 PolarHBondContact O-N 3.35Å; E524-E527 PolarHBondContact O-N 3.17Å; E524-M528 WeakPolarHBondContact O-CB 3.47Å; E524-M528 WeakPolarHBondContact O-CG 3.27Å; E524-M528 PolarHBondContact O-N 2.91Å
525	N	64.6	Low	60.7	Low	88 Å²	88	118 Å²	118	47%	0.471	59%	0.59	S	S	.	*	H	α-helix	trans	-68.2	-30.9	174.7	-78.2	-37.7	0	0	0	113.5	E521 N522 I523 K529	E521-N525 VanDerWaalsContact O-CB 3.3Å; E521-N525 WeakPolarHBondContact O-CB 3.47Å; E521-N525 VanDerWaalsContact O-CG 3.24Å; E521-N525 PolarHBondContact O-N 2.6Å; E521-N525 PolarHBondContact O-ND2 2.98Å; E521-N525 VanDerWaalsContact O-ND2 3.08Å; N522-N525 PolarHBondContact O-N 2.84Å; I523-N525 VanDerWaalsContact C-N 3.28Å; I523-N525 PolarHBondContact O-N 2.88Å; N525-K529 PolarHBondContact O-N 2.86Å
526	I	60.6	Low	59.1	Low	102 Å²	102	119 Å²	119	52%	0.523	60%	0.599	S	S	.	*	H	α-helix	trans	-73.4	-44.8	173.1	-68.9	164.5	0	0	0	110	N522 I523 E524 M528 K529 D530	N522-I526 VanDerWaalsContact O-CG1 3.26Å; N522-I526 WeakPolarHBondContact O-CG1 3.29Å; N522-I526 PolarHBondContact O-N 3.04Å; I523-I526 PolarHBondContact O-N 3.09Å; I523-I526 VanDerWaalsContact O-N 3.1Å; E524-I526 PolarHBondContact O-N 3.35Å; I526-M528 VanDerWaalsContact C-N 3.31Å; I526-M528 PolarHBondContact O-N 2.82Å; I526-K529 PolarHBondContact O-N 2.82Å; I526-K529 VanDerWaalsContact O-N 3.12Å; I526-D530 PolarHBondContact O-N 2.78Å
527	E	54.2	Low	58.1	Low	134 Å²	134	118.4 Å²	118.4	63%	0.626	60%	0.601	S	S	*	*	H	α-helix	trans	-63.9	-34.9	177.2	-75.6	-171.3	162.4	0	0	112.4	I523 E524 K529 D530	I523-E527 PolarHBondContact O-N 2.83Å; E524-E527 PolarHBondContact O-N 3.17Å; E527-K529 VanDerWaalsContact C-N 3.32Å; E527-K529 PolarHBondContact O-N 2.84Å; E527-D530 CarbonylContact O-C 3.57Å; E527-D530 PolarHBondContact O-N 2.88Å
528	M	52.4	Low	57	Low	142 Å²	142	123.5 Å²	123.5	70%	0.7	62%	0.619	S	S	*	*	H	α-helix	trans	-70.3	-26.2	175	-72.7	-73.6	-75	0	0	113.2	E524 I526	E524-M528 WeakPolarHBondContact O-CB 3.47Å; E524-M528 WeakPolarHBondContact O-CG 3.27Å; E524-M528 PolarHBondContact O-N 2.91Å; I526-M528 VanDerWaalsContact C-N 3.31Å; I526-M528 PolarHBondContact O-N 2.82Å
529	K	53.7	Low	56	Low	186 Å²	186	125.6 Å²	125.6	81%	0.809	63%	0.634	S	S	*	*	H	α-helix	trans	-83.8	-31.3	173	-83.9	-177.8	176.4	175.2	0	112.9	N525 I526 E527 N531	N525-K529 PolarHBondContact O-N 2.86Å; I526-K529 PolarHBondContact O-N 2.82Å; I526-K529 VanDerWaalsContact O-N 3.12Å; E527-K529 VanDerWaalsContact C-N 3.32Å; E527-K529 PolarHBondContact O-N 2.84Å; K529-N531 PolarHBondContact O-N 2.89Å
530	D	43.1	Very low	54.9	Low	110 Å²	110	122.7 Å²	122.7	59%	0.588	62%	0.623	S	S	*	*			trans	-97.8	43.6	-179.6	-77.1	-19.5	0	0	0	113	I526 E527 S532	I526-D530 PolarHBondContact O-N 2.78Å; E527-D530 CarbonylContact O-C 3.57Å; E527-D530 PolarHBondContact O-N 2.88Å; D530-S532 PolarHBondContact O-N 2.92Å
531	N	41.3	Very low	54.7	Low	136 Å²	136	122.5 Å²	122.5	73%	0.727	63%	0.625	S	S	*	*			trans	-68	28.9	163.9	-92.1	-32.4	0	0	0	113.2	K529 S533	K529-N531 PolarHBondContact O-N 2.89Å; N531-S533 PolarHBondContact O-N 2.83Å
532	S	41.9	Very low	54.5	Low	90 Å²	90	122.2 Å²	122.2	63%	0.629	63%	0.633	S	S	*	*	S	Bend	trans	-84.7	104.4	165.5	68.3	0	0	0	0	108.9	D530 F534	D530-S532 PolarHBondContact O-N 2.92Å; S532-F534 PolarHBondContact O-N 2.52Å
533	S	43.4	Very low	54.6	Low	91 Å²	91	123.5 Å²	123.5	64%	0.636	64%	0.64	S	S	*	*			trans	-16.3	117.4	169.6	63.2	0	0	0	0	114.7	N531 K535	N531-S533 PolarHBondContact O-N 2.83Å; S533-K535 PolarHBondContact O-N 2.91Å
534	F	42.6	Very low	54.9	Low	198 Å²	198	125.1 Å²	125.1	87%	0.868	64%	0.643	S	S	*	*			trans	-44.6	99.6	169.4	-126.4	-97.1	0	0	0	110.5	S532 L536	S532-F534 PolarHBondContact O-N 2.52Å; F534-L536 PolarHBondContact O-N 3.46Å
535	K	45.2	Very low	55.4	Low	185 Å²	185	123.1 Å²	123.1	80%	0.804	64%	0.636	S	S	*	*			trans	-85.4	99.4	174.3	-76.4	-176.8	-178.4	174.5	0	108.3	S533 P537	S533-K535 PolarHBondContact O-N 2.91Å; K535-P537 WeakPolarHBondContact O-CD 2.89Å
536	L	45.6	Very low	56	Low	126 Å²	126	127.8 Å²	127.8	66%	0.66	65%	0.647	S	S	*	*			trans	-54.9	124.9	165.2	-112.6	86.7	0	0	0	108.9	F534 K538	F534-L536 PolarHBondContact O-N 3.46Å; L536-K538 PolarHBondContact O-N 2.92Å; L536-K538 VanDerWaalsContact O-N 3.17Å
537	P	51.3	Low	56.9	Low	88 Å²	88	127.6 Å²	127.6	57%	0.571	65%	0.647	S	S	*	*			trans	-60.3	119.4	175.2	-19	28	0	0	0	110.3	K535 N539 I540	K535-P537 WeakPolarHBondContact O-CD 2.89Å; P537-N539 PolarHBondContact O-N 2.85Å; P537-I540 HydrophobicContact CB-CD1 4.02Å; P537-I540 HydrophobicContact CB-CG1 4.04Å; P537-I540 HydrophobicContact CG-CD1 3.92Å; P537-I540 HydrophobicContact CG-CG1 4.42Å
538	K	52.7	Low	58	Low	204 Å²	204	124.9 Å²	124.9	89%	0.887	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	10	-169.5	-73.6	-171.9	174.7	-175.6	0	116.5	L536	L536-K538 PolarHBondContact O-N 2.92Å; L536-K538 VanDerWaalsContact O-N 3.17Å
539	N	53.2	Low	59.3	Low	168 Å²	168	122.2 Å²	122.2	90%	0.898	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.7	49.4	-178.4	-97.5	-16.7	0	0	0	112	P537	P537-N539 PolarHBondContact O-N 2.85Å
540	I	56.5	Low	60.6	Low	48 Å²	48	119.3 Å²	119.3	25%	0.246	61%	0.612	C	S	.	*			trans	-83.3	123	171.7	-63.2	168	0	0	0	107.7	P537 K544 L545	P537-I540 HydrophobicContact CB-CD1 4.02Å; P537-I540 HydrophobicContact CB-CG1 4.04Å; P537-I540 HydrophobicContact CG-CD1 3.92Å; P537-I540 HydrophobicContact CG-CG1 4.42Å; I540-K544 HydrophobicContact CG2-CB 3.89Å; I540-K544 HydrophobicContact CG2-CG 4.28Å; I540-L545 HydrophobicContact CG2-CB 3.83Å
541	S	67.4	Low	62.3	Low	63 Å²	63	117.3 Å²	117.3	44%	0.441	60%	0.602	S	S	.	*			trans	-60.4	143.5	173.7	65	0	0	0	0	109.7	N543 K544 L545	S541-N543 PolarHBondContact O-N 3.19Å; S541-K544 PolarHBondContact O-N 3.47Å; S541-K544 WeakPolarHBondContact OG-CB 3.47Å; S541-K544 PolarHBondContact OG-N 2.64Å; S541-L545 PolarHBondContact O-N 2.96Å
542	P	70.1	Confident	64.2	Low	107 Å²	107	117.5 Å²	117.5	70%	0.695	59%	0.593	S	S	*	*	H	α-helix	trans	-54.7	-30.4	-178.1	16.3	-29	0	0	0	113	R546	P542-R546 WeakPolarHBondContact O-CB 3.45Å; P542-R546 PolarHBondContact O-N 3.01Å
543	N	75.2	Confident	66.1	Low	116 Å²	116	117.1 Å²	117.1	62%	0.62	58%	0.581	S	S	*	*	H	α-helix	trans	-65.9	-47	173.4	-65.9	-4.6	0	0	0	112	S541 L545 R546 D547	S541-N543 PolarHBondContact O-N 3.19Å; N543-L545 VanDerWaalsContact C-N 3.32Å; N543-L545 PolarHBondContact O-N 2.76Å; N543-R546 WeakPolarHBondContact O-CB 3.09Å; N543-R546 PolarHBondContact O-N 2.99Å; N543-R546 VanDerWaalsContact O-N 3.14Å; N543-D547 PolarHBondContact O-N 2.75Å
544	K	75.3	Confident	67.9	Low	129 Å²	129	118.3 Å²	118.3	56%	0.561	58%	0.577	S	S	*	*	H	α-helix	trans	-68.7	-31.5	-179.5	-166.9	170.6	-172.9	175.8	0	112.4	I540 S541 M548	I540-K544 HydrophobicContact CG2-CB 3.89Å; I540-K544 HydrophobicContact CG2-CG 4.28Å; S541-K544 PolarHBondContact O-N 3.47Å; S541-K544 WeakPolarHBondContact OG-CB 3.47Å; S541-K544 PolarHBondContact OG-N 2.64Å; K544-M548 WeakPolarHBondContact O-CB 3.23Å; K544-M548 VanDerWaalsContact O-CG 3.29Å; K544-M548 WeakPolarHBondContact O-CG 3.49Å; K544-M548 PolarHBondContact O-N 3.28Å
545	L	73.6	Confident	69.8	Low	74 Å²	74	113.6 Å²	113.6	39%	0.387	56%	0.556	S	S	.	*	H	α-helix	trans	-66.9	-42.1	171.5	-172.6	70.5	0	0	0	110.8	I540 S541 N543 M548 I549	I540-L545 HydrophobicContact CG2-CB 3.83Å; S541-L545 PolarHBondContact O-N 2.96Å; N543-L545 VanDerWaalsContact C-N 3.32Å; N543-L545 PolarHBondContact O-N 2.76Å; L545-M548 PolarHBondContact O-N 2.82Å; L545-I549 HydrophobicContact CD2-CD1 4.49Å; L545-I549 HydrophobicContact CG-CD1 4.01Å; L545-I549 VanDerWaalsContact O-CG1 3.25Å; L545-I549 WeakPolarHBondContact O-CG1 3.37Å; L545-I549 PolarHBondContact O-N 2.99Å
546	R	76.4	Confident	71.6	Confident	186 Å²	186	111.3 Å²	111.3	70%	0.702	55%	0.548	S	S	*	.	H	α-helix	trans	-62.1	-45.4	176.2	-166.5	175	-172.4	167	2	111.5	P542 N543 M548 I549 E550	P542-R546 WeakPolarHBondContact O-CB 3.45Å; P542-R546 PolarHBondContact O-N 3.01Å; N543-R546 WeakPolarHBondContact O-CB 3.09Å; N543-R546 PolarHBondContact O-N 2.99Å; N543-R546 VanDerWaalsContact O-N 3.14Å; R546-M548 VanDerWaalsContact C-N 3.33Å; R546-M548 PolarHBondContact O-N 2.51Å; R546-I549 PolarHBondContact O-N 3.33Å; R546-E550 WeakPolarHBondContact O-CB 3.3Å; R546-E550 PolarHBondContact O-N 2.85Å
547	D	79	Confident	73.3	Confident	99 Å²	99	112.7 Å²	112.7	53%	0.529	54%	0.544	S	S	.	.	H	α-helix	trans	-60.8	-41.9	175.9	-60.8	-20.8	0	0	0	111.5	N543 E550 D551	N543-D547 PolarHBondContact O-N 2.75Å; D547-E550 PolarHBondContact O-N 2.77Å; D547-D551 WeakPolarHBondContact O-CB 3.4Å; D547-D551 PolarHBondContact O-N 2.87Å
548	M	78	Confident	75	Confident	77 Å²	77	112.3 Å²	112.3	38%	0.379	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-44.1	175.4	-75.3	179.6	66.5	0	0	111.8	K544 L545 R546 E550 D551 Y552	K544-M548 WeakPolarHBondContact O-CB 3.23Å; K544-M548 VanDerWaalsContact O-CG 3.29Å; K544-M548 WeakPolarHBondContact O-CG 3.49Å; K544-M548 PolarHBondContact O-N 3.28Å; L545-M548 PolarHBondContact O-N 2.82Å; R546-M548 VanDerWaalsContact C-N 3.33Å; R546-M548 PolarHBondContact O-N 2.51Å; M548-E550 VanDerWaalsContact C-N 3.3Å; M548-E550 PolarHBondContact O-N 2.83Å; M548-D551 PolarHBondContact O-N 3.42Å; M548-Y552 HydrophobicContact CE-CE2 4.17Å; M548-Y552 WeakPolarHBondContact O-CB 3.46Å; M548-Y552 WeakPolarHBondContact O-CD2 3.3Å; M548-Y552 PolarHBondContact O-N 3.36Å
549	I	79.1	Confident	76.4	Confident	86 Å²	86	108.1 Å²	108.1	44%	0.441	52%	0.523	S	S	.	.	H	α-helix	trans	-60.2	-43.6	176.7	-70.4	165.1	0	0	0	110	L545 R546 Y552 E553	L545-I549 HydrophobicContact CD2-CD1 4.49Å; L545-I549 HydrophobicContact CG-CD1 4.01Å; L545-I549 VanDerWaalsContact O-CG1 3.25Å; L545-I549 WeakPolarHBondContact O-CG1 3.37Å; L545-I549 PolarHBondContact O-N 2.99Å; R546-I549 PolarHBondContact O-N 3.33Å; I549-Y552 PolarHBondContact O-N 2.87Å; I549-E553 HydrophobicContact CG2-CG 4.41Å; I549-E553 WeakPolarHBondContact O-CB 3.38Å; I549-E553 WeakPolarHBondContact O-CG 3.47Å; I549-E553 PolarHBondContact O-N 2.78Å
550	E	81.1	Confident	77.7	Confident	124 Å²	124	107.3 Å²	107.3	58%	0.579	51%	0.509	S	S	*	.	H	α-helix	trans	-66.2	-41.2	179.8	-153.7	167.3	-160.7	0	0	111.8	R546 D547 M548 E553 Q554	R546-E550 WeakPolarHBondContact O-CB 3.3Å; R546-E550 PolarHBondContact O-N 2.85Å; D547-E550 PolarHBondContact O-N 2.77Å; M548-E550 VanDerWaalsContact C-N 3.3Å; M548-E550 PolarHBondContact O-N 2.83Å; E550-E553 PolarHBondContact O-N 2.66Å; E550-Q554 WeakPolarHBondContact O-CB 3.23Å; E550-Q554 PolarHBondContact O-N 3.26Å
551	D	80.5	Confident	79.1	Confident	69 Å²	69	114.2 Å²	114.2	37%	0.369	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-40.6	172.9	-176.1	50.5	0	0	0	112	D547 M548 Q554 K555	D547-D551 WeakPolarHBondContact O-CB 3.4Å; D547-D551 PolarHBondContact O-N 2.87Å; M548-D551 PolarHBondContact O-N 3.42Å; D551-Q554 PolarHBondContact O-N 2.84Å; D551-K555 WeakPolarHBondContact O-CB 3.34Å; D551-K555 WeakPolarHBondContact O-CG 3.34Å; D551-K555 PolarHBondContact O-N 2.61Å; D551-K555 IonicContact OD1-NZ 2.71Å; D551-K555 WeakPolarHBondContact OD2-CE 3.17Å; D551-K555 IonicContact OD2-NZ 3.88Å; D551-K555 PolarHBondContact OD2-NZ 3.12Å
552	Y	79.9	Confident	80	Confident	139 Å²	139	117.4 Å²	117.4	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-66	-43.9	175.1	-87.8	-68	0	0	0	112.1	M548 I549 Q554 K555 Q556	M548-Y552 HydrophobicContact CE-CE2 4.17Å; M548-Y552 WeakPolarHBondContact O-CB 3.46Å; M548-Y552 WeakPolarHBondContact O-CD2 3.3Å; M548-Y552 PolarHBondContact O-N 3.36Å; I549-Y552 PolarHBondContact O-N 2.87Å; Y552-Q554 VanDerWaalsContact C-N 3.29Å; Y552-Q554 PolarHBondContact O-N 3.18Å; Y552-K555 PolarHBondContact O-N 2.89Å; Y552-Q556 VanDerWaalsContact O-CB 3.29Å; Y552-Q556 WeakPolarHBondContact O-CB 3.34Å; Y552-Q556 PolarHBondContact O-N 3.24Å
553	E	81.6	Confident	80.7	Confident	82 Å²	82	116.8 Å²	116.8	38%	0.383	53%	0.529	S	S	.	.	H	α-helix	trans	-60.5	-40.9	173.7	-78.6	-171.8	-166.2	0	0	111.1	I549 E550 Q556 R557	I549-E553 HydrophobicContact CG2-CG 4.41Å; I549-E553 WeakPolarHBondContact O-CB 3.38Å; I549-E553 WeakPolarHBondContact O-CG 3.47Å; I549-E553 PolarHBondContact O-N 2.78Å; E550-E553 PolarHBondContact O-N 2.66Å; E553-Q556 PolarHBondContact O-N 3.36Å; E553-R557 WeakPolarHBondContact O-CB 3.45Å; E553-R557 VanDerWaalsContact O-CG 3.25Å; E553-R557 WeakPolarHBondContact O-CG 3.46Å; E553-R557 PolarHBondContact O-N 3.36Å; E553-R557 IonicContact OE2-NH2 2.91Å; E553-R557 PolarHBondContact OE2-NH2 2.97Å
554	Q	81.3	Confident	81.2	Confident	117 Å²	117	115.2 Å²	115.2	55%	0.547	52%	0.518	S	S	.	.	H	α-helix	trans	-65.8	-45.1	177.8	-167.1	172.6	2.9	0	0	111.4	E550 D551 Y552 Q556 R557 I558	E550-Q554 WeakPolarHBondContact O-CB 3.23Å; E550-Q554 PolarHBondContact O-N 3.26Å; D551-Q554 PolarHBondContact O-N 2.84Å; Y552-Q554 VanDerWaalsContact C-N 3.29Å; Y552-Q554 PolarHBondContact O-N 3.18Å; Q554-Q556 PolarHBondContact O-N 3.23Å; Q554-R557 PolarHBondContact O-N 3.31Å; Q554-I558 HydrophobicContact CG-CD1 4.28Å; Q554-I558 VanDerWaalsContact O-CG1 3.28Å; Q554-I558 WeakPolarHBondContact O-CG1 3.37Å; Q554-I558 PolarHBondContact O-N 3.48Å
555	K	83.8	Confident	81.9	Confident	99 Å²	99	115.4 Å²	115.4	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-60.1	-43.6	172.6	-78.4	169.6	179.4	158.6	0	111.8	D551 Y552 R557 I558 L559	D551-K555 WeakPolarHBondContact O-CB 3.34Å; D551-K555 WeakPolarHBondContact O-CG 3.34Å; D551-K555 PolarHBondContact O-N 2.61Å; D551-K555 IonicContact OD1-NZ 2.71Å; D551-K555 WeakPolarHBondContact OD2-CE 3.17Å; D551-K555 IonicContact OD2-NZ 3.88Å; D551-K555 PolarHBondContact OD2-NZ 3.12Å; Y552-K555 PolarHBondContact O-N 2.89Å; K555-R557 PolarHBondContact O-N 2.85Å; K555-I558 PolarHBondContact O-N 2.84Å; K555-L559 WeakPolarHBondContact O-CB 3.29Å; K555-L559 WeakPolarHBondContact O-CG 3.42Å; K555-L559 PolarHBondContact O-N 3.09Å
556	Q	81.5	Confident	82.6	Confident	137 Å²	137	116.6 Å²	116.6	64%	0.64	53%	0.525	S	S	*	.	H	α-helix	trans	-61.9	-43.2	177.1	-171	-178.4	5	0	0	111.3	Y552 E553 Q554 I558 L559 Y560	Y552-Q556 VanDerWaalsContact O-CB 3.29Å; Y552-Q556 WeakPolarHBondContact O-CB 3.34Å; Y552-Q556 PolarHBondContact O-N 3.24Å; E553-Q556 PolarHBondContact O-N 3.36Å; Q554-Q556 PolarHBondContact O-N 3.23Å; Q556-I558 PolarHBondContact O-N 3.38Å; Q556-L559 PolarHBondContact O-N 2.7Å; Q556-Y560 VanDerWaalsContact O-CB 3.3Å; Q556-Y560 WeakPolarHBondContact O-CB 3.1Å; Q556-Y560 PolarHBondContact O-N 3.34Å
557	R	82.8	Confident	83.1	Confident	154 Å²	154	110.6 Å²	110.6	58%	0.581	51%	0.506	S	S	*	.	H	α-helix	trans	-62.6	-41	174.6	-71.3	175.9	-150.8	177.2	9.8	111.9	E553 Q554 K555 R561	E553-R557 WeakPolarHBondContact O-CB 3.45Å; E553-R557 VanDerWaalsContact O-CG 3.25Å; E553-R557 WeakPolarHBondContact O-CG 3.46Å; E553-R557 PolarHBondContact O-N 3.36Å; E553-R557 IonicContact OE2-NH2 2.91Å; E553-R557 PolarHBondContact OE2-NH2 2.97Å; Q554-R557 PolarHBondContact O-N 3.31Å; K555-R557 PolarHBondContact O-N 2.85Å; R557-R561 WeakPolarHBondContact O-CG 3.25Å; R557-R561 PolarHBondContact O-N 2.96Å
558	I	85.2	Confident	83.5	Confident	81 Å²	81	108.9 Å²	108.9	42%	0.415	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-45.9	177.2	-68.2	165	0	0	0	110.7	Q554 K555 Q556 R561 K562	Q554-I558 HydrophobicContact CG-CD1 4.28Å; Q554-I558 VanDerWaalsContact O-CG1 3.28Å; Q554-I558 WeakPolarHBondContact O-CG1 3.37Å; Q554-I558 PolarHBondContact O-N 3.48Å; K555-I558 PolarHBondContact O-N 2.84Å; Q556-I558 PolarHBondContact O-N 3.38Å; I558-R561 PolarHBondContact O-N 2.85Å; I558-K562 HydrophobicContact CG2-CD 4.49Å; I558-K562 WeakPolarHBondContact O-CG 3.39Å; I558-K562 PolarHBondContact O-N 3.38Å
559	L	82.7	Confident	84	Confident	115 Å²	115	108 Å²	108	60%	0.602	50%	0.495	S	S	*	.	H	α-helix	trans	-64.7	-41.5	177.8	-71.2	173.1	0	0	0	111.7	K555 Q556 R561 K562 N563	K555-L559 WeakPolarHBondContact O-CB 3.29Å; K555-L559 WeakPolarHBondContact O-CG 3.42Å; K555-L559 PolarHBondContact O-N 3.09Å; Q556-L559 PolarHBondContact O-N 2.7Å; L559-R561 VanDerWaalsContact C-N 3.35Å; L559-R561 PolarHBondContact O-N 2.93Å; L559-K562 PolarHBondContact O-N 3.23Å; L559-N563 WeakPolarHBondContact O-CB 3.5Å; L559-N563 PolarHBondContact O-N 3.33Å
560	Y	81.5	Confident	84.5	Confident	152 Å²	152	109.1 Å²	109.1	60%	0.596	50%	0.5	S	S	*	.	H	α-helix	trans	-59.8	-44.5	174.8	-174.9	-97.4	0	0	0	111.5	Q556 N563 Q564	Q556-Y560 VanDerWaalsContact O-CB 3.3Å; Q556-Y560 WeakPolarHBondContact O-CB 3.1Å; Q556-Y560 PolarHBondContact O-N 3.34Å; Y560-N563 PolarHBondContact O-N 3.49Å; Y560-Q564 HydrophobicContact CD1-CG 4.13Å; Y560-Q564 HydrophobicContact CE1-CG 3.8Å; Y560-Q564 WeakPolarHBondContact O-CB 3.45Å; Y560-Q564 VanDerWaalsContact O-CG 3.28Å; Y560-Q564 WeakPolarHBondContact O-CG 3.47Å; Y560-Q564 PolarHBondContact O-N 2.94Å; Y560-Q564 PolarHBondContact OH-NE2 3.15Å; Y560-Q564 VanDerWaalsContact OH-NE2 3.16Å
561	R	84.5	Confident	84.8	Confident	193 Å²	193	111.7 Å²	111.7	73%	0.728	50%	0.504	S	S	*	.	H	α-helix	trans	-62.8	-42.4	174.6	-75.8	179.5	-178.6	171.3	0.6	112.6	R557 I558 L559 Q564 F565	R557-R561 WeakPolarHBondContact O-CG 3.25Å; R557-R561 PolarHBondContact O-N 2.96Å; I558-R561 PolarHBondContact O-N 2.85Å; L559-R561 VanDerWaalsContact C-N 3.35Å; L559-R561 PolarHBondContact O-N 2.93Å; R561-Q564 PolarHBondContact O-N 3.19Å; R561-F565 WeakPolarHBondContact O-CB 3.24Å; R561-F565 PolarHBondContact O-N 2.79Å
562	K	86.1	Confident	85.2	Confident	130 Å²	130	114 Å²	114	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-63.7	-42.6	176.1	-76.8	-175.1	176.1	-175.1	0	112	I558 L559 F565 L566	I558-K562 HydrophobicContact CG2-CD 4.49Å; I558-K562 WeakPolarHBondContact O-CG 3.39Å; I558-K562 PolarHBondContact O-N 3.38Å; L559-K562 PolarHBondContact O-N 3.23Å; K562-F565 WeakPolarHBondContact O-CB 3.02Å; K562-F565 PolarHBondContact O-N 3.04Å; K562-L566 WeakPolarHBondContact O-CD1 3.43Å; K562-L566 PolarHBondContact O-N 2.91Å
563	N	85.3	Confident	85.6	Confident	94 Å²	94	111.2 Å²	111.2	50%	0.503	51%	0.507	S	S	.	.	H	α-helix	trans	-66.7	-42.7	178.6	-163.1	-9.5	0	0	0	111.1	L559 Y560 F565 L566 I567	L559-N563 WeakPolarHBondContact O-CB 3.5Å; L559-N563 PolarHBondContact O-N 3.33Å; Y560-N563 PolarHBondContact O-N 3.49Å; N563-F565 VanDerWaalsContact C-N 3.33Å; N563-F565 PolarHBondContact O-N 3.43Å; N563-L566 PolarHBondContact O-N 3.33Å; N563-I567 VanDerWaalsContact O-CG1 3.28Å; N563-I567 WeakPolarHBondContact O-CG1 3.47Å; N563-I567 PolarHBondContact O-N 2.95Å; N563-I567 WeakPolarHBondContact OD1-CD1 3.44Å
564	Q	86.7	Confident	85.9	Confident	83 Å²	83	110 Å²	110	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-57.5	-45.5	172.1	-74.7	-68.9	-20	0	0	111.9	Y560 R561 I567 T568	Y560-Q564 HydrophobicContact CD1-CG 4.13Å; Y560-Q564 HydrophobicContact CE1-CG 3.8Å; Y560-Q564 WeakPolarHBondContact O-CB 3.45Å; Y560-Q564 VanDerWaalsContact O-CG 3.28Å; Y560-Q564 WeakPolarHBondContact O-CG 3.47Å; Y560-Q564 PolarHBondContact O-N 2.94Å; Y560-Q564 PolarHBondContact OH-NE2 3.15Å; Y560-Q564 VanDerWaalsContact OH-NE2 3.16Å; R561-Q564 PolarHBondContact O-N 3.19Å; Q564-I567 PolarHBondContact O-N 3.36Å; Q564-T568 PolarHBondContact O-N 2.97Å; Q564-T568 PolarHBondContact O-OG1 3.11Å
565	F	90.3	Very high	86.4	Confident	133 Å²	133	107.9 Å²	107.9	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-60.4	-45.8	175.9	177.9	-95.5	0	0	0	112.5	R561 K562 N563 T568 E569	R561-F565 WeakPolarHBondContact O-CB 3.24Å; R561-F565 PolarHBondContact O-N 2.79Å; K562-F565 WeakPolarHBondContact O-CB 3.02Å; K562-F565 PolarHBondContact O-N 3.04Å; N563-F565 VanDerWaalsContact C-N 3.33Å; N563-F565 PolarHBondContact O-N 3.43Å; F565-T568 VanDerWaalsContact C-OG1 3.31Å; F565-T568 VanDerWaalsContact CA-OG1 3.3Å; F565-T568 WeakPolarHBondContact CA-OG1 3.41Å; F565-T568 PolarHBondContact O-N 2.9Å; F565-T568 PolarHBondContact O-OG1 2.94Å; F565-E569 WeakPolarHBondContact O-CB 3.26Å; F565-E569 PolarHBondContact O-N 3.06Å
566	L	87	Confident	86.6	Confident	98 Å²	98	107.2 Å²	107.2	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-42.6	176.5	-82.3	153.2	0	0	0	112	K562 N563 T568 E569 I570	K562-L566 WeakPolarHBondContact O-CD1 3.43Å; K562-L566 PolarHBondContact O-N 2.91Å; N563-L566 PolarHBondContact O-N 3.33Å; L566-T568 PolarHBondContact O-N 3.31Å; L566-E569 PolarHBondContact O-N 3.04Å; L566-I570 WeakPolarHBondContact O-CB 3.48Å; L566-I570 WeakPolarHBondContact O-CG1 3.41Å; L566-I570 PolarHBondContact O-N 3.46Å
567	I	87	Confident	87	Confident	60 Å²	60	107.9 Å²	107.9	31%	0.308	51%	0.51	S	S	.	.	H	α-helix	trans	-63.2	-42.3	177.2	-69.3	165.6	0	0	0	110.8	N563 Q564 R571	N563-I567 VanDerWaalsContact O-CG1 3.28Å; N563-I567 WeakPolarHBondContact O-CG1 3.47Å; N563-I567 PolarHBondContact O-N 2.95Å; N563-I567 WeakPolarHBondContact OD1-CD1 3.44Å; Q564-I567 PolarHBondContact O-N 3.36Å; I567-R571 VanDerWaalsContact O-CG 3.3Å; I567-R571 WeakPolarHBondContact O-CG 3.44Å; I567-R571 PolarHBondContact O-N 3.31Å
568	T	88.4	Confident	87.3	Confident	63 Å²	63	108 Å²	108	39%	0.387	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-45.8	174.7	38.8	0	0	0	0	111.8	Q564 F565 L566 I570 R571 E572	Q564-T568 PolarHBondContact O-N 2.97Å; Q564-T568 PolarHBondContact O-OG1 3.11Å; F565-T568 VanDerWaalsContact C-OG1 3.31Å; F565-T568 VanDerWaalsContact CA-OG1 3.3Å; F565-T568 WeakPolarHBondContact CA-OG1 3.41Å; F565-T568 PolarHBondContact O-N 2.9Å; F565-T568 PolarHBondContact O-OG1 2.94Å; L566-T568 PolarHBondContact O-N 3.31Å; T568-I570 PolarHBondContact O-N 3.18Å; T568-R571 PolarHBondContact O-N 3.43Å; T568-E572 WeakPolarHBondContact O-CG 3.46Å; T568-E572 PolarHBondContact O-N 3.01Å
569	E	88.3	Confident	87.5	Confident	60 Å²	60	109.7 Å²	109.7	28%	0.28	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-43.1	178.7	-168.7	76.1	-169.9	0	0	111.6	F565 L566 R571 E572 L573	F565-E569 WeakPolarHBondContact O-CB 3.26Å; F565-E569 PolarHBondContact O-N 3.06Å; L566-E569 PolarHBondContact O-N 3.04Å; E569-R571 VanDerWaalsContact C-N 3.33Å; E569-R571 PolarHBondContact O-N 2.63Å; E569-E572 PolarHBondContact O-N 2.89Å; E569-L573 HydrophobicContact CG-CD1 4.22Å; E569-L573 WeakPolarHBondContact O-CB 3.3Å; E569-L573 WeakPolarHBondContact O-CG 3.39Å; E569-L573 PolarHBondContact O-N 3.32Å
570	I	88.7	Confident	87.9	Confident	108 Å²	108	110.8 Å²	110.8	55%	0.554	52%	0.519	S	S	*	.	H	α-helix	trans	-61.9	-41.4	176.5	-70.8	166.4	0	0	0	110.8	L566 T568 L573 A574	L566-I570 WeakPolarHBondContact O-CB 3.48Å; L566-I570 WeakPolarHBondContact O-CG1 3.41Å; L566-I570 PolarHBondContact O-N 3.46Å; T568-I570 PolarHBondContact O-N 3.18Å; I570-L573 PolarHBondContact O-N 3.06Å; I570-A574 VanDerWaalsContact O-CB 3.29Å; I570-A574 WeakPolarHBondContact O-CB 3.41Å; I570-A574 PolarHBondContact O-N 2.86Å
571	R	87.2	Confident	88.3	Confident	179 Å²	179	106.7 Å²	106.7	68%	0.675	51%	0.51	S	S	*	.	H	α-helix	trans	-64.6	-41.5	176.3	-75.4	175	179.9	174.3	1.6	111.9	I567 T568 E569 A574 S575	I567-R571 VanDerWaalsContact O-CG 3.3Å; I567-R571 WeakPolarHBondContact O-CG 3.44Å; I567-R571 PolarHBondContact O-N 3.31Å; T568-R571 PolarHBondContact O-N 3.43Å; E569-R571 VanDerWaalsContact C-N 3.33Å; E569-R571 PolarHBondContact O-N 2.63Å; R571-A574 PolarHBondContact O-N 3.23Å; R571-S575 WeakPolarHBondContact O-CB 3.34Å; R571-S575 PolarHBondContact O-N 2.9Å
572	E	89.3	Confident	88.6	Confident	118 Å²	118	99.6 Å²	99.6	55%	0.551	49%	0.487	S	S	*	.	H	α-helix	trans	-65.1	-45.5	175.9	-72.4	-174.2	-174.3	0	0	111.7	T568 E569 A574 S575 I576	T568-E572 WeakPolarHBondContact O-CG 3.46Å; T568-E572 PolarHBondContact O-N 3.01Å; E569-E572 PolarHBondContact O-N 2.89Å; E572-A574 PolarHBondContact O-N 2.77Å; E572-S575 WeakPolarHBondContact O-CB 3.31Å; E572-S575 PolarHBondContact O-N 3.33Å; E572-I576 WeakPolarHBondContact O-CG1 3.32Å; E572-I576 PolarHBondContact O-N 3.13Å
573	L	89.4	Confident	88.8	Confident	79 Å²	79	99.1 Å²	99.1	41%	0.414	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-39.9	176.4	-71.8	173.8	0	0	0	112.5	E569 I570 S575 I576 K577	E569-L573 HydrophobicContact CG-CD1 4.22Å; E569-L573 WeakPolarHBondContact O-CB 3.3Å; E569-L573 WeakPolarHBondContact O-CG 3.39Å; E569-L573 PolarHBondContact O-N 3.32Å; I570-L573 PolarHBondContact O-N 3.06Å; L573-S575 VanDerWaalsContact C-N 3.35Å; L573-I576 PolarHBondContact O-N 3.34Å; L573-K577 WeakPolarHBondContact O-CB 3.43Å; L573-K577 PolarHBondContact O-N 3.01Å
574	A	87.4	Confident	89	Confident	57 Å²	57	97.8 Å²	97.8	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-63.6	-40.9	174.7	0	0	0	0	0	111.7	I570 R571 E572 K577 Y578	I570-A574 VanDerWaalsContact O-CB 3.29Å; I570-A574 WeakPolarHBondContact O-CB 3.41Å; I570-A574 PolarHBondContact O-N 2.86Å; R571-A574 PolarHBondContact O-N 3.23Å; E572-A574 PolarHBondContact O-N 2.77Å; A574-K577 PolarHBondContact O-N 3.07Å; A574-Y578 WeakPolarHBondContact O-CB 3.44Å; A574-Y578 PolarHBondContact O-N 3.06Å
575	S	90.5	Very high	89.1	Confident	72 Å²	72	98.3 Å²	98.3	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-61.6	-46.8	174	-178.4	0	0	0	0	111.7	R571 E572 L573 K577 Y578 M579	R571-S575 WeakPolarHBondContact O-CB 3.34Å; R571-S575 PolarHBondContact O-N 2.9Å; E572-S575 WeakPolarHBondContact O-CB 3.31Å; E572-S575 PolarHBondContact O-N 3.33Å; L573-S575 VanDerWaalsContact C-N 3.35Å; S575-K577 PolarHBondContact O-N 3.21Å; S575-Y578 PolarHBondContact O-N 3.47Å; S575-M579 VanDerWaalsContact O-CG 3.3Å; S575-M579 WeakPolarHBondContact O-CG 3.47Å; S575-M579 PolarHBondContact O-N 3.25Å
576	I	89.7	Confident	89.2	Confident	85 Å²	85	98 Å²	98	44%	0.436	49%	0.488	S	S	.	.	H	α-helix	trans	-61.7	-45.2	176.9	-68.7	167.7	0	0	0	111	E572 L573 Y578 M579 F580	E572-I576 WeakPolarHBondContact O-CG1 3.32Å; E572-I576 PolarHBondContact O-N 3.13Å; L573-I576 PolarHBondContact O-N 3.34Å; I576-Y578 PolarHBondContact O-N 3.38Å; I576-M579 WeakPolarHBondContact O-CB 3.16Å; I576-M579 PolarHBondContact O-N 3.21Å; I576-F580 HydrophobicContact CG2-CD2 3.63Å; I576-F580 HydrophobicContact CG2-CE2 3.46Å; I576-F580 VanDerWaalsContact CG2-CE2 3.46Å; I576-F580 VanDerWaalsContact O-CD2 3.24Å; I576-F580 WeakPolarHBondContact O-CD2 3.45Å; I576-F580 PolarHBondContact O-N 3.44Å
577	K	88.4	Confident	89.3	Confident	152 Å²	152	97.7 Å²	97.7	66%	0.661	49%	0.485	S	S	*	.	H	α-helix	trans	-59.6	-45.8	176.6	-176.3	176.9	179.4	177.8	0	111.4	L573 A574 S575 M579 F580 T581	L573-K577 WeakPolarHBondContact O-CB 3.43Å; L573-K577 PolarHBondContact O-N 3.01Å; A574-K577 PolarHBondContact O-N 3.07Å; S575-K577 PolarHBondContact O-N 3.21Å; K577-M579 VanDerWaalsContact C-N 3.35Å; K577-M579 PolarHBondContact O-N 2.81Å; K577-F580 PolarHBondContact O-N 2.88Å; K577-T581 WeakPolarHBondContact O-CG2 3.34Å; K577-T581 PolarHBondContact O-N 3.2Å; K577-T581 PolarHBondContact O-OG1 3.24Å
578	Y	89.8	Confident	89.5	Confident	157 Å²	157	98 Å²	98	62%	0.616	49%	0.493	S	S	*	.	H	α-helix	trans	-58.4	-46.6	175.9	179	-97.2	0	0	0	111.4	A574 S575 I576 F580 T581 D582	A574-Y578 WeakPolarHBondContact O-CB 3.44Å; A574-Y578 PolarHBondContact O-N 3.06Å; S575-Y578 PolarHBondContact O-N 3.47Å; I576-Y578 PolarHBondContact O-N 3.38Å; Y578-F580 PolarHBondContact O-N 3.19Å; Y578-T581 WeakPolarHBondContact CA-OG1 3.33Å; Y578-T581 PolarHBondContact O-N 2.95Å; Y578-T581 PolarHBondContact O-OG1 3.37Å; Y578-D582 WeakPolarHBondContact O-CB 3.08Å; Y578-D582 PolarHBondContact O-N 2.56Å
579	M	90.4	Very high	89.5	Confident	116 Å²	116	102.1 Å²	102.1	57%	0.571	51%	0.505	S	S	*	.	H	α-helix	trans	-58.4	-43.4	176.6	-72.1	-70.2	-65.9	0	0	112.6	S575 I576 K577 D582 H583	S575-M579 VanDerWaalsContact O-CG 3.3Å; S575-M579 WeakPolarHBondContact O-CG 3.47Å; S575-M579 PolarHBondContact O-N 3.25Å; I576-M579 WeakPolarHBondContact O-CB 3.16Å; I576-M579 PolarHBondContact O-N 3.21Å; K577-M579 VanDerWaalsContact C-N 3.35Å; K577-M579 PolarHBondContact O-N 2.81Å; M579-D582 PolarHBondContact O-N 3.37Å; M579-H583 WeakPolarHBondContact O-CB 3.28Å; M579-H583 PolarHBondContact O-N 3.34Å
580	F	90.3	Very high	89.7	Confident	138 Å²	138	105.7 Å²	105.7	61%	0.605	52%	0.517	S	S	*	.	H	α-helix	trans	-65.8	-41	175.8	-82.3	-68	0	0	0	112.5	I576 K577 Y578 H583 S584	I576-F580 HydrophobicContact CG2-CD2 3.63Å; I576-F580 HydrophobicContact CG2-CE2 3.46Å; I576-F580 VanDerWaalsContact CG2-CE2 3.46Å; I576-F580 VanDerWaalsContact O-CD2 3.24Å; I576-F580 WeakPolarHBondContact O-CD2 3.45Å; I576-F580 PolarHBondContact O-N 3.44Å; K577-F580 PolarHBondContact O-N 2.88Å; Y578-F580 PolarHBondContact O-N 3.19Å; F580-H583 PolarHBondContact O-N 3.32Å; F580-S584 VanDerWaalsContact O-CB 3.3Å; F580-S584 WeakPolarHBondContact O-CB 3.42Å; F580-S584 PolarHBondContact O-N 3.49Å
581	T	89.5	Confident	89.7	Confident	65 Å²	65	104.6 Å²	104.6	40%	0.399	51%	0.512	S	S	.	.	H	α-helix	trans	-66.8	-39.8	176.5	53.4	0	0	0	0	112.4	K577 Y578 S584 N585	K577-T581 WeakPolarHBondContact O-CG2 3.34Å; K577-T581 PolarHBondContact O-N 3.2Å; K577-T581 PolarHBondContact O-OG1 3.24Å; Y578-T581 WeakPolarHBondContact CA-OG1 3.33Å; Y578-T581 PolarHBondContact O-N 2.95Å; Y578-T581 PolarHBondContact O-OG1 3.37Å; T581-S584 PolarHBondContact O-N 2.9Å; T581-N585 WeakPolarHBondContact O-CB 3.37Å; T581-N585 VanDerWaalsContact O-CG 3.23Å; T581-N585 PolarHBondContact O-N 3.24Å; T581-N585 PolarHBondContact O-ND2 3.32Å
582	D	89.9	Confident	89.6	Confident	45 Å²	45	102 Å²	102	24%	0.241	51%	0.507	C	S	.	.	H	α-helix	trans	-65.2	-43.9	175.2	178.6	55.1	0	0	0	111.2	Y578 M579 N585 K586	Y578-D582 WeakPolarHBondContact O-CB 3.08Å; Y578-D582 PolarHBondContact O-N 2.56Å; M579-D582 PolarHBondContact O-N 3.37Å; D582-N585 PolarHBondContact O-N 3.14Å; D582-K586 WeakPolarHBondContact O-CB 3.39Å; D582-K586 VanDerWaalsContact O-CG 3.32Å; D582-K586 WeakPolarHBondContact O-CG 3.21Å; D582-K586 PolarHBondContact O-N 3.43Å; D582-K586 WeakPolarHBondContact OD1-CE 3.41Å; D582-K586 IonicContact OD1-NZ 2.69Å; D582-K586 WeakPolarHBondContact OD2-CE 3.44Å; D582-K586 IonicContact OD2-NZ 3.7Å; D582-K586 PolarHBondContact OD2-NZ 3.21Å
583	H	91	Very high	89.5	Confident	119 Å²	119	104.1 Å²	104.1	55%	0.551	51%	0.51	S	S	*	.	H	α-helix	trans	-62.2	-43.7	174.3	-173.9	-84.5	0	0	0	112.1	M579 F580 K586 M587	M579-H583 WeakPolarHBondContact O-CB 3.28Å; M579-H583 PolarHBondContact O-N 3.34Å; F580-H583 PolarHBondContact O-N 3.32Å; H583-K586 PolarHBondContact O-N 2.98Å; H583-M587 WeakPolarHBondContact O-CB 3.49Å; H583-M587 PolarHBondContact O-N 3.21Å
584	S	88.9	Confident	89.4	Confident	66 Å²	66	103.9 Å²	103.9	46%	0.462	51%	0.509	S	S	.	.	H	α-helix	trans	-60.3	-46.5	175.9	-176.8	0	0	0	0	111.4	F580 T581 K586 M587 S588	F580-S584 VanDerWaalsContact O-CB 3.3Å; F580-S584 WeakPolarHBondContact O-CB 3.42Å; F580-S584 PolarHBondContact O-N 3.49Å; T581-S584 PolarHBondContact O-N 2.9Å; S584-K586 PolarHBondContact O-N 2.83Å; S584-M587 PolarHBondContact O-N 2.69Å; S584-S588 PolarHBondContact O-N 3.08Å; S584-S588 PolarHBondContact O-OG 3.29Å
585	N	90.5	Very high	89.4	Confident	94 Å²	94	105.5 Å²	105.5	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-62.7	-42.6	176.4	-73.9	-26.7	0	0	0	112.7	T581 D582 S588 K589	T581-N585 WeakPolarHBondContact O-CB 3.37Å; T581-N585 VanDerWaalsContact O-CG 3.23Å; T581-N585 PolarHBondContact O-N 3.24Å; T581-N585 PolarHBondContact O-ND2 3.32Å; D582-N585 PolarHBondContact O-N 3.14Å; N585-S588 PolarHBondContact O-N 3.49Å; N585-K589 WeakPolarHBondContact O-CB 3.35Å; N585-K589 WeakPolarHBondContact O-CG 3.49Å; N585-K589 PolarHBondContact O-N 3.14Å
586	K	90.7	Very high	89.1	Confident	126 Å²	126	105 Å²	105	55%	0.548	50%	0.5	S	S	.	.	H	α-helix	trans	-62	-43.4	174.7	-76.8	170.5	177.1	167.4	0	111.2	D582 H583 S584 K589 Y590	D582-K586 WeakPolarHBondContact O-CB 3.39Å; D582-K586 VanDerWaalsContact O-CG 3.32Å; D582-K586 WeakPolarHBondContact O-CG 3.21Å; D582-K586 PolarHBondContact O-N 3.43Å; D582-K586 WeakPolarHBondContact OD1-CE 3.41Å; D582-K586 IonicContact OD1-NZ 2.69Å; D582-K586 WeakPolarHBondContact OD2-CE 3.44Å; D582-K586 IonicContact OD2-NZ 3.7Å; D582-K586 PolarHBondContact OD2-NZ 3.21Å; H583-K586 PolarHBondContact O-N 2.98Å; S584-K586 PolarHBondContact O-N 2.83Å; K586-K589 PolarHBondContact O-N 3.03Å; K586-Y590 WeakPolarHBondContact O-CB 3.31Å; K586-Y590 PolarHBondContact O-N 3.05Å
587	M	90.8	Very high	89	Confident	93 Å²	93	104.6 Å²	104.6	46%	0.458	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-44.9	176.9	-172.6	63.3	112.3	0	0	111.7	H583 S584 K589 Y590 I591	H583-M587 WeakPolarHBondContact O-CB 3.49Å; H583-M587 PolarHBondContact O-N 3.21Å; S584-M587 PolarHBondContact O-N 2.69Å; M587-K589 PolarHBondContact O-N 2.63Å; M587-Y590 WeakPolarHBondContact O-CB 3.4Å; M587-Y590 PolarHBondContact O-N 3.03Å; M587-Y590 VanDerWaalsContact O-N 3.14Å; M587-Y590 HydrophobicContact SD-CD1 4.37Å; M587-I591 HydrophobicContact CG-CD1 4.06Å; M587-I591 WeakPolarHBondContact O-CG1 3.36Å; M587-I591 PolarHBondContact O-N 3.18Å
588	S	91	Very high	89	Confident	67 Å²	67	98.6 Å²	98.6	47%	0.469	48%	0.478	S	S	.	.	H	α-helix	trans	-60.5	-42.4	175.6	-64.6	0	0	0	0	112.3	S584 N585 Y590 I591 Q592	S584-S588 PolarHBondContact O-N 3.08Å; S584-S588 PolarHBondContact O-OG 3.29Å; N585-S588 PolarHBondContact O-N 3.49Å; S588-Y590 VanDerWaalsContact C-N 3.33Å; S588-Y590 PolarHBondContact O-N 3.31Å; S588-I591 PolarHBondContact O-N 3.3Å; S588-Q592 WeakPolarHBondContact O-CB 3.12Å; S588-Q592 PolarHBondContact O-N 3.47Å
589	K	88.8	Confident	88.9	Confident	148 Å²	148	92.1 Å²	92.1	64%	0.643	45%	0.453	S	S	*	.	H	α-helix	trans	-62.6	-39.8	173.6	-74.2	176.5	-179.2	-179.9	0	112	N585 K586 M587 Q592 R593	N585-K589 WeakPolarHBondContact O-CB 3.35Å; N585-K589 WeakPolarHBondContact O-CG 3.49Å; N585-K589 PolarHBondContact O-N 3.14Å; K586-K589 PolarHBondContact O-N 3.03Å; M587-K589 PolarHBondContact O-N 2.63Å; K589-Q592 PolarHBondContact O-N 3.19Å; K589-R593 WeakPolarHBondContact O-CB 3.48Å; K589-R593 PolarHBondContact O-N 2.86Å
590	Y	90.7	Very high	88.8	Confident	135 Å²	135	91.6 Å²	91.6	53%	0.529	45%	0.447	S	S	.	.	H	α-helix	trans	-65.7	-45.6	176.7	-177.5	-112.1	0	0	0	112.1	K586 M587 S588 Q592 R593 L594	K586-Y590 WeakPolarHBondContact O-CB 3.31Å; K586-Y590 PolarHBondContact O-N 3.05Å; M587-Y590 WeakPolarHBondContact O-CB 3.4Å; M587-Y590 PolarHBondContact O-N 3.03Å; M587-Y590 VanDerWaalsContact O-N 3.14Å; M587-Y590 HydrophobicContact SD-CD1 4.37Å; S588-Y590 VanDerWaalsContact C-N 3.33Å; S588-Y590 PolarHBondContact O-N 3.31Å; Y590-Q592 VanDerWaalsContact C-N 3.34Å; Y590-Q592 PolarHBondContact O-N 3.24Å; Y590-R593 WeakPolarHBondContact O-CB 3.24Å; Y590-R593 PolarHBondContact O-N 3.15Å; Y590-L594 HydrophobicContact CD1-CD1 3.93Å; Y590-L594 HydrophobicContact CD1-CG 4.49Å; Y590-L594 HydrophobicContact CE1-CD1 3.38Å; Y590-L594 HydrophobicContact CE1-CG 4.11Å; Y590-L594 HydrophobicContact CE2-CD1 4.41Å; Y590-L594 HydrophobicContact CE2-CD2 4.45Å; Y590-L594 HydrophobicContact CE2-CG 4.28Å; Y590-L594 PolarHBondContact O-N 3.34Å
591	I	90.1	Very high	88.8	Confident	86 Å²	86	93.4 Å²	93.4	44%	0.441	45%	0.45	S	S	.	.	H	α-helix	trans	-60.7	-43.1	175.2	-68.7	168	0	0	0	110.9	M587 S588 R593 L594 N595	M587-I591 HydrophobicContact CG-CD1 4.06Å; M587-I591 WeakPolarHBondContact O-CG1 3.36Å; M587-I591 PolarHBondContact O-N 3.18Å; S588-I591 PolarHBondContact O-N 3.3Å; I591-R593 VanDerWaalsContact C-N 3.33Å; I591-R593 PolarHBondContact O-N 3.16Å; I591-L594 PolarHBondContact O-N 3.4Å; I591-N595 WeakPolarHBondContact O-CB 3.42Å; I591-N595 PolarHBondContact O-N 3.47Å; I591-N595 PolarHBondContact O-ND2 2.69Å
592	Q	85.3	Confident	88.8	Confident	123 Å²	123	93.9 Å²	93.9	58%	0.575	45%	0.445	S	S	*	.	H	α-helix	trans	-61	-43.2	176.3	-172.8	179.4	6.5	0	0	111.6	S588 K589 Y590 N595 M596	S588-Q592 WeakPolarHBondContact O-CB 3.12Å; S588-Q592 PolarHBondContact O-N 3.47Å; K589-Q592 PolarHBondContact O-N 3.19Å; Y590-Q592 VanDerWaalsContact C-N 3.34Å; Y590-Q592 PolarHBondContact O-N 3.24Å; Q592-N595 PolarHBondContact O-N 2.73Å; Q592-M596 WeakPolarHBondContact O-CG 3.3Å; Q592-M596 PolarHBondContact O-N 3.46Å
593	R	85.8	Confident	88.8	Confident	163 Å²	163	93.7 Å²	93.7	62%	0.615	44%	0.44	S	S	*	.	H	α-helix	trans	-62	-46.3	175.6	-177.4	179.3	177.5	155	3.5	112.1	K589 Y590 I591 N595 M596 E597	K589-R593 WeakPolarHBondContact O-CB 3.48Å; K589-R593 PolarHBondContact O-N 2.86Å; Y590-R593 WeakPolarHBondContact O-CB 3.24Å; Y590-R593 PolarHBondContact O-N 3.15Å; I591-R593 VanDerWaalsContact C-N 3.33Å; I591-R593 PolarHBondContact O-N 3.16Å; R593-N595 VanDerWaalsContact C-N 3.34Å; R593-N595 PolarHBondContact O-N 3.03Å; R593-M596 WeakPolarHBondContact O-CB 3.45Å; R593-M596 PolarHBondContact O-N 2.9Å; R593-E597 IonicContact NE-OE1 2.78Å; R593-E597 PolarHBondContact NE-OE1 2.93Å; R593-E597 IonicContact NH2-OE1 2.65Å; R593-E597 PolarHBondContact O-N 3Å
594	L	88.6	Confident	88.6	Confident	75 Å²	75	91.2 Å²	91.2	39%	0.393	43%	0.429	S	S	.	.	H	α-helix	trans	-62.3	-40.2	176.8	-73.6	179.1	0	0	0	112.1	Y590 I591 M596 E597 G598	Y590-L594 HydrophobicContact CD1-CD1 3.93Å; Y590-L594 HydrophobicContact CD1-CG 4.49Å; Y590-L594 HydrophobicContact CE1-CD1 3.38Å; Y590-L594 HydrophobicContact CE1-CG 4.11Å; Y590-L594 HydrophobicContact CE2-CD1 4.41Å; Y590-L594 HydrophobicContact CE2-CD2 4.45Å; Y590-L594 HydrophobicContact CE2-CG 4.28Å; Y590-L594 PolarHBondContact O-N 3.34Å; I591-L594 PolarHBondContact O-N 3.4Å; L594-M596 VanDerWaalsContact C-N 3.34Å; L594-M596 PolarHBondContact O-N 3.47Å; L594-E597 PolarHBondContact O-N 3.08Å; L594-G598 PolarHBondContact O-N 3.3Å
595	N	86	Confident	88.6	Confident	90 Å²	90	92.5 Å²	92.5	48%	0.481	43%	0.425	S	S	.	.	H	α-helix	trans	-62	-42	175.2	-78.9	-30.9	0	0	0	111.8	I591 Q592 R593 G598 F599	I591-N595 WeakPolarHBondContact O-CB 3.42Å; I591-N595 PolarHBondContact O-N 3.47Å; I591-N595 PolarHBondContact O-ND2 2.69Å; Q592-N595 PolarHBondContact O-N 2.73Å; R593-N595 VanDerWaalsContact C-N 3.34Å; R593-N595 PolarHBondContact O-N 3.03Å; N595-G598 PolarHBondContact O-N 3.41Å; N595-F599 HydrophobicContact CB-CE2 4.48Å; N595-F599 WeakPolarHBondContact O-CD2 3.24Å; N595-F599 PolarHBondContact O-N 3.4Å
596	M	84.8	Confident	88.5	Confident	62 Å²	62	88 Å²	88	31%	0.305	40%	0.401	S	S	.	.	H	α-helix	trans	-63.3	-45.2	174.7	-75.9	-172	61	0	0	112.5	Q592 R593 L594 G598 F599 K600 L696 S697	Q592-M596 WeakPolarHBondContact O-CG 3.3Å; Q592-M596 PolarHBondContact O-N 3.46Å; R593-M596 WeakPolarHBondContact O-CB 3.45Å; R593-M596 PolarHBondContact O-N 2.9Å; L594-M596 VanDerWaalsContact C-N 3.34Å; L594-M596 PolarHBondContact O-N 3.47Å; M596-G598 VanDerWaalsContact C-N 3.27Å; M596-G598 PolarHBondContact O-N 3.35Å; M596-F599 PolarHBondContact O-N 3.3Å; M596-K600 PolarHBondContact O-N 3.4Å; M596-L696 WeakPolarHBondContact O-CD2 3.3Å; M596-S697 WeakPolarHBondContact CE-OG 3.48Å; M596-S697 PolarHBondContact SD-OG 3.19Å
597	E	87.3	Confident	88.2	Confident	76 Å²	76	85.1 Å²	85.1	36%	0.355	39%	0.388	S	S	.	.	H	α-helix	trans	-60.4	-40	174.3	-73.5	177.1	-168.8	0	0	110.7	R593 L594 K600 W601	R593-E597 IonicContact NE-OE1 2.78Å; R593-E597 PolarHBondContact NE-OE1 2.93Å; R593-E597 IonicContact NH2-OE1 2.65Å; R593-E597 PolarHBondContact O-N 3Å; L594-E597 PolarHBondContact O-N 3.08Å; E597-K600 WeakPolarHBondContact O-CB 3.43Å; E597-K600 PolarHBondContact O-N 2.96Å; E597-W601 PolarHBondContact O-N 3.07Å
598	G	89.1	Confident	87.7	Confident	26 Å²	26	85.5 Å²	85.5	27%	0.268	39%	0.392	S	S	.	.	H	α-helix	trans	-60.5	-45.3	174	0	0	0	0	0	113.6	L594 N595 M596 K600 W601 R602	L594-G598 PolarHBondContact O-N 3.3Å; N595-G598 PolarHBondContact O-N 3.41Å; M596-G598 VanDerWaalsContact C-N 3.27Å; M596-G598 PolarHBondContact O-N 3.35Å; G598-K600 VanDerWaalsContact C-N 3.34Å; G598-W601 PolarHBondContact O-N 2.67Å; G598-R602 WeakPolarHBondContact O-CG 3.43Å; G598-R602 PolarHBondContact O-N 2.77Å
599	F	88.1	Confident	87.2	Confident	21 Å²	21	82.8 Å²	82.8	9%	0.092	37%	0.372	C	S	.	.	H	α-helix	trans	-64.4	-39.1	174.3	-69.1	-54.2	0	0	0	112.4	N595 M596 R602 R603 Y692 Q695 L696	N595-F599 HydrophobicContact CB-CE2 4.48Å; N595-F599 WeakPolarHBondContact O-CD2 3.24Å; N595-F599 PolarHBondContact O-N 3.4Å; M596-F599 PolarHBondContact O-N 3.3Å; F599-R602 PolarHBondContact O-N 3.17Å; F599-R603 WeakPolarHBondContact O-CB 3.16Å; F599-R603 PolarHBondContact O-N 3.26Å; F599-Y692 AromaticContact CD1-CD1 3.77Å; F599-Y692 HydrophobicContact CD1-CD1 3.77Å; F599-Y692 HydrophobicContact CD1-CE1 4.1Å; F599-Y692 HydrophobicContact CE1-CD1 4.48Å; F599-Y692 HydrophobicContact CE1-CE1 4.49Å; F599-Q695 HydrophobicContact CD1-CB 4.29Å; F599-Q695 HydrophobicContact CD2-CB 4.12Å; F599-Q695 HydrophobicContact CE2-CB 4.43Å; F599-Q695 HydrophobicContact CG-CB 4.08Å; F599-L696 HydrophobicContact CB-CD2 3.97Å; F599-L696 HydrophobicContact CB-CG 4.38Å
600	K	87.6	Confident	86.7	Confident	105 Å²	105	77 Å²	77	46%	0.457	35%	0.347	S	S	.	.	H	α-helix	trans	-59.3	-50.4	175.8	-177.6	-176.6	176.5	-179	0	110.6	M596 E597 G598 R602 R603 E604 L696	M596-K600 PolarHBondContact O-N 3.4Å; E597-K600 WeakPolarHBondContact O-CB 3.43Å; E597-K600 PolarHBondContact O-N 2.96Å; G598-K600 VanDerWaalsContact C-N 3.34Å; K600-R602 PolarHBondContact O-N 3.09Å; K600-R603 WeakPolarHBondContact O-CB 3.4Å; K600-R603 PolarHBondContact O-N 3.42Å; K600-E604 WeakPolarHBondContact O-CG 3.19Å; K600-E604 PolarHBondContact O-N 3.05Å; K600-L696 HydrophobicContact CB-CD2 4.09Å
601	W	90.3	Very high	85.8	Confident	177 Å²	177	72.3 Å²	72.3	67%	0.67	34%	0.336	S	S	*	.	H	α-helix	trans	-65.5	-37.1	179.4	-70.8	119	0	0	0	112.9	E597 G598 E604 Y605	E597-W601 PolarHBondContact O-N 3.07Å; G598-W601 PolarHBondContact O-N 2.67Å; W601-E604 PolarHBondContact O-N 3.26Å; W601-Y605 WeakPolarHBondContact O-CB 3.42Å; W601-Y605 PolarHBondContact O-N 3.39Å
602	R	90.7	Very high	84.7	Confident	75 Å²	75	72.2 Å²	72.2	28%	0.283	34%	0.342	S	S	.	.	H	α-helix	trans	-62.9	-42.5	172.8	-73.8	-179.4	-179.8	131	-22.9	112.2	G598 F599 K600 Y605 V606 E644 Y692	G598-R602 WeakPolarHBondContact O-CG 3.43Å; G598-R602 PolarHBondContact O-N 2.77Å; F599-R602 PolarHBondContact O-N 3.17Å; K600-R602 PolarHBondContact O-N 3.09Å; R602-Y605 PolarHBondContact O-N 2.92Å; R602-V606 VanDerWaalsContact O-CG2 3.32Å; R602-V606 WeakPolarHBondContact O-CG2 3.5Å; R602-V606 PolarHBondContact O-N 3.37Å; R602-E644 IonicContact CZ-OE1 2.73Å; R602-E644 IonicContact NH2-OE1 3.5Å; R602-E644 PolarHBondContact NH2-OE1 3.44Å; R602-E644 IonicContact NH2-OE2 2.84Å; R602-E644 PolarHBondContact NH2-OE2 3.01Å; R602-Y692 HydrophobicContact CB-CD1 4.25Å; R602-Y692 HydrophobicContact CB-CD2 4.12Å; R602-Y692 HydrophobicContact CB-CE1 4.08Å; R602-Y692 HydrophobicContact CB-CE2 3.97Å; R602-Y692 HydrophobicContact CB-CG 4.28Å
603	R	89.3	Confident	83.7	Confident	40 Å²	40	67.6 Å²	67.6	15%	0.151	32%	0.321	C	S	.	.	H	α-helix	trans	-58	-52.1	174.5	-175.9	-167.6	69.1	-177.7	3.8	111.2	F599 K600 Y605 V606 K607 Y689 T693	F599-R603 WeakPolarHBondContact O-CB 3.16Å; F599-R603 PolarHBondContact O-N 3.26Å; K600-R603 WeakPolarHBondContact O-CB 3.4Å; K600-R603 PolarHBondContact O-N 3.42Å; R603-Y605 VanDerWaalsContact C-N 3.3Å; R603-Y605 PolarHBondContact O-N 3.27Å; R603-V606 PolarHBondContact O-N 3Å; R603-K607 PolarHBondContact O-N 3.45Å; R603-Y689 HydrophobicContact CG-CD2 3.56Å; R603-Y689 HydrophobicContact CG-CE2 3.41Å; R603-Y689 VanDerWaalsContact CG-CE2 3.41Å; R603-Y689 HydrophobicContact CG-CG 4.44Å; R603-T693 VanDerWaalsContact CD-OG1 3.24Å; R603-T693 WeakPolarHBondContact CD-OG1 3.5Å
604	E	87.2	Confident	82	Confident	68 Å²	68	61 Å²	61	32%	0.318	30%	0.304	S	S	.	.	H	α-helix	trans	-62.6	-38.8	179	-64.6	-45.9	128.7	0	0	111.9	K600 W601 K607 L608	K600-E604 WeakPolarHBondContact O-CG 3.19Å; K600-E604 PolarHBondContact O-N 3.05Å; W601-E604 PolarHBondContact O-N 3.26Å; E604-K607 PolarHBondContact O-N 3.27Å; E604-L608 WeakPolarHBondContact O-CB 3.42Å; E604-L608 PolarHBondContact O-N 3.02Å
605	Y	88.3	Confident	79.8	Confident	92 Å²	92	58.5 Å²	58.5	36%	0.361	29%	0.294	S	S	.	.	H	α-helix	trans	-66.7	-43.5	178.1	-175	-110.6	0	0	0	112.4	W601 R602 R603 K607 L608 L609 L637	W601-Y605 WeakPolarHBondContact O-CB 3.42Å; W601-Y605 PolarHBondContact O-N 3.39Å; R602-Y605 PolarHBondContact O-N 2.92Å; R603-Y605 VanDerWaalsContact C-N 3.3Å; R603-Y605 PolarHBondContact O-N 3.27Å; Y605-K607 VanDerWaalsContact C-N 3.32Å; Y605-K607 PolarHBondContact O-N 3.01Å; Y605-L608 WeakPolarHBondContact O-CB 3.21Å; Y605-L608 PolarHBondContact O-N 2.69Å; Y605-L609 HydrophobicContact CD1-CD1 3.94Å; Y605-L609 HydrophobicContact CD1-CG 4.37Å; Y605-L609 HydrophobicContact CE1-CD1 3.5Å; Y605-L609 VanDerWaalsContact CE1-CD1 3.5Å; Y605-L609 HydrophobicContact CE1-CD2 4.46Å; Y605-L609 HydrophobicContact CE1-CG 4.01Å; Y605-L609 HydrophobicContact CE2-CG 4.48Å; Y605-L609 WeakPolarHBondContact O-CG 3.32Å; Y605-L609 PolarHBondContact O-N 2.91Å; Y605-L637 HydrophobicContact CE1-CD2 3.54Å; Y605-L637 HydrophobicContact CE1-CG 4.41Å; Y605-L637 WeakPolarHBondContact OH-CD2 3.23Å
606	V	88.5	Confident	77.5	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-41.3	174.2	169.9	0	0	0	0	111.1	R602 R603 L609 Q610 L641 C685 L688 Y692	R602-V606 VanDerWaalsContact O-CG2 3.32Å; R602-V606 WeakPolarHBondContact O-CG2 3.5Å; R602-V606 PolarHBondContact O-N 3.37Å; R603-V606 PolarHBondContact O-N 3Å; V606-L609 PolarHBondContact O-N 3.26Å; V606-Q610 WeakPolarHBondContact O-CB 3.11Å; V606-Q610 PolarHBondContact O-N 2.71Å; V606-L641 HydrophobicContact CG2-CD1 4.18Å; V606-C685 HydrophobicContact CG1-CB 4.09Å; V606-C685 WeakPolarHBondContact CG1-O 3.32Å; V606-L688 HydrophobicContact CG1-CB 3.92Å; V606-L688 HydrophobicContact CG2-CB 4.27Å; V606-L688 HydrophobicContact CG2-CD1 4.44Å; V606-Y692 HydrophobicContact CG2-CD2 4.26Å; V606-Y692 HydrophobicContact CG2-CE2 3.95Å
607	K	83.6	Confident	75.3	Confident	65 Å²	65	63.5 Å²	63.5	28%	0.283	32%	0.319	S	S	.	.	H	α-helix	trans	-62.6	-42.5	175.9	-165	178.5	-167.3	174	0	111.8	R603 E604 Y605 Q610 A611 Y689 D968	R603-K607 PolarHBondContact O-N 3.45Å; E604-K607 PolarHBondContact O-N 3.27Å; Y605-K607 VanDerWaalsContact C-N 3.32Å; Y605-K607 PolarHBondContact O-N 3.01Å; K607-Q610 PolarHBondContact O-N 3.18Å; K607-A611 WeakPolarHBondContact O-CB 3.47Å; K607-A611 PolarHBondContact O-N 3.13Å; K607-Y689 HydrophobicContact CB-CD2 4Å; K607-Y689 HydrophobicContact CB-CE2 4.03Å; K607-Y689 HydrophobicContact CD-CE2 3.83Å; K607-Y689 HydrophobicContact CG-CD2 4.42Å; K607-Y689 HydrophobicContact CG-CE2 4.19Å; K607-D968 WeakPolarHBondContact CE-OD2 3.02Å; K607-D968 IonicContact NZ-OD2 2.86Å; K607-D968 PolarHBondContact NZ-OD2 2.71Å
608	L	80.9	Confident	72.8	Confident	102 Å²	102	62.8 Å²	62.8	53%	0.534	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-44.9	174.9	-178	66.9	0	0	0	111.3	E604 Y605 Q610 A611 C612	E604-L608 WeakPolarHBondContact O-CB 3.42Å; E604-L608 PolarHBondContact O-N 3.02Å; Y605-L608 WeakPolarHBondContact O-CB 3.21Å; Y605-L608 PolarHBondContact O-N 2.69Å; L608-Q610 PolarHBondContact O-N 3.35Å; L608-A611 WeakPolarHBondContact O-CB 3.34Å; L608-A611 PolarHBondContact O-N 3.04Å; L608-C612 WeakPolarHBondContact O-CB 3.33Å; L608-C612 PolarHBondContact O-N 3.11Å; L608-C612 PolarHBondContact O-SG 3.01Å
609	L	79.5	Confident	70.2	Confident	9 Å²	9	64.4 Å²	64.4	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-46.6	175.2	-73.2	178	0	0	0	111.2	Y605 V606 A611 C612 L613 Y634 I638	Y605-L609 HydrophobicContact CD1-CD1 3.94Å; Y605-L609 HydrophobicContact CD1-CG 4.37Å; Y605-L609 HydrophobicContact CE1-CD1 3.5Å; Y605-L609 VanDerWaalsContact CE1-CD1 3.5Å; Y605-L609 HydrophobicContact CE1-CD2 4.46Å; Y605-L609 HydrophobicContact CE1-CG 4.01Å; Y605-L609 HydrophobicContact CE2-CG 4.48Å; Y605-L609 WeakPolarHBondContact O-CG 3.32Å; Y605-L609 PolarHBondContact O-N 2.91Å; V606-L609 PolarHBondContact O-N 3.26Å; L609-A611 VanDerWaalsContact C-N 3.31Å; L609-A611 PolarHBondContact O-N 3.04Å; L609-C612 CarbonylContact O-C 3.59Å; L609-C612 PolarHBondContact O-N 3.33Å; L609-C612 VanDerWaalsContact O-N 3.08Å; L609-L613 WeakPolarHBondContact O-CB 3.38Å; L609-L613 WeakPolarHBondContact O-CD1 3.45Å; L609-L613 WeakPolarHBondContact O-CG 3.44Å; L609-L613 PolarHBondContact O-N 3.45Å; L609-Y634 HydrophobicContact CD2-CD1 3.44Å; L609-Y634 VanDerWaalsContact CD2-CD1 3.44Å; L609-Y634 HydrophobicContact CD2-CE1 3.76Å; L609-Y634 HydrophobicContact CD2-CG 3.97Å; L609-I638 HydrophobicContact CD1-CD1 4.47Å; L609-I638 HydrophobicContact CD1-CG1 4.12Å
610	Q	78.7	Confident	68.1	Low	26 Å²	26	69.1 Å²	69.1	12%	0.121	36%	0.355	C	S	.	.	H	α-helix	trans	-59.3	-41.7	176.7	-166	-179.8	4.9	0	0	111.8	V606 K607 L608 C612 L613 H682 C685 Q686	V606-Q610 WeakPolarHBondContact O-CB 3.11Å; V606-Q610 PolarHBondContact O-N 2.71Å; K607-Q610 PolarHBondContact O-N 3.18Å; L608-Q610 PolarHBondContact O-N 3.35Å; Q610-C612 VanDerWaalsContact C-N 3.3Å; Q610-C612 PolarHBondContact O-N 2.94Å; Q610-L613 PolarHBondContact O-N 2.76Å; Q610-H682 WeakPolarHBondContact CG-ND1 3.47Å; Q610-H682 PolarHBondContact O-CE1 3.4Å; Q610-C685 HydrophobicContact CB-CB 3.9Å; Q610-C685 HydrophobicContact CG-CB 3.92Å; Q610-Q686 VanDerWaalsContact NE2-OE1 3.1Å
611	A	72.1	Confident	66	Low	37 Å²	37	71.7 Å²	71.7	31%	0.306	37%	0.368	S	S	.	.	H	α-helix	trans	-64.5	-33.5	174.8	0	0	0	0	0	112.9	K607 L608 L609 D966	K607-A611 WeakPolarHBondContact O-CB 3.47Å; K607-A611 PolarHBondContact O-N 3.13Å; L608-A611 WeakPolarHBondContact O-CB 3.34Å; L608-A611 PolarHBondContact O-N 3.04Å; L609-A611 VanDerWaalsContact C-N 3.31Å; L609-A611 PolarHBondContact O-N 3.04Å; A611-D966 HydrophobicContact CB-CB 4.06Å
612	C	67.9	Low	63.7	Low	85 Å²	85	66.6 Å²	66.6	57%	0.574	35%	0.352	S	S	*	.	H	α-helix	trans	-85.2	-19.5	178.1	-66.5	0	0	0	0	114	L608 L609 Q610 G614	L608-C612 WeakPolarHBondContact O-CB 3.33Å; L608-C612 PolarHBondContact O-N 3.11Å; L608-C612 PolarHBondContact O-SG 3.01Å; L609-C612 CarbonylContact O-C 3.59Å; L609-C612 PolarHBondContact O-N 3.33Å; L609-C612 VanDerWaalsContact O-N 3.08Å; Q610-C612 VanDerWaalsContact C-N 3.3Å; Q610-C612 PolarHBondContact O-N 2.94Å; C612-G614 VanDerWaalsContact C-N 3.25Å; C612-G614 PolarHBondContact O-N 3.27Å
613	L	64.2	Low	61.1	Low	26 Å²	26	74.3 Å²	74.3	14%	0.136	38%	0.381	C	S	.	.			trans	-70.3	82.8	177.9	-81.2	158.6	0	0	0	109.4	L609 Q610 I638 I681 H682 C685	L609-L613 WeakPolarHBondContact O-CB 3.38Å; L609-L613 WeakPolarHBondContact O-CD1 3.45Å; L609-L613 WeakPolarHBondContact O-CG 3.44Å; L609-L613 PolarHBondContact O-N 3.45Å; Q610-L613 PolarHBondContact O-N 2.76Å; L613-I638 HydrophobicContact CD1-CD1 3.87Å; L613-I681 HydrophobicContact CD1-CG2 3.42Å; L613-I681 VanDerWaalsContact CD1-CG2 3.42Å; L613-I681 HydrophobicContact CD2-CG2 3.7Å; L613-I681 HydrophobicContact CG-CG2 4.19Å; L613-H682 PolarHBondContact O-CE1 2.75Å; L613-H682 PolarHBondContact O-NE2 3.41Å; L613-C685 VanDerWaalsContact CD1-SG 3.55Å
614	G	50.3	Low	58.6	Low	25 Å²	25	73.4 Å²	73.4	26%	0.258	38%	0.379	S	S	.	.			trans	-169.4	85.7	-177.2	0	0	0	0	0	110.5	C612 L963	C612-G614 VanDerWaalsContact C-N 3.25Å; C612-G614 PolarHBondContact O-N 3.27Å; G614-L963 VanDerWaalsContact CA-CD2 3.43Å
615	A	42.2	Very low	55.7	Low	21 Å²	21	77.3 Å²	77.3	17%	0.174	40%	0.399	C	S	.	.			trans	172.9	105.4	139.7	0	0	0	0	0	111.3	F626	A615-F626 HydrophobicContact CB-CB 2.92Å; A615-F626 HydrophobicContact CB-CD1 3.79Å; A615-F626 HydrophobicContact CB-CD2 3.79Å; A615-F626 HydrophobicContact CB-CG 3.26Å
616	T	37.3	Very low	53.5	Low	70 Å²	70	75.1 Å²	75.1	43%	0.429	39%	0.391	S	S	.	.			trans	-127.3	80.6	165.7	53.9	0	0	0	0	106.9	K631 T678	T616-K631 HydrophobicContact CG2-CD 4.5Å; T616-T678 PolarHBondContact OG1-OG1 3.3Å
617	Q	37.8	Very low	51.1	Low	187 Å²	187	77.9 Å²	77.9	87%	0.874	41%	0.411	S	S	*	.			trans	-174.9	73.9	155.7	-103.1	170.5	42.5	0	0	108.1
618	T	35.1	Very low	49.1	Very low	62 Å²	62	79.3 Å²	79.3	38%	0.38	42%	0.422	S	S	.	.			trans	-83.5	117.4	168.1	48.3	0	0	0	0	108	P620 L624	T618-P620 WeakPolarHBondContact O-CD 3.33Å; T618-L624 WeakPolarHBondContact CG2-O 3.44Å
619	D	35.7	Very low	47.2	Very low	59 Å²	59	83 Å²	83	32%	0.316	43%	0.43	S	S	.	.			trans	-86.6	111.1	163.9	-169.1	-19.8	0	0	0	106.3	H621 H622 K955	D619-H621 PolarHBondContact O-N 3.41Å; D619-H621 IonicContact OD1-CD2 3.29Å; D619-H621 PolarHBondContact OD1-N 3.12Å; D619-H622 PolarHBondContact O-N 2.95Å; D619-H622 VanDerWaalsContact O-N 3.1Å; D619-K955 IonicContact OD2-NZ 3.11Å; D619-K955 PolarHBondContact OD2-NZ 3.46Å
620	P	43.5	Very low	45.8	Very low	120 Å²	120	84 Å²	84	78%	0.779	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.6	-173.8	20.4	-31.2	0	0	0	113.3	T618	T618-P620 WeakPolarHBondContact O-CD 3.33Å
621	H	41.9	Very low	44.9	Very low	160 Å²	160	85.6 Å²	85.6	74%	0.741	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-15.5	178.7	-72.1	-69.1	0	0	0	115.2	D619	D619-H621 PolarHBondContact O-N 3.41Å; D619-H621 IonicContact OD1-CD2 3.29Å; D619-H621 PolarHBondContact OD1-N 3.12Å
622	H	42.7	Very low	44.6	Very low	69 Å²	69	89 Å²	89	32%	0.319	46%	0.462	S	S	.	.	S	Bend	trans	-119.2	17.1	-166.3	-72.4	12	0	0	0	115.6	D619 L624 S952	D619-H622 PolarHBondContact O-N 2.95Å; D619-H622 VanDerWaalsContact O-N 3.1Å; H622-L624 PolarHBondContact O-N 2.81Å; H622-S952 PolarHBondContact CD2-OG 3.25Å
623	R	36.6	Very low	44.7	Very low	237 Å²	237	94.1 Å²	94.1	89%	0.894	47%	0.469	S	S	*	.			trans	56.7	11.1	172.7	-122.5	-177.4	-162.8	-176.3	4.2	115.2	M625	R623-M625 PolarHBondContact O-N 3Å
624	L	35.8	Very low	45.1	Very low	21 Å²	21	96.9 Å²	96.9	11%	0.11	48%	0.478	C	S	.	.			trans	-74.4	74.5	166.9	-77.7	160.4	0	0	0	107.7	T618 H622 F626 C956	T618-L624 WeakPolarHBondContact CG2-O 3.44Å; H622-L624 PolarHBondContact O-N 2.81Å; L624-F626 HydrophobicContact CB-CE2 4.44Å; L624-F626 HydrophobicContact CD2-CE2 4.1Å; L624-F626 HydrophobicContact CD2-CZ 4.45Å; L624-F626 PolarHBondContact O-N 3.36Å; L624-F626 VanDerWaalsContact O-N 3.08Å; L624-C956 HydrophobicContact CD2-CB 4.15Å
625	M	28.1	Very low	46.3	Very low	151 Å²	151	98.8 Å²	98.8	74%	0.744	48%	0.479	S	S	*	.			trans	-79.8	77.7	170.5	-69.6	-73.2	-78.8	0	0	107.6	R623 S627	R623-M625 PolarHBondContact O-N 3Å; M625-S627 PolarHBondContact O-N 3.48Å; M625-S627 VanDerWaalsContact O-N 3.07Å
626	F	41.9	Very low	48.1	Very low	45 Å²	45	102.2 Å²	102.2	20%	0.197	49%	0.494	C	S	.	.			trans	-75	96.6	150.9	-58.6	-83.5	0	0	0	105.7	A615 L624 D628 M943 A959	A615-F626 HydrophobicContact CB-CB 2.92Å; A615-F626 HydrophobicContact CB-CD1 3.79Å; A615-F626 HydrophobicContact CB-CD2 3.79Å; A615-F626 HydrophobicContact CB-CG 3.26Å; L624-F626 HydrophobicContact CB-CE2 4.44Å; L624-F626 HydrophobicContact CD2-CE2 4.1Å; L624-F626 HydrophobicContact CD2-CZ 4.45Å; L624-F626 PolarHBondContact O-N 3.36Å; L624-F626 VanDerWaalsContact O-N 3.08Å; F626-D628 PolarHBondContact O-N 3.19Å; F626-M943 HydrophobicContact CD1-SD 4.39Å; F626-M943 HydrophobicContact CE1-CE 4.02Å; F626-M943 HydrophobicContact CE1-SD 3.3Å; F626-M943 WeakPolarHBondContact CE1-SD 3.1Å; F626-M943 HydrophobicContact CZ-CE 3.86Å; F626-M943 HydrophobicContact CZ-SD 3.37Å; F626-M943 WeakPolarHBondContact CZ-SD 3.4Å; F626-A959 HydrophobicContact CZ-CB 4.42Å
627	S	37.7	Very low	50.3	Low	59 Å²	59	101.1 Å²	101.1	41%	0.413	49%	0.486	S	S	.	.			trans	-64.4	122.6	-172.6	33.7	0	0	0	0	109.1	M625 Y629	M625-S627 PolarHBondContact O-N 3.48Å; M625-S627 VanDerWaalsContact O-N 3.07Å; S627-Y629 PolarHBondContact O-N 2.76Å; S627-Y629 WeakPolarHBondContact OG-CD2 3.44Å; S627-Y629 WeakPolarHBondContact OG-CE2 3.42Å
628	D	41.5	Very low	52.6	Low	95 Å²	95	92.2 Å²	92.2	51%	0.508	44%	0.444	S	S	.	.			trans	-63.1	43	163.8	-73.4	-49.9	0	0	0	110.8	F626 G630 K631	F626-D628 PolarHBondContact O-N 3.19Å; D628-G630 VanDerWaalsContact C-N 3.28Å; D628-G630 PolarHBondContact O-N 3.32Å; D628-K631 PolarHBondContact O-N 2.68Å
629	Y	41.3	Very low	55.1	Low	179 Å²	179	90.7 Å²	90.7	70%	0.702	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	95	-178.4	-82.5	-55.9	0	0	0	108.7	S627 Y634	S627-Y629 PolarHBondContact O-N 2.76Å; S627-Y629 WeakPolarHBondContact OG-CD2 3.44Å; S627-Y629 WeakPolarHBondContact OG-CE2 3.42Å; Y629-Y634 WeakPolarHBondContact O-CE2 3.37Å
630	G	50.5	Low	57.6	Low	29 Å²	29	93.9 Å²	93.9	30%	0.299	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	33.3	176.5	0	0	0	0	0	115.1	D628 D632 R633 Y634	D628-G630 VanDerWaalsContact C-N 3.28Å; D628-G630 PolarHBondContact O-N 3.32Å; G630-D632 VanDerWaalsContact C-N 3.26Å; G630-D632 PolarHBondContact O-N 2.85Å; G630-R633 CarbonylContact O-C 3.54Å; G630-R633 WeakPolarHBondContact O-CA 3.48Å; G630-R633 WeakPolarHBondContact O-CB 3.49Å; G630-R633 PolarHBondContact O-N 3.09Å; G630-Y634 VanDerWaalsContact O-CD2 3.24Å; G630-Y634 WeakPolarHBondContact O-CD2 3.4Å; G630-Y634 PolarHBondContact O-N 3.11Å
631	K	58.3	Low	59.8	Low	61 Å²	61	89 Å²	89	27%	0.265	42%	0.416	S	S	.	.	H	α-helix	trans	-49.5	-49.5	173.5	-175.7	-176.1	171.8	-165.7	0	111.6	T616 D628 R633 Y634 K635 E677	T616-K631 HydrophobicContact CG2-CD 4.5Å; D628-K631 PolarHBondContact O-N 2.68Å; K631-R633 VanDerWaalsContact C-N 3.32Å; K631-R633 PolarHBondContact O-N 2.65Å; K631-Y634 PolarHBondContact O-N 2.59Å; K631-K635 WeakPolarHBondContact O-CB 3.33Å; K631-K635 PolarHBondContact O-N 2.98Å; K631-E677 VanDerWaalsContact CE-OE2 3.31Å; K631-E677 WeakPolarHBondContact CE-OE2 3.42Å; K631-E677 IonicContact NZ-OE2 2.7Å; K631-E677 PolarHBondContact NZ-OE2 3.44Å
632	D	66.1	Low	62.1	Low	109 Å²	109	81.4 Å²	81.4	58%	0.583	38%	0.381	S	S	*	.	H	α-helix	trans	-65.2	-37.1	175.8	-64.9	-38.4	0	0	0	112	G630 K635 N636	G630-D632 VanDerWaalsContact C-N 3.26Å; G630-D632 PolarHBondContact O-N 2.85Å; D632-K635 PolarHBondContact O-N 3.42Å; D632-N636 VanDerWaalsContact O-CB 3.25Å; D632-N636 WeakPolarHBondContact O-CB 3.2Å; D632-N636 PolarHBondContact O-N 3.29Å; D632-N636 PolarHBondContact O-ND2 2.92Å; D632-N636 PolarHBondContact O-OD1 3.46Å
633	R	69.8	Low	64.4	Low	191 Å²	191	81.4 Å²	81.4	72%	0.721	38%	0.384	S	S	*	.	H	α-helix	trans	-63.4	-46.3	176.4	-171.6	-177.4	179.2	-175.4	0.4	111.8	G630 K631 L637	G630-R633 CarbonylContact O-C 3.54Å; G630-R633 WeakPolarHBondContact O-CA 3.48Å; G630-R633 WeakPolarHBondContact O-CB 3.49Å; G630-R633 PolarHBondContact O-N 3.09Å; K631-R633 VanDerWaalsContact C-N 3.32Å; K631-R633 PolarHBondContact O-N 2.65Å; R633-L637 VanDerWaalsContact O-CB 3.24Å; R633-L637 WeakPolarHBondContact O-CB 3.4Å; R633-L637 PolarHBondContact O-N 3.03Å
634	Y	72.3	Confident	66.9	Low	84 Å²	84	73 Å²	73	33%	0.329	36%	0.355	S	S	.	.	H	α-helix	trans	-71.1	-38.6	178.3	-62.6	-46	0	0	0	111.4	L609 Y629 G630 K631 L637 I638	L609-Y634 HydrophobicContact CD2-CD1 3.44Å; L609-Y634 VanDerWaalsContact CD2-CD1 3.44Å; L609-Y634 HydrophobicContact CD2-CE1 3.76Å; L609-Y634 HydrophobicContact CD2-CG 3.97Å; Y629-Y634 WeakPolarHBondContact O-CE2 3.37Å; G630-Y634 VanDerWaalsContact O-CD2 3.24Å; G630-Y634 WeakPolarHBondContact O-CD2 3.4Å; G630-Y634 PolarHBondContact O-N 3.11Å; K631-Y634 PolarHBondContact O-N 2.59Å; Y634-L637 PolarHBondContact O-N 3.14Å; Y634-I638 WeakPolarHBondContact O-CB 3.34Å; Y634-I638 WeakPolarHBondContact O-CD1 3.5Å; Y634-I638 WeakPolarHBondContact O-CG1 3.46Å; Y634-I638 PolarHBondContact O-N 3.15Å
635	K	75.5	Confident	69.5	Low	65 Å²	65	72.1 Å²	72.1	28%	0.283	35%	0.35	S	S	.	.	H	α-helix	trans	-59.7	-48.7	172.8	-179.7	-174.2	175.6	179.8	0	111.3	K631 D632 L637 I638 S639 M655 E677 I681	K631-K635 WeakPolarHBondContact O-CB 3.33Å; K631-K635 PolarHBondContact O-N 2.98Å; D632-K635 PolarHBondContact O-N 3.42Å; K635-L637 VanDerWaalsContact C-N 3.33Å; K635-L637 PolarHBondContact O-N 3.48Å; K635-I638 PolarHBondContact O-N 2.98Å; K635-S639 WeakPolarHBondContact O-CB 3.25Å; K635-S639 PolarHBondContact O-N 3.33Å; K635-M655 HydrophobicContact CG-CE 4.11Å; K635-E677 VanDerWaalsContact CD-OE1 3.3Å; K635-E677 WeakPolarHBondContact CD-OE1 3.27Å; K635-E677 WeakPolarHBondContact CE-OE1 3.5Å; K635-E677 IonicContact NZ-OE1 3.89Å; K635-E677 PolarHBondContact NZ-OE1 3.48Å; K635-I681 HydrophobicContact CG-CD1 4.43Å
636	N	81.3	Confident	72.5	Confident	93 Å²	93	68.8 Å²	68.8	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-43.9	177.2	-68.5	-12	0	0	0	110.6	D632 I638 S639 E640	D632-N636 VanDerWaalsContact O-CB 3.25Å; D632-N636 WeakPolarHBondContact O-CB 3.2Å; D632-N636 PolarHBondContact O-N 3.29Å; D632-N636 PolarHBondContact O-ND2 2.92Å; D632-N636 PolarHBondContact O-OD1 3.46Å; N636-I638 PolarHBondContact O-N 3.34Å; N636-S639 WeakPolarHBondContact O-CB 3.45Å; N636-S639 PolarHBondContact O-N 3.25Å; N636-E640 WeakPolarHBondContact O-CG 3.22Å; N636-E640 PolarHBondContact O-N 2.85Å
637	L	83.8	Confident	74.8	Confident	47 Å²	47	76.1 Å²	76.1	25%	0.246	36%	0.356	C	S	.	.	H	α-helix	trans	-62.9	-42.2	177	-173.6	61.2	0	0	0	112.7	Y605 R633 Y634 K635 S639 E640 L641	Y605-L637 HydrophobicContact CE1-CD2 3.54Å; Y605-L637 HydrophobicContact CE1-CG 4.41Å; Y605-L637 WeakPolarHBondContact OH-CD2 3.23Å; R633-L637 VanDerWaalsContact O-CB 3.24Å; R633-L637 WeakPolarHBondContact O-CB 3.4Å; R633-L637 PolarHBondContact O-N 3.03Å; Y634-L637 PolarHBondContact O-N 3.14Å; K635-L637 VanDerWaalsContact C-N 3.33Å; K635-L637 PolarHBondContact O-N 3.48Å; L637-S639 VanDerWaalsContact C-N 3.33Å; L637-E640 PolarHBondContact O-N 3.22Å; L637-L641 HydrophobicContact CG-CD1 4.4Å; L637-L641 WeakPolarHBondContact O-CB 3.39Å; L637-L641 VanDerWaalsContact O-CG 3.27Å; L637-L641 WeakPolarHBondContact O-CG 3.38Å; L637-L641 PolarHBondContact O-N 3.12Å
638	I	85.3	Confident	77.1	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-63.9	-41.9	174.4	-70.8	162.6	0	0	0	109.8	L609 L613 Y634 K635 N636 L641 L642 I681 C685 L688	L609-I638 HydrophobicContact CD1-CD1 4.47Å; L609-I638 HydrophobicContact CD1-CG1 4.12Å; L613-I638 HydrophobicContact CD1-CD1 3.87Å; Y634-I638 WeakPolarHBondContact O-CB 3.34Å; Y634-I638 WeakPolarHBondContact O-CD1 3.5Å; Y634-I638 WeakPolarHBondContact O-CG1 3.46Å; Y634-I638 PolarHBondContact O-N 3.15Å; K635-I638 PolarHBondContact O-N 2.98Å; N636-I638 PolarHBondContact O-N 3.34Å; I638-L641 PolarHBondContact O-N 3.5Å; I638-L642 WeakPolarHBondContact O-CB 3.17Å; I638-L642 PolarHBondContact O-N 3.26Å; I638-I681 HydrophobicContact CD1-CG2 3.66Å; I638-C685 VanDerWaalsContact CD1-SG 3.55Å; I638-L688 HydrophobicContact CG2-CD1 4.14Å
639	S	86.6	Confident	79.3	Confident	29 Å²	29	75.9 Å²	75.9	20%	0.203	34%	0.344	C	S	.	.	H	α-helix	trans	-61.2	-45.5	175.6	-163.4	0	0	0	0	111.8	K635 N636 L637 L642 D643	K635-S639 WeakPolarHBondContact O-CB 3.25Å; K635-S639 PolarHBondContact O-N 3.33Å; N636-S639 WeakPolarHBondContact O-CB 3.45Å; N636-S639 PolarHBondContact O-N 3.25Å; L637-S639 VanDerWaalsContact C-N 3.33Å; S639-L642 WeakPolarHBondContact O-CB 3.49Å; S639-L642 PolarHBondContact O-N 3.4Å; S639-D643 WeakPolarHBondContact O-CB 3.18Å; S639-D643 PolarHBondContact O-N 3.09Å
640	E	88.9	Confident	81.5	Confident	126 Å²	126	72.2 Å²	72.2	59%	0.589	34%	0.342	S	S	*	.	H	α-helix	trans	-62.1	-44.9	176.9	-74.5	174.6	-162.7	0	0	112	N636 L637 L642 D643 E644	N636-E640 WeakPolarHBondContact O-CG 3.22Å; N636-E640 PolarHBondContact O-N 2.85Å; L637-E640 PolarHBondContact O-N 3.22Å; E640-L642 VanDerWaalsContact C-N 3.32Å; E640-L642 PolarHBondContact O-N 3.48Å; E640-D643 PolarHBondContact O-N 2.97Å; E640-E644 PolarHBondContact O-N 3.44Å
641	L	90.3	Very high	83.2	Confident	18 Å²	18	75.5 Å²	75.5	9%	0.094	36%	0.36	C	S	.	.	H	α-helix	trans	-63.6	-38.9	175.9	-72	173	0	0	0	111.7	V606 L637 I638 A645 L688	V606-L641 HydrophobicContact CG2-CD1 4.18Å; L637-L641 HydrophobicContact CG-CD1 4.4Å; L637-L641 WeakPolarHBondContact O-CB 3.39Å; L637-L641 VanDerWaalsContact O-CG 3.27Å; L637-L641 WeakPolarHBondContact O-CG 3.38Å; L637-L641 PolarHBondContact O-N 3.12Å; I638-L641 PolarHBondContact O-N 3.5Å; L641-A645 VanDerWaalsContact O-CB 3.31Å; L641-A645 WeakPolarHBondContact O-CB 3.28Å; L641-A645 PolarHBondContact O-N 2.98Å; L641-L688 HydrophobicContact CB-CD1 4.05Å
642	L	90.3	Very high	84.6	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-65.7	-45.2	176.4	-162.4	75.7	0	0	0	110.7	I638 S639 E640 A645 R646 P653 M655 L688	I638-L642 WeakPolarHBondContact O-CB 3.17Å; I638-L642 PolarHBondContact O-N 3.26Å; S639-L642 WeakPolarHBondContact O-CB 3.49Å; S639-L642 PolarHBondContact O-N 3.4Å; E640-L642 VanDerWaalsContact C-N 3.32Å; E640-L642 PolarHBondContact O-N 3.48Å; L642-A645 PolarHBondContact O-N 2.95Å; L642-R646 WeakPolarHBondContact O-CB 3.4Å; L642-R646 WeakPolarHBondContact O-CG 3.1Å; L642-R646 PolarHBondContact O-N 3.24Å; L642-P653 HydrophobicContact CD1-CG 4.3Å; L642-P653 WeakPolarHBondContact CD2-O 3.32Å; L642-P653 WeakPolarHBondContact CG-O 3.3Å; L642-M655 HydrophobicContact CD2-CG 4Å; L642-L688 HydrophobicContact CB-CD1 4.37Å; L642-L688 HydrophobicContact CD1-CD1 4.16Å; L642-L688 HydrophobicContact CD1-CD2 4.09Å; L642-L688 HydrophobicContact CD1-CG 3.76Å
643	D	89.7	Confident	85.4	Confident	70 Å²	70	68 Å²	68	37%	0.374	32%	0.324	S	S	.	.	H	α-helix	trans	-66.9	-36.4	177.5	-71.6	-27.5	0	0	0	112.1	S639 E640 R647	S639-D643 WeakPolarHBondContact O-CB 3.18Å; S639-D643 PolarHBondContact O-N 3.09Å; E640-D643 PolarHBondContact O-N 2.97Å; D643-R647 WeakPolarHBondContact O-CG 3.42Å; D643-R647 PolarHBondContact O-N 3.44Å
644	E	89.3	Confident	86	Confident	61 Å²	61	60 Å²	60	29%	0.285	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-48.8	170.1	-171.4	-170.9	162.9	0	0	111.1	R602 E640 R646 R647	R602-E644 IonicContact CZ-OE1 2.73Å; R602-E644 IonicContact NH2-OE1 3.5Å; R602-E644 PolarHBondContact NH2-OE1 3.44Å; R602-E644 IonicContact NH2-OE2 2.84Å; R602-E644 PolarHBondContact NH2-OE2 3.01Å; E640-E644 PolarHBondContact O-N 3.44Å; E644-R646 VanDerWaalsContact C-N 3.32Å; E644-R646 PolarHBondContact O-N 3.02Å; E644-R647 WeakPolarHBondContact O-CB 3.39Å; E644-R647 PolarHBondContact O-N 2.73Å
645	A	90.9	Very high	86.4	Confident	2 Å²	2	57.3 Å²	57.3	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-38	179.6	0	0	0	0	0	112	L641 L642 R647 K648 D649 L652 L688 F691	L641-A645 VanDerWaalsContact O-CB 3.31Å; L641-A645 WeakPolarHBondContact O-CB 3.28Å; L641-A645 PolarHBondContact O-N 2.98Å; L642-A645 PolarHBondContact O-N 2.95Å; A645-R647 VanDerWaalsContact C-N 3.26Å; A645-R647 PolarHBondContact O-N 3.21Å; A645-K648 WeakPolarHBondContact O-CA 3.32Å; A645-K648 PolarHBondContact O-N 2.96Å; A645-D649 PolarHBondContact O-N 3.47Å; A645-L652 HydrophobicContact CB-CD1 3.47Å; A645-L652 VanDerWaalsContact CB-CD1 3.47Å; A645-L688 HydrophobicContact CB-CD2 3.77Å; A645-F691 HydrophobicContact CB-CD1 3.66Å; A645-F691 HydrophobicContact CB-CE1 3.53Å; A645-F691 HydrophobicContact CB-CG 4.21Å; A645-F691 HydrophobicContact CB-CZ 3.99Å
646	R	90.7	Very high	86.6	Confident	81 Å²	81	60.5 Å²	60.5	31%	0.306	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-25.5	177.5	-77.6	177.8	88.4	-163.7	2.3	114.3	L642 E644 K648 D649 P650 L652 P653 S654	L642-R646 WeakPolarHBondContact O-CB 3.4Å; L642-R646 WeakPolarHBondContact O-CG 3.1Å; L642-R646 PolarHBondContact O-N 3.24Å; E644-R646 VanDerWaalsContact C-N 3.32Å; E644-R646 PolarHBondContact O-N 3.02Å; R646-K648 PolarHBondContact O-N 3Å; R646-D649 WeakPolarHBondContact CA-O 3.29Å; R646-D649 CarbonylContact O-C 3.5Å; R646-P650 WeakPolarHBondContact O-CA 3.35Å; R646-L652 HydrophobicContact CG-CB 3.73Å; R646-L652 PolarHBondContact NE-O 2.93Å; R646-P653 WeakPolarHBondContact CD-O 3.48Å; R646-S654 VanDerWaalsContact NH1-CB 3.29Å; R646-S654 PolarHBondContact NH1-OG 3.43Å
647	R	90.1	Very high	86.3	Confident	199 Å²	199	61.1 Å²	61.1	75%	0.751	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.1	171.6	-63.3	179.6	-140.3	139.5	4.5	112.1	D643 E644 A645	D643-R647 WeakPolarHBondContact O-CG 3.42Å; D643-R647 PolarHBondContact O-N 3.44Å; E644-R647 WeakPolarHBondContact O-CB 3.39Å; E644-R647 PolarHBondContact O-N 2.73Å; A645-R647 VanDerWaalsContact C-N 3.26Å; A645-R647 PolarHBondContact O-N 3.21Å
648	K	87.1	Confident	85.8	Confident	123 Å²	123	61 Å²	61	54%	0.535	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-39.7	175.6	-64.5	-172.5	178.3	-175	0	112.6	A645 R646 F691	A645-K648 WeakPolarHBondContact O-CA 3.32Å; A645-K648 PolarHBondContact O-N 2.96Å; R646-K648 PolarHBondContact O-N 3Å; K648-F691 HydrophobicContact CB-CE2 4.21Å; K648-F691 HydrophobicContact CB-CZ 4Å; K648-F691 HydrophobicContact CD-CZ 4.18Å
649	D	88.4	Confident	85.2	Confident	26 Å²	26	71.3 Å²	71.3	14%	0.139	35%	0.352	C	S	.	.			trans	-128.3	88.6	179.8	-170.2	-8.3	0	0	0	110.3	A645 R646 S651 L652 F691 R694	A645-D649 PolarHBondContact O-N 3.47Å; R646-D649 WeakPolarHBondContact CA-O 3.29Å; R646-D649 CarbonylContact O-C 3.5Å; D649-S651 PolarHBondContact O-N 3.33Å; D649-S651 WeakPolarHBondContact OD1-CB 3.32Å; D649-S651 PolarHBondContact OD1-N 3.49Å; D649-S651 PolarHBondContact OD1-OG 3.37Å; D649-L652 HydrophobicContact CB-CD1 4.16Å; D649-L652 HydrophobicContact CB-CG 4.25Å; D649-L652 PolarHBondContact O-N 2.97Å; D649-F691 HydrophobicContact CB-CD2 3.94Å; D649-F691 HydrophobicContact CB-CE2 3.76Å; D649-R694 IonicContact OD2-CZ 2.8Å; D649-R694 IonicContact OD2-NH1 3.77Å; D649-R694 PolarHBondContact OD2-NH1 2.94Å; D649-R694 IonicContact OD2-NH2 3.77Å; D649-R694 PolarHBondContact OD2-NH2 2.93Å; D649-R694 VanDerWaalsContact OD2-NH2 3.1Å
650	P	87.4	Confident	84.6	Confident	101 Å²	101	76.6 Å²	76.6	66%	0.656	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-12	-179.5	-23	33.9	0	0	0	114.6	R646 L652	R646-P650 WeakPolarHBondContact O-CA 3.35Å; P650-L652 VanDerWaalsContact C-N 3.3Å
651	S	84.8	Confident	84	Confident	99 Å²	99	72.3 Å²	72.3	69%	0.692	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-13.9	179.2	77	0	0	0	0	114.2	D649	D649-S651 PolarHBondContact O-N 3.33Å; D649-S651 WeakPolarHBondContact OD1-CB 3.32Å; D649-S651 PolarHBondContact OD1-N 3.49Å; D649-S651 PolarHBondContact OD1-OG 3.37Å
652	L	87.3	Confident	83.7	Confident	6 Å²	6	76 Å²	76	3%	0.031	39%	0.389	C	S	.	.	S	Bend	trans	-63.9	148.5	176.6	-70.9	170.6	0	0	0	111.8	A645 R646 D649 P650 Q687 F691	A645-L652 HydrophobicContact CB-CD1 3.47Å; A645-L652 VanDerWaalsContact CB-CD1 3.47Å; R646-L652 HydrophobicContact CG-CB 3.73Å; R646-L652 PolarHBondContact NE-O 2.93Å; D649-L652 HydrophobicContact CB-CD1 4.16Å; D649-L652 HydrophobicContact CB-CG 4.25Å; D649-L652 PolarHBondContact O-N 2.97Å; P650-L652 VanDerWaalsContact C-N 3.3Å; L652-Q687 HydrophobicContact CD2-CB 4Å; L652-F691 HydrophobicContact CD1-CB 4.16Å; L652-F691 HydrophobicContact CD1-CD2 3.88Å; L652-F691 HydrophobicContact CD1-CE2 4.45Å; L652-F691 HydrophobicContact CD1-CG 3.95Å; L652-F691 HydrophobicContact CD2-CB 4.25Å
653	P	84.5	Confident	83.4	Confident	7 Å²	7	80.6 Å²	80.6	5%	0.045	41%	0.407	C	S	.	.			trans	-64.8	167.3	-177.1	29.7	-37.4	0	0	0	112.4	L642 R646 H664 Y683 Q687	L642-P653 HydrophobicContact CD1-CG 4.3Å; L642-P653 WeakPolarHBondContact CD2-O 3.32Å; L642-P653 WeakPolarHBondContact CG-O 3.3Å; R646-P653 WeakPolarHBondContact CD-O 3.48Å; P653-H664 WeakPolarHBondContact CB-NE2 3.47Å; P653-Y683 HydrophobicContact CB-CD1 4.43Å; P653-Y683 HydrophobicContact CB-CE1 3.73Å; P653-Y683 HydrophobicContact CG-CD1 4.24Å; P653-Y683 HydrophobicContact CG-CE1 3.68Å; P653-Q687 HydrophobicContact CG-CB 4.12Å; P653-Q687 HydrophobicContact CG-CG 3.92Å
654	S	82.2	Confident	83.2	Confident	23 Å²	23	79.2 Å²	79.2	16%	0.161	40%	0.398	C	S	.	.			trans	-113.1	142.8	170.6	-170.1	0	0	0	0	110.1	R646 I656 Y674	R646-S654 VanDerWaalsContact NH1-CB 3.29Å; R646-S654 PolarHBondContact NH1-OG 3.43Å; S654-I656 PolarHBondContact O-N 3.46Å; S654-I656 PolarHBondContact OG-N 2.89Å; S654-Y674 WeakPolarHBondContact O-CE1 3.36Å; S654-Y674 PolarHBondContact O-OH 2.88Å
655	M	80.4	Confident	83.1	Confident	26 Å²	26	79.1 Å²	79.1	13%	0.128	40%	0.401	C	S	.	.	S	Bend	trans	-66.3	-20.8	168.5	-72.5	-58.6	-63.3	0	0	112.5	K635 L642 I680 I681 S684	K635-M655 HydrophobicContact CG-CE 4.11Å; L642-M655 HydrophobicContact CD2-CG 4Å; M655-I680 HydrophobicContact CE-CG2 4.03Å; M655-I680 HydrophobicContact SD-CG2 4.45Å; M655-I681 HydrophobicContact CE-CG1 3.71Å; M655-S684 PolarHBondContact SD-OG 3.09Å
656	I	79.6	Confident	82.9	Confident	133 Å²	133	80.4 Å²	80.4	68%	0.682	41%	0.408	S	S	*	.	S	Bend	trans	-86.4	123.7	175.9	-56.8	172.6	0	0	0	108.3	S654 P658	S654-I656 PolarHBondContact O-N 3.46Å; S654-I656 PolarHBondContact OG-N 2.89Å; I656-P658 WeakPolarHBondContact O-CD 3.23Å
657	K	74.7	Confident	82.6	Confident	105 Å²	105	83.5 Å²	83.5	46%	0.457	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-55.6	119.9	177.1	-178	-177.9	175.5	179.1	0	110.4	D662 Y674	K657-D662 WeakPolarHBondContact CE-OD1 3.2Å; K657-D662 IonicContact NZ-OD1 3.33Å; K657-D662 PolarHBondContact NZ-OD1 3.45Å; K657-Y674 HydrophobicContact CB-CD1 3.97Å; K657-Y674 HydrophobicContact CB-CD2 4.32Å; K657-Y674 HydrophobicContact CB-CE1 4.35Å; K657-Y674 HydrophobicContact CB-CG 3.93Å; K657-Y674 HydrophobicContact CG-CD1 4.47Å; K657-Y674 HydrophobicContact CG-CD2 3.95Å; K657-Y674 HydrophobicContact CG-CE2 4.47Å; K657-Y674 HydrophobicContact CG-CG 3.93Å
658	P	74.3	Confident	82.6	Confident	44 Å²	44	75.4 Å²	75.4	29%	0.286	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-69.7	148.6	173.7	28.8	-33.1	0	0	0	110.2	I656 T660 A661 Y674	I656-P658 WeakPolarHBondContact O-CD 3.23Å; P658-T660 PolarHBondContact O-N 3.34Å; P658-T660 VanDerWaalsContact O-N 3.09Å; P658-A661 HydrophobicContact CG-CB 4.04Å; P658-Y674 VanDerWaalsContact CD-CE2 3.45Å; P658-Y674 VanDerWaalsContact CD-CZ 3.45Å; P658-Y674 VanDerWaalsContact CD-OH 3.25Å; P658-Y674 WeakPolarHBondContact CD-OH 3.43Å; P658-Y674 HydrophobicContact CG-CE2 4.24Å
659	K	72.6	Confident	82.7	Confident	219 Å²	219	70 Å²	70	95%	0.952	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.5	-179	-68.6	-174.4	178	-177.9	0	114
660	T	73.9	Confident	82.9	Confident	139 Å²	139	69.3 Å²	69.3	85%	0.853	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-13.5	-170.6	51.1	0	0	0	0	114.6	P658	P658-T660 PolarHBondContact O-N 3.34Å; P658-T660 VanDerWaalsContact O-N 3.09Å
661	A	75.8	Confident	83	Confident	36 Å²	36	67 Å²	67	30%	0.298	35%	0.348	S	S	.	.			trans	-136.9	127.7	-174.5	0	0	0	0	0	111.8	P658	P658-A661 HydrophobicContact CG-CB 4.04Å
662	D	83.1	Confident	83.1	Confident	96 Å²	96	63.9 Å²	63.9	51%	0.513	32%	0.322	S	S	.	.	S	Bend	trans	-85.2	-14.1	179.4	-69.5	-39.4	0	0	0	113.7	K657 Y674	K657-D662 WeakPolarHBondContact CE-OD1 3.2Å; K657-D662 IonicContact NZ-OD1 3.33Å; K657-D662 PolarHBondContact NZ-OD1 3.45Å; D662-Y674 WeakPolarHBondContact O-CD2 3.47Å; D662-Y674 PolarHBondContact O-N 3.19Å; D662-Y674 VanDerWaalsContact O-N 3.11Å
663	Y	85.1	Confident	82.8	Confident	96 Å²	96	65.3 Å²	65.3	38%	0.376	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	157	-177.6	54.9	-94.8	0	0	0	111.4	V665 K671 H672	Y663-V665 HydrophobicContact CD2-CG2 3.85Å; Y663-V665 HydrophobicContact CE2-CG2 3.71Å; Y663-K671 HydrophobicContact CD1-CD 4.49Å; Y663-K671 HydrophobicContact CD2-CB 3.77Å; Y663-K671 HydrophobicContact CD2-CD 3.98Å; Y663-K671 HydrophobicContact CD2-CG 3.68Å; Y663-K671 HydrophobicContact CE1-CD 4.18Å; Y663-K671 HydrophobicContact CE2-CB 4.27Å; Y663-K671 HydrophobicContact CE2-CD 3.64Å; Y663-K671 HydrophobicContact CE2-CG 3.66Å; Y663-K671 HydrophobicContact CG-CB 4.05Å; Y663-K671 HydrophobicContact CG-CD 4.39Å; Y663-K671 HydrophobicContact CG-CG 4.34Å; Y663-H672 CarbonylContact C-O 3.59Å; Y663-H672 VanDerWaalsContact CA-O 3.24Å; Y663-H672 WeakPolarHBondContact CA-O 3.43Å; Y663-H672 WeakPolarHBondContact CB-O 3.18Å
664	H	85.1	Confident	82.6	Confident	42 Å²	42	66.5 Å²	66.5	19%	0.194	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	151.8	163.3	-83.4	-69.8	0	0	0	110.6	P653 K671 H672 Y674 I680 Y683	P653-H664 WeakPolarHBondContact CB-NE2 3.47Å; H664-K671 CarbonylContact O-C 3.57Å; H664-K671 WeakPolarHBondContact O-CA 3.4Å; H664-H672 PolarHBondContact N-O 3.5Å; H664-H672 PolarHBondContact O-N 3.42Å; H664-Y674 AromaticContact CD2-CE2 3.78Å; H664-Y674 AromaticContact CD2-CZ 3.59Å; H664-Y674 PolarHBondContact CD2-OH 3.01Å; H664-Y674 AromaticContact NE2-CZ 3.68Å; H664-Y674 PolarHBondContact NE2-OH 3.15Å; H664-I680 HydrophobicContact CB-CD1 4.42Å; H664-Y683 HydrophobicContact CB-CD1 3.92Å; H664-Y683 HydrophobicContact CB-CE1 3.4Å; H664-Y683 VanDerWaalsContact CB-CE1 3.4Å; H664-Y683 AromaticContact CD2-CE1 3.87Å; H664-Y683 AromaticContact CG-CE1 3.51Å
665	V	87	Confident	82.3	Confident	59 Å²	59	73 Å²	73	36%	0.358	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.5	172.7	-175.9	0	0	0	0	107.7	Y663 F670 K671 V791	Y663-V665 HydrophobicContact CD2-CG2 3.85Å; Y663-V665 HydrophobicContact CE2-CG2 3.71Å; V665-F670 WeakPolarHBondContact CA-O 3.46Å; V665-K671 HydrophobicContact CG2-CG 4.35Å; V665-V791 HydrophobicContact CG1-CG1 3.97Å; V665-V791 HydrophobicContact CG2-CG1 4.1Å
666	D	87.3	Confident	82.1	Confident	28 Å²	28	75.5 Å²	75.5	15%	0.15	38%	0.382	C	S	.	.			trans	-80.2	177.6	175.5	69.8	20.3	0	0	0	112.7	Y668 G669 F670 H672 Y683	D666-Y668 PolarHBondContact O-N 3.21Å; D666-Y668 WeakPolarHBondContact OD1-CA 3.27Å; D666-Y668 PolarHBondContact OD1-N 3.49Å; D666-G669 PolarHBondContact O-N 3.36Å; D666-G669 PolarHBondContact OD1-N 3.49Å; D666-F670 PolarHBondContact N-O 3.03Å; D666-F670 PolarHBondContact OD1-N 3.14Å; D666-F670 WeakPolarHBondContact OD2-CB 3.47Å; D666-H672 IonicContact OD2-CD2 2.79Å; D666-H672 IonicContact OD2-CE1 3.24Å; D666-H672 IonicContact OD2-NE2 3.33Å; D666-H672 PolarHBondContact OD2-NE2 3.28Å; D666-Y683 HydrophobicContact CB-CD2 4.05Å; D666-Y683 HydrophobicContact CB-CE2 3.93Å
667	F	84.4	Confident	81.8	Confident	146 Å²	146	71.8 Å²	71.8	64%	0.64	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-20	-179.1	-69.4	-77.5	0	0	0	114.2	I732	F667-I732 HydrophobicContact CB-CD1 4.35Å
668	Y	89.5	Confident	81.8	Confident	30 Å²	30	68.5 Å²	68.5	12%	0.118	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-4.3	176.5	-52.6	-66.4	0	0	0	112.7	D666 I732 N790 F834 F911 E912 I915	D666-Y668 PolarHBondContact O-N 3.21Å; D666-Y668 WeakPolarHBondContact OD1-CA 3.27Å; D666-Y668 PolarHBondContact OD1-N 3.49Å; Y668-I732 HydrophobicContact CD1-CD1 4Å; Y668-I732 HydrophobicContact CE1-CD1 3.44Å; Y668-I732 VanDerWaalsContact CE1-CD1 3.44Å; Y668-I732 HydrophobicContact CE1-CG1 4.26Å; Y668-N790 PolarHBondContact O-ND2 3.49Å; Y668-F834 AromaticContact CD1-CE1 3.74Å; Y668-F834 HydrophobicContact CD1-CE1 3.74Å; Y668-F834 AromaticContact CD1-CZ 3.67Å; Y668-F834 HydrophobicContact CD1-CZ 3.67Å; Y668-F834 AromaticContact CE1-CE1 3.71Å; Y668-F834 HydrophobicContact CE1-CE1 3.71Å; Y668-F834 AromaticContact CE1-CZ 3.75Å; Y668-F834 HydrophobicContact CE1-CZ 3.75Å; Y668-F911 AromaticContact CD1-CE1 3.74Å; Y668-F911 HydrophobicContact CD1-CE1 3.74Å; Y668-F911 AromaticContact CD2-CD1 3.64Å; Y668-F911 HydrophobicContact CD2-CD1 3.64Å; Y668-F911 AromaticContact CD2-CE1 3.62Å; Y668-F911 HydrophobicContact CD2-CE1 3.62Å; Y668-F911 HydrophobicContact CE1-CE1 4.18Å; Y668-F911 AromaticContact CE2-CD1 3.99Å; Y668-F911 HydrophobicContact CE2-CD1 3.99Å; Y668-F911 HydrophobicContact CE2-CE1 4.06Å; Y668-F911 AromaticContact CG-CD1 3.96Å; Y668-F911 HydrophobicContact CG-CD1 3.96Å; Y668-F911 AromaticContact CG-CE1 3.44Å; Y668-F911 HydrophobicContact CG-CE1 3.44Å; Y668-F911 VanDerWaalsContact CG-CE1 3.44Å; Y668-F911 HydrophobicContact CG-CZ 4.42Å; Y668-E912 VanDerWaalsContact CE2-OE1 3.26Å; Y668-E912 WeakPolarHBondContact CE2-OE1 3.39Å; Y668-E912 PolarHBondContact OH-OE2 3.13Å; Y668-E912 VanDerWaalsContact OH-OE2 3.08Å; Y668-I915 HydrophobicContact CE1-CD1 4.15Å; Y668-I915 HydrophobicContact CE2-CD1 4.33Å; Y668-I915 WeakPolarHBondContact OH-CD1 3.16Å
669	G	89.9	Confident	81.9	Confident	8 Å²	8	68.1 Å²	68.1	8%	0.082	35%	0.349	C	S	.	.	S	Bend	trans	92	7.3	-179.4	0	0	0	0	0	114.6	D666 N790 V791	D666-G669 PolarHBondContact O-N 3.36Å; D666-G669 PolarHBondContact OD1-N 3.49Å; G669-N790 CarbonylContact O-C 3.52Å; G669-N790 WeakPolarHBondContact O-CA 3.19Å; G669-V791 PolarHBondContact O-N 2.78Å
670	F	91.7	Very high	82.4	Confident	13 Å²	13	57.9 Å²	57.9	6%	0.057	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-78.9	137.9	176.7	-66.1	-78	0	0	0	112	V665 D666 H672 M787 N790 L833 F911	V665-F670 WeakPolarHBondContact CA-O 3.46Å; D666-F670 PolarHBondContact N-O 3.03Å; D666-F670 PolarHBondContact OD1-N 3.14Å; D666-F670 WeakPolarHBondContact OD2-CB 3.47Å; F670-H672 PolarHBondContact O-CD2 3.28Å; F670-M787 HydrophobicContact CE1-CG 4.41Å; F670-M787 HydrophobicContact CZ-SD 4.23Å; F670-N790 HydrophobicContact CD1-CB 3.83Å; F670-N790 HydrophobicContact CE1-CB 3.8Å; F670-N790 HydrophobicContact CZ-CB 4.47Å; F670-L833 HydrophobicContact CE2-CD1 4.24Å; F670-L833 HydrophobicContact CZ-CD1 4.16Å; F670-F911 HydrophobicContact CD2-CD1 4.29Å; F670-F911 HydrophobicContact CD2-CG 4.28Å; F670-F911 HydrophobicContact CE2-CB 4.4Å; F670-F911 AromaticContact CE2-CD1 3.72Å; F670-F911 HydrophobicContact CE2-CD1 3.72Å; F670-F911 AromaticContact CE2-CD2 3.46Å; F670-F911 HydrophobicContact CE2-CD2 3.46Å; F670-F911 VanDerWaalsContact CE2-CD2 3.46Å; F670-F911 AromaticContact CE2-CE1 3.77Å; F670-F911 HydrophobicContact CE2-CE1 3.77Å; F670-F911 AromaticContact CE2-CE2 3.52Å; F670-F911 HydrophobicContact CE2-CE2 3.52Å; F670-F911 AromaticContact CE2-CG 3.56Å; F670-F911 HydrophobicContact CE2-CG 3.56Å; F670-F911 AromaticContact CE2-CZ 3.68Å; F670-F911 HydrophobicContact CE2-CZ 3.68Å; F670-F911 AromaticContact CZ-CD2 3.59Å; F670-F911 HydrophobicContact CZ-CD2 3.59Å; F670-F911 AromaticContact CZ-CE2 3.63Å; F670-F911 HydrophobicContact CZ-CE2 3.63Å; F670-F911 HydrophobicContact CZ-CG 4.13Å; F670-F911 HydrophobicContact CZ-CZ 4.21Å
671	K	89.6	Confident	82.8	Confident	53 Å²	53	51.4 Å²	51.4	23%	0.23	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	114.7	178.4	-59.6	178.5	-176.3	-177.1	0	110.6	Y663 H664 V665 N789 V791 D794	Y663-K671 HydrophobicContact CD1-CD 4.49Å; Y663-K671 HydrophobicContact CD2-CB 3.77Å; Y663-K671 HydrophobicContact CD2-CD 3.98Å; Y663-K671 HydrophobicContact CD2-CG 3.68Å; Y663-K671 HydrophobicContact CE1-CD 4.18Å; Y663-K671 HydrophobicContact CE2-CB 4.27Å; Y663-K671 HydrophobicContact CE2-CD 3.64Å; Y663-K671 HydrophobicContact CE2-CG 3.66Å; Y663-K671 HydrophobicContact CG-CB 4.05Å; Y663-K671 HydrophobicContact CG-CD 4.39Å; Y663-K671 HydrophobicContact CG-CG 4.34Å; H664-K671 CarbonylContact O-C 3.57Å; H664-K671 WeakPolarHBondContact O-CA 3.4Å; V665-K671 HydrophobicContact CG2-CG 4.35Å; K671-N789 WeakPolarHBondContact CB-O 3.27Å; K671-N789 WeakPolarHBondContact CG-O 3.47Å; K671-N789 PolarHBondContact N-O 2.76Å; K671-V791 HydrophobicContact CG-CG1 4.18Å; K671-D794 VanDerWaalsContact CE-OD2 3.22Å; K671-D794 WeakPolarHBondContact CE-OD2 3.24Å; K671-D794 IonicContact NZ-OD2 2.79Å; K671-D794 PolarHBondContact NZ-OD2 3.36Å
672	H	86.8	Confident	83	Confident	33 Å²	33	51 Å²	51	15%	0.153	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	95.7	173.5	-62.5	-74.6	0	0	0	109.5	Y663 H664 D666 F670 I680 Y683	Y663-H672 CarbonylContact C-O 3.59Å; Y663-H672 VanDerWaalsContact CA-O 3.24Å; Y663-H672 WeakPolarHBondContact CA-O 3.43Å; Y663-H672 WeakPolarHBondContact CB-O 3.18Å; H664-H672 PolarHBondContact N-O 3.5Å; H664-H672 PolarHBondContact O-N 3.42Å; D666-H672 IonicContact OD2-CD2 2.79Å; D666-H672 IonicContact OD2-CE1 3.24Å; D666-H672 IonicContact OD2-NE2 3.33Å; D666-H672 PolarHBondContact OD2-NE2 3.28Å; F670-H672 PolarHBondContact O-CD2 3.28Å; H672-I680 HydrophobicContact CB-CD1 4.17Å; H672-Y683 HydrophobicContact CB-CG 4.35Å; H672-Y683 AromaticContact CD2-CD2 3.65Å; H672-Y683 AromaticContact CD2-CG 3.97Å
673	S	81.6	Confident	83.1	Confident	35 Å²	35	47.6 Å²	47.6	25%	0.245	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.4	-178.3	180	0	0	0	0	112	L675 N676	S673-L675 PolarHBondContact O-N 2.68Å; S673-L675 WeakPolarHBondContact OG-CB 3.28Å; S673-L675 PolarHBondContact OG-N 3.09Å; S673-L675 VanDerWaalsContact OG-N 3.14Å; S673-N676 CarbonylContact O-C 3.52Å; S673-N676 PolarHBondContact O-N 2.92Å
674	Y	79.9	Confident	83.3	Confident	32 Å²	32	43 Å²	43	13%	0.125	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-16.3	170.6	-77.9	-81	0	0	0	113.3	S654 K657 P658 D662 H664 N676 I680	S654-Y674 WeakPolarHBondContact O-CE1 3.36Å; S654-Y674 PolarHBondContact O-OH 2.88Å; K657-Y674 HydrophobicContact CB-CD1 3.97Å; K657-Y674 HydrophobicContact CB-CD2 4.32Å; K657-Y674 HydrophobicContact CB-CE1 4.35Å; K657-Y674 HydrophobicContact CB-CG 3.93Å; K657-Y674 HydrophobicContact CG-CD1 4.47Å; K657-Y674 HydrophobicContact CG-CD2 3.95Å; K657-Y674 HydrophobicContact CG-CE2 4.47Å; K657-Y674 HydrophobicContact CG-CG 3.93Å; P658-Y674 VanDerWaalsContact CD-CE2 3.45Å; P658-Y674 VanDerWaalsContact CD-CZ 3.45Å; P658-Y674 VanDerWaalsContact CD-OH 3.25Å; P658-Y674 WeakPolarHBondContact CD-OH 3.43Å; P658-Y674 HydrophobicContact CG-CE2 4.24Å; D662-Y674 WeakPolarHBondContact O-CD2 3.47Å; D662-Y674 PolarHBondContact O-N 3.19Å; D662-Y674 VanDerWaalsContact O-N 3.11Å; H664-Y674 AromaticContact CD2-CE2 3.78Å; H664-Y674 AromaticContact CD2-CZ 3.59Å; H664-Y674 PolarHBondContact CD2-OH 3.01Å; H664-Y674 AromaticContact NE2-CZ 3.68Å; H664-Y674 PolarHBondContact NE2-OH 3.15Å; Y674-N676 VanDerWaalsContact C-N 3.27Å; Y674-I680 HydrophobicContact CD1-CD1 4.2Å; Y674-I680 HydrophobicContact CD1-CG1 3.87Å; Y674-I680 HydrophobicContact CE1-CD1 4.08Å; Y674-I680 HydrophobicContact CE1-CG1 3.81Å; Y674-I680 HydrophobicContact CE2-CD1 4.45Å; Y674-I680 HydrophobicContact CG-CD1 4.46Å
675	L	76.5	Confident	83.4	Confident	159 Å²	159	41 Å²	41	83%	0.832	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.3	171.8	-62.6	171.4	0	0	0	112.1	S673	S673-L675 PolarHBondContact O-N 2.68Å; S673-L675 WeakPolarHBondContact OG-CB 3.28Å; S673-L675 PolarHBondContact OG-N 3.09Å; S673-L675 VanDerWaalsContact OG-N 3.14Å
676	N	75.5	Confident	83.4	Confident	79 Å²	79	40 Å²	40	42%	0.422	20%	0.201	S	C	.	.			trans	-104.8	89.1	175.2	-171.5	-13.8	0	0	0	109.5	S673 Y674 T678 S679 I680	S673-N676 CarbonylContact O-C 3.52Å; S673-N676 PolarHBondContact O-N 2.92Å; Y674-N676 VanDerWaalsContact C-N 3.27Å; N676-T678 PolarHBondContact O-N 3.4Å; N676-T678 PolarHBondContact OD1-N 3.14Å; N676-S679 VanDerWaalsContact CG-OG 3.26Å; N676-S679 PolarHBondContact ND2-OG 3.4Å; N676-S679 WeakPolarHBondContact O-CB 3.3Å; N676-S679 PolarHBondContact O-N 2.67Å; N676-S679 VanDerWaalsContact O-N 3.07Å; N676-S679 PolarHBondContact OD1-N 3.16Å; N676-I680 PolarHBondContact O-N 3.41Å; N676-I680 VanDerWaalsContact O-N 3.09Å
677	E	74.4	Confident	83.5	Confident	56 Å²	56	39.7 Å²	39.7	26%	0.262	20%	0.199	S	C	.	.	H	α-helix	trans	-55.9	-37.2	-177.9	-172.7	179.7	-148.2	0	0	112.8	K631 K635 S679 I680 I681	K631-E677 VanDerWaalsContact CE-OE2 3.31Å; K631-E677 WeakPolarHBondContact CE-OE2 3.42Å; K631-E677 IonicContact NZ-OE2 2.7Å; K631-E677 PolarHBondContact NZ-OE2 3.44Å; K635-E677 VanDerWaalsContact CD-OE1 3.3Å; K635-E677 WeakPolarHBondContact CD-OE1 3.27Å; K635-E677 WeakPolarHBondContact CE-OE1 3.5Å; K635-E677 IonicContact NZ-OE1 3.89Å; K635-E677 PolarHBondContact NZ-OE1 3.48Å; E677-S679 PolarHBondContact O-N 3.39Å; E677-I680 WeakPolarHBondContact O-CG2 3.42Å; E677-I680 PolarHBondContact O-N 2.96Å; E677-I681 HydrophobicContact CG-CD1 3.8Å; E677-I681 HydrophobicContact CG-CG1 4.37Å; E677-I681 WeakPolarHBondContact O-CB 3.31Å; E677-I681 WeakPolarHBondContact O-CG1 3.45Å; E677-I681 PolarHBondContact O-N 2.9Å
678	T	74.3	Confident	83.8	Confident	36 Å²	36	32.7 Å²	32.7	22%	0.221	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-42.9	178	-55.3	0	0	0	0	111.1	T616 N676 I681 H682	T616-T678 PolarHBondContact OG1-OG1 3.3Å; N676-T678 PolarHBondContact O-N 3.4Å; N676-T678 PolarHBondContact OD1-N 3.14Å; T678-I681 PolarHBondContact O-N 3.33Å; T678-H682 PolarHBondContact O-CD2 2.93Å; T678-H682 VanDerWaalsContact O-CD2 3.32Å; T678-H682 PolarHBondContact O-N 3.02Å
679	S	75.8	Confident	83.8	Confident	35 Å²	35	33.3 Å²	33.3	25%	0.245	17%	0.17	C	C	.	.	H	α-helix	trans	-63.6	-43.1	176.4	-65.9	0	0	0	0	112.4	N676 E677 I681 H682 Y683	N676-S679 VanDerWaalsContact CG-OG 3.26Å; N676-S679 PolarHBondContact ND2-OG 3.4Å; N676-S679 WeakPolarHBondContact O-CB 3.3Å; N676-S679 PolarHBondContact O-N 2.67Å; N676-S679 VanDerWaalsContact O-N 3.07Å; N676-S679 PolarHBondContact OD1-N 3.16Å; E677-S679 PolarHBondContact O-N 3.39Å; S679-I681 VanDerWaalsContact C-N 3.35Å; S679-I681 PolarHBondContact O-N 2.98Å; S679-H682 PolarHBondContact O-N 3.39Å; S679-Y683 WeakPolarHBondContact O-CB 3.38Å; S679-Y683 PolarHBondContact O-N 3.34Å
680	I	82.5	Confident	83.7	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-68.8	-34.9	-179.1	-150.7	64.9	0	0	0	112.3	M655 H664 H672 Y674 N676 E677 Y683 S684	M655-I680 HydrophobicContact CE-CG2 4.03Å; M655-I680 HydrophobicContact SD-CG2 4.45Å; H664-I680 HydrophobicContact CB-CD1 4.42Å; H672-I680 HydrophobicContact CB-CD1 4.17Å; Y674-I680 HydrophobicContact CD1-CD1 4.2Å; Y674-I680 HydrophobicContact CD1-CG1 3.87Å; Y674-I680 HydrophobicContact CE1-CD1 4.08Å; Y674-I680 HydrophobicContact CE1-CG1 3.81Å; Y674-I680 HydrophobicContact CE2-CD1 4.45Å; Y674-I680 HydrophobicContact CG-CD1 4.46Å; N676-I680 PolarHBondContact O-N 3.41Å; N676-I680 VanDerWaalsContact O-N 3.09Å; E677-I680 WeakPolarHBondContact O-CG2 3.42Å; E677-I680 PolarHBondContact O-N 2.96Å; I680-Y683 HydrophobicContact CD1-CD1 4.32Å; I680-S684 WeakPolarHBondContact O-CB 3.13Å; I680-S684 PolarHBondContact O-N 3.32Å; I680-S684 PolarHBondContact O-OG 3.26Å
681	I	82.3	Confident	83.6	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.015	18%	0.176	C	C	.	.	H	α-helix	trans	-67.7	-46.7	176	-67	169.2	0	0	0	109.9	L613 K635 I638 M655 E677 T678 S679 Y683 S684 C685	L613-I681 HydrophobicContact CD1-CG2 3.42Å; L613-I681 VanDerWaalsContact CD1-CG2 3.42Å; L613-I681 HydrophobicContact CD2-CG2 3.7Å; L613-I681 HydrophobicContact CG-CG2 4.19Å; K635-I681 HydrophobicContact CG-CD1 4.43Å; I638-I681 HydrophobicContact CD1-CG2 3.66Å; M655-I681 HydrophobicContact CE-CG1 3.71Å; E677-I681 HydrophobicContact CG-CD1 3.8Å; E677-I681 HydrophobicContact CG-CG1 4.37Å; E677-I681 WeakPolarHBondContact O-CB 3.31Å; E677-I681 WeakPolarHBondContact O-CG1 3.45Å; E677-I681 PolarHBondContact O-N 2.9Å; T678-I681 PolarHBondContact O-N 3.33Å; S679-I681 VanDerWaalsContact C-N 3.35Å; S679-I681 PolarHBondContact O-N 2.98Å; I681-Y683 VanDerWaalsContact C-N 3.34Å; I681-Y683 PolarHBondContact O-N 3.25Å; I681-S684 PolarHBondContact O-N 3.4Å; I681-S684 VanDerWaalsContact O-N 3.14Å; I681-C685 PolarHBondContact O-N 2.78Å
682	H	80.4	Confident	83.6	Confident	29 Å²	29	32.3 Å²	32.3	13%	0.134	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-47	176	-94.8	-74.2	0	0	0	112.3	Q610 L613 T678 S679 S684 C685 Q686 N965	Q610-H682 WeakPolarHBondContact CG-ND1 3.47Å; Q610-H682 PolarHBondContact O-CE1 3.4Å; L613-H682 PolarHBondContact O-CE1 2.75Å; L613-H682 PolarHBondContact O-NE2 3.41Å; T678-H682 PolarHBondContact O-CD2 2.93Å; T678-H682 VanDerWaalsContact O-CD2 3.32Å; T678-H682 PolarHBondContact O-N 3.02Å; S679-H682 PolarHBondContact O-N 3.39Å; H682-S684 VanDerWaalsContact C-N 3.34Å; H682-S684 PolarHBondContact O-N 2.57Å; H682-C685 PolarHBondContact O-N 3.4Å; H682-Q686 PolarHBondContact O-N 3.41Å; H682-N965 VanDerWaalsContact CE1-CG 3.45Å; H682-N965 PolarHBondContact CE1-ND2 3.15Å; H682-N965 PolarHBondContact NE2-ND2 3.32Å
683	Y	85.9	Confident	83.6	Confident	23 Å²	23	31.6 Å²	31.6	9%	0.09	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-46.5	173.9	173.4	-107.3	0	0	0	111.6	P653 H664 D666 H672 S679 I680 I681 C685 Q686 Q687	P653-Y683 HydrophobicContact CB-CD1 4.43Å; P653-Y683 HydrophobicContact CB-CE1 3.73Å; P653-Y683 HydrophobicContact CG-CD1 4.24Å; P653-Y683 HydrophobicContact CG-CE1 3.68Å; H664-Y683 HydrophobicContact CB-CD1 3.92Å; H664-Y683 HydrophobicContact CB-CE1 3.4Å; H664-Y683 VanDerWaalsContact CB-CE1 3.4Å; H664-Y683 AromaticContact CD2-CE1 3.87Å; H664-Y683 AromaticContact CG-CE1 3.51Å; D666-Y683 HydrophobicContact CB-CD2 4.05Å; D666-Y683 HydrophobicContact CB-CE2 3.93Å; H672-Y683 HydrophobicContact CB-CG 4.35Å; H672-Y683 AromaticContact CD2-CD2 3.65Å; H672-Y683 AromaticContact CD2-CG 3.97Å; S679-Y683 WeakPolarHBondContact O-CB 3.38Å; S679-Y683 PolarHBondContact O-N 3.34Å; I680-Y683 HydrophobicContact CD1-CD1 4.32Å; I681-Y683 VanDerWaalsContact C-N 3.34Å; I681-Y683 PolarHBondContact O-N 3.25Å; Y683-C685 PolarHBondContact O-N 3.48Å; Y683-Q686 WeakPolarHBondContact O-CB 3.44Å; Y683-Q686 PolarHBondContact O-N 2.87Å; Y683-Q686 VanDerWaalsContact O-N 3.16Å; Y683-Q687 HydrophobicContact CD1-CG 4.38Å; Y683-Q687 HydrophobicContact CD2-CG 4.26Å; Y683-Q687 HydrophobicContact CE1-CG 3.96Å; Y683-Q687 HydrophobicContact CE2-CG 3.81Å; Y683-Q687 WeakPolarHBondContact O-CG 3.36Å; Y683-Q687 PolarHBondContact O-N 2.82Å
684	S	88.2	Confident	83.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.1	-39	179.8	-58.8	0	0	0	0	112.6	M655 I680 I681 H682 Q687 L688	M655-S684 PolarHBondContact SD-OG 3.09Å; I680-S684 WeakPolarHBondContact O-CB 3.13Å; I680-S684 PolarHBondContact O-N 3.32Å; I680-S684 PolarHBondContact O-OG 3.26Å; I681-S684 PolarHBondContact O-N 3.4Å; I681-S684 VanDerWaalsContact O-N 3.14Å; H682-S684 VanDerWaalsContact C-N 3.34Å; H682-S684 PolarHBondContact O-N 2.57Å; S684-Q687 PolarHBondContact O-N 3.36Å; S684-L688 WeakPolarHBondContact O-CB 3.43Å; S684-L688 WeakPolarHBondContact O-CG 3.04Å; S684-L688 PolarHBondContact O-N 3.33Å
685	C	87.9	Confident	83.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.6	-45.1	171.8	-78.1	0	0	0	0	111.6	V606 Q610 L613 I638 I681 H682 Y683 L688 Y689	V606-C685 HydrophobicContact CG1-CB 4.09Å; V606-C685 WeakPolarHBondContact CG1-O 3.32Å; Q610-C685 HydrophobicContact CB-CB 3.9Å; Q610-C685 HydrophobicContact CG-CB 3.92Å; L613-C685 VanDerWaalsContact CD1-SG 3.55Å; I638-C685 VanDerWaalsContact CD1-SG 3.55Å; I681-C685 PolarHBondContact O-N 2.78Å; H682-C685 PolarHBondContact O-N 3.4Å; Y683-C685 PolarHBondContact O-N 3.48Å; C685-L688 PolarHBondContact O-N 2.75Å; C685-Y689 WeakPolarHBondContact O-CB 3.26Å; C685-Y689 PolarHBondContact O-N 3.45Å
686	Q	87.6	Confident	84.2	Confident	37 Å²	37	32.1 Å²	32.1	17%	0.173	15%	0.154	C	C	.	.	H	α-helix	trans	-60.3	-47.3	177.1	-170.4	61.5	38.2	0	0	111.3	Q610 H682 Y683 L688 Y689 D690	Q610-Q686 VanDerWaalsContact NE2-OE1 3.1Å; H682-Q686 PolarHBondContact O-N 3.41Å; Y683-Q686 WeakPolarHBondContact O-CB 3.44Å; Y683-Q686 PolarHBondContact O-N 2.87Å; Y683-Q686 VanDerWaalsContact O-N 3.16Å; Q686-L688 VanDerWaalsContact C-N 3.32Å; Q686-L688 PolarHBondContact O-N 3.46Å; Q686-Y689 WeakPolarHBondContact O-CB 3.17Å; Q686-Y689 PolarHBondContact O-N 2.94Å; Q686-D690 PolarHBondContact NE2-OD1 2.79Å; Q686-D690 PolarHBondContact O-N 2.94Å
687	Q	89.8	Confident	83.6	Confident	22 Å²	22	33 Å²	33	10%	0.103	17%	0.167	C	C	.	.	H	α-helix	trans	-63	-37.1	178.1	-62.6	-55.2	110.5	0	0	112.5	L652 P653 Y683 S684 F691	L652-Q687 HydrophobicContact CD2-CB 4Å; P653-Q687 HydrophobicContact CG-CB 4.12Å; P653-Q687 HydrophobicContact CG-CG 3.92Å; Y683-Q687 HydrophobicContact CD1-CG 4.38Å; Y683-Q687 HydrophobicContact CD2-CG 4.26Å; Y683-Q687 HydrophobicContact CE1-CG 3.96Å; Y683-Q687 HydrophobicContact CE2-CG 3.81Å; Y683-Q687 WeakPolarHBondContact O-CG 3.36Å; Y683-Q687 PolarHBondContact O-N 2.82Å; S684-Q687 PolarHBondContact O-N 3.36Å; Q687-F691 WeakPolarHBondContact O-CB 3.47Å; Q687-F691 PolarHBondContact O-N 3.26Å
688	L	90	Very high	83	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-42.6	173.9	-84.9	174	0	0	0	112.2	V606 I638 L641 L642 A645 S684 C685 Q686 D690 F691 Y692	V606-L688 HydrophobicContact CG1-CB 3.92Å; V606-L688 HydrophobicContact CG2-CB 4.27Å; V606-L688 HydrophobicContact CG2-CD1 4.44Å; I638-L688 HydrophobicContact CG2-CD1 4.14Å; L641-L688 HydrophobicContact CB-CD1 4.05Å; L642-L688 HydrophobicContact CB-CD1 4.37Å; L642-L688 HydrophobicContact CD1-CD1 4.16Å; L642-L688 HydrophobicContact CD1-CD2 4.09Å; L642-L688 HydrophobicContact CD1-CG 3.76Å; A645-L688 HydrophobicContact CB-CD2 3.77Å; S684-L688 WeakPolarHBondContact O-CB 3.43Å; S684-L688 WeakPolarHBondContact O-CG 3.04Å; S684-L688 PolarHBondContact O-N 3.33Å; C685-L688 PolarHBondContact O-N 2.75Å; Q686-L688 VanDerWaalsContact C-N 3.32Å; Q686-L688 PolarHBondContact O-N 3.46Å; L688-D690 VanDerWaalsContact C-N 3.33Å; L688-D690 PolarHBondContact O-N 3.04Å; L688-F691 WeakPolarHBondContact O-CB 3.37Å; L688-F691 PolarHBondContact O-N 3.39Å; L688-Y692 HydrophobicContact CB-CE2 4.3Å; L688-Y692 HydrophobicContact CD2-CE2 3.95Å; L688-Y692 WeakPolarHBondContact O-CD2 3.42Å; L688-Y692 PolarHBondContact O-N 2.86Å
689	Y	89.3	Confident	82.5	Confident	42 Å²	42	33.1 Å²	33.1	17%	0.165	19%	0.19	C	C	.	.	H	α-helix	trans	-58.6	-47.1	176.2	179.4	-94.6	0	0	0	110.9	R603 K607 C685 Q686 F691 Y692 T693	R603-Y689 HydrophobicContact CG-CD2 3.56Å; R603-Y689 HydrophobicContact CG-CE2 3.41Å; R603-Y689 VanDerWaalsContact CG-CE2 3.41Å; R603-Y689 HydrophobicContact CG-CG 4.44Å; K607-Y689 HydrophobicContact CB-CD2 4Å; K607-Y689 HydrophobicContact CB-CE2 4.03Å; K607-Y689 HydrophobicContact CD-CE2 3.83Å; K607-Y689 HydrophobicContact CG-CD2 4.42Å; K607-Y689 HydrophobicContact CG-CE2 4.19Å; C685-Y689 WeakPolarHBondContact O-CB 3.26Å; C685-Y689 PolarHBondContact O-N 3.45Å; Q686-Y689 WeakPolarHBondContact O-CB 3.17Å; Q686-Y689 PolarHBondContact O-N 2.94Å; Y689-F691 PolarHBondContact O-N 3.05Å; Y689-Y692 PolarHBondContact O-N 2.89Å; Y689-T693 WeakPolarHBondContact O-CB 3.17Å; Y689-T693 PolarHBondContact O-N 3.01Å; Y689-T693 PolarHBondContact O-OG1 2.98Å
690	D	87	Confident	82.3	Confident	47 Å²	47	34.3 Å²	34.3	25%	0.251	19%	0.193	S	C	.	.	H	α-helix	trans	-65.7	-38.9	177.8	-66.9	-17	0	0	0	111.8	Q686 L688 T693 R694	Q686-D690 PolarHBondContact NE2-OD1 2.79Å; Q686-D690 PolarHBondContact O-N 2.94Å; L688-D690 VanDerWaalsContact C-N 3.33Å; L688-D690 PolarHBondContact O-N 3.04Å; D690-T693 PolarHBondContact O-N 2.63Å; D690-R694 WeakPolarHBondContact O-CG 3.45Å; D690-R694 PolarHBondContact O-N 2.94Å; D690-R694 PolarHBondContact O-NE 2.85Å
691	F	89.9	Confident	82.2	Confident	3 Å²	3	41.1 Å²	41.1	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-59.5	-52.4	173.5	171.5	-99.1	0	0	0	111.7	A645 K648 D649 L652 Q687 L688 Y689 T693 R694 Q695	A645-F691 HydrophobicContact CB-CD1 3.66Å; A645-F691 HydrophobicContact CB-CE1 3.53Å; A645-F691 HydrophobicContact CB-CG 4.21Å; A645-F691 HydrophobicContact CB-CZ 3.99Å; K648-F691 HydrophobicContact CB-CE2 4.21Å; K648-F691 HydrophobicContact CB-CZ 4Å; K648-F691 HydrophobicContact CD-CZ 4.18Å; D649-F691 HydrophobicContact CB-CD2 3.94Å; D649-F691 HydrophobicContact CB-CE2 3.76Å; L652-F691 HydrophobicContact CD1-CB 4.16Å; L652-F691 HydrophobicContact CD1-CD2 3.88Å; L652-F691 HydrophobicContact CD1-CE2 4.45Å; L652-F691 HydrophobicContact CD1-CG 3.95Å; L652-F691 HydrophobicContact CD2-CB 4.25Å; Q687-F691 WeakPolarHBondContact O-CB 3.47Å; Q687-F691 PolarHBondContact O-N 3.26Å; L688-F691 WeakPolarHBondContact O-CB 3.37Å; L688-F691 PolarHBondContact O-N 3.39Å; Y689-F691 PolarHBondContact O-N 3.05Å; F691-T693 VanDerWaalsContact C-N 3.3Å; F691-T693 PolarHBondContact O-N 3.2Å; F691-R694 PolarHBondContact O-N 2.74Å; F691-Q695 HydrophobicContact CE1-CG 4.18Å; F691-Q695 HydrophobicContact CE2-CG 4.39Å; F691-Q695 HydrophobicContact CZ-CG 4.07Å; F691-Q695 WeakPolarHBondContact O-CG 3.33Å; F691-Q695 PolarHBondContact O-N 3.36Å
692	Y	89.9	Confident	82.2	Confident	3 Å²	3	42.1 Å²	42.1	1%	0.012	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-33.5	-179.3	-68.1	-53.4	0	0	0	112.5	F599 R602 V606 L688 Y689 Q695 L696	F599-Y692 AromaticContact CD1-CD1 3.77Å; F599-Y692 HydrophobicContact CD1-CD1 3.77Å; F599-Y692 HydrophobicContact CD1-CE1 4.1Å; F599-Y692 HydrophobicContact CE1-CD1 4.48Å; F599-Y692 HydrophobicContact CE1-CE1 4.49Å; R602-Y692 HydrophobicContact CB-CD1 4.25Å; R602-Y692 HydrophobicContact CB-CD2 4.12Å; R602-Y692 HydrophobicContact CB-CE1 4.08Å; R602-Y692 HydrophobicContact CB-CE2 3.97Å; R602-Y692 HydrophobicContact CB-CG 4.28Å; V606-Y692 HydrophobicContact CG2-CD2 4.26Å; V606-Y692 HydrophobicContact CG2-CE2 3.95Å; L688-Y692 HydrophobicContact CB-CE2 4.3Å; L688-Y692 HydrophobicContact CD2-CE2 3.95Å; L688-Y692 WeakPolarHBondContact O-CD2 3.42Å; L688-Y692 PolarHBondContact O-N 2.86Å; Y689-Y692 PolarHBondContact O-N 2.89Å; Y692-Q695 PolarHBondContact O-N 2.95Å; Y692-L696 PolarHBondContact O-N 2.9Å
693	T	86.1	Confident	82.4	Confident	18 Å²	18	44.2 Å²	44.2	11%	0.11	24%	0.239	C	C	.	.	H	α-helix	trans	-62.5	-41.6	174	-59	0	0	0	0	111.5	R603 Y689 D690 F691 Q695 L696 D700	R603-T693 VanDerWaalsContact CD-OG1 3.24Å; R603-T693 WeakPolarHBondContact CD-OG1 3.5Å; Y689-T693 WeakPolarHBondContact O-CB 3.17Å; Y689-T693 PolarHBondContact O-N 3.01Å; Y689-T693 PolarHBondContact O-OG1 2.98Å; D690-T693 PolarHBondContact O-N 2.63Å; F691-T693 VanDerWaalsContact C-N 3.3Å; F691-T693 PolarHBondContact O-N 3.2Å; T693-Q695 VanDerWaalsContact C-N 3.26Å; T693-Q695 PolarHBondContact O-N 2.84Å; T693-L696 PolarHBondContact O-N 3.49Å; T693-D700 HydrophobicContact CG2-CB 3.97Å
694	R	85.1	Confident	82.3	Confident	142 Å²	142	49.9 Å²	49.9	54%	0.536	26%	0.262	S	S	.	.	H	α-helix	trans	-64.7	-24.8	174.4	-73	-179.5	-71.5	143.5	-5.2	114	D649 D690 F691	D649-R694 IonicContact OD2-CZ 2.8Å; D649-R694 IonicContact OD2-NH1 3.77Å; D649-R694 PolarHBondContact OD2-NH1 2.94Å; D649-R694 IonicContact OD2-NH2 3.77Å; D649-R694 PolarHBondContact OD2-NH2 2.93Å; D649-R694 VanDerWaalsContact OD2-NH2 3.1Å; D690-R694 WeakPolarHBondContact O-CG 3.45Å; D690-R694 PolarHBondContact O-N 2.94Å; D690-R694 PolarHBondContact O-NE 2.85Å; F691-R694 PolarHBondContact O-N 2.74Å
695	Q	84.4	Confident	82.1	Confident	76 Å²	76	54.6 Å²	54.6	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-81.5	-15.9	179.5	-62.9	-57.3	-56.4	0	0	113.7	F599 F691 Y692 T693	F599-Q695 HydrophobicContact CD1-CB 4.29Å; F599-Q695 HydrophobicContact CD2-CB 4.12Å; F599-Q695 HydrophobicContact CE2-CB 4.43Å; F599-Q695 HydrophobicContact CG-CB 4.08Å; F691-Q695 HydrophobicContact CE1-CG 4.18Å; F691-Q695 HydrophobicContact CE2-CG 4.39Å; F691-Q695 HydrophobicContact CZ-CG 4.07Å; F691-Q695 WeakPolarHBondContact O-CG 3.33Å; F691-Q695 PolarHBondContact O-N 3.36Å; Y692-Q695 PolarHBondContact O-N 2.95Å; T693-Q695 VanDerWaalsContact C-N 3.26Å; T693-Q695 PolarHBondContact O-N 2.84Å
696	L	81.5	Confident	82.1	Confident	19 Å²	19	54.7 Å²	54.7	10%	0.099	28%	0.279	C	S	.	.	S	Bend	trans	-82.7	126.9	179.4	-68.7	166.5	0	0	0	109.8	M596 F599 K600 Y692 T693 G698 G699	M596-L696 WeakPolarHBondContact O-CD2 3.3Å; F599-L696 HydrophobicContact CB-CD2 3.97Å; F599-L696 HydrophobicContact CB-CG 4.38Å; K600-L696 HydrophobicContact CB-CD2 4.09Å; Y692-L696 PolarHBondContact O-N 2.9Å; T693-L696 PolarHBondContact O-N 3.49Å; L696-G698 PolarHBondContact O-N 2.98Å; L696-G698 VanDerWaalsContact O-N 3.16Å; L696-G699 PolarHBondContact O-N 3.28Å
697	S	62.7	Low	82	Confident	99 Å²	99	54.6 Å²	54.6	69%	0.692	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.8	-177.9	57.2	0	0	0	0	114.6	M596 G699	M596-S697 WeakPolarHBondContact CE-OG 3.48Å; M596-S697 PolarHBondContact SD-OG 3.19Å; S697-G699 VanDerWaalsContact C-N 3.35Å
698	G	62.3	Low	81.7	Confident	60 Å²	60	57.1 Å²	57.1	62%	0.619	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-4.8	171.1	0	0	0	0	0	114.5	L696	L696-G698 PolarHBondContact O-N 2.98Å; L696-G698 VanDerWaalsContact O-N 3.16Å
699	G	64.9	Low	81.2	Confident	34 Å²	34	58 Å²	58	35%	0.351	30%	0.298	S	S	.	.			trans	58.7	-158.3	-174.9	0	0	0	0	0	113.4	L696 S697 E701	L696-G699 PolarHBondContact O-N 3.28Å; S697-G699 VanDerWaalsContact C-N 3.35Å; G699-E701 PolarHBondContact O-N 3.49Å
700	D	71.7	Confident	80.8	Confident	60 Å²	60	59.8 Å²	59.8	32%	0.321	31%	0.31	S	S	.	.			trans	-80	110.9	165.3	178.5	7.8	0	0	0	108.6	T693 N702 F703 Y704	T693-D700 HydrophobicContact CG2-CB 3.97Å; D700-N702 PolarHBondContact O-N 3.43Å; D700-N702 VanDerWaalsContact OD1-CB 3.29Å; D700-N702 WeakPolarHBondContact OD1-CB 3.32Å; D700-N702 PolarHBondContact OD1-N 3.39Å; D700-F703 HydrophobicContact CB-CB 3.77Å; D700-F703 WeakPolarHBondContact O-CA 3.45Å; D700-F703 WeakPolarHBondContact O-CB 3.46Å; D700-F703 PolarHBondContact O-N 2.96Å; D700-Y704 PolarHBondContact O-N 3.05Å
701	E	78.9	Confident	80.5	Confident	147 Å²	147	62.5 Å²	62.5	69%	0.687	33%	0.329	S	S	*	.	H	α-helix	trans	-53.6	-35.7	178.2	-175	179.3	174.6	0	0	111.4	G699 Y704 R705	G699-E701 PolarHBondContact O-N 3.49Å; E701-Y704 PolarHBondContact O-N 3.4Å; E701-R705 VanDerWaalsContact O-CG 3.3Å; E701-R705 WeakPolarHBondContact O-CG 3.47Å; E701-R705 PolarHBondContact O-N 3.29Å
702	N	83.2	Confident	79.9	Confident	24 Å²	24	65.9 Å²	65.9	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-67	-43.8	176.1	-174.1	46.8	0	0	0	111.4	D700 Y704 R705 W706 S728 G729	D700-N702 PolarHBondContact O-N 3.43Å; D700-N702 VanDerWaalsContact OD1-CB 3.29Å; D700-N702 WeakPolarHBondContact OD1-CB 3.32Å; D700-N702 PolarHBondContact OD1-N 3.39Å; N702-Y704 VanDerWaalsContact C-N 3.32Å; N702-Y704 PolarHBondContact O-N 3.22Å; N702-R705 PolarHBondContact O-N 3.36Å; N702-W706 VanDerWaalsContact O-CD1 3.27Å; N702-W706 PolarHBondContact O-N 3.21Å; N702-S728 WeakPolarHBondContact OD1-CB 3.41Å; N702-S728 PolarHBondContact OD1-OG 3.05Å; N702-G729 PolarHBondContact ND2-O 3.45Å; N702-G729 PolarHBondContact OD1-O 2.96Å
703	F	83.7	Confident	78.4	Confident	72 Å²	72	70.5 Å²	70.5	32%	0.316	38%	0.383	S	S	.	.	H	α-helix	trans	-59.1	-41.6	172.8	-179.4	-91.6	0	0	0	112.2	D700 W706 T707 P731 Q733 Y734	D700-F703 HydrophobicContact CB-CB 3.77Å; D700-F703 WeakPolarHBondContact O-CA 3.45Å; D700-F703 WeakPolarHBondContact O-CB 3.46Å; D700-F703 PolarHBondContact O-N 2.96Å; F703-W706 PolarHBondContact O-N 3.48Å; F703-T707 WeakPolarHBondContact CE1-OG1 3.38Å; F703-T707 WeakPolarHBondContact O-CB 3.39Å; F703-T707 PolarHBondContact O-N 3.19Å; F703-T707 PolarHBondContact O-OG1 2.84Å; F703-P731 HydrophobicContact CB-CG 4.37Å; F703-P731 HydrophobicContact CD2-CB 3.86Å; F703-P731 HydrophobicContact CD2-CG 4.14Å; F703-Q733 HydrophobicContact CE2-CG 4.49Å; F703-Y734 HydrophobicContact CD2-CD2 4.49Å; F703-Y734 AromaticContact CD2-CE2 3.86Å; F703-Y734 HydrophobicContact CD2-CE2 3.86Å; F703-Y734 HydrophobicContact CE2-CD2 4.32Å; F703-Y734 AromaticContact CE2-CE2 3.49Å; F703-Y734 HydrophobicContact CE2-CE2 3.49Å; F703-Y734 VanDerWaalsContact CE2-CE2 3.49Å; F703-Y734 AromaticContact CE2-CZ 3.91Å; F703-Y734 HydrophobicContact CZ-CE2 4.01Å
704	Y	83.9	Confident	77.3	Confident	143 Å²	143	77.5 Å²	77.5	56%	0.561	42%	0.42	S	S	*	.	H	α-helix	trans	-62.9	-46	175.9	179.5	-91.9	0	0	0	111.4	D700 E701 N702 W706 T707 E708	D700-Y704 PolarHBondContact O-N 3.05Å; E701-Y704 PolarHBondContact O-N 3.4Å; N702-Y704 VanDerWaalsContact C-N 3.32Å; N702-Y704 PolarHBondContact O-N 3.22Å; Y704-W706 VanDerWaalsContact C-N 3.33Å; Y704-W706 PolarHBondContact O-N 2.89Å; Y704-T707 PolarHBondContact O-N 3.41Å; Y704-T707 VanDerWaalsContact O-N 3.17Å; Y704-E708 HydrophobicContact CE1-CB 4.32Å; Y704-E708 WeakPolarHBondContact CE1-OE2 3.31Å; Y704-E708 WeakPolarHBondContact O-CB 3.44Å; Y704-E708 PolarHBondContact O-N 3.25Å
705	R	84.7	Confident	76.5	Confident	98 Å²	98	76.7 Å²	76.7	37%	0.37	42%	0.417	S	S	.	.	H	α-helix	trans	-59.8	-41.9	177.4	-71.9	176.9	68.6	-165.9	-1.4	112.3	E701 N702 L709 L725	E701-R705 VanDerWaalsContact O-CG 3.3Å; E701-R705 WeakPolarHBondContact O-CG 3.47Å; E701-R705 PolarHBondContact O-N 3.29Å; N702-R705 PolarHBondContact O-N 3.36Å; R705-L709 WeakPolarHBondContact O-CB 3.27Å; R705-L709 PolarHBondContact O-N 3.43Å; R705-L725 HydrophobicContact CB-CD2 3.85Å
706	W	87.8	Confident	75.6	Confident	2 Å²	2	81.7 Å²	81.7	1%	0.008	44%	0.44	C	S	.	.	H	α-helix	trans	-65.7	-43.4	173.8	-85.5	98.9	0	0	0	112.5	N702 F703 Y704 L709 L710 L722 L725 G729 V730 P731 Y734 V738	N702-W706 VanDerWaalsContact O-CD1 3.27Å; N702-W706 PolarHBondContact O-N 3.21Å; F703-W706 PolarHBondContact O-N 3.48Å; Y704-W706 VanDerWaalsContact C-N 3.33Å; Y704-W706 PolarHBondContact O-N 2.89Å; W706-L709 HydrophobicContact CE3-CD2 4.48Å; W706-L709 PolarHBondContact O-N 3.41Å; W706-L710 HydrophobicContact CE3-CD1 4.14Å; W706-L710 HydrophobicContact CE3-CG 4.29Å; W706-L710 WeakPolarHBondContact O-CB 3.15Å; W706-L710 VanDerWaalsContact O-CG 3.29Å; W706-L710 WeakPolarHBondContact O-CG 3.32Å; W706-L710 PolarHBondContact O-N 3.03Å; W706-L722 HydrophobicContact CH2-CD1 3.83Å; W706-L722 HydrophobicContact CZ3-CD1 4.3Å; W706-L725 HydrophobicContact CH2-CB 4.22Å; W706-L725 HydrophobicContact CZ2-CB 3.57Å; W706-G729 PolarHBondContact NE1-O 3.1Å; W706-V730 HydrophobicContact CH2-CG2 4.02Å; W706-V730 HydrophobicContact CZ2-CB 4.25Å; W706-V730 HydrophobicContact CZ2-CG1 4.33Å; W706-V730 HydrophobicContact CZ2-CG2 3.61Å; W706-P731 HydrophobicContact CB-CG 4.15Å; W706-P731 HydrophobicContact CG-CG 4.01Å; W706-Y734 HydrophobicContact CB-CD2 3.89Å; W706-Y734 HydrophobicContact CB-CE2 4.09Å; W706-V738 HydrophobicContact CE3-CG2 4.13Å; W706-V738 HydrophobicContact CH2-CG1 3.89Å; W706-V738 HydrophobicContact CH2-CG2 3.94Å; W706-V738 HydrophobicContact CZ3-CG1 4.21Å; W706-V738 HydrophobicContact CZ3-CG2 3.46Å; W706-V738 VanDerWaalsContact CZ3-CG2 3.46Å
707	T	85.7	Confident	75.1	Confident	36 Å²	36	84.1 Å²	84.1	22%	0.221	45%	0.453	C	S	.	.	H	α-helix	trans	-63.6	-48.3	179.2	-56.3	0	0	0	0	110.6	F703 Y704 L709 L710 T711 Y734	F703-T707 WeakPolarHBondContact CE1-OG1 3.38Å; F703-T707 WeakPolarHBondContact O-CB 3.39Å; F703-T707 PolarHBondContact O-N 3.19Å; F703-T707 PolarHBondContact O-OG1 2.84Å; Y704-T707 PolarHBondContact O-N 3.41Å; Y704-T707 VanDerWaalsContact O-N 3.17Å; T707-L709 VanDerWaalsContact C-N 3.28Å; T707-L709 PolarHBondContact O-N 3.39Å; T707-L710 PolarHBondContact O-N 3.46Å; T707-T711 VanDerWaalsContact O-CB 3.26Å; T707-T711 WeakPolarHBondContact O-CB 3.25Å; T707-T711 PolarHBondContact O-N 3.39Å; T707-T711 PolarHBondContact O-OG1 3.23Å; T707-Y734 PolarHBondContact OG1-OH 3.44Å
708	E	83.7	Confident	76.1	Confident	75 Å²	75	82.7 Å²	82.7	35%	0.35	44%	0.44	S	S	.	.	H	α-helix	trans	-55.4	-46.7	176	-179.1	178.2	-169.5	0	0	110.8	Y704 Q712	Y704-E708 HydrophobicContact CE1-CB 4.32Å; Y704-E708 WeakPolarHBondContact CE1-OE2 3.31Å; Y704-E708 WeakPolarHBondContact O-CB 3.44Å; Y704-E708 PolarHBondContact O-N 3.25Å; E708-Q712 WeakPolarHBondContact O-CB 3.28Å; E708-Q712 WeakPolarHBondContact O-CG 3.39Å; E708-Q712 PolarHBondContact O-N 3.41Å; E708-Q712 PolarHBondContact OE1-NE2 3.49Å
709	L	79.4	Confident	77.1	Confident	17 Å²	17	87.2 Å²	87.2	9%	0.089	44%	0.438	C	S	.	.	H	α-helix	trans	-68.3	-40.7	-178	-177.5	134	0	0	0	113.3	R705 W706 T707 L717 L725	R705-L709 WeakPolarHBondContact O-CB 3.27Å; R705-L709 PolarHBondContact O-N 3.43Å; W706-L709 HydrophobicContact CE3-CD2 4.48Å; W706-L709 PolarHBondContact O-N 3.41Å; T707-L709 VanDerWaalsContact C-N 3.28Å; T707-L709 PolarHBondContact O-N 3.39Å; L709-L717 HydrophobicContact CD1-CD1 3.59Å; L709-L717 HydrophobicContact CD1-CG 4.21Å; L709-L717 HydrophobicContact CD2-CD1 3.43Å; L709-L717 VanDerWaalsContact CD2-CD1 3.43Å; L709-L717 HydrophobicContact CD2-CD2 3.96Å; L709-L717 HydrophobicContact CD2-CG 4.21Å; L709-L717 HydrophobicContact CG-CD1 3.45Å; L709-L717 VanDerWaalsContact CG-CD1 3.45Å; L709-L717 HydrophobicContact CG-CG 4.45Å; L709-L725 HydrophobicContact CB-CD1 4.36Å; L709-L725 HydrophobicContact CD1-CD1 3.33Å; L709-L725 HydrophobicContact CD2-CD1 4.14Å; L709-L725 HydrophobicContact CG-CD1 4.12Å
710	L	80.6	Confident	78.2	Confident	80 Å²	80	88.5 Å²	88.5	42%	0.419	45%	0.445	S	S	.	.	H	α-helix	trans	-78.1	-23	179.4	-67.4	173.7	0	0	0	113.2	W706 T707 Y734	W706-L710 HydrophobicContact CE3-CD1 4.14Å; W706-L710 HydrophobicContact CE3-CG 4.29Å; W706-L710 WeakPolarHBondContact O-CB 3.15Å; W706-L710 VanDerWaalsContact O-CG 3.29Å; W706-L710 WeakPolarHBondContact O-CG 3.32Å; W706-L710 PolarHBondContact O-N 3.03Å; T707-L710 PolarHBondContact O-N 3.46Å; L710-Y734 HydrophobicContact CD1-CD1 3.55Å; L710-Y734 HydrophobicContact CD1-CD2 4.08Å; L710-Y734 HydrophobicContact CD1-CE1 4.03Å; L710-Y734 HydrophobicContact CD1-CE2 4.5Å; L710-Y734 HydrophobicContact CD1-CG 3.58Å
711	T	81.2	Confident	78.9	Confident	105 Å²	105	88.2 Å²	88.2	64%	0.644	44%	0.444	S	S	*	.	H	α-helix	trans	-87.6	-23.6	-179.7	-44.7	0	0	0	0	112.3	T707 A713	T707-T711 VanDerWaalsContact O-CB 3.26Å; T707-T711 WeakPolarHBondContact O-CB 3.25Å; T707-T711 PolarHBondContact O-N 3.39Å; T707-T711 PolarHBondContact O-OG1 3.23Å; T711-A713 PolarHBondContact O-N 3.34Å
712	Q	76.8	Confident	79.4	Confident	74 Å²	74	82 Å²	82	35%	0.346	42%	0.415	S	S	.	.			trans	-73.6	90.5	177.9	-77.2	173.7	10.4	0	0	111.3	E708 N714 R715	E708-Q712 WeakPolarHBondContact O-CB 3.28Å; E708-Q712 WeakPolarHBondContact O-CG 3.39Å; E708-Q712 PolarHBondContact O-N 3.41Å; E708-Q712 PolarHBondContact OE1-NE2 3.49Å; Q712-N714 PolarHBondContact O-N 3.34Å; Q712-R715 HydrophobicContact CB-CB 4.2Å; Q712-R715 PolarHBondContact O-N 3.44Å
713	A	58.2	Low	79.8	Confident	99 Å²	99	83 Å²	83	82%	0.818	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-19.9	-175.7	0	0	0	0	0	115.9	T711	T711-A713 PolarHBondContact O-N 3.34Å
714	N	63.2	Low	80.2	Confident	166 Å²	166	82.9 Å²	82.9	89%	0.888	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	11.7	-171.5	-73.5	-9.9	0	0	0	114.6	Q712	Q712-N714 PolarHBondContact O-N 3.34Å
715	R	67.1	Low	80.5	Confident	125 Å²	125	76.3 Å²	76.3	47%	0.472	40%	0.399	S	S	.	.			trans	-93.2	117.9	178	-166.2	171.4	175	-175.7	-3.4	110	Q712 L717	Q712-R715 HydrophobicContact CB-CB 4.2Å; Q712-R715 PolarHBondContact O-N 3.44Å; R715-L717 PolarHBondContact O-N 2.92Å
716	E	66.8	Low	80.9	Confident	180 Å²	180	71.7 Å²	71.7	84%	0.841	38%	0.381	S	S	*	.			trans	-62.4	118.2	168.9	-72.5	-176.1	173.2	0	0	109	T718	E716-T718 PolarHBondContact O-N 3.45Å
717	L	70.7	Confident	81.2	Confident	71 Å²	71	74.5 Å²	74.5	37%	0.372	39%	0.392	S	S	.	.			trans	-73.2	109.6	177.7	-132.2	80.2	0	0	0	109.6	L709 R715 L722	L709-L717 HydrophobicContact CD1-CD1 3.59Å; L709-L717 HydrophobicContact CD1-CG 4.21Å; L709-L717 HydrophobicContact CD2-CD1 3.43Å; L709-L717 VanDerWaalsContact CD2-CD1 3.43Å; L709-L717 HydrophobicContact CD2-CD2 3.96Å; L709-L717 HydrophobicContact CD2-CG 4.21Å; L709-L717 HydrophobicContact CG-CD1 3.45Å; L709-L717 VanDerWaalsContact CG-CD1 3.45Å; L709-L717 HydrophobicContact CG-CG 4.45Å; R715-L717 PolarHBondContact O-N 2.92Å; L717-L722 HydrophobicContact CD2-CB 4.08Å; L717-L722 HydrophobicContact CD2-CD1 3.85Å; L717-L722 HydrophobicContact CD2-CD2 4.18Å; L717-L722 HydrophobicContact CD2-CG 4.26Å
718	T	82.7	Confident	81.5	Confident	68 Å²	68	74.7 Å²	74.7	42%	0.417	40%	0.395	S	S	.	.			trans	-72.8	143.9	170.9	77.4	0	0	0	0	109.2	E716 A720 D721 L722	E716-T718 PolarHBondContact O-N 3.45Å; T718-A720 PolarHBondContact O-N 2.94Å; T718-D721 PolarHBondContact O-N 3.42Å; T718-D721 VanDerWaalsContact O-N 3.16Å; T718-D721 PolarHBondContact OG1-N 2.82Å; T718-D721 PolarHBondContact OG1-OD2 3.07Å; T718-L722 PolarHBondContact O-N 3.33Å
719	R	85.2	Confident	81.9	Confident	156 Å²	156	71.3 Å²	71.3	59%	0.589	38%	0.38	S	S	*	.	H	α-helix	trans	-56.8	-34.5	175.5	-174.5	174.5	-177.8	125.1	5.3	111.8	L722 E723 L923	R719-L722 PolarHBondContact O-N 3.48Å; R719-E723 IonicContact NE-OE1 2.63Å; R719-E723 WeakPolarHBondContact O-CG 3.35Å; R719-E723 PolarHBondContact O-N 3.44Å; R719-L923 PolarHBondContact NH2-O 3.36Å
720	A	87.1	Confident	82.5	Confident	60 Å²	60	70.6 Å²	70.6	50%	0.496	38%	0.377	S	S	.	.	H	α-helix	trans	-65.1	-42.2	178.2	0	0	0	0	0	112.5	T718 L722 E723 V724	T718-A720 PolarHBondContact O-N 2.94Å; A720-L722 VanDerWaalsContact C-N 3.32Å; A720-L722 PolarHBondContact O-N 3.11Å; A720-E723 PolarHBondContact O-N 3.14Å; A720-V724 WeakPolarHBondContact O-CG2 3.43Å; A720-V724 PolarHBondContact O-N 3.34Å; A720-V724 VanDerWaalsContact O-N 3.08Å
721	D	86.5	Confident	83	Confident	54 Å²	54	67.4 Å²	67.4	29%	0.289	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-42.9	175.6	-67.6	-41	0	0	0	110.8	T718 V724 L725	T718-D721 PolarHBondContact O-N 3.42Å; T718-D721 VanDerWaalsContact O-N 3.16Å; T718-D721 PolarHBondContact OG1-N 2.82Å; T718-D721 PolarHBondContact OG1-OD2 3.07Å; D721-V724 PolarHBondContact O-N 2.81Å; D721-L725 WeakPolarHBondContact O-CG 3.38Å; D721-L725 PolarHBondContact O-N 3.34Å
722	L	88.9	Confident	83.3	Confident	16 Å²	16	65.6 Å²	65.6	8%	0.084	35%	0.346	C	S	.	.	H	α-helix	trans	-65.5	-38.8	178.2	-169.9	57.4	0	0	0	112	W706 L717 T718 R719 A720 L725 C726 M741 L742 L923	W706-L722 HydrophobicContact CH2-CD1 3.83Å; W706-L722 HydrophobicContact CZ3-CD1 4.3Å; L717-L722 HydrophobicContact CD2-CB 4.08Å; L717-L722 HydrophobicContact CD2-CD1 3.85Å; L717-L722 HydrophobicContact CD2-CD2 4.18Å; L717-L722 HydrophobicContact CD2-CG 4.26Å; T718-L722 PolarHBondContact O-N 3.33Å; R719-L722 PolarHBondContact O-N 3.48Å; A720-L722 VanDerWaalsContact C-N 3.32Å; A720-L722 PolarHBondContact O-N 3.11Å; L722-L725 PolarHBondContact O-N 3.08Å; L722-C726 WeakPolarHBondContact O-CB 3.43Å; L722-C726 PolarHBondContact O-N 3.45Å; L722-M741 HydrophobicContact CD2-CE 4.38Å; L722-L742 HydrophobicContact CD2-CD2 4.01Å; L722-L923 HydrophobicContact CB-CD2 4.3Å; L722-L923 HydrophobicContact CD2-CD1 3.53Å; L722-L923 HydrophobicContact CD2-CD2 4.45Å; L722-L923 HydrophobicContact CG-CD1 3.89Å; L722-L923 HydrophobicContact CG-CD2 3.86Å
723	E	92.4	Very high	83.8	Confident	46 Å²	46	68.1 Å²	68.1	22%	0.215	36%	0.358	C	S	.	.	H	α-helix	trans	-60.8	-45.3	173.7	-78.9	179.2	-158.5	0	0	111.7	R719 A720 L725 R727 L923 E924	R719-E723 IonicContact NE-OE1 2.63Å; R719-E723 WeakPolarHBondContact O-CG 3.35Å; R719-E723 PolarHBondContact O-N 3.44Å; A720-E723 PolarHBondContact O-N 3.14Å; E723-L725 VanDerWaalsContact C-N 3.3Å; E723-L725 PolarHBondContact O-N 3.36Å; E723-R727 WeakPolarHBondContact O-CB 3.49Å; E723-R727 WeakPolarHBondContact O-CD 3.11Å; E723-R727 WeakPolarHBondContact O-CG 3.3Å; E723-R727 PolarHBondContact O-N 3.39Å; E723-R727 IonicContact OE2-CZ 2.59Å; E723-R727 IonicContact OE2-NH1 2.67Å; E723-R727 IonicContact OE2-NH2 2.65Å; E723-R727 PolarHBondContact OE2-NH2 3.29Å; E723-L923 HydrophobicContact CB-CD2 4.29Å; E723-L923 HydrophobicContact CG-CD2 3.84Å; E723-E924 HydrophobicContact CG-CG 4.08Å
724	V	91.4	Very high	85.4	Confident	70 Å²	70	66.1 Å²	66.1	42%	0.424	33%	0.33	S	S	.	.	H	α-helix	trans	-62.1	-40.7	177.9	173.5	0	0	0	0	110.9	A720 D721 S728	A720-V724 WeakPolarHBondContact O-CG2 3.43Å; A720-V724 PolarHBondContact O-N 3.34Å; A720-V724 VanDerWaalsContact O-N 3.08Å; D721-V724 PolarHBondContact O-N 2.81Å; V724-S728 PolarHBondContact O-N 3.42Å; V724-S728 PolarHBondContact O-OG 3.14Å
725	L	91.2	Very high	86.9	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-74.1	-42.7	-178.8	-71.9	175.8	0	0	0	113.7	R705 W706 L709 D721 L722 E723 R727 S728 G729	R705-L725 HydrophobicContact CB-CD2 3.85Å; W706-L725 HydrophobicContact CH2-CB 4.22Å; W706-L725 HydrophobicContact CZ2-CB 3.57Å; L709-L725 HydrophobicContact CB-CD1 4.36Å; L709-L725 HydrophobicContact CD1-CD1 3.33Å; L709-L725 HydrophobicContact CD2-CD1 4.14Å; L709-L725 HydrophobicContact CG-CD1 4.12Å; D721-L725 WeakPolarHBondContact O-CG 3.38Å; D721-L725 PolarHBondContact O-N 3.34Å; L722-L725 PolarHBondContact O-N 3.08Å; E723-L725 VanDerWaalsContact C-N 3.3Å; E723-L725 PolarHBondContact O-N 3.36Å; L725-R727 VanDerWaalsContact C-N 3.27Å; L725-R727 PolarHBondContact O-N 3.46Å; L725-S728 WeakPolarHBondContact CA-OG 3.46Å; L725-S728 PolarHBondContact O-N 3.33Å; L725-S728 VanDerWaalsContact O-N 3.1Å; L725-S728 PolarHBondContact O-OG 2.99Å; L725-G729 PolarHBondContact O-N 3.41Å
726	C	92.8	Very high	88.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-37.5	174	-75.2	0	0	0	0	110.7	L722 S728 G729 R916 L923	L722-C726 WeakPolarHBondContact O-CB 3.43Å; L722-C726 PolarHBondContact O-N 3.45Å; C726-S728 VanDerWaalsContact C-N 3.3Å; C726-S728 PolarHBondContact O-N 3.17Å; C726-G729 PolarHBondContact O-N 2.97Å; C726-R916 PolarHBondContact O-NH1 3.32Å; C726-L923 HydrophobicContact CB-CD2 3.89Å
727	R	94.1	Very high	89.5	Confident	62 Å²	62	50.8 Å²	50.8	23%	0.234	27%	0.27	C	S	.	.	H	α-helix	trans	-69.1	-22.3	173	-69.4	171.5	-169.2	152	5.4	113.2	E723 L725 R916 V920 E924 I971	E723-R727 WeakPolarHBondContact O-CB 3.49Å; E723-R727 WeakPolarHBondContact O-CD 3.11Å; E723-R727 WeakPolarHBondContact O-CG 3.3Å; E723-R727 PolarHBondContact O-N 3.39Å; E723-R727 IonicContact OE2-CZ 2.59Å; E723-R727 IonicContact OE2-NH1 2.67Å; E723-R727 IonicContact OE2-NH2 2.65Å; E723-R727 PolarHBondContact OE2-NH2 3.29Å; L725-R727 VanDerWaalsContact C-N 3.27Å; L725-R727 PolarHBondContact O-N 3.46Å; R727-R916 VanDerWaalsContact C-NH2 3.27Å; R727-R916 PolarHBondContact O-NH2 2.98Å; R727-V920 HydrophobicContact CG-CG1 4.29Å; R727-V920 HydrophobicContact CG-CG2 4.08Å; R727-E924 IonicContact CZ-OE1 3.22Å; R727-E924 IonicContact CZ-OE2 3.15Å; R727-E924 IonicContact NE-OE1 3.93Å; R727-E924 PolarHBondContact NE-OE1 3.28Å; R727-E924 IonicContact NE-OE2 3.07Å; R727-E924 IonicContact NH2-OE1 3.22Å; R727-E924 PolarHBondContact NH2-OE1 3.43Å; R727-E924 IonicContact NH2-OE2 2.68Å; R727-E924 PolarHBondContact NH2-OE2 2.82Å; R727-I971 HydrophobicContact CB-CG2 4.17Å; R727-I971 WeakPolarHBondContact O-CD1 3.02Å
728	S	90.7	Very high	90.6	Very high	39 Å²	39	47.6 Å²	47.6	27%	0.273	25%	0.253	S	S	.	.	H	α-helix	trans	-87.3	-22.3	172.5	60.9	0	0	0	0	114.4	N702 V724 L725 C726 R916	N702-S728 WeakPolarHBondContact OD1-CB 3.41Å; N702-S728 PolarHBondContact OD1-OG 3.05Å; V724-S728 PolarHBondContact O-N 3.42Å; V724-S728 PolarHBondContact O-OG 3.14Å; L725-S728 WeakPolarHBondContact CA-OG 3.46Å; L725-S728 PolarHBondContact O-N 3.33Å; L725-S728 VanDerWaalsContact O-N 3.1Å; L725-S728 PolarHBondContact O-OG 2.99Å; C726-S728 VanDerWaalsContact C-N 3.3Å; C726-S728 PolarHBondContact O-N 3.17Å; S728-R916 PolarHBondContact O-NH2 3.13Å
729	G	92.2	Very high	91.3	Very high	5 Å²	5	44.3 Å²	44.3	5%	0.052	23%	0.233	C	C	.	.			trans	132.1	124.1	-177.8	0	0	0	0	0	110.9	N702 W706 L725 C726 P731	N702-G729 PolarHBondContact ND2-O 3.45Å; N702-G729 PolarHBondContact OD1-O 2.96Å; W706-G729 PolarHBondContact NE1-O 3.1Å; L725-G729 PolarHBondContact O-N 3.41Å; C726-G729 PolarHBondContact O-N 2.97Å; G729-P731 WeakPolarHBondContact O-CD 3.36Å
730	V	93.2	Very high	91.8	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.012	22%	0.223	C	C	.	.			trans	-82.2	119.8	161.3	-172.9	0	0	0	0	107.4	W706 R735 V738 D919	W706-V730 HydrophobicContact CH2-CG2 4.02Å; W706-V730 HydrophobicContact CZ2-CB 4.25Å; W706-V730 HydrophobicContact CZ2-CG1 4.33Å; W706-V730 HydrophobicContact CZ2-CG2 3.61Å; V730-R735 HydrophobicContact CG1-CB 4.05Å; V730-R735 HydrophobicContact CG1-CG 4.35Å; V730-R735 PolarHBondContact O-NE 3.24Å; V730-R735 PolarHBondContact O-NH2 3.48Å; V730-V738 HydrophobicContact CG1-CB 3.98Å; V730-V738 HydrophobicContact CG1-CG1 4.26Å; V730-V738 HydrophobicContact CG1-CG2 3.96Å; V730-V738 HydrophobicContact CG2-CG1 4.14Å; V730-D919 WeakPolarHBondContact CB-OD1 3.47Å; V730-D919 HydrophobicContact CG2-CB 3.86Å; V730-D919 VanDerWaalsContact CG2-CG 3.43Å; V730-D919 WeakPolarHBondContact CG2-OD1 3.31Å; V730-D919 PolarHBondContact N-OD2 2.72Å
731	P	90.9	Very high	92.1	Very high	12 Å²	12	43.2 Å²	43.2	8%	0.078	22%	0.221	C	C	.	.			trans	-61.8	147.7	175	-21.9	32.8	0	0	0	111.3	F703 W706 G729 Q733 Y734 R735	F703-P731 HydrophobicContact CB-CG 4.37Å; F703-P731 HydrophobicContact CD2-CB 3.86Å; F703-P731 HydrophobicContact CD2-CG 4.14Å; W706-P731 HydrophobicContact CB-CG 4.15Å; W706-P731 HydrophobicContact CG-CG 4.01Å; G729-P731 WeakPolarHBondContact O-CD 3.36Å; P731-Q733 PolarHBondContact O-N 3.01Å; P731-Q733 VanDerWaalsContact O-N 3.15Å; P731-Y734 HydrophobicContact CB-CD2 4.08Å; P731-Y734 HydrophobicContact CG-CD2 4.08Å; P731-Y734 PolarHBondContact O-N 2.75Å; P731-R735 PolarHBondContact O-N 2.99Å
732	I	86.9	Confident	92.5	Very high	67 Å²	67	41.7 Å²	41.7	34%	0.344	21%	0.213	S	C	.	.	H	α-helix	trans	-57.2	-36.1	-172.6	-167.5	166.1	0	0	0	113.4	F667 Y668 Y734 R735	F667-I732 HydrophobicContact CB-CD1 4.35Å; Y668-I732 HydrophobicContact CD1-CD1 4Å; Y668-I732 HydrophobicContact CE1-CD1 3.44Å; Y668-I732 VanDerWaalsContact CE1-CD1 3.44Å; Y668-I732 HydrophobicContact CE1-CG1 4.26Å; I732-Y734 PolarHBondContact O-N 3.07Å; I732-R735 PolarHBondContact O-N 3.43Å
733	Q	88.3	Confident	92.9	Very high	127 Å²	127	41 Å²	41	59%	0.593	21%	0.21	S	C	*	.	H	α-helix	trans	-66.9	-26.1	-179.2	-55.4	84.1	-5.8	0	0	112.8	F703 P731	F703-Q733 HydrophobicContact CE2-CG 4.49Å; P731-Q733 PolarHBondContact O-N 3.01Å; P731-Q733 VanDerWaalsContact O-N 3.15Å
734	Y	92	Very high	93	Very high	57 Å²	57	40.8 Å²	40.8	22%	0.224	21%	0.209	C	C	.	.	H	α-helix	trans	-102.9	-12	-179.1	-57.5	-51.1	0	0	0	112.4	F703 W706 T707 L710 P731 I732 E736 G737 V738	F703-Y734 HydrophobicContact CD2-CD2 4.49Å; F703-Y734 AromaticContact CD2-CE2 3.86Å; F703-Y734 HydrophobicContact CD2-CE2 3.86Å; F703-Y734 HydrophobicContact CE2-CD2 4.32Å; F703-Y734 AromaticContact CE2-CE2 3.49Å; F703-Y734 HydrophobicContact CE2-CE2 3.49Å; F703-Y734 VanDerWaalsContact CE2-CE2 3.49Å; F703-Y734 AromaticContact CE2-CZ 3.91Å; F703-Y734 HydrophobicContact CZ-CE2 4.01Å; W706-Y734 HydrophobicContact CB-CD2 3.89Å; W706-Y734 HydrophobicContact CB-CE2 4.09Å; T707-Y734 PolarHBondContact OG1-OH 3.44Å; L710-Y734 HydrophobicContact CD1-CD1 3.55Å; L710-Y734 HydrophobicContact CD1-CD2 4.08Å; L710-Y734 HydrophobicContact CD1-CE1 4.03Å; L710-Y734 HydrophobicContact CD1-CE2 4.5Å; L710-Y734 HydrophobicContact CD1-CG 3.58Å; P731-Y734 HydrophobicContact CB-CD2 4.08Å; P731-Y734 HydrophobicContact CG-CD2 4.08Å; P731-Y734 PolarHBondContact O-N 2.75Å; I732-Y734 PolarHBondContact O-N 3.07Å; Y734-E736 PolarHBondContact O-N 3.3Å; Y734-G737 PolarHBondContact O-N 3.25Å; Y734-G737 VanDerWaalsContact O-N 3.15Å; Y734-V738 WeakPolarHBondContact O-CB 3.47Å; Y734-V738 VanDerWaalsContact O-CG2 3.3Å; Y734-V738 WeakPolarHBondContact O-CG2 3.38Å; Y734-V738 PolarHBondContact O-N 3.08Å
735	R	94.5	Very high	93.1	Very high	11 Å²	11	40.1 Å²	40.1	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-46.1	-172.1	-165.8	174.3	-65.9	126.9	-0.6	113.3	V730 P731 I732 G737 V738 W739 F834 D919	V730-R735 HydrophobicContact CG1-CB 4.05Å; V730-R735 HydrophobicContact CG1-CG 4.35Å; V730-R735 PolarHBondContact O-NE 3.24Å; V730-R735 PolarHBondContact O-NH2 3.48Å; P731-R735 PolarHBondContact O-N 2.99Å; I732-R735 PolarHBondContact O-N 3.43Å; R735-G737 VanDerWaalsContact C-N 3.33Å; R735-G737 PolarHBondContact O-N 3.5Å; R735-V738 PolarHBondContact O-N 3.35Å; R735-W739 HydrophobicContact CG-CD2 3.94Å; R735-W739 HydrophobicContact CG-CG 4.09Å; R735-W739 HydrophobicContact CG-CZ2 4.05Å; R735-W739 VanDerWaalsContact O-CB 3.29Å; R735-W739 WeakPolarHBondContact O-CB 3.23Å; R735-W739 PolarHBondContact O-N 3.38Å; R735-F834 HydrophobicContact CG-CD1 4.39Å; R735-D919 IonicContact NE-OD1 2.9Å
736	E	94.8	Very high	93.2	Very high	92 Å²	92	44.7 Å²	44.7	43%	0.43	24%	0.237	S	C	.	.	H	α-helix	trans	-53.6	-51.1	174.4	175.1	174.5	-175	0	0	110.9	Y734 R740 F834 L835	Y734-E736 PolarHBondContact O-N 3.3Å; E736-R740 WeakPolarHBondContact O-CB 3.25Å; E736-R740 PolarHBondContact O-N 3.38Å; E736-F834 VanDerWaalsContact CB-O 3.23Å; E736-F834 WeakPolarHBondContact CB-O 3.37Å; E736-F834 WeakPolarHBondContact CG-O 3.25Å; E736-L835 HydrophobicContact CG-CD2 4.38Å
737	G	93.5	Very high	93.3	Very high	46 Å²	46	44.8 Å²	44.8	47%	0.474	24%	0.237	S	C	.	.	H	α-helix	trans	-65.3	-45	-178.2	0	0	0	0	0	113.2	Y734 R735 M741	Y734-G737 PolarHBondContact O-N 3.25Å; Y734-G737 VanDerWaalsContact O-N 3.15Å; R735-G737 VanDerWaalsContact C-N 3.33Å; R735-G737 PolarHBondContact O-N 3.5Å; G737-M741 VanDerWaalsContact O-CB 3.31Å; G737-M741 WeakPolarHBondContact O-CB 3.49Å; G737-M741 PolarHBondContact O-N 3.38Å
738	V	93.7	Very high	93.2	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.024	25%	0.249	C	C	.	.	H	α-helix	trans	-67.4	-49.2	-179.1	172.6	0	0	0	0	111	W706 V730 Y734 R735 R740 M741 L742	W706-V738 HydrophobicContact CE3-CG2 4.13Å; W706-V738 HydrophobicContact CH2-CG1 3.89Å; W706-V738 HydrophobicContact CH2-CG2 3.94Å; W706-V738 HydrophobicContact CZ3-CG1 4.21Å; W706-V738 HydrophobicContact CZ3-CG2 3.46Å; W706-V738 VanDerWaalsContact CZ3-CG2 3.46Å; V730-V738 HydrophobicContact CG1-CB 3.98Å; V730-V738 HydrophobicContact CG1-CG1 4.26Å; V730-V738 HydrophobicContact CG1-CG2 3.96Å; V730-V738 HydrophobicContact CG2-CG1 4.14Å; Y734-V738 WeakPolarHBondContact O-CB 3.47Å; Y734-V738 VanDerWaalsContact O-CG2 3.3Å; Y734-V738 WeakPolarHBondContact O-CG2 3.38Å; Y734-V738 PolarHBondContact O-N 3.08Å; R735-V738 PolarHBondContact O-N 3.35Å; V738-R740 VanDerWaalsContact C-N 3.33Å; V738-R740 PolarHBondContact O-N 3.43Å; V738-M741 WeakPolarHBondContact O-CB 3.22Å; V738-M741 PolarHBondContact O-N 2.93Å; V738-L742 HydrophobicContact CG1-CD1 4.09Å; V738-L742 HydrophobicContact CG1-CG 4.44Å; V738-L742 VanDerWaalsContact O-CG 3.31Å; V738-L742 WeakPolarHBondContact O-CG 3.17Å; V738-L742 PolarHBondContact O-N 2.94Å
739	W	97	Very high	93.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-45.2	178.6	-75.1	18	0	0	0	110.8	R735 M741 L742 I743 V830 F834 L835 W918 D919 L922	R735-W739 HydrophobicContact CG-CD2 3.94Å; R735-W739 HydrophobicContact CG-CG 4.09Å; R735-W739 HydrophobicContact CG-CZ2 4.05Å; R735-W739 VanDerWaalsContact O-CB 3.29Å; R735-W739 WeakPolarHBondContact O-CB 3.23Å; R735-W739 PolarHBondContact O-N 3.38Å; W739-M741 VanDerWaalsContact C-N 3.33Å; W739-M741 PolarHBondContact O-N 2.97Å; W739-L742 PolarHBondContact O-N 3.29Å; W739-I743 HydrophobicContact CB-CD1 4.46Å; W739-I743 WeakPolarHBondContact O-CB 3.38Å; W739-I743 VanDerWaalsContact O-CD1 3.27Å; W739-I743 WeakPolarHBondContact O-CD1 3.03Å; W739-I743 VanDerWaalsContact O-CG1 3.26Å; W739-I743 WeakPolarHBondContact O-CG1 3.46Å; W739-I743 PolarHBondContact O-N 3.28Å; W739-V830 HydrophobicContact CH2-CG1 4.38Å; W739-V830 HydrophobicContact CZ3-CG1 4.46Å; W739-F834 HydrophobicContact CE3-CB 4.14Å; W739-F834 HydrophobicContact CE3-CD2 4.24Å; W739-F834 HydrophobicContact CE3-CG 4.45Å; W739-F834 AromaticContact CH2-CD2 3.71Å; W739-F834 HydrophobicContact CH2-CD2 3.71Å; W739-F834 AromaticContact CH2-CE2 3.99Å; W739-F834 HydrophobicContact CH2-CE2 3.99Å; W739-F834 HydrophobicContact CH2-CG 4.47Å; W739-F834 HydrophobicContact CZ3-CB 4.2Å; W739-F834 AromaticContact CZ3-CD2 3.47Å; W739-F834 HydrophobicContact CZ3-CD2 3.47Å; W739-F834 VanDerWaalsContact CZ3-CD2 3.47Å; W739-F834 HydrophobicContact CZ3-CE2 4.21Å; W739-F834 HydrophobicContact CZ3-CG 4.1Å; W739-L835 HydrophobicContact CB-CD2 4.22Å; W739-W918 HydrophobicContact CE3-CE3 4.34Å; W739-W918 HydrophobicContact CH2-CB 3.71Å; W739-W918 HydrophobicContact CH2-CD2 4.06Å; W739-W918 AromaticContact CH2-CE3 3.58Å; W739-W918 HydrophobicContact CH2-CE3 3.58Å; W739-W918 HydrophobicContact CH2-CG 4.16Å; W739-W918 HydrophobicContact CH2-CZ3 4.48Å; W739-W918 HydrophobicContact CZ2-CB 3.53Å; W739-W918 HydrophobicContact CZ2-CE3 4.35Å; W739-W918 HydrophobicContact CZ2-CG 4.44Å; W739-W918 HydrophobicContact CZ3-CD2 4.47Å; W739-W918 AromaticContact CZ3-CE3 3.57Å; W739-W918 HydrophobicContact CZ3-CE3 3.57Å; W739-W918 HydrophobicContact CZ3-CZ3 4.09Å; W739-D919 PolarHBondContact NE1-OD1 2.73Å; W739-L922 HydrophobicContact CB-CD1 4.02Å; W739-L922 HydrophobicContact CD2-CD1 3.45Å; W739-L922 VanDerWaalsContact CD2-CD1 3.45Å; W739-L922 HydrophobicContact CE3-CD1 3.89Å; W739-L922 HydrophobicContact CG-CD1 3.51Å; W739-L922 HydrophobicContact CZ2-CD1 4.43Å
740	R	96	Very high	93.4	Very high	98 Å²	98	53.1 Å²	53.1	37%	0.37	27%	0.274	S	S	.	.	H	α-helix	trans	-57.8	-45.6	175.2	-173	177.9	-177.7	-135.1	-10.1	111.6	E736 V738 L742 I743 H744 L835 D839	E736-R740 WeakPolarHBondContact O-CB 3.25Å; E736-R740 PolarHBondContact O-N 3.38Å; V738-R740 VanDerWaalsContact C-N 3.33Å; V738-R740 PolarHBondContact O-N 3.43Å; R740-L742 PolarHBondContact O-N 3.24Å; R740-I743 PolarHBondContact O-N 3.16Å; R740-H744 VanDerWaalsContact O-CB 3.23Å; R740-H744 WeakPolarHBondContact O-CB 3.41Å; R740-H744 PolarHBondContact O-CD2 2.94Å; R740-H744 PolarHBondContact O-N 3.31Å; R740-L835 HydrophobicContact CB-CD2 4.19Å; R740-D839 IonicContact CZ-OD1 2.69Å; R740-D839 IonicContact NE-OD1 3.57Å; R740-D839 PolarHBondContact NE-OD1 3.16Å; R740-D839 IonicContact NE-OD2 3.77Å; R740-D839 PolarHBondContact NE-OD2 3.29Å
741	M	93.5	Very high	93.4	Very high	94 Å²	94	54.7 Å²	54.7	46%	0.463	28%	0.282	S	S	.	.	H	α-helix	trans	-58.9	-46.5	176.6	179.3	-167.2	74	0	0	112	L722 G737 V738 W739 G745	L722-M741 HydrophobicContact CD2-CE 4.38Å; G737-M741 VanDerWaalsContact O-CB 3.31Å; G737-M741 WeakPolarHBondContact O-CB 3.49Å; G737-M741 PolarHBondContact O-N 3.38Å; V738-M741 WeakPolarHBondContact O-CB 3.22Å; V738-M741 PolarHBondContact O-N 2.93Å; W739-M741 VanDerWaalsContact C-N 3.33Å; W739-M741 PolarHBondContact O-N 2.97Å; M741-G745 PolarHBondContact O-N 3.03Å
742	L	94.8	Very high	93.5	Very high	23 Å²	23	60.7 Å²	60.7	12%	0.12	31%	0.308	C	S	.	.	H	α-helix	trans	-62.1	-48	179.7	-67.8	173.1	0	0	0	111.6	L722 V738 W739 R740 G745 E746 L922 L923	L722-L742 HydrophobicContact CD2-CD2 4.01Å; V738-L742 HydrophobicContact CG1-CD1 4.09Å; V738-L742 HydrophobicContact CG1-CG 4.44Å; V738-L742 VanDerWaalsContact O-CG 3.31Å; V738-L742 WeakPolarHBondContact O-CG 3.17Å; V738-L742 PolarHBondContact O-N 2.94Å; W739-L742 PolarHBondContact O-N 3.29Å; R740-L742 PolarHBondContact O-N 3.24Å; L742-G745 PolarHBondContact O-N 3.48Å; L742-E746 PolarHBondContact O-N 3.21Å; L742-E746 VanDerWaalsContact O-N 3.08Å; L742-L922 HydrophobicContact CD1-CB 3.98Å; L742-L923 HydrophobicContact CD1-CB 4.28Å; L742-L923 HydrophobicContact CD2-CB 4.4Å; L742-L923 HydrophobicContact CD2-CD1 3.77Å
743	I	96.2	Very high	93.8	Very high	1 Å²	1	64 Å²	64	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-67	-47.1	-178.4	-67.3	157.3	0	0	0	111.1	W739 R740 G745 E746 L747 L835 W842 C843 A846 L922	W739-I743 HydrophobicContact CB-CD1 4.46Å; W739-I743 WeakPolarHBondContact O-CB 3.38Å; W739-I743 VanDerWaalsContact O-CD1 3.27Å; W739-I743 WeakPolarHBondContact O-CD1 3.03Å; W739-I743 VanDerWaalsContact O-CG1 3.26Å; W739-I743 WeakPolarHBondContact O-CG1 3.46Å; W739-I743 PolarHBondContact O-N 3.28Å; R740-I743 PolarHBondContact O-N 3.16Å; I743-G745 VanDerWaalsContact C-N 3.29Å; I743-G745 PolarHBondContact O-N 2.76Å; I743-E746 PolarHBondContact O-N 2.77Å; I743-L747 HydrophobicContact CG2-CD1 4.21Å; I743-L747 WeakPolarHBondContact O-CB 3.41Å; I743-L747 PolarHBondContact O-N 3.48Å; I743-L835 HydrophobicContact CD1-CD1 3.77Å; I743-W842 HydrophobicContact CG2-CB 4.24Å; I743-C843 HydrophobicContact CD1-CB 3.58Å; I743-C843 WeakPolarHBondContact CD1-SG 3.47Å; I743-C843 HydrophobicContact CG1-CB 4.48Å; I743-A846 HydrophobicContact CG2-CB 3.94Å; I743-L922 HydrophobicContact CD1-CD2 4.5Å; I743-L922 HydrophobicContact CG1-CD2 4.33Å
744	H	95.4	Very high	94	Very high	42 Å²	42	62 Å²	62	19%	0.194	32%	0.315	C	S	.	.	H	α-helix	trans	-67.5	-33.4	179.3	-76.9	-131.3	0	0	0	111.3	R740 L747 H748 M751 D839	R740-H744 VanDerWaalsContact O-CB 3.23Å; R740-H744 WeakPolarHBondContact O-CB 3.41Å; R740-H744 PolarHBondContact O-CD2 2.94Å; R740-H744 PolarHBondContact O-N 3.31Å; H744-L747 CarbonylContact O-C 3.18Å; H744-L747 PolarHBondContact O-N 3.33Å; H744-H748 VanDerWaalsContact O-CA 3.25Å; H744-H748 WeakPolarHBondContact O-CA 3.46Å; H744-H748 WeakPolarHBondContact O-CB 3.35Å; H744-H748 PolarHBondContact O-N 2.95Å; H744-M751 HydrophobicContact CB-SD 4.33Å; H744-M751 WeakPolarHBondContact CE1-CE 3.17Å; H744-M751 WeakPolarHBondContact ND1-CE 3.2Å; H744-D839 IonicContact CD2-OD1 3.21Å; H744-D839 IonicContact CE1-OD1 2.7Å; H744-D839 PolarHBondContact CE1-OD1 3.27Å; H744-D839 VanDerWaalsContact CE1-OD1 3.26Å; H744-D839 IonicContact NE2-OD1 2.56Å; H744-D839 PolarHBondContact NE2-OD1 3.42Å
745	G	92.7	Very high	93.7	Very high	56 Å²	56	60.4 Å²	60.4	58%	0.577	32%	0.315	S	S	*	.	H	α-helix	trans	-60.6	-47.9	172.2	0	0	0	0	0	111.9	M741 L742 I743 L747	M741-G745 PolarHBondContact O-N 3.03Å; L742-G745 PolarHBondContact O-N 3.48Å; I743-G745 VanDerWaalsContact C-N 3.29Å; I743-G745 PolarHBondContact O-N 2.76Å; G745-L747 VanDerWaalsContact C-N 3.35Å; G745-L747 PolarHBondContact O-N 3.3Å
746	E	93.6	Very high	93.3	Very high	101 Å²	101	65.2 Å²	65.2	47%	0.472	35%	0.348	S	S	.	.	H	α-helix	trans	-67	-34.9	178.6	-166.6	62.2	-155.6	0	0	112.6	L742 I743 R850 F851	L742-E746 PolarHBondContact O-N 3.21Å; L742-E746 VanDerWaalsContact O-N 3.08Å; I743-E746 PolarHBondContact O-N 2.77Å; E746-R850 HydrophobicContact CG-CB 3.88Å; E746-R850 HydrophobicContact CG-CG 4.12Å; E746-F851 HydrophobicContact CB-CZ 4.44Å; E746-F851 HydrophobicContact CG-CE1 3.88Å; E746-F851 HydrophobicContact CG-CZ 4.24Å
747	L	95.5	Very high	92.9	Very high	1 Å²	1	67 Å²	67	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-99.4	5.9	-176.6	-65.1	-176.1	0	0	0	115.1	I743 H744 G745 Q749 L750 M751 W842 I845 A846 R850	I743-L747 HydrophobicContact CG2-CD1 4.21Å; I743-L747 WeakPolarHBondContact O-CB 3.41Å; I743-L747 PolarHBondContact O-N 3.48Å; H744-L747 CarbonylContact O-C 3.18Å; H744-L747 PolarHBondContact O-N 3.33Å; G745-L747 VanDerWaalsContact C-N 3.35Å; G745-L747 PolarHBondContact O-N 3.3Å; L747-Q749 VanDerWaalsContact C-N 3.3Å; L747-Q749 PolarHBondContact O-N 2.77Å; L747-Q749 VanDerWaalsContact O-N 3.13Å; L747-L750 HydrophobicContact CD2-CD2 4.12Å; L747-L750 PolarHBondContact O-N 3Å; L747-M751 HydrophobicContact CB-CG 4.04Å; L747-M751 HydrophobicContact CB-SD 4.07Å; L747-M751 WeakPolarHBondContact O-CG 3.44Å; L747-M751 PolarHBondContact O-N 3.15Å; L747-W842 HydrophobicContact CD1-CB 4.16Å; L747-W842 HydrophobicContact CD1-CE3 4.01Å; L747-W842 WeakPolarHBondContact CD1-O 3.49Å; L747-I845 HydrophobicContact CD1-CB 4.19Å; L747-I845 HydrophobicContact CD1-CG2 4.04Å; L747-I845 HydrophobicContact CD2-CG2 4.19Å; L747-A846 HydrophobicContact CD1-CB 3.76Å; L747-A846 HydrophobicContact CD2-CB 4.36Å; L747-A846 HydrophobicContact CG-CB 3.95Å; L747-R850 HydrophobicContact CD2-CG 3.56Å
748	H	93	Very high	92.9	Very high	104 Å²	104	66.8 Å²	66.8	48%	0.481	35%	0.345	S	S	.	.	H	α-helix	trans	-50.3	-47.4	-170.9	177.2	-99.7	0	0	0	113.2	H744 Q752	H744-H748 VanDerWaalsContact O-CA 3.25Å; H744-H748 WeakPolarHBondContact O-CA 3.46Å; H744-H748 WeakPolarHBondContact O-CB 3.35Å; H744-H748 PolarHBondContact O-N 2.95Å; H748-Q752 PolarHBondContact CE1-NE2 2.98Å; H748-Q752 PolarHBondContact NE2-NE2 3.02Å; H748-Q752 VanDerWaalsContact NE2-NE2 3.11Å; H748-Q752 WeakPolarHBondContact O-CG 3.45Å; H748-Q752 PolarHBondContact O-N 3.03Å; H748-Q752 VanDerWaalsContact O-N 3.11Å
749	Q	93.6	Very high	92.9	Very high	152 Å²	152	66.7 Å²	66.7	71%	0.71	34%	0.344	S	S	*	.	H	α-helix	trans	-65.1	-42.6	178.9	-64.3	-179.8	7.4	0	0	112.3	L747 Q752 I753	L747-Q749 VanDerWaalsContact C-N 3.3Å; L747-Q749 PolarHBondContact O-N 2.77Å; L747-Q749 VanDerWaalsContact O-N 3.13Å; Q749-Q752 PolarHBondContact O-N 2.7Å; Q749-I753 WeakPolarHBondContact O-CD1 3.24Å; Q749-I753 VanDerWaalsContact O-CG1 3.27Å; Q749-I753 WeakPolarHBondContact O-CG1 3.37Å; Q749-I753 PolarHBondContact O-N 2.95Å; Q749-I753 VanDerWaalsContact O-N 3.12Å
750	L	93.5	Very high	92.5	Very high	25 Å²	25	69.9 Å²	69.9	13%	0.131	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-43.6	-179.6	-178.4	64.5	0	0	0	111.1	L747 Q752 I753 K754 W842 I845	L747-L750 HydrophobicContact CD2-CD2 4.12Å; L747-L750 PolarHBondContact O-N 3Å; L750-Q752 VanDerWaalsContact C-N 3.33Å; L750-Q752 PolarHBondContact O-N 3.44Å; L750-I753 PolarHBondContact O-N 2.84Å; L750-K754 HydrophobicContact CD1-CG 4.18Å; L750-K754 HydrophobicContact CG-CG 4.44Å; L750-K754 WeakPolarHBondContact O-CG 3.34Å; L750-K754 PolarHBondContact O-N 3.19Å; L750-W842 HydrophobicContact CD2-CZ3 4.3Å; L750-W842 HydrophobicContact CG-CZ3 4.4Å; L750-I845 HydrophobicContact CD2-CG2 3.88Å
751	M	93.2	Very high	92	Very high	36 Å²	36	66.9 Å²	66.9	18%	0.177	36%	0.361	C	S	.	.	H	α-helix	trans	-63.8	-38.4	178.9	-65.9	177.7	75.7	0	0	111.7	H744 L747 G755 W842	H744-M751 HydrophobicContact CB-SD 4.33Å; H744-M751 WeakPolarHBondContact CE1-CE 3.17Å; H744-M751 WeakPolarHBondContact ND1-CE 3.2Å; L747-M751 HydrophobicContact CB-CG 4.04Å; L747-M751 HydrophobicContact CB-SD 4.07Å; L747-M751 WeakPolarHBondContact O-CG 3.44Å; L747-M751 PolarHBondContact O-N 3.15Å; M751-G755 PolarHBondContact O-N 2.86Å; M751-W842 HydrophobicContact CE-CD2 4.1Å; M751-W842 HydrophobicContact CE-CG 4.04Å; M751-W842 HydrophobicContact CG-CD2 3.95Å; M751-W842 HydrophobicContact CG-CE3 3.88Å; M751-W842 HydrophobicContact CG-CH2 3.99Å; M751-W842 HydrophobicContact CG-CZ2 4.08Å; M751-W842 HydrophobicContact CG-CZ3 3.9Å; M751-W842 HydrophobicContact SD-CD2 4.29Å; M751-W842 HydrophobicContact SD-CG 4.4Å
752	Q	92	Very high	91.7	Very high	137 Å²	137	62.7 Å²	62.7	64%	0.64	34%	0.34	S	S	*	.	H	α-helix	trans	-64	-42.3	173.7	-75.4	-171.4	-7.4	0	0	112.6	H748 Q749 L750	H748-Q752 PolarHBondContact CE1-NE2 2.98Å; H748-Q752 PolarHBondContact NE2-NE2 3.02Å; H748-Q752 VanDerWaalsContact NE2-NE2 3.11Å; H748-Q752 WeakPolarHBondContact O-CG 3.45Å; H748-Q752 PolarHBondContact O-N 3.03Å; H748-Q752 VanDerWaalsContact O-N 3.11Å; Q749-Q752 PolarHBondContact O-N 2.7Å; L750-Q752 VanDerWaalsContact C-N 3.33Å; L750-Q752 PolarHBondContact O-N 3.44Å
753	I	93.9	Very high	91.2	Very high	136 Å²	136	63.5 Å²	63.5	70%	0.697	34%	0.344	S	S	*	.	H	α-helix	trans	-65.8	-41.6	179.4	-68.3	163.7	0	0	0	111.2	Q749 L750	Q749-I753 WeakPolarHBondContact O-CD1 3.24Å; Q749-I753 VanDerWaalsContact O-CG1 3.27Å; Q749-I753 WeakPolarHBondContact O-CG1 3.37Å; Q749-I753 PolarHBondContact O-N 2.95Å; Q749-I753 VanDerWaalsContact O-N 3.12Å; L750-I753 PolarHBondContact O-N 2.84Å
754	K	92	Very high	90.4	Very high	87 Å²	87	70.1 Å²	70.1	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-79.8	-28.5	-177	-66.5	-61.6	-171.9	173.9	0	113.3	L750 Y758 W842	L750-K754 HydrophobicContact CD1-CG 4.18Å; L750-K754 HydrophobicContact CG-CG 4.44Å; L750-K754 WeakPolarHBondContact O-CG 3.34Å; L750-K754 PolarHBondContact O-N 3.19Å; K754-Y758 HydrophobicContact CB-CD1 3.8Å; K754-Y758 HydrophobicContact CB-CD2 4.15Å; K754-Y758 HydrophobicContact CB-CE1 4.32Å; K754-Y758 HydrophobicContact CB-CG 3.69Å; K754-Y758 HydrophobicContact CD-CD1 4.31Å; K754-Y758 HydrophobicContact CD-CD2 4.1Å; K754-Y758 HydrophobicContact CD-CE1 4.01Å; K754-Y758 HydrophobicContact CD-CE2 3.85Å; K754-Y758 HydrophobicContact CD-CG 4.34Å; K754-Y758 HydrophobicContact CG-CD1 4.01Å; K754-Y758 HydrophobicContact CG-CE1 4.02Å; K754-Y758 HydrophobicContact CG-CG 4.25Å; K754-W842 HydrophobicContact CB-CH2 4.15Å; K754-W842 HydrophobicContact CG-CH2 4.43Å
755	G	85.7	Confident	89.6	Confident	22 Å²	22	72.3 Å²	72.3	23%	0.227	39%	0.385	C	S	.	.			trans	79.9	169.5	180	0	0	0	0	0	114.1	M751 L757 Y758	M751-G755 PolarHBondContact O-N 2.86Å; G755-L757 PolarHBondContact O-N 3.45Å; G755-Y758 WeakPolarHBondContact O-CB 3.43Å; G755-Y758 PolarHBondContact O-N 3.11Å
756	P	85.1	Confident	88.6	Confident	112 Å²	112	70 Å²	70	73%	0.727	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-16.3	-168.6	29.6	-36.3	0	0	0	115
757	L	88.1	Confident	87.1	Confident	130 Å²	130	69.2 Å²	69.2	68%	0.681	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	3.5	179.9	-63.9	176.8	0	0	0	113	G755 Y759 N760 G761	G755-L757 PolarHBondContact O-N 3.45Å; L757-Y759 PolarHBondContact O-N 2.99Å; L757-N760 PolarHBondContact O-N 2.78Å; L757-G761 PolarHBondContact O-N 3.12Å
758	Y	93	Very high	85.5	Confident	42 Å²	42	77.4 Å²	77.4	17%	0.165	40%	0.404	C	S	.	.	H	α-helix	trans	-59.8	-48	-170.1	-177.3	-122.5	0	0	0	113.2	K754 G755 N760 G761 L762 H814 F841 W842	K754-Y758 HydrophobicContact CB-CD1 3.8Å; K754-Y758 HydrophobicContact CB-CD2 4.15Å; K754-Y758 HydrophobicContact CB-CE1 4.32Å; K754-Y758 HydrophobicContact CB-CG 3.69Å; K754-Y758 HydrophobicContact CD-CD1 4.31Å; K754-Y758 HydrophobicContact CD-CD2 4.1Å; K754-Y758 HydrophobicContact CD-CE1 4.01Å; K754-Y758 HydrophobicContact CD-CE2 3.85Å; K754-Y758 HydrophobicContact CD-CG 4.34Å; K754-Y758 HydrophobicContact CG-CD1 4.01Å; K754-Y758 HydrophobicContact CG-CE1 4.02Å; K754-Y758 HydrophobicContact CG-CG 4.25Å; G755-Y758 WeakPolarHBondContact O-CB 3.43Å; G755-Y758 PolarHBondContact O-N 3.11Å; Y758-N760 PolarHBondContact O-N 3.43Å; Y758-G761 PolarHBondContact O-N 3.2Å; Y758-L762 HydrophobicContact CD1-CD1 4.1Å; Y758-L762 HydrophobicContact CE1-CD1 3.68Å; Y758-L762 HydrophobicContact CE1-CG 4.48Å; Y758-L762 HydrophobicContact CE2-CD1 4.21Å; Y758-L762 HydrophobicContact CE2-CD2 4.1Å; Y758-L762 HydrophobicContact CE2-CG 4.14Å; Y758-L762 WeakPolarHBondContact O-CG 3.45Å; Y758-L762 PolarHBondContact O-N 3.01Å; Y758-L762 VanDerWaalsContact O-N 3.09Å; Y758-H814 AromaticContact CE1-CE1 3.95Å; Y758-H814 AromaticContact CE1-ND1 3.37Å; Y758-H814 WeakPolarHBondContact CE1-ND1 3.35Å; Y758-H814 AromaticContact CZ-ND1 3.52Å; Y758-H814 PolarHBondContact OH-ND1 3.26Å; Y758-F841 HydrophobicContact CD1-CE1 4.22Å; Y758-F841 HydrophobicContact CD1-CZ 4.37Å; Y758-F841 HydrophobicContact CE1-CE1 4.37Å; Y758-F841 HydrophobicContact CE1-CZ 4.12Å; Y758-W842 AromaticContact CD1-CH2 3.75Å; Y758-W842 HydrophobicContact CD1-CH2 3.75Å; Y758-W842 HydrophobicContact CD1-CZ2 4.16Å; Y758-W842 HydrophobicContact CE1-CH2 4.4Å
759	Y	92.4	Very high	84	Confident	1 Å²	1	74.2 Å²	74.2	0%	0.004	39%	0.39	C	S	.	.	H	α-helix	trans	-60.4	-45.3	-179.9	173.4	-108.1	0	0	0	112.4	L757 L762 L763 A810 K837 E838 F841	L757-Y759 PolarHBondContact O-N 2.99Å; Y759-L762 PolarHBondContact O-N 3.4Å; Y759-L763 HydrophobicContact CD1-CD1 4.35Å; Y759-L763 HydrophobicContact CE1-CD1 3.71Å; Y759-L763 HydrophobicContact CE1-CG 4.5Å; Y759-L763 HydrophobicContact CE2-CD1 4.49Å; Y759-L763 PolarHBondContact O-N 2.95Å; Y759-A810 HydrophobicContact CD2-CB 3.77Å; Y759-A810 HydrophobicContact CE2-CB 3.55Å; Y759-K837 HydrophobicContact CE1-CD 4.17Å; Y759-K837 HydrophobicContact CE1-CG 4.08Å; Y759-E838 HydrophobicContact CD1-CB 4Å; Y759-E838 HydrophobicContact CD1-CG 4.12Å; Y759-E838 HydrophobicContact CE1-CB 4.4Å; Y759-E838 HydrophobicContact CG-CB 4.37Å; Y759-E838 HydrophobicContact CG-CG 4.1Å; Y759-F841 HydrophobicContact CD2-CB 3.72Å; Y759-F841 AromaticContact CD2-CD1 3.66Å; Y759-F841 HydrophobicContact CD2-CD1 3.66Å; Y759-F841 AromaticContact CD2-CD2 3.9Å; Y759-F841 HydrophobicContact CD2-CD2 3.9Å; Y759-F841 HydrophobicContact CD2-CE1 4.19Å; Y759-F841 HydrophobicContact CD2-CE2 4.41Å; Y759-F841 AromaticContact CD2-CG 3.48Å; Y759-F841 HydrophobicContact CD2-CG 3.48Å; Y759-F841 VanDerWaalsContact CD2-CG 3.48Å; Y759-F841 HydrophobicContact CE2-CB 3.71Å; Y759-F841 HydrophobicContact CE2-CD1 4.49Å; Y759-F841 HydrophobicContact CE2-CD2 4.15Å; Y759-F841 AromaticContact CE2-CG 3.88Å; Y759-F841 HydrophobicContact CE2-CG 3.88Å; Y759-F841 HydrophobicContact CG-CD1 4.3Å; Y759-F841 HydrophobicContact CG-CG 4.48Å
760	N	88.5	Confident	82.6	Confident	68 Å²	68	72.6 Å²	72.6	36%	0.364	39%	0.391	S	S	.	.	H	α-helix	trans	-65.9	-39.8	178.8	-66.4	-31.4	0	0	0	111.6	L757 Y758 L762 L763 E764	L757-N760 PolarHBondContact O-N 2.78Å; Y758-N760 PolarHBondContact O-N 3.43Å; N760-L762 VanDerWaalsContact C-N 3.28Å; N760-L762 PolarHBondContact O-N 3.09Å; N760-L763 PolarHBondContact O-N 3.25Å; N760-L763 VanDerWaalsContact O-N 3.13Å; N760-E764 PolarHBondContact O-N 2.8Å; N760-E764 VanDerWaalsContact O-N 3.14Å
761	G	86	Confident	81	Confident	34 Å²	34	75.5 Å²	75.5	35%	0.351	41%	0.406	S	S	.	.	H	α-helix	trans	-59.7	-37.7	175.4	0	0	0	0	0	112.9	L757 Y758 L763 E764 E765	L757-G761 PolarHBondContact O-N 3.12Å; Y758-G761 PolarHBondContact O-N 3.2Å; G761-L763 PolarHBondContact O-N 3.48Å; G761-E764 PolarHBondContact O-N 3.36Å; G761-E765 WeakPolarHBondContact O-CB 3.31Å; G761-E765 PolarHBondContact O-N 3.28Å
762	L	88.4	Confident	79.4	Confident	7 Å²	7	73.9 Å²	73.9	4%	0.037	40%	0.398	C	S	.	.	H	α-helix	trans	-65.8	-36.2	175.4	-66.8	170.6	0	0	0	112.8	Y758 Y759 N760 E765 F766 A810 I813 H814 F841	Y758-L762 HydrophobicContact CD1-CD1 4.1Å; Y758-L762 HydrophobicContact CE1-CD1 3.68Å; Y758-L762 HydrophobicContact CE1-CG 4.48Å; Y758-L762 HydrophobicContact CE2-CD1 4.21Å; Y758-L762 HydrophobicContact CE2-CD2 4.1Å; Y758-L762 HydrophobicContact CE2-CG 4.14Å; Y758-L762 WeakPolarHBondContact O-CG 3.45Å; Y758-L762 PolarHBondContact O-N 3.01Å; Y758-L762 VanDerWaalsContact O-N 3.09Å; Y759-L762 PolarHBondContact O-N 3.4Å; N760-L762 VanDerWaalsContact C-N 3.28Å; N760-L762 PolarHBondContact O-N 3.09Å; L762-E765 PolarHBondContact O-N 3.24Å; L762-F766 PolarHBondContact O-N 3.36Å; L762-F766 VanDerWaalsContact O-N 3.09Å; L762-A810 HydrophobicContact CB-CB 4.1Å; L762-A810 HydrophobicContact CD1-CB 4.35Å; L762-I813 HydrophobicContact CD2-CB 4.07Å; L762-I813 HydrophobicContact CD2-CG2 3.63Å; L762-I813 WeakPolarHBondContact O-CD1 3.23Å; L762-H814 HydrophobicContact CD1-CB 4.11Å; L762-F841 HydrophobicContact CD1-CE1 4.4Å; L762-F841 HydrophobicContact CD1-CE2 3.97Å; L762-F841 HydrophobicContact CD1-CZ 3.5Å
763	L	84	Confident	78.1	Confident	39 Å²	39	69.9 Å²	69.9	20%	0.204	39%	0.389	C	S	.	.	H	α-helix	trans	-68	-39.3	177.4	-66.9	178.6	0	0	0	112	Y759 N760 G761 F766 E806 A810	Y759-L763 HydrophobicContact CD1-CD1 4.35Å; Y759-L763 HydrophobicContact CE1-CD1 3.71Å; Y759-L763 HydrophobicContact CE1-CG 4.5Å; Y759-L763 HydrophobicContact CE2-CD1 4.49Å; Y759-L763 PolarHBondContact O-N 2.95Å; N760-L763 PolarHBondContact O-N 3.25Å; N760-L763 VanDerWaalsContact O-N 3.13Å; G761-L763 PolarHBondContact O-N 3.48Å; L763-F766 PolarHBondContact O-N 3.41Å; L763-E806 HydrophobicContact CD1-CB 4.31Å; L763-E806 HydrophobicContact CD1-CG 4.44Å; L763-E806 HydrophobicContact CD2-CB 3.82Å; L763-E806 HydrophobicContact CD2-CG 4.25Å; L763-E806 VanDerWaalsContact CD2-O 3.25Å; L763-E806 WeakPolarHBondContact CD2-O 3.48Å; L763-A810 HydrophobicContact CD2-CB 4.02Å
764	E	79.8	Confident	76.9	Confident	141 Å²	141	69.3 Å²	69.3	66%	0.659	38%	0.383	S	S	*	.	H	α-helix	trans	-63.8	-46.1	174.7	-69.2	174.2	-176.1	0	0	110.6	N760 G761 F766 S767	N760-E764 PolarHBondContact O-N 2.8Å; N760-E764 VanDerWaalsContact O-N 3.14Å; G761-E764 PolarHBondContact O-N 3.36Å; E764-F766 VanDerWaalsContact C-N 3.25Å; E764-F766 PolarHBondContact O-N 3.4Å; E764-S767 PolarHBondContact O-N 3.02Å; E764-S767 PolarHBondContact O-OG 3.37Å
765	E	78	Confident	76.1	Confident	87 Å²	87	66.9 Å²	66.9	41%	0.407	37%	0.373	S	S	.	.	H	α-helix	trans	-60.2	-32.6	177.7	-164	-169.1	143.5	0	0	112.7	G761 L762 S767 E768 N769 I813	G761-E765 WeakPolarHBondContact O-CB 3.31Å; G761-E765 PolarHBondContact O-N 3.28Å; L762-E765 PolarHBondContact O-N 3.24Å; E765-S767 PolarHBondContact O-N 2.72Å; E765-E768 PolarHBondContact O-N 3.09Å; E765-E768 VanDerWaalsContact O-N 3.07Å; E765-N769 HydrophobicContact CG-CB 4.4Å; E765-N769 VanDerWaalsContact O-CB 3.28Å; E765-N769 WeakPolarHBondContact O-CB 3.37Å; E765-N769 PolarHBondContact O-N 3.07Å; E765-N769 PolarHBondContact OE1-ND2 3.47Å; E765-I813 HydrophobicContact CB-CD1 4.37Å; E765-I813 WeakPolarHBondContact OE1-CG2 3.35Å
766	F	71.3	Confident	75.7	Confident	7 Å²	7	70.1 Å²	70.1	3%	0.031	38%	0.379	C	S	.	.	H	α-helix	trans	-61.2	-27.5	-178.2	-168.5	-85.7	0	0	0	114.2	L762 L763 E764 E768 A772 R776 Q809 I813	L762-F766 PolarHBondContact O-N 3.36Å; L762-F766 VanDerWaalsContact O-N 3.09Å; L763-F766 PolarHBondContact O-N 3.41Å; E764-F766 VanDerWaalsContact C-N 3.25Å; E764-F766 PolarHBondContact O-N 3.4Å; F766-E768 VanDerWaalsContact C-N 3.32Å; F766-A772 HydrophobicContact CD1-CB 4.3Å; F766-A772 HydrophobicContact CD2-CB 3.29Å; F766-A772 HydrophobicContact CE1-CB 4.26Å; F766-A772 HydrophobicContact CE2-CB 3.23Å; F766-A772 HydrophobicContact CG-CB 3.82Å; F766-A772 HydrophobicContact CZ-CB 3.73Å; F766-A772 WeakPolarHBondContact CZ-O 3.28Å; F766-R776 HydrophobicContact CE1-CG 4.4Å; F766-R776 HydrophobicContact CZ-CB 4.15Å; F766-R776 HydrophobicContact CZ-CG 4.46Å; F766-R776 PolarHBondContact O-NH2 3.48Å; F766-Q809 HydrophobicContact CD1-CB 4.27Å; F766-Q809 HydrophobicContact CD1-CG 4.12Å; F766-Q809 HydrophobicContact CD2-CB 3.5Å; F766-Q809 HydrophobicContact CD2-CG 3.92Å; F766-Q809 HydrophobicContact CE1-CB 4.31Å; F766-Q809 HydrophobicContact CE1-CG 3.72Å; F766-Q809 HydrophobicContact CE2-CB 3.55Å; F766-Q809 HydrophobicContact CE2-CG 3.5Å; F766-Q809 VanDerWaalsContact CE2-CG 3.5Å; F766-Q809 HydrophobicContact CG-CB 3.93Å; F766-Q809 HydrophobicContact CG-CG 4.25Å; F766-Q809 HydrophobicContact CZ-CB 4Å; F766-Q809 HydrophobicContact CZ-CG 3.42Å; F766-Q809 VanDerWaalsContact CZ-CG 3.42Å; F766-I813 VanDerWaalsContact CA-CD1 3.4Å; F766-I813 HydrophobicContact CB-CD1 3.5Å; F766-I813 HydrophobicContact CD2-CD1 3.6Å; F766-I813 HydrophobicContact CD2-CG1 4.05Å; F766-I813 HydrophobicContact CG-CD1 4.01Å
767	S	62.8	Low	75	Confident	86 Å²	86	70 Å²	70	60%	0.601	36%	0.364	S	S	*	.	H	α-helix	trans	-68.2	-32.6	177.2	66.1	0	0	0	0	112.5	E764 E765	E764-S767 PolarHBondContact O-N 3.02Å; E764-S767 PolarHBondContact O-OG 3.37Å; E765-S767 PolarHBondContact O-N 2.72Å
768	E	61.9	Low	74.4	Confident	172 Å²	172	67.6 Å²	67.6	80%	0.804	35%	0.349	S	S	*	.	H	α-helix	trans	-101.7	-19.4	-174.9	-59.3	-173.1	167.3	0	0	113.5	E765 F766 T770	E765-E768 PolarHBondContact O-N 3.09Å; E765-E768 VanDerWaalsContact O-N 3.07Å; F766-E768 VanDerWaalsContact C-N 3.32Å; E768-T770 PolarHBondContact O-N 3.47Å
769	N	61.8	Low	74	Confident	37 Å²	37	65.6 Å²	65.6	20%	0.198	34%	0.341	C	S	.	.			trans	-79.6	121.6	-170.4	-168.4	-34.2	0	0	0	113.1	E765 L771 A772 A773	E765-N769 HydrophobicContact CG-CB 4.4Å; E765-N769 VanDerWaalsContact O-CB 3.28Å; E765-N769 WeakPolarHBondContact O-CB 3.37Å; E765-N769 PolarHBondContact O-N 3.07Å; E765-N769 PolarHBondContact OE1-ND2 3.47Å; N769-L771 VanDerWaalsContact C-N 3.32Å; N769-L771 PolarHBondContact O-N 3.37Å; N769-L771 WeakPolarHBondContact OD1-CB 3.45Å; N769-L771 PolarHBondContact OD1-N 3.36Å; N769-A772 HydrophobicContact CB-CB 4.01Å; N769-A772 WeakPolarHBondContact O-CB 3.46Å; N769-A772 PolarHBondContact O-N 3.36Å; N769-A773 PolarHBondContact O-N 3.23Å
770	T	63.1	Low	73.5	Confident	119 Å²	119	66.5 Å²	66.5	73%	0.73	35%	0.347	S	S	*	.	H	α-helix	trans	-66.2	-29.7	-179.8	-36.9	0	0	0	0	113.3	E768 A773	E768-T770 PolarHBondContact O-N 3.47Å; T770-A773 WeakPolarHBondContact O-CB 3.43Å; T770-A773 PolarHBondContact O-N 3.14Å
771	L	59.3	Low	73	Confident	85 Å²	85	68.1 Å²	68.1	45%	0.445	36%	0.356	S	S	.	.	H	α-helix	trans	-70.8	-38.5	176.3	-67.4	170.9	0	0	0	111.1	N769 A773 Q774	N769-L771 VanDerWaalsContact C-N 3.32Å; N769-L771 PolarHBondContact O-N 3.37Å; N769-L771 WeakPolarHBondContact OD1-CB 3.45Å; N769-L771 PolarHBondContact OD1-N 3.36Å; L771-A773 PolarHBondContact O-N 2.71Å; L771-Q774 VanDerWaalsContact O-CB 3.3Å; L771-Q774 WeakPolarHBondContact O-CB 3.34Å; L771-Q774 PolarHBondContact O-N 2.66Å
772	A	61.1	Low	73.1	Confident	2 Å²	2	66.9 Å²	66.9	2%	0.017	34%	0.341	C	S	.	.	H	α-helix	trans	-57.6	-35.2	174.7	0	0	0	0	0	112.4	F766 N769 Q774 H775 R776 I813	F766-A772 HydrophobicContact CD1-CB 4.3Å; F766-A772 HydrophobicContact CD2-CB 3.29Å; F766-A772 HydrophobicContact CE1-CB 4.26Å; F766-A772 HydrophobicContact CE2-CB 3.23Å; F766-A772 HydrophobicContact CG-CB 3.82Å; F766-A772 HydrophobicContact CZ-CB 3.73Å; F766-A772 WeakPolarHBondContact CZ-O 3.28Å; N769-A772 HydrophobicContact CB-CB 4.01Å; N769-A772 WeakPolarHBondContact O-CB 3.46Å; N769-A772 PolarHBondContact O-N 3.36Å; A772-Q774 PolarHBondContact O-N 3.05Å; A772-H775 PolarHBondContact O-N 3.08Å; A772-R776 PolarHBondContact O-N 3.41Å; A772-I813 HydrophobicContact CB-CD1 4.31Å; A772-I813 HydrophobicContact CB-CG1 4.32Å
773	A	65	Low	73.2	Confident	54 Å²	54	67 Å²	67	45%	0.446	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-28.4	175.8	0	0	0	0	0	113.2	N769 T770 L771	N769-A773 PolarHBondContact O-N 3.23Å; T770-A773 WeakPolarHBondContact O-CB 3.43Å; T770-A773 PolarHBondContact O-N 3.14Å; L771-A773 PolarHBondContact O-N 2.71Å
774	Q	68.6	Low	73.3	Confident	124 Å²	124	69.2 Å²	69.2	58%	0.579	35%	0.353	S	S	*	.	H	α-helix	trans	-68.2	-40.5	178.8	-57.7	-177.3	-2.5	0	0	111.8	L771 A772	L771-Q774 VanDerWaalsContact O-CB 3.3Å; L771-Q774 WeakPolarHBondContact O-CB 3.34Å; L771-Q774 PolarHBondContact O-N 2.66Å; A772-Q774 PolarHBondContact O-N 3.05Å
775	H	75.2	Confident	73.7	Confident	36 Å²	36	67 Å²	67	17%	0.167	34%	0.339	C	S	.	.	H	α-helix	trans	-87.9	-21.3	-178.3	-61.4	-62.3	0	0	0	113.3	A772 R777 Q778 I779	A772-H775 PolarHBondContact O-N 3.08Å; H775-R777 PolarHBondContact O-N 2.99Å; H775-R777 VanDerWaalsContact O-N 3.15Å; H775-Q778 PolarHBondContact O-N 3.1Å; H775-I779 HydrophobicContact CB-CD1 4.2Å; H775-I779 WeakPolarHBondContact O-CG1 3.25Å; H775-I779 PolarHBondContact O-N 2.95Å
776	R	75.9	Confident	74.3	Confident	90 Å²	90	62.9 Å²	62.9	34%	0.34	32%	0.32	S	S	.	.	H	α-helix	trans	-49	-45	-178.3	-173.1	-180	-68.5	178.7	-2.9	112.6	F766 A772 S780	F766-R776 HydrophobicContact CE1-CG 4.4Å; F766-R776 HydrophobicContact CZ-CB 4.15Å; F766-R776 HydrophobicContact CZ-CG 4.46Å; F766-R776 PolarHBondContact O-NH2 3.48Å; A772-R776 PolarHBondContact O-N 3.41Å; R776-S780 WeakPolarHBondContact O-CB 3.25Å; R776-S780 PolarHBondContact O-N 3.01Å; R776-S780 PolarHBondContact O-OG 3.46Å
777	R	70.7	Confident	75.2	Confident	109 Å²	109	62.6 Å²	62.6	41%	0.411	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-48.1	178.6	-177.6	177.6	178.9	155.1	3.9	111.9	H775 S780 L781 D1122 T1145	H775-R777 PolarHBondContact O-N 2.99Å; H775-R777 VanDerWaalsContact O-N 3.15Å; R777-S780 PolarHBondContact O-N 3.06Å; R777-L781 HydrophobicContact CG-CD1 4.39Å; R777-L781 WeakPolarHBondContact O-CG 3.37Å; R777-L781 PolarHBondContact O-N 3.03Å; R777-L781 VanDerWaalsContact O-N 3.08Å; R777-D1122 IonicContact NH1-OD2 2.73Å; R777-T1145 PolarHBondContact NH1-O 3.34Å; R777-T1145 VanDerWaalsContact NH1-O 3.14Å
778	Q	74.9	Confident	76.4	Confident	80 Å²	80	62 Å²	62	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-69.8	-39	-176	-163.1	164.8	-1	0	0	111.9	H775 L781 D782 Y820	H775-Q778 PolarHBondContact O-N 3.1Å; Q778-L781 PolarHBondContact O-N 2.81Å; Q778-D782 PolarHBondContact O-N 2.8Å; Q778-Y820 HydrophobicContact CB-CD1 4.23Å; Q778-Y820 HydrophobicContact CB-CE1 4.39Å; Q778-Y820 HydrophobicContact CG-CD1 4.16Å; Q778-Y820 HydrophobicContact CG-CE1 4Å
779	I	85.6	Confident	77.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.1	-51.4	170.9	-67	169.6	0	0	0	109.5	H775 L781 D782 L783 Q805 L808 Q809 Y820	H775-I779 HydrophobicContact CB-CD1 4.2Å; H775-I779 WeakPolarHBondContact O-CG1 3.25Å; H775-I779 PolarHBondContact O-N 2.95Å; I779-L781 VanDerWaalsContact C-N 3.29Å; I779-L781 PolarHBondContact O-N 3.2Å; I779-D782 PolarHBondContact O-N 2.89Å; I779-L783 HydrophobicContact CG2-CD2 4.2Å; I779-L783 HydrophobicContact CG2-CG 4.42Å; I779-L783 WeakPolarHBondContact O-CG 3.33Å; I779-L783 PolarHBondContact O-N 2.8Å; I779-L783 VanDerWaalsContact O-N 3.12Å; I779-Q805 HydrophobicContact CG2-CG 4.47Å; I779-L808 HydrophobicContact CD1-CB 4.13Å; I779-L808 HydrophobicContact CG1-CB 4.31Å; I779-L808 HydrophobicContact CG2-CB 4.14Å; I779-L808 HydrophobicContact CG2-CD1 4.12Å; I779-Q809 HydrophobicContact CD1-CG 4.09Å; I779-Y820 HydrophobicContact CD1-CD2 4.46Å; I779-Y820 HydrophobicContact CD1-CG 4.26Å; I779-Y820 HydrophobicContact CG1-CD1 3.8Å; I779-Y820 HydrophobicContact CG1-CD2 3.89Å; I779-Y820 HydrophobicContact CG1-CE1 4.19Å; I779-Y820 HydrophobicContact CG1-CE2 4.27Å; I779-Y820 HydrophobicContact CG1-CG 3.64Å
780	S	81.4	Confident	79.1	Confident	19 Å²	19	55.8 Å²	55.8	13%	0.133	29%	0.285	C	S	.	.	H	α-helix	trans	-58.8	-38.1	-177.2	-56	0	0	0	0	113.2	R776 R777 D782	R776-S780 WeakPolarHBondContact O-CB 3.25Å; R776-S780 PolarHBondContact O-N 3.01Å; R776-S780 PolarHBondContact O-OG 3.46Å; R777-S780 PolarHBondContact O-N 3.06Å; S780-D782 VanDerWaalsContact C-N 3.28Å; S780-D782 PolarHBondContact O-N 2.87Å
781	L	79.1	Confident	80.5	Confident	102 Å²	102	52.9 Å²	52.9	53%	0.534	27%	0.267	S	S	.	.	H	α-helix	trans	-67.1	-29.2	175.7	-69.6	172.8	0	0	0	112.9	R777 Q778 I779	R777-L781 HydrophobicContact CG-CD1 4.39Å; R777-L781 WeakPolarHBondContact O-CG 3.37Å; R777-L781 PolarHBondContact O-N 3.03Å; R777-L781 VanDerWaalsContact O-N 3.08Å; Q778-L781 PolarHBondContact O-N 2.81Å; I779-L781 VanDerWaalsContact C-N 3.29Å; I779-L781 PolarHBondContact O-N 3.2Å
782	D	87.9	Confident	82	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.043	26%	0.259	C	S	.	.	H	α-helix	trans	-85.9	-24	-176.7	-74.3	-4.2	0	0	0	113.1	Q778 I779 S780 L784 R785 T786 Y820 N825	Q778-D782 PolarHBondContact O-N 2.8Å; I779-D782 PolarHBondContact O-N 2.89Å; S780-D782 VanDerWaalsContact C-N 3.28Å; S780-D782 PolarHBondContact O-N 2.87Å; D782-L784 PolarHBondContact O-N 2.84Å; D782-R785 VanDerWaalsContact O-CG 3.3Å; D782-R785 WeakPolarHBondContact O-CG 3.49Å; D782-R785 PolarHBondContact O-N 3.13Å; D782-R785 IonicContact OD1-CZ 2.91Å; D782-R785 IonicContact OD1-NE 2.85Å; D782-R785 PolarHBondContact OD1-NE 2.86Å; D782-R785 IonicContact OD1-NH2 3.92Å; D782-R785 PolarHBondContact OD1-NH2 3.04Å; D782-R785 IonicContact OD2-NH2 3.11Å; D782-R785 PolarHBondContact OD2-NH2 2.82Å; D782-T786 PolarHBondContact O-N 2.65Å; D782-T786 PolarHBondContact O-OG1 2.83Å; D782-Y820 WeakPolarHBondContact CB-OH 3.49Å; D782-Y820 WeakPolarHBondContact OD2-CE1 3.27Å; D782-Y820 PolarHBondContact OD2-OH 2.98Å; D782-N825 HydrophobicContact CB-CB 4.35Å
783	L	89.7	Confident	83.6	Confident	10 Å²	10	51.7 Å²	51.7	5%	0.052	26%	0.258	C	S	.	.	H	α-helix	trans	-53.7	-58.3	-176.9	-68.4	179.6	0	0	0	113	I779 R785 T786 V801 L804 Q805	I779-L783 HydrophobicContact CG2-CD2 4.2Å; I779-L783 HydrophobicContact CG2-CG 4.42Å; I779-L783 WeakPolarHBondContact O-CG 3.33Å; I779-L783 PolarHBondContact O-N 2.8Å; I779-L783 VanDerWaalsContact O-N 3.12Å; L783-R785 VanDerWaalsContact C-N 3.29Å; L783-R785 PolarHBondContact O-N 2.89Å; L783-T786 WeakPolarHBondContact O-CB 3.29Å; L783-T786 PolarHBondContact O-N 2.77Å; L783-V801 HydrophobicContact CB-CG1 3.99Å; L783-V801 HydrophobicContact CD1-CG1 4.01Å; L783-V801 HydrophobicContact CG-CG1 4.39Å; L783-L804 HydrophobicContact CD2-CB 4.2Å; L783-L804 HydrophobicContact CD2-CD2 3.93Å; L783-L804 HydrophobicContact CD2-CG 3.86Å; L783-Q805 HydrophobicContact CD1-CB 3.83Å; L783-Q805 HydrophobicContact CD1-CG 4.05Å; L783-Q805 HydrophobicContact CD2-CB 3.94Å
784	L	86.3	Confident	84.7	Confident	86 Å²	86	51.5 Å²	51.5	45%	0.45	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-15.2	-172.8	-64.8	178.7	0	0	0	114.4	D782 I796	D782-L784 PolarHBondContact O-N 2.84Å; L784-I796 HydrophobicContact CD2-CB 3.97Å; L784-I796 HydrophobicContact CD2-CG1 4.45Å
785	R	87.5	Confident	85.5	Confident	95 Å²	95	48.9 Å²	48.9	36%	0.358	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-1.8	174.3	67.5	178.8	-166.8	79.4	4.1	112.9	D782 L783 Q822	D782-R785 VanDerWaalsContact O-CG 3.3Å; D782-R785 WeakPolarHBondContact O-CG 3.49Å; D782-R785 PolarHBondContact O-N 3.13Å; D782-R785 IonicContact OD1-CZ 2.91Å; D782-R785 IonicContact OD1-NE 2.85Å; D782-R785 PolarHBondContact OD1-NE 2.86Å; D782-R785 IonicContact OD1-NH2 3.92Å; D782-R785 PolarHBondContact OD1-NH2 3.04Å; D782-R785 IonicContact OD2-NH2 3.11Å; D782-R785 PolarHBondContact OD2-NH2 2.82Å; L783-R785 VanDerWaalsContact C-N 3.29Å; L783-R785 PolarHBondContact O-N 2.89Å; R785-Q822 VanDerWaalsContact NH2-NE2 3.17Å
786	T	91.5	Very high	85.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.255	C	S	.	.	S	Bend	trans	-91.5	116.7	179.5	-57.4	0	0	0	0	110	D782 L783 F793 L804 N825 F826 A829	D782-T786 PolarHBondContact O-N 2.65Å; D782-T786 PolarHBondContact O-OG1 2.83Å; L783-T786 WeakPolarHBondContact O-CB 3.29Å; L783-T786 PolarHBondContact O-N 2.77Å; T786-F793 VanDerWaalsContact O-CB 3.27Å; T786-F793 WeakPolarHBondContact O-CB 3.21Å; T786-L804 HydrophobicContact CG2-CD2 3.85Å; T786-N825 HydrophobicContact CG2-CB 4.43Å; T786-N825 PolarHBondContact OG1-ND2 2.85Å; T786-F826 HydrophobicContact CG2-CD1 3.97Å; T786-F826 HydrophobicContact CG2-CE1 4.35Å; T786-A829 HydrophobicContact CG2-CB 3.46Å; T786-A829 VanDerWaalsContact CG2-CB 3.46Å
787	M	89.4	Confident	86.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	48.1	49.4	-177.3	-66.6	-178.3	179.2	0	0	114.6	F670 N789 N790 F793 A829 V830 L833 Y906 F911	F670-M787 HydrophobicContact CE1-CG 4.41Å; F670-M787 HydrophobicContact CZ-SD 4.23Å; M787-N789 PolarHBondContact O-N 2.76Å; M787-N790 HydrophobicContact CB-CB 4Å; M787-N790 WeakPolarHBondContact O-CB 3.19Å; M787-N790 PolarHBondContact O-N 3.4Å; M787-F793 HydrophobicContact CB-CB 4.28Å; M787-F793 HydrophobicContact CB-CD2 3.81Å; M787-F793 HydrophobicContact CB-CG 4.28Å; M787-F793 HydrophobicContact SD-CD2 4.02Å; M787-F793 HydrophobicContact SD-CE2 3.82Å; M787-A829 HydrophobicContact CE-CB 4.01Å; M787-A829 HydrophobicContact CG-CB 4.42Å; M787-A829 HydrophobicContact SD-CB 3.9Å; M787-V830 HydrophobicContact CE-CB 4.21Å; M787-V830 HydrophobicContact CE-CG2 3.4Å; M787-V830 VanDerWaalsContact CE-CG2 3.4Å; M787-L833 HydrophobicContact CE-CD1 3.78Å; M787-L833 HydrophobicContact SD-CD1 3.8Å; M787-L833 HydrophobicContact SD-CG 4.26Å; M787-Y906 HydrophobicContact CE-CD2 3.85Å; M787-Y906 HydrophobicContact CE-CE2 3.31Å; M787-Y906 HydrophobicContact CG-CE2 3.73Å; M787-Y906 WeakPolarHBondContact CG-OH 3.46Å; M787-Y906 PolarHBondContact N-OH 2.71Å; M787-Y906 HydrophobicContact SD-CE2 4.35Å; M787-F911 HydrophobicContact CE-CE2 4.45Å
788	P	88.2	Confident	86.9	Confident	74 Å²	74	49.3 Å²	49.3	48%	0.481	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.3	-173.9	28.3	-36.7	0	0	0	113.8	N790 D794	P788-N790 VanDerWaalsContact C-N 3.35Å; P788-D794 WeakPolarHBondContact O-CB 3.36Å
789	N	87.2	Confident	87.6	Confident	79 Å²	79	49.3 Å²	49.3	42%	0.422	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	2.6	175.3	63.6	-26.6	0	0	0	113.6	K671 M787	K671-N789 WeakPolarHBondContact CB-O 3.27Å; K671-N789 WeakPolarHBondContact CG-O 3.47Å; K671-N789 PolarHBondContact N-O 2.76Å; M787-N789 PolarHBondContact O-N 2.76Å
790	N	93.1	Very high	87.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-103.5	134.2	177.2	-171.4	-67.4	0	0	0	110.9	Y668 G669 F670 M787 P788 Q792 F793 D794	Y668-N790 PolarHBondContact O-ND2 3.49Å; G669-N790 CarbonylContact O-C 3.52Å; G669-N790 WeakPolarHBondContact O-CA 3.19Å; F670-N790 HydrophobicContact CD1-CB 3.83Å; F670-N790 HydrophobicContact CE1-CB 3.8Å; F670-N790 HydrophobicContact CZ-CB 4.47Å; M787-N790 HydrophobicContact CB-CB 4Å; M787-N790 WeakPolarHBondContact O-CB 3.19Å; M787-N790 PolarHBondContact O-N 3.4Å; P788-N790 VanDerWaalsContact C-N 3.35Å; N790-Q792 PolarHBondContact O-N 3.25Å; N790-Q792 WeakPolarHBondContact OD1-CB 3.12Å; N790-Q792 PolarHBondContact OD1-N 3.28Å; N790-F793 HydrophobicContact CB-CD2 4.08Å; N790-F793 PolarHBondContact O-N 3.48Å; N790-D794 WeakPolarHBondContact O-CB 3Å; N790-D794 PolarHBondContact O-N 2.84Å
791	V	92.2	Very high	88.4	Confident	57 Å²	57	48.6 Å²	48.6	35%	0.345	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.8	-177.8	-63.2	0	0	0	0	114.6	V665 G669 K671	V665-V791 HydrophobicContact CG1-CG1 3.97Å; V665-V791 HydrophobicContact CG2-CG1 4.1Å; G669-V791 PolarHBondContact O-N 2.78Å; K671-V791 HydrophobicContact CG-CG1 4.18Å
792	Q	91.8	Very high	88.9	Confident	62 Å²	62	49.4 Å²	49.4	29%	0.29	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-18	176.4	-63.3	-166.5	-15.9	0	0	113	N790 A798 G800 V801	N790-Q792 PolarHBondContact O-N 3.25Å; N790-Q792 WeakPolarHBondContact OD1-CB 3.12Å; N790-Q792 PolarHBondContact OD1-N 3.28Å; Q792-A798 VanDerWaalsContact O-CB 3.25Å; Q792-A798 WeakPolarHBondContact O-CB 3.44Å; Q792-G800 CarbonylContact O-C 3.59Å; Q792-G800 WeakPolarHBondContact O-CA 3.4Å; Q792-G800 PolarHBondContact O-N 3.17Å; Q792-V801 PolarHBondContact O-N 3.38Å
793	F	93.7	Very high	89.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131	5.7	-171.5	-51	-79.8	0	0	0	114.2	T786 M787 N790 N795 G800 V801 L804 A829 L832 L833	T786-F793 VanDerWaalsContact O-CB 3.27Å; T786-F793 WeakPolarHBondContact O-CB 3.21Å; M787-F793 HydrophobicContact CB-CB 4.28Å; M787-F793 HydrophobicContact CB-CD2 3.81Å; M787-F793 HydrophobicContact CB-CG 4.28Å; M787-F793 HydrophobicContact SD-CD2 4.02Å; M787-F793 HydrophobicContact SD-CE2 3.82Å; N790-F793 HydrophobicContact CB-CD2 4.08Å; N790-F793 PolarHBondContact O-N 3.48Å; F793-N795 VanDerWaalsContact C-N 3.33Å; F793-N795 PolarHBondContact O-N 3.39Å; F793-G800 VanDerWaalsContact CE1-C 3.48Å; F793-G800 VanDerWaalsContact CE1-O 3.31Å; F793-G800 WeakPolarHBondContact CE1-O 3.27Å; F793-V801 HydrophobicContact CB-CG2 4.43Å; F793-L804 HydrophobicContact CD1-CD2 4.28Å; F793-L804 HydrophobicContact CE1-CB 4.1Å; F793-L804 HydrophobicContact CE1-CD2 4.31Å; F793-A829 HydrophobicContact CE1-CB 4.41Å; F793-A829 HydrophobicContact CE2-CB 4.47Å; F793-A829 HydrophobicContact CZ-CB 4.13Å; F793-L832 HydrophobicContact CE1-CD1 4.47Å; F793-L832 HydrophobicContact CZ-CB 4.2Å; F793-L833 HydrophobicContact CE2-CD2 3.86Å; F793-L833 HydrophobicContact CE2-CG 4.39Å
794	D	88	Confident	89.7	Confident	51 Å²	51	52.7 Å²	52.7	27%	0.273	28%	0.275	S	S	.	.	S	Bend	trans	-73.9	-17.2	-169.3	63.6	0.1	0	0	0	115.2	K671 P788 N790	K671-D794 VanDerWaalsContact CE-OD2 3.22Å; K671-D794 WeakPolarHBondContact CE-OD2 3.24Å; K671-D794 IonicContact NZ-OD2 2.79Å; K671-D794 PolarHBondContact NZ-OD2 3.36Å; P788-D794 WeakPolarHBondContact O-CB 3.36Å; N790-D794 WeakPolarHBondContact O-CB 3Å; N790-D794 PolarHBondContact O-N 2.84Å
795	N	86.5	Confident	90	Very high	69 Å²	69	51.3 Å²	51.3	37%	0.369	27%	0.266	S	S	.	.	S	Bend	trans	-151.9	168.1	179.4	72	73	0	0	0	111.2	F793 D797 A798 V801	F793-N795 VanDerWaalsContact C-N 3.33Å; F793-N795 PolarHBondContact O-N 3.39Å; N795-D797 VanDerWaalsContact C-N 3.28Å; N795-D797 PolarHBondContact O-N 2.92Å; N795-D797 WeakPolarHBondContact OD1-CA 3.31Å; N795-D797 WeakPolarHBondContact OD1-CB 3.38Å; N795-D797 PolarHBondContact OD1-N 2.83Å; N795-A798 WeakPolarHBondContact O-CB 3.49Å; N795-A798 PolarHBondContact O-N 2.76Å; N795-A798 VanDerWaalsContact O-N 3.11Å; N795-A798 PolarHBondContact OD1-N 2.9Å; N795-V801 VanDerWaalsContact O-CG2 3.25Å; N795-V801 WeakPolarHBondContact O-CG2 3.45Å
796	I	81	Confident	90.3	Very high	92 Å²	92	48.3 Å²	48.3	47%	0.472	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.6	-173.6	-162.2	160.6	0	0	0	114	L784 A798 F1171	L784-I796 HydrophobicContact CD2-CB 3.97Å; L784-I796 HydrophobicContact CD2-CG1 4.45Å; I796-A798 VanDerWaalsContact C-N 3.29Å; I796-F1171 HydrophobicContact CD1-CE2 4.1Å
797	D	81.7	Confident	90.5	Very high	146 Å²	146	48.3 Å²	48.3	78%	0.781	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-1.3	178.2	-55.7	-46.4	0	0	0	111.8	N795	N795-D797 VanDerWaalsContact C-N 3.28Å; N795-D797 PolarHBondContact O-N 2.92Å; N795-D797 WeakPolarHBondContact OD1-CA 3.31Å; N795-D797 WeakPolarHBondContact OD1-CB 3.38Å; N795-D797 PolarHBondContact OD1-N 2.83Å
798	A	88	Confident	90.8	Very high	5 Å²	5	48.4 Å²	48.4	4%	0.041	26%	0.256	C	S	.	.			trans	-69.4	136.4	-179.6	0	0	0	0	0	110.5	Q792 N795 I796 G800 V801	Q792-A798 VanDerWaalsContact O-CB 3.25Å; Q792-A798 WeakPolarHBondContact O-CB 3.44Å; N795-A798 WeakPolarHBondContact O-CB 3.49Å; N795-A798 PolarHBondContact O-N 2.76Å; N795-A798 VanDerWaalsContact O-N 3.11Å; N795-A798 PolarHBondContact OD1-N 2.9Å; I796-A798 VanDerWaalsContact C-N 3.29Å; A798-G800 PolarHBondContact O-N 3.41Å; A798-G800 VanDerWaalsContact O-N 3.13Å; A798-V801 HydrophobicContact CB-CG2 4.32Å; A798-V801 WeakPolarHBondContact O-CB 3.23Å; A798-V801 PolarHBondContact O-N 2.98Å
799	P	89	Confident	91	Very high	80 Å²	80	45.9 Å²	45.9	52%	0.519	24%	0.238	S	C	.	.	H	α-helix	trans	-66.1	-23.1	-171.1	26.1	-35.5	0	0	0	113.6	K803	P799-K803 VanDerWaalsContact O-CG 3.29Å; P799-K803 WeakPolarHBondContact O-CG 3.3Å; P799-K803 PolarHBondContact O-N 2.82Å
800	G	92.4	Very high	91.3	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-74	-31.2	175.5	0	0	0	0	0	112.7	Q792 F793 A798 K803 L804	Q792-G800 CarbonylContact O-C 3.59Å; Q792-G800 WeakPolarHBondContact O-CA 3.4Å; Q792-G800 PolarHBondContact O-N 3.17Å; F793-G800 VanDerWaalsContact CE1-C 3.48Å; F793-G800 VanDerWaalsContact CE1-O 3.31Å; F793-G800 WeakPolarHBondContact CE1-O 3.27Å; A798-G800 PolarHBondContact O-N 3.41Å; A798-G800 VanDerWaalsContact O-N 3.13Å; G800-K803 PolarHBondContact O-N 3.06Å; G800-L804 VanDerWaalsContact O-CB 3.24Å; G800-L804 WeakPolarHBondContact O-CB 3.24Å; G800-L804 PolarHBondContact O-N 3.25Å
801	V	92.2	Very high	91.3	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.024	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-47.5	176.8	172.6	0	0	0	0	111	L783 Q792 F793 N795 A798 L804 Q805	L783-V801 HydrophobicContact CB-CG1 3.99Å; L783-V801 HydrophobicContact CD1-CG1 4.01Å; L783-V801 HydrophobicContact CG-CG1 4.39Å; Q792-V801 PolarHBondContact O-N 3.38Å; F793-V801 HydrophobicContact CB-CG2 4.43Å; N795-V801 VanDerWaalsContact O-CG2 3.25Å; N795-V801 WeakPolarHBondContact O-CG2 3.45Å; A798-V801 HydrophobicContact CB-CG2 4.32Å; A798-V801 WeakPolarHBondContact O-CB 3.23Å; A798-V801 PolarHBondContact O-N 2.98Å; V801-L804 PolarHBondContact O-N 3.02Å; V801-Q805 WeakPolarHBondContact O-CB 3.34Å; V801-Q805 PolarHBondContact O-N 2.93Å
802	Q	90.4	Very high	91.3	Very high	118 Å²	118	39.7 Å²	39.7	55%	0.551	20%	0.203	S	C	*	.	H	α-helix	trans	-61.9	-46	176.6	-174.8	-175.3	-9.8	0	0	111.5	L804 Q805 E806	Q802-L804 VanDerWaalsContact C-N 3.32Å; Q802-L804 PolarHBondContact O-N 3.4Å; Q802-Q805 WeakPolarHBondContact O-CB 3.32Å; Q802-Q805 PolarHBondContact O-N 2.95Å; Q802-E806 PolarHBondContact NE2-OE1 3.35Å; Q802-E806 WeakPolarHBondContact O-CG 3.4Å; Q802-E806 PolarHBondContact O-N 2.79Å
803	K	95.8	Very high	91.3	Very high	87 Å²	87	37.5 Å²	37.5	38%	0.378	19%	0.193	S	C	.	.	H	α-helix	trans	-61.3	-41.1	177.7	-68.8	170.9	-173.3	177	0	112	P799 G800 E806 V807 L832 K837	P799-K803 VanDerWaalsContact O-CG 3.29Å; P799-K803 WeakPolarHBondContact O-CG 3.3Å; P799-K803 PolarHBondContact O-N 2.82Å; G800-K803 PolarHBondContact O-N 3.06Å; K803-E806 PolarHBondContact O-N 3.41Å; K803-V807 WeakPolarHBondContact O-CG2 3.27Å; K803-V807 PolarHBondContact O-N 3.3Å; K803-L832 HydrophobicContact CB-CD1 4.13Å; K803-L832 HydrophobicContact CB-CD2 3.98Å; K803-K837 HydrophobicContact CB-CB 4.5Å; K803-K837 HydrophobicContact CG-CB 4.5Å
804	L	96.9	Very high	91.2	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-44.8	177.1	179.3	61.9	0	0	0	110.9	L783 T786 F793 G800 V801 Q802 V807 L808 A828 A829 L832	L783-L804 HydrophobicContact CD2-CB 4.2Å; L783-L804 HydrophobicContact CD2-CD2 3.93Å; L783-L804 HydrophobicContact CD2-CG 3.86Å; T786-L804 HydrophobicContact CG2-CD2 3.85Å; F793-L804 HydrophobicContact CD1-CD2 4.28Å; F793-L804 HydrophobicContact CE1-CB 4.1Å; F793-L804 HydrophobicContact CE1-CD2 4.31Å; G800-L804 VanDerWaalsContact O-CB 3.24Å; G800-L804 WeakPolarHBondContact O-CB 3.24Å; G800-L804 PolarHBondContact O-N 3.25Å; V801-L804 PolarHBondContact O-N 3.02Å; Q802-L804 VanDerWaalsContact C-N 3.32Å; Q802-L804 PolarHBondContact O-N 3.4Å; L804-V807 PolarHBondContact O-N 2.96Å; L804-L808 HydrophobicContact CD1-CD1 3.9Å; L804-L808 HydrophobicContact CD1-CG 4.09Å; L804-L808 HydrophobicContact CG-CD1 3.96Å; L804-L808 HydrophobicContact CG-CG 4.5Å; L804-L808 WeakPolarHBondContact O-CB 3.24Å; L804-L808 VanDerWaalsContact O-CG 3.27Å; L804-L808 WeakPolarHBondContact O-CG 3.4Å; L804-L808 PolarHBondContact O-N 2.7Å; L804-A828 HydrophobicContact CD1-CB 3.59Å; L804-A829 HydrophobicContact CD1-CB 4.29Å; L804-L832 VanDerWaalsContact CA-CD1 3.49Å; L804-L832 HydrophobicContact CB-CD1 3.88Å; L804-L832 HydrophobicContact CD1-CD1 4.13Å
805	Q	93.4	Very high	91.3	Very high	57 Å²	57	38.1 Å²	38.1	27%	0.266	20%	0.196	S	C	.	.	H	α-helix	trans	-57.1	-52.5	174.5	-175.6	175.7	1.7	0	0	111	I779 L783 V801 Q802 V807 L808 Q809	I779-Q805 HydrophobicContact CG2-CG 4.47Å; L783-Q805 HydrophobicContact CD1-CB 3.83Å; L783-Q805 HydrophobicContact CD1-CG 4.05Å; L783-Q805 HydrophobicContact CD2-CB 3.94Å; V801-Q805 WeakPolarHBondContact O-CB 3.34Å; V801-Q805 PolarHBondContact O-N 2.93Å; Q802-Q805 WeakPolarHBondContact O-CB 3.32Å; Q802-Q805 PolarHBondContact O-N 2.95Å; Q805-V807 PolarHBondContact O-N 3.41Å; Q805-L808 PolarHBondContact O-N 2.8Å; Q805-Q809 HydrophobicContact CG-CG 4.22Å; Q805-Q809 VanDerWaalsContact NE2-NE2 3.12Å; Q805-Q809 VanDerWaalsContact O-CB 3.25Å; Q805-Q809 WeakPolarHBondContact O-CB 3.25Å; Q805-Q809 WeakPolarHBondContact O-CG 3.4Å; Q805-Q809 PolarHBondContact O-N 3.12Å
806	E	93.8	Very high	91.2	Very high	33 Å²	33	38.3 Å²	38.3	15%	0.154	20%	0.202	C	C	.	.	H	α-helix	trans	-57.3	-46.2	179.3	-71.9	175	-163.8	0	0	112	L763 Q802 K803 Q809 A810 K837	L763-E806 HydrophobicContact CD1-CB 4.31Å; L763-E806 HydrophobicContact CD1-CG 4.44Å; L763-E806 HydrophobicContact CD2-CB 3.82Å; L763-E806 HydrophobicContact CD2-CG 4.25Å; L763-E806 VanDerWaalsContact CD2-O 3.25Å; L763-E806 WeakPolarHBondContact CD2-O 3.48Å; Q802-E806 PolarHBondContact NE2-OE1 3.35Å; Q802-E806 WeakPolarHBondContact O-CG 3.4Å; Q802-E806 PolarHBondContact O-N 2.79Å; K803-E806 PolarHBondContact O-N 3.41Å; E806-Q809 PolarHBondContact O-N 3.45Å; E806-A810 WeakPolarHBondContact O-CB 3.49Å; E806-A810 PolarHBondContact O-N 3.46Å; E806-K837 WeakPolarHBondContact OE2-CD 3.44Å; E806-K837 IonicContact OE2-NZ 2.79Å; E806-K837 PolarHBondContact OE2-NZ 3.43Å
807	V	96.8	Very high	91.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-46.8	179.1	170.3	0	0	0	0	112.2	K803 L804 Q805 A810 Y811 A828 L832 K837 A840 F841 L844	K803-V807 WeakPolarHBondContact O-CG2 3.27Å; K803-V807 PolarHBondContact O-N 3.3Å; L804-V807 PolarHBondContact O-N 2.96Å; Q805-V807 PolarHBondContact O-N 3.41Å; V807-A810 PolarHBondContact O-N 3.03Å; V807-Y811 PolarHBondContact O-N 3.36Å; V807-A828 HydrophobicContact CG1-CB 4.11Å; V807-L832 HydrophobicContact CG2-CD2 4.28Å; V807-K837 HydrophobicContact CG2-CB 4.23Å; V807-K837 VanDerWaalsContact CG2-O 3.26Å; V807-K837 WeakPolarHBondContact CG2-O 3.31Å; V807-A840 HydrophobicContact CG2-CB 4.47Å; V807-F841 HydrophobicContact CG1-CB 4.23Å; V807-F841 HydrophobicContact CG2-CB 4.47Å; V807-L844 HydrophobicContact CG1-CD2 4.22Å
808	L	95.3	Very high	91.6	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-67.8	-37.4	-179.7	-67.4	175.9	0	0	0	112.1	I779 L804 Q805 Y811 S812 Y820 M824 N825 A828 L844	I779-L808 HydrophobicContact CD1-CB 4.13Å; I779-L808 HydrophobicContact CG1-CB 4.31Å; I779-L808 HydrophobicContact CG2-CB 4.14Å; I779-L808 HydrophobicContact CG2-CD1 4.12Å; L804-L808 HydrophobicContact CD1-CD1 3.9Å; L804-L808 HydrophobicContact CD1-CG 4.09Å; L804-L808 HydrophobicContact CG-CD1 3.96Å; L804-L808 HydrophobicContact CG-CG 4.5Å; L804-L808 WeakPolarHBondContact O-CB 3.24Å; L804-L808 VanDerWaalsContact O-CG 3.27Å; L804-L808 WeakPolarHBondContact O-CG 3.4Å; L804-L808 PolarHBondContact O-N 2.7Å; Q805-L808 PolarHBondContact O-N 2.8Å; L808-Y811 PolarHBondContact O-N 3.47Å; L808-S812 WeakPolarHBondContact O-CB 3.38Å; L808-S812 PolarHBondContact O-N 3.17Å; L808-Y820 HydrophobicContact CB-CD2 4.44Å; L808-Y820 HydrophobicContact CD1-CE2 3.86Å; L808-Y820 HydrophobicContact CD2-CD2 4.14Å; L808-Y820 HydrophobicContact CD2-CE2 3.8Å; L808-Y820 HydrophobicContact CG-CE2 4.27Å; L808-M824 HydrophobicContact CD2-CB 4.2Å; L808-N825 HydrophobicContact CD1-CB 3.98Å; L808-A828 HydrophobicContact CD2-CB 3.86Å; L808-A828 HydrophobicContact CG-CB 4.4Å; L808-L844 HydrophobicContact CD2-CD2 4.27Å
809	Q	91.9	Very high	91.6	Very high	22 Å²	22	36.1 Å²	36.1	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-48.8	175.5	-74.9	-178.9	-16.7	0	0	111.4	F766 I779 Q805 E806 Y811 S812 I813	F766-Q809 HydrophobicContact CD1-CB 4.27Å; F766-Q809 HydrophobicContact CD1-CG 4.12Å; F766-Q809 HydrophobicContact CD2-CB 3.5Å; F766-Q809 HydrophobicContact CD2-CG 3.92Å; F766-Q809 HydrophobicContact CE1-CB 4.31Å; F766-Q809 HydrophobicContact CE1-CG 3.72Å; F766-Q809 HydrophobicContact CE2-CB 3.55Å; F766-Q809 HydrophobicContact CE2-CG 3.5Å; F766-Q809 VanDerWaalsContact CE2-CG 3.5Å; F766-Q809 HydrophobicContact CG-CB 3.93Å; F766-Q809 HydrophobicContact CG-CG 4.25Å; F766-Q809 HydrophobicContact CZ-CB 4Å; F766-Q809 HydrophobicContact CZ-CG 3.42Å; F766-Q809 VanDerWaalsContact CZ-CG 3.42Å; I779-Q809 HydrophobicContact CD1-CG 4.09Å; Q805-Q809 HydrophobicContact CG-CG 4.22Å; Q805-Q809 VanDerWaalsContact NE2-NE2 3.12Å; Q805-Q809 VanDerWaalsContact O-CB 3.25Å; Q805-Q809 WeakPolarHBondContact O-CB 3.25Å; Q805-Q809 WeakPolarHBondContact O-CG 3.4Å; Q805-Q809 PolarHBondContact O-N 3.12Å; E806-Q809 PolarHBondContact O-N 3.45Å; Q809-Y811 VanDerWaalsContact C-N 3.31Å; Q809-Y811 PolarHBondContact O-N 3.46Å; Q809-S812 PolarHBondContact O-N 3.24Å; Q809-S812 VanDerWaalsContact O-N 3.16Å; Q809-S812 PolarHBondContact O-OG 2.81Å; Q809-I813 PolarHBondContact O-N 2.87Å
810	A	93.1	Very high	91.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.3	-44.2	175.9	0	0	0	0	0	111.5	Y759 L762 L763 E806 V807 S812 I813 H814 F841	Y759-A810 HydrophobicContact CD2-CB 3.77Å; Y759-A810 HydrophobicContact CE2-CB 3.55Å; L762-A810 HydrophobicContact CB-CB 4.1Å; L762-A810 HydrophobicContact CD1-CB 4.35Å; L763-A810 HydrophobicContact CD2-CB 4.02Å; E806-A810 WeakPolarHBondContact O-CB 3.49Å; E806-A810 PolarHBondContact O-N 3.46Å; V807-A810 PolarHBondContact O-N 3.03Å; A810-S812 VanDerWaalsContact C-N 3.34Å; A810-S812 PolarHBondContact O-N 3.17Å; A810-I813 PolarHBondContact O-N 2.85Å; A810-H814 WeakPolarHBondContact O-CB 3.47Å; A810-H814 PolarHBondContact O-N 3.38Å; A810-F841 HydrophobicContact CB-CD2 3.89Å; A810-F841 HydrophobicContact CB-CE2 3.86Å
811	Y	94.6	Very high	91.5	Very high	1 Å²	1	34.1 Å²	34.1	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-62.4	-40.2	176.8	-176	-91.3	0	0	0	112.7	V807 L808 Q809 I813 H814 N815 M824 L844 I845 L848	V807-Y811 PolarHBondContact O-N 3.36Å; L808-Y811 PolarHBondContact O-N 3.47Å; Q809-Y811 VanDerWaalsContact C-N 3.31Å; Q809-Y811 PolarHBondContact O-N 3.46Å; Y811-I813 PolarHBondContact O-N 3.42Å; Y811-I813 VanDerWaalsContact O-N 3.14Å; Y811-H814 WeakPolarHBondContact O-CB 3.5Å; Y811-H814 PolarHBondContact O-N 2.78Å; Y811-H814 VanDerWaalsContact O-N 3.14Å; Y811-N815 PolarHBondContact O-N 3.39Å; Y811-N815 VanDerWaalsContact O-N 3.1Å; Y811-M824 HydrophobicContact CD1-SD 4.06Å; Y811-M824 HydrophobicContact CE1-CE 3.85Å; Y811-M824 HydrophobicContact CE1-SD 3.79Å; Y811-L844 HydrophobicContact CD1-CD2 4.33Å; Y811-L844 HydrophobicContact CD2-CD2 3.88Å; Y811-L844 HydrophobicContact CD2-CG 4.02Å; Y811-L844 HydrophobicContact CE2-CG 4.4Å; Y811-L844 HydrophobicContact CG-CD2 3.7Å; Y811-L844 HydrophobicContact CG-CG 4.3Å; Y811-I845 HydrophobicContact CD2-CG1 4.02Å; Y811-I845 HydrophobicContact CE2-CG1 4.12Å; Y811-L848 HydrophobicContact CD1-CD1 4.47Å; Y811-L848 HydrophobicContact CD2-CD1 4.46Å; Y811-L848 HydrophobicContact CE1-CD1 3.74Å; Y811-L848 HydrophobicContact CE2-CB 4.43Å; Y811-L848 HydrophobicContact CE2-CD1 3.71Å; Y811-L848 VanDerWaalsContact OH-CD1 3.28Å; Y811-L848 WeakPolarHBondContact OH-CD1 3.06Å
812	S	91.7	Very high	91	Very high	4 Å²	4	39.2 Å²	39.2	3%	0.028	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-25.8	-179.6	74.7	0	0	0	0	113.8	L808 Q809 A810 S816	L808-S812 WeakPolarHBondContact O-CB 3.38Å; L808-S812 PolarHBondContact O-N 3.17Å; Q809-S812 PolarHBondContact O-N 3.24Å; Q809-S812 VanDerWaalsContact O-N 3.16Å; Q809-S812 PolarHBondContact O-OG 2.81Å; A810-S812 VanDerWaalsContact C-N 3.34Å; A810-S812 PolarHBondContact O-N 3.17Å; S812-S816 WeakPolarHBondContact O-CA 3.43Å
813	I	90.5	Very high	90.7	Very high	16 Å²	16	33.9 Å²	33.9	8%	0.082	17%	0.17	C	C	.	.	H	α-helix	trans	-89.1	-42.3	174.4	-61.5	173.2	0	0	0	110.7	L762 E765 F766 A772 Q809 A810 Y811 N815 S816	L762-I813 HydrophobicContact CD2-CB 4.07Å; L762-I813 HydrophobicContact CD2-CG2 3.63Å; L762-I813 WeakPolarHBondContact O-CD1 3.23Å; E765-I813 HydrophobicContact CB-CD1 4.37Å; E765-I813 WeakPolarHBondContact OE1-CG2 3.35Å; F766-I813 VanDerWaalsContact CA-CD1 3.4Å; F766-I813 HydrophobicContact CB-CD1 3.5Å; F766-I813 HydrophobicContact CD2-CD1 3.6Å; F766-I813 HydrophobicContact CD2-CG1 4.05Å; F766-I813 HydrophobicContact CG-CD1 4.01Å; A772-I813 HydrophobicContact CB-CD1 4.31Å; A772-I813 HydrophobicContact CB-CG1 4.32Å; Q809-I813 PolarHBondContact O-N 2.87Å; A810-I813 PolarHBondContact O-N 2.85Å; Y811-I813 PolarHBondContact O-N 3.42Å; Y811-I813 VanDerWaalsContact O-N 3.14Å; I813-N815 PolarHBondContact O-N 3.26Å; I813-S816 PolarHBondContact O-N 2.82Å
814	H	92.3	Very high	90.6	Very high	30 Å²	30	29.8 Å²	29.8	14%	0.139	15%	0.152	C	C	.	.	H	α-helix	trans	-47.5	-46.8	177.7	175.9	65.3	0	0	0	111.9	Y758 L762 A810 Y811 F841 I845 E849	Y758-H814 AromaticContact CE1-CE1 3.95Å; Y758-H814 AromaticContact CE1-ND1 3.37Å; Y758-H814 WeakPolarHBondContact CE1-ND1 3.35Å; Y758-H814 AromaticContact CZ-ND1 3.52Å; Y758-H814 PolarHBondContact OH-ND1 3.26Å; L762-H814 HydrophobicContact CD1-CB 4.11Å; A810-H814 WeakPolarHBondContact O-CB 3.47Å; A810-H814 PolarHBondContact O-N 3.38Å; Y811-H814 WeakPolarHBondContact O-CB 3.5Å; Y811-H814 PolarHBondContact O-N 2.78Å; Y811-H814 VanDerWaalsContact O-N 3.14Å; H814-F841 HydrophobicContact CB-CE2 4.18Å; H814-F841 HydrophobicContact CB-CZ 4.21Å; H814-I845 WeakPolarHBondContact NE2-CD1 3.5Å; H814-E849 IonicContact CD2-OE1 4Å; H814-E849 IonicContact NE2-OE1 3.85Å; H814-E849 IonicContact NE2-OE2 2.84Å
815	N	90	Very high	90.5	Very high	34 Å²	34	29.8 Å²	29.8	18%	0.182	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	72.5	177.2	-167.2	-27.1	0	0	0	110.5	Y811 I813 K817 I818 G819 E849	Y811-N815 PolarHBondContact O-N 3.39Å; Y811-N815 VanDerWaalsContact O-N 3.1Å; I813-N815 PolarHBondContact O-N 3.26Å; N815-K817 PolarHBondContact O-N 3.15Å; N815-K817 VanDerWaalsContact O-N 3.08Å; N815-I818 PolarHBondContact O-N 3.23Å; N815-I818 VanDerWaalsContact O-N 3.07Å; N815-I818 PolarHBondContact OD1-N 3.3Å; N815-G819 PolarHBondContact O-N 2.94Å; N815-E849 PolarHBondContact ND2-OE1 3.47Å
816	S	85.5	Confident	90.6	Very high	73 Å²	73	28.3 Å²	28.3	51%	0.51	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.7	-178	59.9	0	0	0	0	115.1	S812 I813	S812-S816 WeakPolarHBondContact O-CA 3.43Å; I813-S816 PolarHBondContact O-N 2.82Å
817	K	84.3	Confident	90.8	Very high	163 Å²	163	26.8 Å²	26.8	71%	0.709	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-38.9	173.3	-176.2	-171.7	179.1	-165.8	0	111.7	N815	N815-K817 PolarHBondContact O-N 3.15Å; N815-K817 VanDerWaalsContact O-N 3.08Å
818	I	86.3	Confident	90.8	Very high	35 Å²	35	26.8 Å²	26.8	18%	0.179	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-42.4	176.4	-64	177.1	0	0	0	110	N815 Y820 M824 F857	N815-I818 PolarHBondContact O-N 3.23Å; N815-I818 VanDerWaalsContact O-N 3.07Å; N815-I818 PolarHBondContact OD1-N 3.3Å; I818-Y820 PolarHBondContact O-N 3Å; I818-M824 HydrophobicContact CG2-CE 3.63Å; I818-F857 HydrophobicContact CG2-CB 4.11Å; I818-F857 WeakPolarHBondContact CG2-O 3.12Å
819	G	88.1	Confident	90.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.137	C	C	.	.			trans	66.4	-120.9	-174.9	0	0	0	0	0	111	N815	N815-G819 PolarHBondContact O-N 2.94Å
820	Y	90.6	Very high	91.1	Very high	9 Å²	9	25.7 Å²	25.7	4%	0.035	13%	0.132	C	C	.	.			trans	-113.6	127.7	173.9	176.5	-104.6	0	0	0	110.9	Q778 I779 D782 L808 I818 M824 N825	Q778-Y820 HydrophobicContact CB-CD1 4.23Å; Q778-Y820 HydrophobicContact CB-CE1 4.39Å; Q778-Y820 HydrophobicContact CG-CD1 4.16Å; Q778-Y820 HydrophobicContact CG-CE1 4Å; I779-Y820 HydrophobicContact CD1-CD2 4.46Å; I779-Y820 HydrophobicContact CD1-CG 4.26Å; I779-Y820 HydrophobicContact CG1-CD1 3.8Å; I779-Y820 HydrophobicContact CG1-CD2 3.89Å; I779-Y820 HydrophobicContact CG1-CE1 4.19Å; I779-Y820 HydrophobicContact CG1-CE2 4.27Å; I779-Y820 HydrophobicContact CG1-CG 3.64Å; D782-Y820 WeakPolarHBondContact CB-OH 3.49Å; D782-Y820 WeakPolarHBondContact OD2-CE1 3.27Å; D782-Y820 PolarHBondContact OD2-OH 2.98Å; L808-Y820 HydrophobicContact CB-CD2 4.44Å; L808-Y820 HydrophobicContact CD1-CE2 3.86Å; L808-Y820 HydrophobicContact CD2-CD2 4.14Å; L808-Y820 HydrophobicContact CD2-CE2 3.8Å; L808-Y820 HydrophobicContact CG-CE2 4.27Å; I818-Y820 PolarHBondContact O-N 3Å; Y820-M824 HydrophobicContact CD2-CB 4.3Å; Y820-M824 HydrophobicContact CD2-SD 4.27Å; Y820-M824 HydrophobicContact CE2-CB 3.98Å; Y820-N825 WeakPolarHBondContact OH-CB 3.46Å; Y820-N825 PolarHBondContact OH-OD1 3.01Å
821	C	87.5	Confident	91.3	Very high	30 Å²	30	25.7 Å²	25.7	20%	0.203	13%	0.132	C	C	.	.			trans	-115.6	135.9	171.2	-170.1	0	0	0	0	110	G823 M824 F857	C821-G823 PolarHBondContact O-N 2.93Å; C821-M824 HydrophobicContact CB-CE 3.56Å; C821-M824 HydrophobicContact CB-CG 4.48Å; C821-M824 HydrophobicContact CB-SD 4.09Å; C821-M824 PolarHBondContact N-SD 3.11Å; C821-M824 WeakPolarHBondContact O-CB 3.39Å; C821-M824 VanDerWaalsContact O-CG 3.24Å; C821-M824 WeakPolarHBondContact O-CG 3.32Å; C821-M824 PolarHBondContact O-N 3.07Å; C821-M824 VanDerWaalsContact O-N 3.16Å; C821-F857 HydrophobicContact CB-CB 4.02Å; C821-F857 HydrophobicContact CB-CD1 3.83Å; C821-F857 HydrophobicContact CB-CG 4.39Å
822	Q	82	Confident	91.5	Very high	110 Å²	110	26.2 Å²	26.2	51%	0.514	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	128.9	178.2	-175.8	176.4	-11	0	0	110.6	R785	R785-Q822 VanDerWaalsContact NH2-NE2 3.17Å
823	G	84.8	Confident	91.6	Very high	7 Å²	7	27.4 Å²	27.4	7%	0.072	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	114.4	-29.6	-172.6	0	0	0	0	0	112.8	C821 N825 F826	C821-G823 PolarHBondContact O-N 2.93Å; G823-N825 VanDerWaalsContact C-OD1 3.31Å; G823-N825 VanDerWaalsContact CA-OD1 3.29Å; G823-N825 WeakPolarHBondContact CA-OD1 3.36Å; G823-N825 PolarHBondContact N-OD1 3Å; G823-N825 PolarHBondContact O-N 3.23Å; G823-F826 PolarHBondContact O-N 3.42Å; G823-F826 VanDerWaalsContact O-N 3.15Å
824	M	94.2	Very high	91.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-31.6	174.9	-67.8	174.4	178.7	0	0	112.6	L808 Y811 I818 Y820 C821 F826 I827 A828 L848 F857	L808-M824 HydrophobicContact CD2-CB 4.2Å; Y811-M824 HydrophobicContact CD1-SD 4.06Å; Y811-M824 HydrophobicContact CE1-CE 3.85Å; Y811-M824 HydrophobicContact CE1-SD 3.79Å; I818-M824 HydrophobicContact CG2-CE 3.63Å; Y820-M824 HydrophobicContact CD2-CB 4.3Å; Y820-M824 HydrophobicContact CD2-SD 4.27Å; Y820-M824 HydrophobicContact CE2-CB 3.98Å; C821-M824 HydrophobicContact CB-CE 3.56Å; C821-M824 HydrophobicContact CB-CG 4.48Å; C821-M824 HydrophobicContact CB-SD 4.09Å; C821-M824 PolarHBondContact N-SD 3.11Å; C821-M824 WeakPolarHBondContact O-CB 3.39Å; C821-M824 VanDerWaalsContact O-CG 3.24Å; C821-M824 WeakPolarHBondContact O-CG 3.32Å; C821-M824 PolarHBondContact O-N 3.07Å; C821-M824 VanDerWaalsContact O-N 3.16Å; M824-F826 PolarHBondContact O-N 3.49Å; M824-I827 PolarHBondContact O-N 3.26Å; M824-A828 WeakPolarHBondContact O-CB 3.32Å; M824-A828 PolarHBondContact O-N 3.49Å; M824-L848 HydrophobicContact CE-CD1 3.96Å; M824-L848 HydrophobicContact CG-CD1 4.05Å; M824-L848 HydrophobicContact SD-CD1 4.15Å; M824-F857 HydrophobicContact CE-CB 3.46Å; M824-F857 VanDerWaalsContact CE-CB 3.46Å; M824-F857 HydrophobicContact CE-CD1 3.88Å; M824-F857 HydrophobicContact CE-CD2 4.36Å; M824-F857 HydrophobicContact CE-CG 3.65Å; M824-F857 HydrophobicContact CG-CD1 4.16Å; M824-F857 HydrophobicContact CG-CE1 4.17Å
825	N	94.6	Very high	92.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-54.2	-38.4	174.6	59.5	-53.9	0	0	0	112.7	D782 T786 L808 Y820 G823 A829	D782-N825 HydrophobicContact CB-CB 4.35Å; T786-N825 HydrophobicContact CG2-CB 4.43Å; T786-N825 PolarHBondContact OG1-ND2 2.85Å; L808-N825 HydrophobicContact CD1-CB 3.98Å; Y820-N825 WeakPolarHBondContact OH-CB 3.46Å; Y820-N825 PolarHBondContact OH-OD1 3.01Å; G823-N825 VanDerWaalsContact C-OD1 3.31Å; G823-N825 VanDerWaalsContact CA-OD1 3.29Å; G823-N825 WeakPolarHBondContact CA-OD1 3.36Å; G823-N825 PolarHBondContact N-OD1 3Å; G823-N825 PolarHBondContact O-N 3.23Å; N825-A829 VanDerWaalsContact O-CB 3.23Å; N825-A829 WeakPolarHBondContact O-CB 3.38Å; N825-A829 PolarHBondContact O-N 3.18Å
826	F	95.1	Very high	92.3	Very high	27 Å²	27	31.2 Å²	31.2	12%	0.118	15%	0.152	C	C	.	.	H	α-helix	trans	-71.8	-41.3	-179.8	-60.4	-54.8	0	0	0	112.1	T786 G823 M824 A829 V830 A903 Y906	T786-F826 HydrophobicContact CG2-CD1 3.97Å; T786-F826 HydrophobicContact CG2-CE1 4.35Å; G823-F826 PolarHBondContact O-N 3.42Å; G823-F826 VanDerWaalsContact O-N 3.15Å; M824-F826 PolarHBondContact O-N 3.49Å; F826-A829 PolarHBondContact O-N 3.21Å; F826-V830 WeakPolarHBondContact O-CG2 3.36Å; F826-V830 PolarHBondContact O-N 3.23Å; F826-A903 HydrophobicContact CD2-CB 4.44Å; F826-Y906 HydrophobicContact CB-CD1 3.53Å; F826-Y906 HydrophobicContact CB-CE1 4.09Å; F826-Y906 HydrophobicContact CB-CG 3.93Å; F826-Y906 AromaticContact CD1-CD1 3.41Å; F826-Y906 HydrophobicContact CD1-CD1 3.41Å; F826-Y906 VanDerWaalsContact CD1-CD1 3.41Å; F826-Y906 AromaticContact CD1-CE1 3.07Å; F826-Y906 HydrophobicContact CD1-CE1 3.07Å; F826-Y906 HydrophobicContact CD1-CG 4.44Å; F826-Y906 AromaticContact CD1-CZ 3.91Å; F826-Y906 HydrophobicContact CD2-CD1 4.18Å; F826-Y906 HydrophobicContact CE1-CD1 4.11Å; F826-Y906 AromaticContact CE1-CE1 3.5Å; F826-Y906 HydrophobicContact CE1-CE1 3.5Å; F826-Y906 VanDerWaalsContact CE1-CE1 3.5Å; F826-Y906 AromaticContact CG-CD1 3.44Å; F826-Y906 HydrophobicContact CG-CD1 3.44Å; F826-Y906 VanDerWaalsContact CG-CD1 3.44Å; F826-Y906 AromaticContact CG-CE1 3.67Å; F826-Y906 HydrophobicContact CG-CE1 3.67Å; F826-Y906 HydrophobicContact CG-CG 4.34Å; F826-Y906 HydrophobicContact CZ-CE1 4.37Å
827	I	96.7	Very high	92.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-49.3	175.8	-58.9	174.1	0	0	0	109.7	M824 A829 V830 A831 L844 I847 L848 F857 L902 V904 W918	M824-I827 PolarHBondContact O-N 3.26Å; I827-A829 VanDerWaalsContact C-N 3.34Å; I827-A829 PolarHBondContact O-N 3.29Å; I827-V830 PolarHBondContact O-N 3.26Å; I827-A831 PolarHBondContact O-N 2.56Å; I827-L844 HydrophobicContact CB-CD1 3.98Å; I827-L844 HydrophobicContact CG2-CD1 3.74Å; I827-I847 HydrophobicContact CD1-CG2 4.2Å; I827-I847 HydrophobicContact CG2-CB 4.38Å; I827-I847 HydrophobicContact CG2-CD1 3.56Å; I827-I847 HydrophobicContact CG2-CG2 4.18Å; I827-L848 HydrophobicContact CD1-CD2 3.97Å; I827-F857 HydrophobicContact CD1-CZ 4.07Å; I827-L902 WeakPolarHBondContact CD1-O 3.24Å; I827-V904 HydrophobicContact CD1-CG2 4.28Å; I827-V904 HydrophobicContact CG1-CG2 4.3Å; I827-W918 HydrophobicContact CG2-CH2 3.86Å; I827-W918 HydrophobicContact CG2-CZ2 4.4Å
828	A	97.8	Very high	93.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.8	-40.4	178.8	0	0	0	0	0	112.2	L804 V807 L808 M824 A831 L832 L844	L804-A828 HydrophobicContact CD1-CB 3.59Å; V807-A828 HydrophobicContact CG1-CB 4.11Å; L808-A828 HydrophobicContact CD2-CB 3.86Å; L808-A828 HydrophobicContact CG-CB 4.4Å; M824-A828 WeakPolarHBondContact O-CB 3.32Å; M824-A828 PolarHBondContact O-N 3.49Å; A828-A831 PolarHBondContact O-N 3.31Å; A828-L832 WeakPolarHBondContact O-CB 3.45Å; A828-L832 VanDerWaalsContact O-CG 3.31Å; A828-L832 WeakPolarHBondContact O-CG 3.4Å; A828-L832 PolarHBondContact O-N 3.26Å; A828-L844 HydrophobicContact CB-CD2 4.36Å
829	A	97.1	Very high	94	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.7	-43.4	177.7	0	0	0	0	0	112.6	T786 M787 F793 L804 N825 F826 I827 A831 L832 L833	T786-A829 HydrophobicContact CG2-CB 3.46Å; T786-A829 VanDerWaalsContact CG2-CB 3.46Å; M787-A829 HydrophobicContact CE-CB 4.01Å; M787-A829 HydrophobicContact CG-CB 4.42Å; M787-A829 HydrophobicContact SD-CB 3.9Å; F793-A829 HydrophobicContact CE1-CB 4.41Å; F793-A829 HydrophobicContact CE2-CB 4.47Å; F793-A829 HydrophobicContact CZ-CB 4.13Å; L804-A829 HydrophobicContact CD1-CB 4.29Å; N825-A829 VanDerWaalsContact O-CB 3.23Å; N825-A829 WeakPolarHBondContact O-CB 3.38Å; N825-A829 PolarHBondContact O-N 3.18Å; F826-A829 PolarHBondContact O-N 3.21Å; I827-A829 VanDerWaalsContact C-N 3.34Å; I827-A829 PolarHBondContact O-N 3.29Å; A829-A831 VanDerWaalsContact C-N 3.33Å; A829-A831 PolarHBondContact O-N 3.49Å; A829-L832 PolarHBondContact O-N 2.98Å; A829-L833 PolarHBondContact O-N 3.06Å
830	V	96.5	Very high	94.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-43.2	174.7	175.5	0	0	0	0	110.8	W739 M787 F826 I827 L832 L833 F834 Y906 L914 W918	W739-V830 HydrophobicContact CH2-CG1 4.38Å; W739-V830 HydrophobicContact CZ3-CG1 4.46Å; M787-V830 HydrophobicContact CE-CB 4.21Å; M787-V830 HydrophobicContact CE-CG2 3.4Å; M787-V830 VanDerWaalsContact CE-CG2 3.4Å; F826-V830 WeakPolarHBondContact O-CG2 3.36Å; F826-V830 PolarHBondContact O-N 3.23Å; I827-V830 PolarHBondContact O-N 3.26Å; V830-L832 VanDerWaalsContact C-N 3.34Å; V830-L832 PolarHBondContact O-N 3.13Å; V830-L833 PolarHBondContact O-N 3.15Å; V830-F834 WeakPolarHBondContact O-CD2 3.41Å; V830-Y906 HydrophobicContact CG2-CD2 3.67Å; V830-Y906 HydrophobicContact CG2-CE2 4.38Å; V830-Y906 HydrophobicContact CG2-CG 4.39Å; V830-L914 HydrophobicContact CG2-CD2 4Å; V830-W918 HydrophobicContact CB-CH2 3.67Å; V830-W918 HydrophobicContact CB-CZ2 3.73Å; V830-W918 HydrophobicContact CB-CZ3 4.2Å; V830-W918 HydrophobicContact CG1-CD2 3.79Å; V830-W918 HydrophobicContact CG1-CE3 3.81Å; V830-W918 HydrophobicContact CG1-CH2 3.65Å; V830-W918 HydrophobicContact CG1-CZ2 3.63Å; V830-W918 HydrophobicContact CG1-CZ3 3.74Å; V830-W918 HydrophobicContact CG2-CZ2 4.21Å
831	A	97.6	Very high	94.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.4	-43.5	175.8	0	0	0	0	0	111.9	I827 A828 A829 L833 F834 L835 A840 C843	I827-A831 PolarHBondContact O-N 2.56Å; A828-A831 PolarHBondContact O-N 3.31Å; A829-A831 VanDerWaalsContact C-N 3.33Å; A829-A831 PolarHBondContact O-N 3.49Å; A831-L833 PolarHBondContact O-N 3.01Å; A831-F834 PolarHBondContact O-N 3.22Å; A831-F834 VanDerWaalsContact O-N 3.12Å; A831-L835 HydrophobicContact CB-CD1 4.45Å; A831-L835 VanDerWaalsContact O-CB 3.28Å; A831-L835 WeakPolarHBondContact O-CB 3.48Å; A831-L835 PolarHBondContact O-N 3.46Å; A831-A840 HydrophobicContact CB-CB 3.86Å; A831-C843 HydrophobicContact CB-CB 3.96Å
832	L	97.6	Very high	95.3	Very high	13 Å²	13	23.3 Å²	23.3	7%	0.068	11%	0.105	C	C	.	.	H	α-helix	trans	-65.4	-19.6	-179.8	-78.9	170	0	0	0	114.8	F793 K803 L804 V807 A828 A829 V830 F834 K837 A840	F793-L832 HydrophobicContact CE1-CD1 4.47Å; F793-L832 HydrophobicContact CZ-CB 4.2Å; K803-L832 HydrophobicContact CB-CD1 4.13Å; K803-L832 HydrophobicContact CB-CD2 3.98Å; L804-L832 VanDerWaalsContact CA-CD1 3.49Å; L804-L832 HydrophobicContact CB-CD1 3.88Å; L804-L832 HydrophobicContact CD1-CD1 4.13Å; V807-L832 HydrophobicContact CG2-CD2 4.28Å; A828-L832 WeakPolarHBondContact O-CB 3.45Å; A828-L832 VanDerWaalsContact O-CG 3.31Å; A828-L832 WeakPolarHBondContact O-CG 3.4Å; A828-L832 PolarHBondContact O-N 3.26Å; A829-L832 PolarHBondContact O-N 2.98Å; V830-L832 VanDerWaalsContact C-N 3.34Å; V830-L832 PolarHBondContact O-N 3.13Å; L832-F834 VanDerWaalsContact C-N 3.27Å; L832-F834 PolarHBondContact O-N 2.97Å; L832-K837 HydrophobicContact CD2-CB 4.19Å; L832-A840 HydrophobicContact CD2-CB 3.72Å; L832-A840 HydrophobicContact CG-CB 3.87Å
833	L	95.2	Very high	96.1	Very high	28 Å²	28	18.1 Å²	18.1	15%	0.147	8%	0.08	C	C	.	.	H	α-helix	trans	-69.7	-26.1	173.8	-69.8	178.5	0	0	0	112.7	F670 M787 F793 A829 V830 A831 F911	F670-L833 HydrophobicContact CE2-CD1 4.24Å; F670-L833 HydrophobicContact CZ-CD1 4.16Å; M787-L833 HydrophobicContact CE-CD1 3.78Å; M787-L833 HydrophobicContact SD-CD1 3.8Å; M787-L833 HydrophobicContact SD-CG 4.26Å; F793-L833 HydrophobicContact CE2-CD2 3.86Å; F793-L833 HydrophobicContact CE2-CG 4.39Å; A829-L833 PolarHBondContact O-N 3.06Å; V830-L833 PolarHBondContact O-N 3.15Å; A831-L833 PolarHBondContact O-N 3.01Å; L833-F911 HydrophobicContact CD1-CE2 3.76Å; L833-F911 HydrophobicContact CD1-CZ 3.49Å; L833-F911 VanDerWaalsContact CD1-CZ 3.49Å
834	F	94.9	Very high	96.7	Very high	19 Å²	19	17.8 Å²	17.8	8%	0.083	8%	0.077	C	C	.	.	H	α-helix	trans	-121.4	-18.3	-174.5	-58.3	-73.9	0	0	0	113.7	Y668 R735 E736 W739 V830 A831 L832 F911 I915	Y668-F834 AromaticContact CD1-CE1 3.74Å; Y668-F834 HydrophobicContact CD1-CE1 3.74Å; Y668-F834 AromaticContact CD1-CZ 3.67Å; Y668-F834 HydrophobicContact CD1-CZ 3.67Å; Y668-F834 AromaticContact CE1-CE1 3.71Å; Y668-F834 HydrophobicContact CE1-CE1 3.71Å; Y668-F834 AromaticContact CE1-CZ 3.75Å; Y668-F834 HydrophobicContact CE1-CZ 3.75Å; R735-F834 HydrophobicContact CG-CD1 4.39Å; E736-F834 VanDerWaalsContact CB-O 3.23Å; E736-F834 WeakPolarHBondContact CB-O 3.37Å; E736-F834 WeakPolarHBondContact CG-O 3.25Å; W739-F834 HydrophobicContact CE3-CB 4.14Å; W739-F834 HydrophobicContact CE3-CD2 4.24Å; W739-F834 HydrophobicContact CE3-CG 4.45Å; W739-F834 AromaticContact CH2-CD2 3.71Å; W739-F834 HydrophobicContact CH2-CD2 3.71Å; W739-F834 AromaticContact CH2-CE2 3.99Å; W739-F834 HydrophobicContact CH2-CE2 3.99Å; W739-F834 HydrophobicContact CH2-CG 4.47Å; W739-F834 HydrophobicContact CZ3-CB 4.2Å; W739-F834 AromaticContact CZ3-CD2 3.47Å; W739-F834 HydrophobicContact CZ3-CD2 3.47Å; W739-F834 VanDerWaalsContact CZ3-CD2 3.47Å; W739-F834 HydrophobicContact CZ3-CE2 4.21Å; W739-F834 HydrophobicContact CZ3-CG 4.1Å; V830-F834 WeakPolarHBondContact O-CD2 3.41Å; A831-F834 PolarHBondContact O-N 3.22Å; A831-F834 VanDerWaalsContact O-N 3.12Å; L832-F834 VanDerWaalsContact C-N 3.27Å; L832-F834 PolarHBondContact O-N 2.97Å; F834-F911 HydrophobicContact CE2-CZ 4.05Å; F834-F911 HydrophobicContact CZ-CE1 4.13Å; F834-F911 HydrophobicContact CZ-CZ 4.07Å; F834-I915 HydrophobicContact CE2-CG2 3.88Å; F834-I915 HydrophobicContact CZ-CG2 3.8Å
835	L	97	Very high	96.8	Very high	9 Å²	9	17.8 Å²	17.8	5%	0.047	8%	0.077	C	C	.	.	S	Bend	trans	-122.8	151	-174.2	-56.8	178	0	0	0	110.9	E736 W739 R740 I743 A831 D839 A840 C843	E736-L835 HydrophobicContact CG-CD2 4.38Å; W739-L835 HydrophobicContact CB-CD2 4.22Å; R740-L835 HydrophobicContact CB-CD2 4.19Å; I743-L835 HydrophobicContact CD1-CD1 3.77Å; A831-L835 HydrophobicContact CB-CD1 4.45Å; A831-L835 VanDerWaalsContact O-CB 3.28Å; A831-L835 WeakPolarHBondContact O-CB 3.48Å; A831-L835 PolarHBondContact O-N 3.46Å; L835-D839 HydrophobicContact CB-CB 3.96Å; L835-A840 HydrophobicContact CB-CB 4.31Å; L835-C843 HydrophobicContact CD1-CB 3.78Å
836	R	96.1	Very high	96.9	Very high	132 Å²	132	17.8 Å²	17.8	50%	0.498	8%	0.077	S	C	.	.			trans	-65.8	157.2	170.4	-58.3	175.6	-60	164	7	109.8	E838 D839 A840	R836-E838 VanDerWaalsContact C-N 3.29Å; R836-E838 PolarHBondContact O-N 2.94Å; R836-E838 VanDerWaalsContact O-N 3.13Å; R836-D839 IonicContact CZ-OD2 3.66Å; R836-D839 VanDerWaalsContact CZ-OD2 3.26Å; R836-D839 IonicContact NE-OD2 3.3Å; R836-D839 PolarHBondContact NE-OD2 3.25Å; R836-D839 IonicContact NH2-OD1 2.65Å; R836-D839 IonicContact NH2-OD2 2.88Å; R836-D839 PolarHBondContact NH2-OD2 3.39Å; R836-D839 CarbonylContact O-C 3.56Å; R836-D839 WeakPolarHBondContact O-CA 3.26Å; R836-D839 PolarHBondContact O-N 3.21Å; R836-A840 WeakPolarHBondContact O-CB 3.47Å; R836-A840 PolarHBondContact O-N 3.14Å
837	K	95.8	Very high	97	Very high	75 Å²	75	16.5 Å²	16.5	33%	0.326	7%	0.071	S	C	.	.	H	α-helix	trans	-51.7	-42.1	-173.6	65.1	177.8	-172.1	170.5	0	114.6	Y759 K803 E806 V807 L832 A840 F841	Y759-K837 HydrophobicContact CE1-CD 4.17Å; Y759-K837 HydrophobicContact CE1-CG 4.08Å; K803-K837 HydrophobicContact CB-CB 4.5Å; K803-K837 HydrophobicContact CG-CB 4.5Å; E806-K837 WeakPolarHBondContact OE2-CD 3.44Å; E806-K837 IonicContact OE2-NZ 2.79Å; E806-K837 PolarHBondContact OE2-NZ 3.43Å; V807-K837 HydrophobicContact CG2-CB 4.23Å; V807-K837 VanDerWaalsContact CG2-O 3.26Å; V807-K837 WeakPolarHBondContact CG2-O 3.31Å; L832-K837 HydrophobicContact CD2-CB 4.19Å; K837-A840 PolarHBondContact O-N 2.9Å; K837-F841 PolarHBondContact O-N 3.16Å
838	E	96.6	Very high	96.9	Very high	62 Å²	62	16.8 Å²	16.8	29%	0.29	7%	0.073	S	C	.	.	H	α-helix	trans	-69.8	-44	177.2	-175.9	-179	175.4	0	0	112	Y759 R836 A840 F841 W842	Y759-E838 HydrophobicContact CD1-CB 4Å; Y759-E838 HydrophobicContact CD1-CG 4.12Å; Y759-E838 HydrophobicContact CE1-CB 4.4Å; Y759-E838 HydrophobicContact CG-CB 4.37Å; Y759-E838 HydrophobicContact CG-CG 4.1Å; R836-E838 VanDerWaalsContact C-N 3.29Å; R836-E838 PolarHBondContact O-N 2.94Å; R836-E838 VanDerWaalsContact O-N 3.13Å; E838-A840 VanDerWaalsContact C-N 3.26Å; E838-A840 PolarHBondContact O-N 3.45Å; E838-F841 WeakPolarHBondContact O-CB 3.24Å; E838-F841 PolarHBondContact O-N 2.97Å; E838-F841 VanDerWaalsContact O-N 3.17Å; E838-W842 PolarHBondContact O-N 3.33Å
839	D	97.7	Very high	96.8	Very high	4 Å²	4	19.8 Å²	19.8	2%	0.021	9%	0.087	C	C	.	.	H	α-helix	trans	-63.9	-33.6	175.9	-66.2	-57.5	0	0	0	111.2	R740 H744 L835 R836 W842 C843	R740-D839 IonicContact CZ-OD1 2.69Å; R740-D839 IonicContact NE-OD1 3.57Å; R740-D839 PolarHBondContact NE-OD1 3.16Å; R740-D839 IonicContact NE-OD2 3.77Å; R740-D839 PolarHBondContact NE-OD2 3.29Å; H744-D839 IonicContact CD2-OD1 3.21Å; H744-D839 IonicContact CE1-OD1 2.7Å; H744-D839 PolarHBondContact CE1-OD1 3.27Å; H744-D839 VanDerWaalsContact CE1-OD1 3.26Å; H744-D839 IonicContact NE2-OD1 2.56Å; H744-D839 PolarHBondContact NE2-OD1 3.42Å; L835-D839 HydrophobicContact CB-CB 3.96Å; R836-D839 IonicContact CZ-OD2 3.66Å; R836-D839 VanDerWaalsContact CZ-OD2 3.26Å; R836-D839 IonicContact NE-OD2 3.3Å; R836-D839 PolarHBondContact NE-OD2 3.25Å; R836-D839 IonicContact NH2-OD1 2.65Å; R836-D839 IonicContact NH2-OD2 2.88Å; R836-D839 PolarHBondContact NH2-OD2 3.39Å; R836-D839 CarbonylContact O-C 3.56Å; R836-D839 WeakPolarHBondContact O-CA 3.26Å; R836-D839 PolarHBondContact O-N 3.21Å; D839-W842 PolarHBondContact O-N 3.3Å; D839-C843 WeakPolarHBondContact O-CB 3.49Å; D839-C843 PolarHBondContact O-N 3.21Å
840	A	98.1	Very high	96.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.9	-35.5	173.7	0	0	0	0	0	112.5	V807 A831 L832 L835 R836 K837 E838 C843 L844	V807-A840 HydrophobicContact CG2-CB 4.47Å; A831-A840 HydrophobicContact CB-CB 3.86Å; L832-A840 HydrophobicContact CD2-CB 3.72Å; L832-A840 HydrophobicContact CG-CB 3.87Å; L835-A840 HydrophobicContact CB-CB 4.31Å; R836-A840 WeakPolarHBondContact O-CB 3.47Å; R836-A840 PolarHBondContact O-N 3.14Å; K837-A840 PolarHBondContact O-N 2.9Å; E838-A840 VanDerWaalsContact C-N 3.26Å; E838-A840 PolarHBondContact O-N 3.45Å; A840-C843 WeakPolarHBondContact O-CB 3.38Å; A840-C843 PolarHBondContact O-N 2.82Å; A840-L844 PolarHBondContact O-N 2.74Å
841	F	98.1	Very high	96.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62	-46.8	170	163.8	-99.8	0	0	0	111.6	Y758 Y759 L762 V807 A810 H814 K837 E838 C843 L844 I845	Y758-F841 HydrophobicContact CD1-CE1 4.22Å; Y758-F841 HydrophobicContact CD1-CZ 4.37Å; Y758-F841 HydrophobicContact CE1-CE1 4.37Å; Y758-F841 HydrophobicContact CE1-CZ 4.12Å; Y759-F841 HydrophobicContact CD2-CB 3.72Å; Y759-F841 AromaticContact CD2-CD1 3.66Å; Y759-F841 HydrophobicContact CD2-CD1 3.66Å; Y759-F841 AromaticContact CD2-CD2 3.9Å; Y759-F841 HydrophobicContact CD2-CD2 3.9Å; Y759-F841 HydrophobicContact CD2-CE1 4.19Å; Y759-F841 HydrophobicContact CD2-CE2 4.41Å; Y759-F841 AromaticContact CD2-CG 3.48Å; Y759-F841 HydrophobicContact CD2-CG 3.48Å; Y759-F841 VanDerWaalsContact CD2-CG 3.48Å; Y759-F841 HydrophobicContact CE2-CB 3.71Å; Y759-F841 HydrophobicContact CE2-CD1 4.49Å; Y759-F841 HydrophobicContact CE2-CD2 4.15Å; Y759-F841 AromaticContact CE2-CG 3.88Å; Y759-F841 HydrophobicContact CE2-CG 3.88Å; Y759-F841 HydrophobicContact CG-CD1 4.3Å; Y759-F841 HydrophobicContact CG-CG 4.48Å; L762-F841 HydrophobicContact CD1-CE1 4.4Å; L762-F841 HydrophobicContact CD1-CE2 3.97Å; L762-F841 HydrophobicContact CD1-CZ 3.5Å; V807-F841 HydrophobicContact CG1-CB 4.23Å; V807-F841 HydrophobicContact CG2-CB 4.47Å; A810-F841 HydrophobicContact CB-CD2 3.89Å; A810-F841 HydrophobicContact CB-CE2 3.86Å; H814-F841 HydrophobicContact CB-CE2 4.18Å; H814-F841 HydrophobicContact CB-CZ 4.21Å; K837-F841 PolarHBondContact O-N 3.16Å; E838-F841 WeakPolarHBondContact O-CB 3.24Å; E838-F841 PolarHBondContact O-N 2.97Å; E838-F841 VanDerWaalsContact O-N 3.17Å; F841-C843 VanDerWaalsContact C-N 3.32Å; F841-C843 PolarHBondContact O-N 3.26Å; F841-L844 WeakPolarHBondContact O-CB 3.13Å; F841-L844 PolarHBondContact O-N 3.32Å; F841-I845 HydrophobicContact CD1-CD1 4.07Å; F841-I845 HydrophobicContact CD2-CD1 4.39Å; F841-I845 HydrophobicContact CE1-CD1 3.47Å; F841-I845 VanDerWaalsContact CE1-CD1 3.47Å; F841-I845 HydrophobicContact CE2-CD1 3.83Å; F841-I845 HydrophobicContact CE2-CG1 4.48Å; F841-I845 HydrophobicContact CZ-CD1 3.35Å; F841-I845 HydrophobicContact CZ-CG1 4.43Å; F841-I845 PolarHBondContact O-N 3.3Å
842	W	98	Very high	96.4	Very high	4 Å²	4	27 Å²	27	2%	0.015	12%	0.115	C	C	.	.	H	α-helix	trans	-65	-35.8	174.5	-67.2	116.9	0	0	0	112.4	I743 L747 L750 M751 K754 Y758 E838 D839 I845 A846	I743-W842 HydrophobicContact CG2-CB 4.24Å; L747-W842 HydrophobicContact CD1-CB 4.16Å; L747-W842 HydrophobicContact CD1-CE3 4.01Å; L747-W842 WeakPolarHBondContact CD1-O 3.49Å; L750-W842 HydrophobicContact CD2-CZ3 4.3Å; L750-W842 HydrophobicContact CG-CZ3 4.4Å; M751-W842 HydrophobicContact CE-CD2 4.1Å; M751-W842 HydrophobicContact CE-CG 4.04Å; M751-W842 HydrophobicContact CG-CD2 3.95Å; M751-W842 HydrophobicContact CG-CE3 3.88Å; M751-W842 HydrophobicContact CG-CH2 3.99Å; M751-W842 HydrophobicContact CG-CZ2 4.08Å; M751-W842 HydrophobicContact CG-CZ3 3.9Å; M751-W842 HydrophobicContact SD-CD2 4.29Å; M751-W842 HydrophobicContact SD-CG 4.4Å; K754-W842 HydrophobicContact CB-CH2 4.15Å; K754-W842 HydrophobicContact CG-CH2 4.43Å; Y758-W842 AromaticContact CD1-CH2 3.75Å; Y758-W842 HydrophobicContact CD1-CH2 3.75Å; Y758-W842 HydrophobicContact CD1-CZ2 4.16Å; Y758-W842 HydrophobicContact CE1-CH2 4.4Å; E838-W842 PolarHBondContact O-N 3.33Å; D839-W842 PolarHBondContact O-N 3.3Å; W842-I845 HydrophobicContact CE3-CD1 3.75Å; W842-I845 HydrophobicContact CZ3-CD1 3.9Å; W842-I845 PolarHBondContact O-N 3.43Å; W842-A846 PolarHBondContact O-N 3.43Å
843	C	98.2	Very high	96.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.1	-48.3	172.2	-173.8	0	0	0	0	111.3	I743 A831 L835 D839 A840 F841 I845 A846 I847	I743-C843 HydrophobicContact CD1-CB 3.58Å; I743-C843 WeakPolarHBondContact CD1-SG 3.47Å; I743-C843 HydrophobicContact CG1-CB 4.48Å; A831-C843 HydrophobicContact CB-CB 3.96Å; L835-C843 HydrophobicContact CD1-CB 3.78Å; D839-C843 WeakPolarHBondContact O-CB 3.49Å; D839-C843 PolarHBondContact O-N 3.21Å; A840-C843 WeakPolarHBondContact O-CB 3.38Å; A840-C843 PolarHBondContact O-N 2.82Å; F841-C843 VanDerWaalsContact C-N 3.32Å; F841-C843 PolarHBondContact O-N 3.26Å; C843-I845 VanDerWaalsContact C-N 3.32Å; C843-I845 PolarHBondContact O-N 3.48Å; C843-A846 PolarHBondContact O-N 2.85Å; C843-I847 VanDerWaalsContact O-CG1 3.32Å; C843-I847 WeakPolarHBondContact O-CG1 3.48Å; C843-I847 PolarHBondContact O-N 3.5Å
844	L	97.5	Very high	95.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.6	-44.8	177.7	-173	62.9	0	0	0	110.9	V807 L808 Y811 I827 A828 A840 F841 I847 L848	V807-L844 HydrophobicContact CG1-CD2 4.22Å; L808-L844 HydrophobicContact CD2-CD2 4.27Å; Y811-L844 HydrophobicContact CD1-CD2 4.33Å; Y811-L844 HydrophobicContact CD2-CD2 3.88Å; Y811-L844 HydrophobicContact CD2-CG 4.02Å; Y811-L844 HydrophobicContact CE2-CG 4.4Å; Y811-L844 HydrophobicContact CG-CD2 3.7Å; Y811-L844 HydrophobicContact CG-CG 4.3Å; I827-L844 HydrophobicContact CB-CD1 3.98Å; I827-L844 HydrophobicContact CG2-CD1 3.74Å; A828-L844 HydrophobicContact CB-CD2 4.36Å; A840-L844 PolarHBondContact O-N 2.74Å; F841-L844 WeakPolarHBondContact O-CB 3.13Å; F841-L844 PolarHBondContact O-N 3.32Å; L844-I847 PolarHBondContact O-N 3.04Å; L844-L848 HydrophobicContact CD1-CD1 3.58Å; L844-L848 HydrophobicContact CD1-CG 3.99Å; L844-L848 HydrophobicContact CG-CD1 3.75Å; L844-L848 HydrophobicContact CG-CG 4.35Å; L844-L848 WeakPolarHBondContact O-CB 3.44Å; L844-L848 WeakPolarHBondContact O-CG 3.47Å; L844-L848 PolarHBondContact O-N 2.99Å
845	I	97	Very high	95.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.8	-46.9	175	-67.9	169.8	0	0	0	111.6	L747 L750 Y811 H814 F841 W842 C843 I847 L848 E849	L747-I845 HydrophobicContact CD1-CB 4.19Å; L747-I845 HydrophobicContact CD1-CG2 4.04Å; L747-I845 HydrophobicContact CD2-CG2 4.19Å; L750-I845 HydrophobicContact CD2-CG2 3.88Å; Y811-I845 HydrophobicContact CD2-CG1 4.02Å; Y811-I845 HydrophobicContact CE2-CG1 4.12Å; H814-I845 WeakPolarHBondContact NE2-CD1 3.5Å; F841-I845 HydrophobicContact CD1-CD1 4.07Å; F841-I845 HydrophobicContact CD2-CD1 4.39Å; F841-I845 HydrophobicContact CE1-CD1 3.47Å; F841-I845 VanDerWaalsContact CE1-CD1 3.47Å; F841-I845 HydrophobicContact CE2-CD1 3.83Å; F841-I845 HydrophobicContact CE2-CG1 4.48Å; F841-I845 HydrophobicContact CZ-CD1 3.35Å; F841-I845 HydrophobicContact CZ-CG1 4.43Å; F841-I845 PolarHBondContact O-N 3.3Å; W842-I845 HydrophobicContact CE3-CD1 3.75Å; W842-I845 HydrophobicContact CZ3-CD1 3.9Å; W842-I845 PolarHBondContact O-N 3.43Å; C843-I845 VanDerWaalsContact C-N 3.32Å; C843-I845 PolarHBondContact O-N 3.48Å; I845-I847 VanDerWaalsContact C-N 3.32Å; I845-I847 PolarHBondContact O-N 3.36Å; I845-L848 PolarHBondContact O-N 3.37Å; I845-E849 HydrophobicContact CG2-CB 4.45Å; I845-E849 HydrophobicContact CG2-CG 4.36Å; I845-E849 WeakPolarHBondContact O-CB 3.42Å; I845-E849 PolarHBondContact O-N 2.92Å
846	A	97.1	Very high	95	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.147	C	C	.	.	I	π-helix	trans	-59.8	-44.8	-179.6	0	0	0	0	0	111.3	I743 L747 W842 C843 R850 F851	I743-A846 HydrophobicContact CG2-CB 3.94Å; L747-A846 HydrophobicContact CD1-CB 3.76Å; L747-A846 HydrophobicContact CD2-CB 4.36Å; L747-A846 HydrophobicContact CG-CB 3.95Å; W842-A846 PolarHBondContact O-N 3.43Å; C843-A846 PolarHBondContact O-N 2.85Å; A846-R850 CarbonylContact O-C 3.56Å; A846-R850 WeakPolarHBondContact O-CA 3.23Å; A846-R850 VanDerWaalsContact O-CB 3.27Å; A846-R850 WeakPolarHBondContact O-CB 3.35Å; A846-R850 PolarHBondContact O-N 2.85Å; A846-F851 HydrophobicContact CB-CE2 4.12Å; A846-F851 PolarHBondContact O-N 3.02Å
847	I	96.9	Very high	94.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	12%	0.124	C	C	.	.	I	π-helix	trans	-64.2	-48.9	179.1	-65.2	178.2	0	0	0	110.8	I827 C843 L844 I845 F851 L852 V904 W918 F921 L922	I827-I847 HydrophobicContact CD1-CG2 4.2Å; I827-I847 HydrophobicContact CG2-CB 4.38Å; I827-I847 HydrophobicContact CG2-CD1 3.56Å; I827-I847 HydrophobicContact CG2-CG2 4.18Å; C843-I847 VanDerWaalsContact O-CG1 3.32Å; C843-I847 WeakPolarHBondContact O-CG1 3.48Å; C843-I847 PolarHBondContact O-N 3.5Å; L844-I847 PolarHBondContact O-N 3.04Å; I845-I847 VanDerWaalsContact C-N 3.32Å; I845-I847 PolarHBondContact O-N 3.36Å; I847-F851 HydrophobicContact CG1-CD2 4.05Å; I847-L852 HydrophobicContact CG2-CD1 3.98Å; I847-L852 HydrophobicContact CG2-CG 4.38Å; I847-L852 VanDerWaalsContact O-CB 3.29Å; I847-L852 WeakPolarHBondContact O-CB 3.29Å; I847-L852 VanDerWaalsContact O-CG 3.27Å; I847-L852 WeakPolarHBondContact O-CG 3.38Å; I847-L852 PolarHBondContact O-N 2.85Å; I847-V904 HydrophobicContact CG2-CG2 4.27Å; I847-W918 HydrophobicContact CD1-CH2 3.75Å; I847-W918 HydrophobicContact CD1-CZ2 4.49Å; I847-W918 HydrophobicContact CD1-CZ3 3.79Å; I847-F921 HydrophobicContact CD1-CE1 4.14Å; I847-F921 HydrophobicContact CG1-CE1 3.89Å; I847-F921 HydrophobicContact CG2-CE1 4.06Å; I847-F921 HydrophobicContact CG2-CZ 4.07Å; I847-L922 HydrophobicContact CD1-CD2 4.25Å; I847-L922 HydrophobicContact CG1-CD2 4.23Å
848	L	95.1	Very high	93.9	Very high	6 Å²	6	25.7 Å²	25.7	3%	0.031	12%	0.119	C	C	.	.	I	π-helix	trans	-79	-30.8	-171.4	-62.1	-174.9	0	0	0	114	Y811 M824 I827 L844 I845 L852 F857	Y811-L848 HydrophobicContact CD1-CD1 4.47Å; Y811-L848 HydrophobicContact CD2-CD1 4.46Å; Y811-L848 HydrophobicContact CE1-CD1 3.74Å; Y811-L848 HydrophobicContact CE2-CB 4.43Å; Y811-L848 HydrophobicContact CE2-CD1 3.71Å; Y811-L848 VanDerWaalsContact OH-CD1 3.28Å; Y811-L848 WeakPolarHBondContact OH-CD1 3.06Å; M824-L848 HydrophobicContact CE-CD1 3.96Å; M824-L848 HydrophobicContact CG-CD1 4.05Å; M824-L848 HydrophobicContact SD-CD1 4.15Å; I827-L848 HydrophobicContact CD1-CD2 3.97Å; L844-L848 HydrophobicContact CD1-CD1 3.58Å; L844-L848 HydrophobicContact CD1-CG 3.99Å; L844-L848 HydrophobicContact CG-CD1 3.75Å; L844-L848 HydrophobicContact CG-CG 4.35Å; L844-L848 WeakPolarHBondContact O-CB 3.44Å; L844-L848 WeakPolarHBondContact O-CG 3.47Å; L844-L848 PolarHBondContact O-N 2.99Å; I845-L848 PolarHBondContact O-N 3.37Å; L848-L852 HydrophobicContact CD2-CD1 4.22Å; L848-F857 HydrophobicContact CD2-CD2 3.45Å; L848-F857 VanDerWaalsContact CD2-CD2 3.45Å; L848-F857 HydrophobicContact CD2-CE2 3.09Å; L848-F857 HydrophobicContact CD2-CG 4.41Å; L848-F857 HydrophobicContact CD2-CZ 3.8Å
849	E	94.2	Very high	92.8	Very high	63 Å²	63	29.4 Å²	29.4	29%	0.294	15%	0.152	S	C	.	.	I	π-helix	trans	-114.6	-14.6	-171.8	-54	-166.7	169.4	0	0	114.3	H814 N815 I845	H814-E849 IonicContact CD2-OE1 4Å; H814-E849 IonicContact NE2-OE1 3.85Å; H814-E849 IonicContact NE2-OE2 2.84Å; N815-E849 PolarHBondContact ND2-OE1 3.47Å; I845-E849 HydrophobicContact CG2-CB 4.45Å; I845-E849 HydrophobicContact CG2-CG 4.36Å; I845-E849 WeakPolarHBondContact O-CB 3.42Å; I845-E849 PolarHBondContact O-N 2.92Å
850	R	94.2	Very high	91.8	Very high	126 Å²	126	29.8 Å²	29.8	48%	0.475	16%	0.157	S	C	.	.	I	π-helix	trans	-116.7	-46.1	179.3	-56.4	-64.6	176	170	-4.1	113.4	E746 L747 A846	E746-R850 HydrophobicContact CG-CB 3.88Å; E746-R850 HydrophobicContact CG-CG 4.12Å; L747-R850 HydrophobicContact CD2-CG 3.56Å; A846-R850 CarbonylContact O-C 3.56Å; A846-R850 WeakPolarHBondContact O-CA 3.23Å; A846-R850 VanDerWaalsContact O-CB 3.27Å; A846-R850 WeakPolarHBondContact O-CB 3.35Å; A846-R850 PolarHBondContact O-N 2.85Å
851	F	94.3	Very high	91.3	Very high	21 Å²	21	31.8 Å²	31.8	9%	0.092	17%	0.167	C	C	.	.	I	π-helix	trans	-85.2	-43.6	-176.7	-59.9	-36.7	0	0	0	112.9	E746 A846 I847 F921 L922 S926	E746-F851 HydrophobicContact CB-CZ 4.44Å; E746-F851 HydrophobicContact CG-CE1 3.88Å; E746-F851 HydrophobicContact CG-CZ 4.24Å; A846-F851 HydrophobicContact CB-CE2 4.12Å; A846-F851 PolarHBondContact O-N 3.02Å; I847-F851 HydrophobicContact CG1-CD2 4.05Å; F851-F921 HydrophobicContact CB-CE2 4.21Å; F851-F921 HydrophobicContact CB-CZ 3.82Å; F851-F921 HydrophobicContact CD2-CE1 4.09Å; F851-F921 HydrophobicContact CD2-CZ 4.18Å; F851-F921 HydrophobicContact CG-CZ 4.39Å; F851-L922 HydrophobicContact CD2-CD2 4.37Å; F851-L922 HydrophobicContact CE2-CD2 3.75Å; F851-L922 WeakPolarHBondContact CZ-O 3.49Å; F851-S926 WeakPolarHBondContact O-CB 3.35Å; F851-S926 PolarHBondContact O-OG 3.07Å
852	L	94.3	Very high	90.8	Very high	6 Å²	6	32.1 Å²	32.1	3%	0.031	17%	0.169	C	C	.	.	S	Bend	trans	-86.7	150.5	174	-62.3	175.3	0	0	0	110.4	I847 L848 Y856 F857 L929	I847-L852 HydrophobicContact CG2-CD1 3.98Å; I847-L852 HydrophobicContact CG2-CG 4.38Å; I847-L852 VanDerWaalsContact O-CB 3.29Å; I847-L852 WeakPolarHBondContact O-CB 3.29Å; I847-L852 VanDerWaalsContact O-CG 3.27Å; I847-L852 WeakPolarHBondContact O-CG 3.38Å; I847-L852 PolarHBondContact O-N 2.85Å; L848-L852 HydrophobicContact CD2-CD1 4.22Å; L852-Y856 HydrophobicContact CB-CD1 4.5Å; L852-Y856 HydrophobicContact CB-CD2 4.32Å; L852-Y856 HydrophobicContact CB-CG 4.1Å; L852-Y856 HydrophobicContact CD1-CD1 3.89Å; L852-Y856 HydrophobicContact CD1-CE1 4.25Å; L852-Y856 HydrophobicContact CD1-CG 4.31Å; L852-Y856 HydrophobicContact CD2-CD1 4.44Å; L852-Y856 HydrophobicContact CD2-CE1 4.23Å; L852-Y856 HydrophobicContact CD2-CE2 4.37Å; L852-F857 HydrophobicContact CD1-CE2 3.8Å; L852-L929 HydrophobicContact CD2-CD1 4Å
853	P	92.1	Very high	90.5	Very high	28 Å²	28	32.6 Å²	32.6	18%	0.182	17%	0.172	C	C	.	.			trans	-54.5	151.2	171.2	-26.2	32.8	0	0	0	113.6	N855 Y856 D863	P853-N855 VanDerWaalsContact C-N 3.3Å; P853-N855 PolarHBondContact O-N 3.04Å; P853-N855 VanDerWaalsContact O-N 3.16Å; P853-Y856 HydrophobicContact CB-CD2 4.24Å; P853-Y856 HydrophobicContact CG-CD2 3.98Å; P853-Y856 HydrophobicContact CG-CE2 4.33Å; P853-Y856 WeakPolarHBondContact O-CB 3.47Å; P853-Y856 PolarHBondContact O-N 3.48Å; P853-D863 HydrophobicContact CB-CB 3.6Å; P853-D863 WeakPolarHBondContact CB-OD2 3.3Å; P853-D863 HydrophobicContact CG-CB 4.18Å
854	E	86.5	Confident	90.4	Very high	142 Å²	142	32.6 Å²	32.6	66%	0.664	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-36.3	-172.3	-170.4	-172.4	158.5	0	0	114.3
855	N	85.6	Confident	90.2	Very high	30 Å²	30	36.2 Å²	36.2	16%	0.16	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	25.1	-175	-56.3	-72.5	0	0	0	112.9	P853 F857 N858 I862 D863	P853-N855 VanDerWaalsContact C-N 3.3Å; P853-N855 PolarHBondContact O-N 3.04Å; P853-N855 VanDerWaalsContact O-N 3.16Å; N855-F857 PolarHBondContact O-N 3.44Å; N855-N858 HydrophobicContact CB-CB 4.4Å; N855-N858 PolarHBondContact O-OD1 3.25Å; N855-I862 HydrophobicContact CB-CG2 3.76Å; N855-D863 VanDerWaalsContact CA-OD2 3.25Å; N855-D863 WeakPolarHBondContact CA-OD2 3.37Å; N855-D863 WeakPolarHBondContact CB-OD2 3.39Å; N855-D863 PolarHBondContact N-OD2 3.43Å
856	Y	90.9	Very high	90.2	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-40.4	-176.9	-142.1	-101	0	0	0	113.5	L852 P853 L861 D863 A864 D867 F901 L902	L852-Y856 HydrophobicContact CB-CD1 4.5Å; L852-Y856 HydrophobicContact CB-CD2 4.32Å; L852-Y856 HydrophobicContact CB-CG 4.1Å; L852-Y856 HydrophobicContact CD1-CD1 3.89Å; L852-Y856 HydrophobicContact CD1-CE1 4.25Å; L852-Y856 HydrophobicContact CD1-CG 4.31Å; L852-Y856 HydrophobicContact CD2-CD1 4.44Å; L852-Y856 HydrophobicContact CD2-CE1 4.23Å; L852-Y856 HydrophobicContact CD2-CE2 4.37Å; P853-Y856 HydrophobicContact CB-CD2 4.24Å; P853-Y856 HydrophobicContact CG-CD2 3.98Å; P853-Y856 HydrophobicContact CG-CE2 4.33Å; P853-Y856 WeakPolarHBondContact O-CB 3.47Å; P853-Y856 PolarHBondContact O-N 3.48Å; Y856-L861 VanDerWaalsContact O-CD2 3.32Å; Y856-L861 WeakPolarHBondContact O-CD2 3.4Å; Y856-D863 HydrophobicContact CD2-CB 3.83Å; Y856-A864 HydrophobicContact CD1-CB 3.89Å; Y856-A864 HydrophobicContact CD2-CB 4.21Å; Y856-A864 HydrophobicContact CE1-CB 3.62Å; Y856-A864 VanDerWaalsContact CE2-CA 3.45Å; Y856-A864 HydrophobicContact CE2-CB 3.96Å; Y856-A864 HydrophobicContact CG-CB 4.17Å; Y856-D867 HydrophobicContact CE2-CB 4.21Å; Y856-D867 WeakPolarHBondContact CE2-OD2 3.37Å; Y856-F901 HydrophobicContact CE1-CB 4.43Å; Y856-F901 WeakPolarHBondContact OH-CB 3.04Å; Y856-F901 WeakPolarHBondContact OH-CD2 3.38Å; Y856-L902 HydrophobicContact CD1-CD2 3.88Å; Y856-L902 HydrophobicContact CE1-CD2 3.83Å
857	F	87.8	Confident	90.2	Very high	6 Å²	6	36.3 Å²	36.3	3%	0.026	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	20.4	-178.2	-71	-90.8	0	0	0	113.4	I818 C821 M824 I827 L848 L852 N855 L902	I818-F857 HydrophobicContact CG2-CB 4.11Å; I818-F857 WeakPolarHBondContact CG2-O 3.12Å; C821-F857 HydrophobicContact CB-CB 4.02Å; C821-F857 HydrophobicContact CB-CD1 3.83Å; C821-F857 HydrophobicContact CB-CG 4.39Å; M824-F857 HydrophobicContact CE-CB 3.46Å; M824-F857 VanDerWaalsContact CE-CB 3.46Å; M824-F857 HydrophobicContact CE-CD1 3.88Å; M824-F857 HydrophobicContact CE-CD2 4.36Å; M824-F857 HydrophobicContact CE-CG 3.65Å; M824-F857 HydrophobicContact CG-CD1 4.16Å; M824-F857 HydrophobicContact CG-CE1 4.17Å; I827-F857 HydrophobicContact CD1-CZ 4.07Å; L848-F857 HydrophobicContact CD2-CD2 3.45Å; L848-F857 VanDerWaalsContact CD2-CD2 3.45Å; L848-F857 HydrophobicContact CD2-CE2 3.09Å; L848-F857 HydrophobicContact CD2-CG 4.41Å; L848-F857 HydrophobicContact CD2-CZ 3.8Å; L852-F857 HydrophobicContact CD1-CE2 3.8Å; N855-F857 PolarHBondContact O-N 3.44Å; F857-L902 HydrophobicContact CD1-CD2 4.28Å; F857-L902 HydrophobicContact CE1-CD2 3.82Å; F857-L902 HydrophobicContact CZ-CD2 3.98Å; F857-L902 WeakPolarHBondContact CZ-O 3.32Å
858	N	82.1	Confident	90.2	Very high	40 Å²	40	36.6 Å²	36.6	21%	0.214	19%	0.191	C	C	.	.	S	Bend	trans	-67.1	171.4	173.2	79.8	-0.2	0	0	0	111	N855 G860 L861 I862	N855-N858 HydrophobicContact CB-CB 4.4Å; N855-N858 PolarHBondContact O-OD1 3.25Å; N858-G860 PolarHBondContact O-N 3.2Å; N858-G860 WeakPolarHBondContact OD1-CA 3.21Å; N858-G860 PolarHBondContact OD1-N 3.3Å; N858-L861 PolarHBondContact O-N 3.3Å; N858-L861 WeakPolarHBondContact OD1-CA 3.2Å; N858-L861 PolarHBondContact OD1-N 3.45Å; N858-I862 WeakPolarHBondContact ND2-CG2 3.48Å; N858-I862 PolarHBondContact OD1-N 3.27Å; N858-I862 VanDerWaalsContact OD1-N 3.17Å
859	S	73.5	Confident	90.3	Very high	140 Å²	140	38.6 Å²	38.6	98%	0.979	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-19.7	-178.1	64.2	0	0	0	0	114.7
860	G	76.7	Confident	90.5	Very high	12 Å²	12	35.6 Å²	35.6	12%	0.124	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-5.6	178.1	0	0	0	0	0	114.9	N858 I862 Q865	N858-G860 PolarHBondContact O-N 3.2Å; N858-G860 WeakPolarHBondContact OD1-CA 3.21Å; N858-G860 PolarHBondContact OD1-N 3.3Å; G860-I862 PolarHBondContact O-N 3.49Å; G860-I862 VanDerWaalsContact O-N 3.17Å; G860-Q865 PolarHBondContact O-NE2 2.77Å
861	L	86.3	Confident	90.7	Very high	42 Å²	42	29.6 Å²	29.6	22%	0.22	16%	0.164	C	C	.	.			trans	46.9	37.7	-169.4	-55.3	176.5	0	0	0	112.5	Y856 N858 D863 A864 Q865 L902	Y856-L861 VanDerWaalsContact O-CD2 3.32Å; Y856-L861 WeakPolarHBondContact O-CD2 3.4Å; N858-L861 PolarHBondContact O-N 3.3Å; N858-L861 WeakPolarHBondContact OD1-CA 3.2Å; N858-L861 PolarHBondContact OD1-N 3.45Å; L861-D863 PolarHBondContact O-N 2.84Å; L861-A864 HydrophobicContact CB-CB 4.17Å; L861-A864 WeakPolarHBondContact O-CB 3.43Å; L861-A864 PolarHBondContact O-N 2.84Å; L861-A864 VanDerWaalsContact O-N 3.07Å; L861-Q865 WeakPolarHBondContact O-CG 3.41Å; L861-Q865 PolarHBondContact O-N 3.37Å; L861-L902 HydrophobicContact CD1-CD1 4.17Å; L861-L902 HydrophobicContact CD2-CD2 4.34Å
862	I	88.1	Confident	90.8	Very high	8 Å²	8	31.6 Å²	31.6	4%	0.041	17%	0.173	C	C	.	.	H	α-helix	trans	-62.4	-43.7	-163.5	-164.4	169.4	0	0	0	111.8	N855 N858 G860 A864 Q865 V866 Y995 L998 M1002	N855-I862 HydrophobicContact CB-CG2 3.76Å; N858-I862 WeakPolarHBondContact ND2-CG2 3.48Å; N858-I862 PolarHBondContact OD1-N 3.27Å; N858-I862 VanDerWaalsContact OD1-N 3.17Å; G860-I862 PolarHBondContact O-N 3.49Å; G860-I862 VanDerWaalsContact O-N 3.17Å; I862-A864 VanDerWaalsContact C-N 3.3Å; I862-A864 PolarHBondContact O-N 2.86Å; I862-Q865 WeakPolarHBondContact O-CB 3.38Å; I862-Q865 PolarHBondContact O-N 3.5Å; I862-V866 VanDerWaalsContact O-CG2 3.32Å; I862-V866 WeakPolarHBondContact O-CG2 3.41Å; I862-V866 PolarHBondContact O-N 3.11Å; I862-Y995 HydrophobicContact CD1-CE2 4.28Å; I862-Y995 HydrophobicContact CG1-CE2 4.5Å; I862-Y995 HydrophobicContact CG2-CD2 4.34Å; I862-Y995 HydrophobicContact CG2-CE2 3.74Å; I862-L998 HydrophobicContact CD1-CB 4.26Å; I862-L998 HydrophobicContact CG1-CB 4.1Å; I862-M1002 HydrophobicContact CB-SD 4.4Å; I862-M1002 HydrophobicContact CD1-SD 4.09Å; I862-M1002 HydrophobicContact CG1-SD 4.3Å
863	D	92.9	Very high	91	Very high	14 Å²	14	34 Å²	34	8%	0.075	19%	0.185	C	C	.	.	H	α-helix	trans	-71.6	-28.9	179.5	-70.4	-16.2	0	0	0	111.8	P853 N855 Y856 L861 V866 D867 Y995	P853-D863 HydrophobicContact CB-CB 3.6Å; P853-D863 WeakPolarHBondContact CB-OD2 3.3Å; P853-D863 HydrophobicContact CG-CB 4.18Å; N855-D863 VanDerWaalsContact CA-OD2 3.25Å; N855-D863 WeakPolarHBondContact CA-OD2 3.37Å; N855-D863 WeakPolarHBondContact CB-OD2 3.39Å; N855-D863 PolarHBondContact N-OD2 3.43Å; Y856-D863 HydrophobicContact CD2-CB 3.83Å; L861-D863 PolarHBondContact O-N 2.84Å; D863-V866 WeakPolarHBondContact O-CB 3.31Å; D863-V866 PolarHBondContact O-N 3.39Å; D863-D867 PolarHBondContact O-N 2.83Å; D863-Y995 WeakPolarHBondContact OD1-CD2 3.31Å; D863-Y995 WeakPolarHBondContact OD1-CE2 3.44Å
864	A	94.3	Very high	91.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-67	-39.3	172.5	0	0	0	0	0	111.3	Y856 L861 I862 D867 Q868 L898 L902	Y856-A864 HydrophobicContact CD1-CB 3.89Å; Y856-A864 HydrophobicContact CD2-CB 4.21Å; Y856-A864 HydrophobicContact CE1-CB 3.62Å; Y856-A864 VanDerWaalsContact CE2-CA 3.45Å; Y856-A864 HydrophobicContact CE2-CB 3.96Å; Y856-A864 HydrophobicContact CG-CB 4.17Å; L861-A864 HydrophobicContact CB-CB 4.17Å; L861-A864 WeakPolarHBondContact O-CB 3.43Å; L861-A864 PolarHBondContact O-N 2.84Å; L861-A864 VanDerWaalsContact O-N 3.07Å; I862-A864 VanDerWaalsContact C-N 3.3Å; I862-A864 PolarHBondContact O-N 2.86Å; A864-D867 PolarHBondContact O-N 3.17Å; A864-Q868 VanDerWaalsContact O-CG 3.32Å; A864-Q868 WeakPolarHBondContact O-CG 3.43Å; A864-Q868 PolarHBondContact O-N 3.4Å; A864-Q868 VanDerWaalsContact O-N 3.13Å; A864-Q868 PolarHBondContact O-NE2 3.34Å; A864-L898 HydrophobicContact CB-CD1 3.7Å; A864-L902 HydrophobicContact CB-CD2 3.96Å
865	Q	93.9	Very high	91.8	Very high	76 Å²	76	26 Å²	26	36%	0.355	15%	0.145	S	C	.	.	H	α-helix	trans	-66.8	-39.9	173	-65.4	-176.6	22.7	0	0	112.2	G860 L861 I862 D867 Q868 L869 L998	G860-Q865 PolarHBondContact O-NE2 2.77Å; L861-Q865 WeakPolarHBondContact O-CG 3.41Å; L861-Q865 PolarHBondContact O-N 3.37Å; I862-Q865 WeakPolarHBondContact O-CB 3.38Å; I862-Q865 PolarHBondContact O-N 3.5Å; Q865-D867 VanDerWaalsContact C-N 3.33Å; Q865-D867 PolarHBondContact O-N 2.92Å; Q865-Q868 WeakPolarHBondContact O-CB 3.26Å; Q865-Q868 PolarHBondContact O-N 2.84Å; Q865-Q868 VanDerWaalsContact O-N 3.11Å; Q865-L869 PolarHBondContact O-N 3.09Å; Q865-L869 VanDerWaalsContact O-N 3.11Å; Q865-L998 HydrophobicContact CB-CD1 3.87Å
866	V	96.6	Very high	92.3	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-55.4	-50.1	172	165.3	0	0	0	0	110.1	I862 D863 Q868 L869 V870 R991 H994 Y995 L998	I862-V866 VanDerWaalsContact O-CG2 3.32Å; I862-V866 WeakPolarHBondContact O-CG2 3.41Å; I862-V866 PolarHBondContact O-N 3.11Å; D863-V866 WeakPolarHBondContact O-CB 3.31Å; D863-V866 PolarHBondContact O-N 3.39Å; V866-Q868 PolarHBondContact O-N 3.04Å; V866-L869 WeakPolarHBondContact O-CB 3.28Å; V866-L869 PolarHBondContact O-N 3.07Å; V866-V870 HydrophobicContact CG1-CG2 4.4Å; V866-V870 WeakPolarHBondContact O-CG2 3.32Å; V866-V870 PolarHBondContact O-N 3.42Å; V866-R991 HydrophobicContact CG1-CB 3.97Å; V866-R991 HydrophobicContact CG1-CG 4.03Å; V866-R991 WeakPolarHBondContact CG1-O 3.41Å; V866-H994 HydrophobicContact CB-CB 4.49Å; V866-H994 HydrophobicContact CG1-CB 3.99Å; V866-H994 HydrophobicContact CG2-CB 4.31Å; V866-Y995 HydrophobicContact CG2-CD2 4.26Å; V866-L998 HydrophobicContact CG2-CD1 3.76Å
867	D	97	Very high	92.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.9	-31.2	178	-85.3	4.7	0	0	0	112.3	Y856 D863 A864 Q865 V870 L871 F901 F930 R991	Y856-D867 HydrophobicContact CE2-CB 4.21Å; Y856-D867 WeakPolarHBondContact CE2-OD2 3.37Å; D863-D867 PolarHBondContact O-N 2.83Å; A864-D867 PolarHBondContact O-N 3.17Å; Q865-D867 VanDerWaalsContact C-N 3.33Å; Q865-D867 PolarHBondContact O-N 2.92Å; D867-V870 PolarHBondContact O-N 3.38Å; D867-L871 VanDerWaalsContact O-CB 3.29Å; D867-L871 WeakPolarHBondContact O-CB 3.37Å; D867-L871 PolarHBondContact O-N 3.44Å; D867-F901 HydrophobicContact CB-CD2 3.98Å; D867-F901 HydrophobicContact CB-CE2 4.12Å; D867-F930 HydrophobicContact CB-CE1 4.32Å; D867-F930 HydrophobicContact CB-CZ 3.91Å; D867-F930 WeakPolarHBondContact O-CE1 3.41Å; D867-R991 IonicContact OD1-CZ 3.28Å; D867-R991 IonicContact OD1-NE 3.35Å; D867-R991 PolarHBondContact OD1-NE 2.89Å; D867-R991 IonicContact OD1-NH2 3.61Å; D867-R991 PolarHBondContact OD1-NH2 3.45Å; D867-R991 IonicContact OD2-CZ 3.89Å; D867-R991 IonicContact OD2-NE 3.49Å; D867-R991 IonicContact OD2-NH2 3.91Å; D867-R991 PolarHBondContact OD2-NH2 2.98Å
868	Q	97.8	Very high	93	Very high	6 Å²	6	35.7 Å²	35.7	3%	0.028	19%	0.188	C	C	.	.	H	α-helix	trans	-67.9	-36.7	172.7	-59.3	-41.8	-64.4	0	0	113.4	A864 Q865 V866 L871 K872 S894 T897 L898	A864-Q868 VanDerWaalsContact O-CG 3.32Å; A864-Q868 WeakPolarHBondContact O-CG 3.43Å; A864-Q868 PolarHBondContact O-N 3.4Å; A864-Q868 VanDerWaalsContact O-N 3.13Å; A864-Q868 PolarHBondContact O-NE2 3.34Å; Q865-Q868 WeakPolarHBondContact O-CB 3.26Å; Q865-Q868 PolarHBondContact O-N 2.84Å; Q865-Q868 VanDerWaalsContact O-N 3.11Å; V866-Q868 PolarHBondContact O-N 3.04Å; Q868-L871 PolarHBondContact O-N 3.22Å; Q868-K872 WeakPolarHBondContact O-CG 3.34Å; Q868-K872 PolarHBondContact O-N 3.47Å; Q868-S894 VanDerWaalsContact CB-OG 3.3Å; Q868-S894 WeakPolarHBondContact CB-OG 3.35Å; Q868-T897 VanDerWaalsContact OE1-C 3.28Å; Q868-T897 PolarHBondContact OE1-OG1 2.84Å; Q868-L898 HydrophobicContact CG-CB 4.2Å; Q868-L898 HydrophobicContact CG-CD1 3.95Å
869	L	97.3	Very high	93.7	Very high	47 Å²	47	33.9 Å²	33.9	25%	0.246	18%	0.178	C	C	.	.	H	α-helix	trans	-67.8	-42.7	174.9	-64.4	179.5	0	0	0	111.1	Q865 V866 L871 K872 E873 H994 L998	Q865-L869 PolarHBondContact O-N 3.09Å; Q865-L869 VanDerWaalsContact O-N 3.11Å; V866-L869 WeakPolarHBondContact O-CB 3.28Å; V866-L869 PolarHBondContact O-N 3.07Å; L869-L871 VanDerWaalsContact C-N 3.33Å; L869-L871 PolarHBondContact O-N 3.08Å; L869-K872 HydrophobicContact CD2-CD 4.38Å; L869-K872 WeakPolarHBondContact O-CB 3.49Å; L869-K872 PolarHBondContact O-N 2.93Å; L869-E873 PolarHBondContact O-N 3.47Å; L869-E873 VanDerWaalsContact O-N 3.11Å; L869-H994 HydrophobicContact CB-CB 4.35Å; L869-H994 HydrophobicContact CD1-CB 4.08Å; L869-L998 HydrophobicContact CD1-CD1 3.66Å; L869-L998 HydrophobicContact CD1-CD2 4.27Å; L869-L998 HydrophobicContact CD1-CG 3.96Å
870	V	97.9	Very high	94.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.7	-44.1	173.6	179.6	0	0	0	0	110.5	V866 D867 K872 E873 I874 F930 I987 R990 R991	V866-V870 HydrophobicContact CG1-CG2 4.4Å; V866-V870 WeakPolarHBondContact O-CG2 3.32Å; V866-V870 PolarHBondContact O-N 3.42Å; D867-V870 PolarHBondContact O-N 3.38Å; V870-K872 VanDerWaalsContact C-N 3.32Å; V870-K872 PolarHBondContact O-N 3.29Å; V870-E873 WeakPolarHBondContact O-CB 3.3Å; V870-E873 PolarHBondContact O-N 3.28Å; V870-E873 VanDerWaalsContact O-N 3.16Å; V870-I874 HydrophobicContact CG1-CD1 4.05Å; V870-I874 HydrophobicContact CG1-CG1 4.47Å; V870-I874 WeakPolarHBondContact O-CG1 3.41Å; V870-I874 PolarHBondContact O-N 3.4Å; V870-F930 HydrophobicContact CB-CE1 3.86Å; V870-F930 HydrophobicContact CB-CZ 4.24Å; V870-F930 HydrophobicContact CG1-CD1 4.43Å; V870-F930 HydrophobicContact CG1-CE1 3.74Å; V870-F930 HydrophobicContact CG1-CZ 4.06Å; V870-I987 HydrophobicContact CG1-CG2 4.36Å; V870-R990 HydrophobicContact CG1-CB 4.23Å; V870-R990 HydrophobicContact CG2-CB 3.88Å; V870-R991 HydrophobicContact CG2-CG 4.08Å
871	L	98.1	Very high	95.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.9	-43.5	176.5	178	63.4	0	0	0	111.5	D867 Q868 L869 E873 I874 V875 T897 F901 F930 A933 V934	D867-L871 VanDerWaalsContact O-CB 3.29Å; D867-L871 WeakPolarHBondContact O-CB 3.37Å; D867-L871 PolarHBondContact O-N 3.44Å; Q868-L871 PolarHBondContact O-N 3.22Å; L869-L871 VanDerWaalsContact C-N 3.33Å; L869-L871 PolarHBondContact O-N 3.08Å; L871-E873 VanDerWaalsContact C-N 3.31Å; L871-E873 PolarHBondContact O-N 2.85Å; L871-I874 PolarHBondContact O-N 2.59Å; L871-V875 HydrophobicContact CD1-CG2 4.18Å; L871-V875 HydrophobicContact CG-CG2 4.34Å; L871-V875 WeakPolarHBondContact O-CB 3.23Å; L871-V875 VanDerWaalsContact O-CG2 3.31Å; L871-V875 WeakPolarHBondContact O-CG2 3.36Å; L871-V875 PolarHBondContact O-N 2.69Å; L871-T897 HydrophobicContact CD2-CG2 3.9Å; L871-F901 HydrophobicContact CD1-CZ 4.36Å; L871-F901 HydrophobicContact CD2-CE1 4.47Å; L871-F901 HydrophobicContact CD2-CZ 3.99Å; L871-F930 HydrophobicContact CB-CD1 4.02Å; L871-F930 HydrophobicContact CB-CE1 4.13Å; L871-F930 HydrophobicContact CD1-CD1 4.15Å; L871-A933 HydrophobicContact CD1-CB 3.84Å; L871-A933 HydrophobicContact CD2-CB 4.19Å; L871-V934 HydrophobicContact CD1-CG2 3.84Å
872	K	97.5	Very high	96.3	Very high	63 Å²	63	35.6 Å²	35.6	27%	0.274	17%	0.166	S	C	.	.	H	α-helix	trans	-59.9	-39.7	176.4	-75	169.1	-179.9	168.7	0	112.5	Q868 L869 V870 V875 H876 D892 I893 S894	Q868-K872 WeakPolarHBondContact O-CG 3.34Å; Q868-K872 PolarHBondContact O-N 3.47Å; L869-K872 HydrophobicContact CD2-CD 4.38Å; L869-K872 WeakPolarHBondContact O-CB 3.49Å; L869-K872 PolarHBondContact O-N 2.93Å; V870-K872 VanDerWaalsContact C-N 3.32Å; V870-K872 PolarHBondContact O-N 3.29Å; K872-V875 PolarHBondContact O-N 3.03Å; K872-H876 WeakPolarHBondContact O-CB 3.47Å; K872-H876 PolarHBondContact O-N 3.12Å; K872-D892 WeakPolarHBondContact CE-OD1 3.46Å; K872-D892 IonicContact NZ-OD1 3.91Å; K872-D892 PolarHBondContact NZ-OD1 3.4Å; K872-D892 IonicContact NZ-OD2 2.82Å; K872-D892 PolarHBondContact NZ-OD2 3.42Å; K872-I893 HydrophobicContact CG-CD1 4.29Å; K872-I893 HydrophobicContact CG-CG1 4.22Å; K872-S894 WeakPolarHBondContact CE-OG 3.28Å; K872-S894 PolarHBondContact NZ-OG 2.94Å
873	E	97.4	Very high	96.7	Very high	58 Å²	58	35.8 Å²	35.8	27%	0.271	17%	0.167	S	C	.	.	H	α-helix	trans	-64.1	-45.3	174.4	-70.1	-178.4	175.7	0	0	111.5	L869 V870 L871 V875 H876 E877 R990 H994	L869-E873 PolarHBondContact O-N 3.47Å; L869-E873 VanDerWaalsContact O-N 3.11Å; V870-E873 WeakPolarHBondContact O-CB 3.3Å; V870-E873 PolarHBondContact O-N 3.28Å; V870-E873 VanDerWaalsContact O-N 3.16Å; L871-E873 VanDerWaalsContact C-N 3.31Å; L871-E873 PolarHBondContact O-N 2.85Å; E873-V875 VanDerWaalsContact C-N 3.33Å; E873-V875 PolarHBondContact O-N 3.4Å; E873-H876 WeakPolarHBondContact O-CB 3.4Å; E873-H876 PolarHBondContact O-N 2.89Å; E873-H876 VanDerWaalsContact O-N 3.13Å; E873-E877 WeakPolarHBondContact O-CG 3.4Å; E873-E877 PolarHBondContact O-N 2.95Å; E873-R990 WeakPolarHBondContact OE2-CD 3.33Å; E873-R990 WeakPolarHBondContact OE2-CG 3.25Å; E873-R990 IonicContact OE2-NE 3.53Å; E873-H994 VanDerWaalsContact CD-NE2 3.32Å; E873-H994 IonicContact OE1-CD2 2.67Å; E873-H994 IonicContact OE1-CE1 2.76Å; E873-H994 PolarHBondContact OE1-CE1 3.4Å; E873-H994 VanDerWaalsContact OE1-CE1 3.29Å; E873-H994 IonicContact OE1-NE2 3.1Å; E873-H994 PolarHBondContact OE1-NE2 3.48Å; E873-H994 IonicContact OE2-NE2 2.68Å
874	I	97.9	Very high	96.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.2	-40.9	178.4	-58.4	174.1	0	0	0	110.6	V870 L871 H876 E877 K878 F930 V934 F981 P982	V870-I874 HydrophobicContact CG1-CD1 4.05Å; V870-I874 HydrophobicContact CG1-CG1 4.47Å; V870-I874 WeakPolarHBondContact O-CG1 3.41Å; V870-I874 PolarHBondContact O-N 3.4Å; L871-I874 PolarHBondContact O-N 2.59Å; I874-H876 VanDerWaalsContact C-N 3.31Å; I874-H876 PolarHBondContact O-N 3.29Å; I874-E877 PolarHBondContact O-N 3.47Å; I874-K878 HydrophobicContact CG2-CG 3.99Å; I874-K878 VanDerWaalsContact O-CB 3.24Å; I874-K878 WeakPolarHBondContact O-CB 3.32Å; I874-K878 WeakPolarHBondContact O-CG 3.19Å; I874-K878 PolarHBondContact O-N 2.79Å; I874-F930 HydrophobicContact CD1-CB 4.01Å; I874-F930 HydrophobicContact CD1-CD1 3.76Å; I874-F930 HydrophobicContact CD1-CE1 4.46Å; I874-F930 HydrophobicContact CD1-CG 4.02Å; I874-V934 HydrophobicContact CB-CG2 4.4Å; I874-V934 HydrophobicContact CG2-CG2 3.77Å; I874-F981 HydrophobicContact CD1-CE1 4.49Å; I874-F981 HydrophobicContact CD1-CZ 4.31Å; I874-F981 HydrophobicContact CG2-CE2 3.88Å; I874-F981 HydrophobicContact CG2-CZ 3.88Å; I874-P982 HydrophobicContact CD1-CG 4.36Å; I874-P982 HydrophobicContact CG1-CG 4.13Å; I874-P982 HydrophobicContact CG2-CG 4.44Å
875	V	97.7	Very high	97	Very high	2 Å²	2	39 Å²	39	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-38.4	174.3	171.1	0	0	0	0	110.9	L871 K872 E873 L879 I893 V934 L937	L871-V875 HydrophobicContact CD1-CG2 4.18Å; L871-V875 HydrophobicContact CG-CG2 4.34Å; L871-V875 WeakPolarHBondContact O-CB 3.23Å; L871-V875 VanDerWaalsContact O-CG2 3.31Å; L871-V875 WeakPolarHBondContact O-CG2 3.36Å; L871-V875 PolarHBondContact O-N 2.69Å; K872-V875 PolarHBondContact O-N 3.03Å; E873-V875 VanDerWaalsContact C-N 3.33Å; E873-V875 PolarHBondContact O-N 3.4Å; V875-L879 HydrophobicContact CG1-CB 4.41Å; V875-L879 CarbonylContact O-C 3.46Å; V875-L879 VanDerWaalsContact O-CA 3.28Å; V875-L879 WeakPolarHBondContact O-CA 3.48Å; V875-L879 WeakPolarHBondContact O-CB 3.4Å; V875-L879 PolarHBondContact O-N 3Å; V875-I893 HydrophobicContact CG2-CD1 4.09Å; V875-V934 HydrophobicContact CG2-CG2 4.08Å; V875-L937 HydrophobicContact CG1-CD1 4.45Å; V875-L937 HydrophobicContact CG2-CD1 3.68Å
876	H	97	Very high	97.1	Very high	88 Å²	88	35.9 Å²	35.9	41%	0.407	18%	0.175	S	C	.	.	H	α-helix	trans	-63.1	-41.6	175	-173.9	61.9	0	0	0	112.3	K872 E873 I874 P880 S883	K872-H876 WeakPolarHBondContact O-CB 3.47Å; K872-H876 PolarHBondContact O-N 3.12Å; E873-H876 WeakPolarHBondContact O-CB 3.4Å; E873-H876 PolarHBondContact O-N 2.89Å; E873-H876 VanDerWaalsContact O-N 3.13Å; I874-H876 VanDerWaalsContact C-N 3.31Å; I874-H876 PolarHBondContact O-N 3.29Å; H876-P880 WeakPolarHBondContact O-CA 3.47Å; H876-P880 WeakPolarHBondContact O-CB 3.38Å; H876-S883 PolarHBondContact ND1-OG 3.42Å; H876-S883 VanDerWaalsContact ND1-OG 3.11Å
877	E	96.2	Very high	97.1	Very high	98 Å²	98	42.9 Å²	42.9	46%	0.458	21%	0.205	S	C	.	.	H	α-helix	trans	-72.7	-41	178.6	-70.3	174	163.3	0	0	113	E873 I874 R990	E873-E877 WeakPolarHBondContact O-CG 3.4Å; E873-E877 PolarHBondContact O-N 2.95Å; I874-E877 PolarHBondContact O-N 3.47Å; E877-R990 VanDerWaalsContact CD-NH2 3.28Å; E877-R990 IonicContact OE1-CZ 2.68Å; E877-R990 IonicContact OE1-NH1 3.21Å; E877-R990 IonicContact OE1-NH2 3.75Å; E877-R990 PolarHBondContact OE1-NH2 3.21Å; E877-R990 IonicContact OE2-CZ 3.05Å; E877-R990 IonicContact OE2-NH1 2.73Å; E877-R990 PolarHBondContact OE2-NH1 3.05Å; E877-R990 IonicContact OE2-NH2 3.07Å; E877-R990 PolarHBondContact OE2-NH2 3.48Å; E877-R990 VanDerWaalsContact OE2-NH2 3.15Å
878	K	96.5	Very high	97	Very high	53 Å²	53	50.3 Å²	50.3	23%	0.23	23%	0.233	C	C	.	.	H	α-helix	trans	-91.1	-32.2	-172.3	-66.9	-69.5	169.7	-175.4	0	113.8	I874 P880 V934 L978 P980	I874-K878 HydrophobicContact CG2-CG 3.99Å; I874-K878 VanDerWaalsContact O-CB 3.24Å; I874-K878 WeakPolarHBondContact O-CB 3.32Å; I874-K878 WeakPolarHBondContact O-CG 3.19Å; I874-K878 PolarHBondContact O-N 2.79Å; K878-P880 VanDerWaalsContact C-CD 3.47Å; K878-V934 HydrophobicContact CB-CG1 3.91Å; K878-V934 HydrophobicContact CG-CG1 4.35Å; K878-L978 HydrophobicContact CB-CD2 4.28Å; K878-L978 HydrophobicContact CD-CD2 4.25Å; K878-L978 WeakPolarHBondContact CE-O 3.41Å; K878-L978 HydrophobicContact CG-CD2 4.44Å; K878-L978 PolarHBondContact NZ-O 2.96Å; K878-P980 VanDerWaalsContact CE-O 3.32Å; K878-P980 WeakPolarHBondContact CE-O 3.42Å; K878-P980 PolarHBondContact NZ-O 2.91Å
879	L	96.9	Very high	96.8	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.016	24%	0.238	C	C	.	.			trans	-133	59.2	-174.9	-49.5	174.1	0	0	0	109.9	V875 R881 L882 S883 V934 L937 K938 Q941	V875-L879 HydrophobicContact CG1-CB 4.41Å; V875-L879 CarbonylContact O-C 3.46Å; V875-L879 VanDerWaalsContact O-CA 3.28Å; V875-L879 WeakPolarHBondContact O-CA 3.48Å; V875-L879 WeakPolarHBondContact O-CB 3.4Å; V875-L879 PolarHBondContact O-N 3Å; L879-R881 VanDerWaalsContact C-N 3.27Å; L879-R881 PolarHBondContact O-N 3.34Å; L879-L882 HydrophobicContact CB-CB 4.04Å; L879-L882 HydrophobicContact CD1-CD2 4.11Å; L879-L882 PolarHBondContact O-N 3.4Å; L879-S883 PolarHBondContact O-N 3.48Å; L879-V934 HydrophobicContact CD1-CG1 4.11Å; L879-V934 HydrophobicContact CG-CG1 4.36Å; L879-L937 HydrophobicContact CD1-CB 3.6Å; L879-K938 HydrophobicContact CD1-CB 4.23Å; L879-K938 HydrophobicContact CD2-CB 3.74Å; L879-K938 HydrophobicContact CD2-CD 4.25Å; L879-K938 HydrophobicContact CD2-CG 3.95Å; L879-Q941 VanDerWaalsContact CD2-OE1 3.23Å
880	P	97.4	Very high	96.6	Very high	67 Å²	67	52.2 Å²	52.2	44%	0.435	26%	0.26	S	S	.	.	H	α-helix	trans	-61	-32.8	-171.4	23.1	-34.6	0	0	0	113.7	H876 K878 S884	H876-P880 WeakPolarHBondContact O-CA 3.47Å; H876-P880 WeakPolarHBondContact O-CB 3.38Å; K878-P880 VanDerWaalsContact C-CD 3.47Å; P880-S884 WeakPolarHBondContact O-CB 3.37Å; P880-S884 PolarHBondContact O-N 3.11Å; P880-S884 PolarHBondContact O-OG 2.95Å
881	R	97.4	Very high	96.4	Very high	163 Å²	163	52.9 Å²	52.9	62%	0.615	26%	0.264	S	S	*	.	H	α-helix	trans	-63	-48.4	174.5	-68.5	177.8	67.3	-165	-2.2	110.8	L879 S884 H885 L945	L879-R881 VanDerWaalsContact C-N 3.27Å; L879-R881 PolarHBondContact O-N 3.34Å; R881-S884 PolarHBondContact O-N 3.46Å; R881-H885 WeakPolarHBondContact O-CB 3.42Å; R881-H885 PolarHBondContact O-N 2.79Å; R881-L945 HydrophobicContact CB-CD1 4.21Å; R881-L945 HydrophobicContact CB-CD2 4.35Å
882	L	96.8	Very high	96.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-41.6	178.6	-175.2	61.6	0	0	0	111.5	L879 S884 H885 L886 L937 Q941 L944 L945 F953	L879-L882 HydrophobicContact CB-CB 4.04Å; L879-L882 HydrophobicContact CD1-CD2 4.11Å; L879-L882 PolarHBondContact O-N 3.4Å; L882-S884 VanDerWaalsContact C-N 3.34Å; L882-S884 PolarHBondContact O-N 2.98Å; L882-H885 WeakPolarHBondContact O-CB 3.15Å; L882-H885 PolarHBondContact O-N 3.12Å; L882-H885 VanDerWaalsContact O-N 3.17Å; L882-L886 HydrophobicContact CG-CD1 4.22Å; L882-L886 WeakPolarHBondContact O-CB 3.42Å; L882-L886 VanDerWaalsContact O-CG 3.29Å; L882-L886 WeakPolarHBondContact O-CG 3.5Å; L882-L886 PolarHBondContact O-N 3.24Å; L882-L937 HydrophobicContact CD2-CB 4.02Å; L882-L937 HydrophobicContact CD2-CD2 4.32Å; L882-Q941 HydrophobicContact CB-CG 4.33Å; L882-L944 HydrophobicContact CD1-CB 3.83Å; L882-L944 HydrophobicContact CD1-CD1 4.39Å; L882-L944 HydrophobicContact CD2-CD1 4.27Å; L882-L945 HydrophobicContact CD1-CD2 4.44Å; L882-F953 HydrophobicContact CD1-CE2 4.12Å; L882-F953 HydrophobicContact CD1-CZ 4.47Å
883	S	96.5	Very high	96	Very high	11 Å²	11	53.7 Å²	53.7	8%	0.077	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-44.5	174.9	-177.6	0	0	0	0	112.2	H876 L879 H885 L886 K887	H876-S883 PolarHBondContact ND1-OG 3.42Å; H876-S883 VanDerWaalsContact ND1-OG 3.11Å; L879-S883 PolarHBondContact O-N 3.48Å; S883-H885 VanDerWaalsContact C-N 3.34Å; S883-L886 PolarHBondContact O-N 3.02Å; S883-K887 WeakPolarHBondContact O-CG 3.28Å; S883-K887 PolarHBondContact O-N 3.19Å; S883-K887 VanDerWaalsContact O-N 3.09Å
884	S	97.1	Very high	95.8	Very high	68 Å²	68	51.8 Å²	51.8	48%	0.476	26%	0.264	S	S	.	.	H	α-helix	trans	-64.6	-39.1	175.5	-58.8	0	0	0	0	112.1	P880 R881 L882 K887 R888	P880-S884 WeakPolarHBondContact O-CB 3.37Å; P880-S884 PolarHBondContact O-N 3.11Å; P880-S884 PolarHBondContact O-OG 2.95Å; R881-S884 PolarHBondContact O-N 3.46Å; L882-S884 VanDerWaalsContact C-N 3.34Å; L882-S884 PolarHBondContact O-N 2.98Å; S884-K887 PolarHBondContact O-N 2.89Å; S884-R888 WeakPolarHBondContact O-CB 3.36Å; S884-R888 PolarHBondContact O-N 2.91Å
885	H	96.7	Very high	95.5	Very high	15 Å²	15	55.6 Å²	55.6	7%	0.069	30%	0.295	C	S	.	.	H	α-helix	trans	-65.1	-44.9	177	-172.1	76.8	0	0	0	112.7	R881 L882 S883 K887 R888 L889 L944 L945 Q947	R881-H885 WeakPolarHBondContact O-CB 3.42Å; R881-H885 PolarHBondContact O-N 2.79Å; L882-H885 WeakPolarHBondContact O-CB 3.15Å; L882-H885 PolarHBondContact O-N 3.12Å; L882-H885 VanDerWaalsContact O-N 3.17Å; S883-H885 VanDerWaalsContact C-N 3.34Å; H885-K887 VanDerWaalsContact C-N 3.35Å; H885-K887 PolarHBondContact O-N 3Å; H885-R888 PolarHBondContact CE1-NH2 3.11Å; H885-R888 PolarHBondContact ND1-NH2 2.83Å; H885-R888 WeakPolarHBondContact O-CB 3.49Å; H885-R888 PolarHBondContact O-N 3.26Å; H885-L889 WeakPolarHBondContact O-CG 3.48Å; H885-L889 PolarHBondContact O-N 3.35Å; H885-L944 PolarHBondContact NE2-O 3.07Å; H885-L944 VanDerWaalsContact NE2-O 3.1Å; H885-L945 HydrophobicContact CB-CD2 3.68Å; H885-L945 PolarHBondContact CE1-O 3.27Å; H885-L945 PolarHBondContact NE2-O 2.88Å; H885-Q947 PolarHBondContact CE1-O 3.11Å; H885-Q947 PolarHBondContact NE2-O 2.94Å
886	L	95.9	Very high	95.2	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.052	30%	0.302	C	S	.	.	H	α-helix	trans	-56.3	-48	173.5	-74.8	166	0	0	0	111.4	L882 S883 R888 L889 G890 I891 I893 F953	L882-L886 HydrophobicContact CG-CD1 4.22Å; L882-L886 WeakPolarHBondContact O-CB 3.42Å; L882-L886 VanDerWaalsContact O-CG 3.29Å; L882-L886 WeakPolarHBondContact O-CG 3.5Å; L882-L886 PolarHBondContact O-N 3.24Å; S883-L886 PolarHBondContact O-N 3.02Å; L886-R888 PolarHBondContact O-N 3.44Å; L886-L889 CarbonylContact O-C 3.59Å; L886-L889 PolarHBondContact O-N 3.39Å; L886-G890 PolarHBondContact O-N 2.95Å; L886-I891 HydrophobicContact CD2-CB 3.78Å; L886-I891 HydrophobicContact CD2-CG2 3.52Å; L886-I891 PolarHBondContact O-N 3.15Å; L886-I893 HydrophobicContact CD1-CG2 3.48Å; L886-I893 VanDerWaalsContact CD1-CG2 3.48Å; L886-I893 HydrophobicContact CD2-CG2 3.52Å; L886-I893 HydrophobicContact CG-CG2 4.14Å; L886-F953 HydrophobicContact CD2-CE1 3.61Å; L886-F953 HydrophobicContact CD2-CE2 3.94Å; L886-F953 HydrophobicContact CD2-CZ 3.28Å; L886-F953 HydrophobicContact CG-CZ 4.24Å
887	K	94.9	Very high	95.1	Very high	148 Å²	148	52.5 Å²	52.5	64%	0.643	28%	0.283	S	S	*	.	H	α-helix	trans	-59.9	-43.9	175.6	-72.6	177.2	-178.3	179.9	0	111.9	S883 S884 H885 L889 G890	S883-K887 WeakPolarHBondContact O-CG 3.28Å; S883-K887 PolarHBondContact O-N 3.19Å; S883-K887 VanDerWaalsContact O-N 3.09Å; S884-K887 PolarHBondContact O-N 2.89Å; H885-K887 VanDerWaalsContact C-N 3.35Å; H885-K887 PolarHBondContact O-N 3Å; K887-L889 VanDerWaalsContact C-N 3.3Å; K887-L889 PolarHBondContact O-N 2.92Å; K887-G890 PolarHBondContact O-N 3.16Å; K887-G890 VanDerWaalsContact O-N 3.11Å
888	R	95.5	Very high	95	Very high	156 Å²	156	50.1 Å²	50.1	59%	0.589	27%	0.273	S	S	*	.	H	α-helix	trans	-62.5	-36.4	178.4	-173.9	-177.8	62.5	73.1	0.7	112.4	S884 H885 L886 G890	S884-R888 WeakPolarHBondContact O-CB 3.36Å; S884-R888 PolarHBondContact O-N 2.91Å; H885-R888 PolarHBondContact CE1-NH2 3.11Å; H885-R888 PolarHBondContact ND1-NH2 2.83Å; H885-R888 WeakPolarHBondContact O-CB 3.49Å; H885-R888 PolarHBondContact O-N 3.26Å; L886-R888 PolarHBondContact O-N 3.44Å; R888-G890 VanDerWaalsContact C-N 3.32Å
889	L	93.5	Very high	94.8	Very high	24 Å²	24	51 Å²	51	13%	0.126	28%	0.28	C	S	.	.	H	α-helix	trans	-83.7	-5.5	176.6	-64.3	-179.1	0	0	0	113.4	H885 L886 K887 I891 S948 T950 F953	H885-L889 WeakPolarHBondContact O-CG 3.48Å; H885-L889 PolarHBondContact O-N 3.35Å; L886-L889 CarbonylContact O-C 3.59Å; L886-L889 PolarHBondContact O-N 3.39Å; K887-L889 VanDerWaalsContact C-N 3.3Å; K887-L889 PolarHBondContact O-N 2.92Å; L889-I891 VanDerWaalsContact C-N 3.25Å; L889-I891 HydrophobicContact CB-CD1 3.66Å; L889-I891 HydrophobicContact CB-CG1 3.68Å; L889-I891 HydrophobicContact CD1-CD1 3.73Å; L889-I891 HydrophobicContact CG-CD1 4.36Å; L889-I891 PolarHBondContact O-N 2.79Å; L889-S948 WeakPolarHBondContact CD2-O 3.38Å; L889-T950 HydrophobicContact CB-CG2 4.29Å; L889-T950 WeakPolarHBondContact O-CG2 3.33Å; L889-F953 HydrophobicContact CD1-CB 4.36Å; L889-F953 HydrophobicContact CD1-CD2 4.22Å; L889-F953 HydrophobicContact CD1-CG 4.49Å
890	G	92.9	Very high	94.7	Very high	69 Å²	69	51 Å²	51	71%	0.711	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	27.5	-174.3	0	0	0	0	0	113.3	L886 K887 R888	L886-G890 PolarHBondContact O-N 2.95Å; K887-G890 PolarHBondContact O-N 3.16Å; K887-G890 VanDerWaalsContact O-N 3.11Å; R888-G890 VanDerWaalsContact C-N 3.32Å
891	I	94.1	Very high	94.7	Very high	15 Å²	15	47.9 Å²	47.9	8%	0.077	26%	0.259	C	S	.	.			trans	-93.1	121.6	-176.1	-64.2	178.7	0	0	0	109.8	L886 L889 T950 F953 W954	L886-I891 HydrophobicContact CD2-CB 3.78Å; L886-I891 HydrophobicContact CD2-CG2 3.52Å; L886-I891 PolarHBondContact O-N 3.15Å; L889-I891 VanDerWaalsContact C-N 3.25Å; L889-I891 HydrophobicContact CB-CD1 3.66Å; L889-I891 HydrophobicContact CB-CG1 3.68Å; L889-I891 HydrophobicContact CD1-CD1 3.73Å; L889-I891 HydrophobicContact CG-CD1 4.36Å; L889-I891 PolarHBondContact O-N 2.79Å; I891-T950 HydrophobicContact CD1-CG2 4.13Å; I891-T950 HydrophobicContact CG1-CG2 3.86Å; I891-F953 HydrophobicContact CD1-CB 3.57Å; I891-F953 HydrophobicContact CD1-CD1 3.38Å; I891-F953 HydrophobicContact CD1-CD2 4.12Å; I891-F953 HydrophobicContact CD1-CE1 4.12Å; I891-F953 HydrophobicContact CD1-CG 3.4Å; I891-F953 HydrophobicContact CG2-CD1 4.07Å; I891-F953 HydrophobicContact CG2-CE1 3.97Å; I891-W954 HydrophobicContact CG2-CH2 3.72Å; I891-W954 HydrophobicContact CG2-CZ2 3.44Å; I891-W954 VanDerWaalsContact CG2-CZ2 3.44Å; I891-W954 HydrophobicContact CG2-CZ3 4.42Å
892	D	94.1	Very high	94.5	Very high	74 Å²	74	41 Å²	41	40%	0.396	24%	0.235	S	C	.	.			trans	-95.7	107.2	167.3	-170.2	-12.3	0	0	0	110.9	K872 S894 A895 W954	K872-D892 WeakPolarHBondContact CE-OD1 3.46Å; K872-D892 IonicContact NZ-OD1 3.91Å; K872-D892 PolarHBondContact NZ-OD1 3.4Å; K872-D892 IonicContact NZ-OD2 2.82Å; K872-D892 PolarHBondContact NZ-OD2 3.42Å; D892-S894 PolarHBondContact O-N 2.88Å; D892-S894 VanDerWaalsContact O-N 3.11Å; D892-S894 WeakPolarHBondContact OD1-CB 3.35Å; D892-S894 PolarHBondContact OD1-N 3.4Å; D892-S894 PolarHBondContact OD1-OG 3.18Å; D892-S894 VanDerWaalsContact OD1-OG 3.06Å; D892-A895 WeakPolarHBondContact O-CB 3.32Å; D892-A895 PolarHBondContact O-N 3.33Å; D892-A895 VanDerWaalsContact O-N 3.15Å; D892-W954 VanDerWaalsContact O-CH2 3.3Å; D892-W954 WeakPolarHBondContact O-CH2 3.33Å
893	I	94.2	Very high	94.3	Very high	6 Å²	6	41 Å²	41	3%	0.031	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.4	178.3	58.6	172	0	0	0	113.8	K872 V875 L886 A895 V896 T897 L937	K872-I893 HydrophobicContact CG-CD1 4.29Å; K872-I893 HydrophobicContact CG-CG1 4.22Å; V875-I893 HydrophobicContact CG2-CD1 4.09Å; L886-I893 HydrophobicContact CD1-CG2 3.48Å; L886-I893 VanDerWaalsContact CD1-CG2 3.48Å; L886-I893 HydrophobicContact CD2-CG2 3.52Å; L886-I893 HydrophobicContact CG-CG2 4.14Å; I893-A895 PolarHBondContact O-N 2.67Å; I893-V896 PolarHBondContact O-N 3.17Å; I893-T897 HydrophobicContact CB-CG2 4.3Å; I893-T897 PolarHBondContact O-N 3.23Å; I893-T897 PolarHBondContact O-OG1 3.45Å; I893-L937 HydrophobicContact CD1-CD1 4.48Å
894	S	93.5	Very high	94.3	Very high	17 Å²	17	40.4 Å²	40.4	12%	0.119	23%	0.231	C	C	.	.	H	α-helix	trans	-55.7	-25.8	176.4	-60.7	0	0	0	0	112.9	Q868 K872 D892 V896 T897 L898	Q868-S894 VanDerWaalsContact CB-OG 3.3Å; Q868-S894 WeakPolarHBondContact CB-OG 3.35Å; K872-S894 WeakPolarHBondContact CE-OG 3.28Å; K872-S894 PolarHBondContact NZ-OG 2.94Å; D892-S894 PolarHBondContact O-N 2.88Å; D892-S894 VanDerWaalsContact O-N 3.11Å; D892-S894 WeakPolarHBondContact OD1-CB 3.35Å; D892-S894 PolarHBondContact OD1-N 3.4Å; D892-S894 PolarHBondContact OD1-OG 3.18Å; D892-S894 VanDerWaalsContact OD1-OG 3.06Å; S894-V896 PolarHBondContact O-N 2.78Å; S894-V896 VanDerWaalsContact O-N 3.13Å; S894-T897 WeakPolarHBondContact CA-OG1 3.16Å; S894-L898 WeakPolarHBondContact O-CB 3.23Å; S894-L898 PolarHBondContact O-N 3.03Å
895	A	91.5	Very high	94.2	Very high	80 Å²	80	37.2 Å²	37.2	66%	0.661	21%	0.208	S	C	*	.	H	α-helix	trans	-60.3	-20.9	176.2	0	0	0	0	0	113.6	D892 I893 W954	D892-A895 WeakPolarHBondContact O-CB 3.32Å; D892-A895 PolarHBondContact O-N 3.33Å; D892-A895 VanDerWaalsContact O-N 3.15Å; I893-A895 PolarHBondContact O-N 2.67Å; A895-W954 HydrophobicContact CB-CH2 3.86Å; A895-W954 HydrophobicContact CB-CZ2 4.11Å
896	V	90.3	Very high	94.1	Very high	25 Å²	25	37.5 Å²	37.5	15%	0.152	21%	0.209	C	C	.	.	H	α-helix	trans	-119.2	-41.9	177.9	173.6	0	0	0	0	111.3	I893 S894 L898 N899 W900 W954	I893-V896 PolarHBondContact O-N 3.17Å; S894-V896 PolarHBondContact O-N 2.78Å; S894-V896 VanDerWaalsContact O-N 3.13Å; V896-L898 VanDerWaalsContact C-N 3.25Å; V896-L898 PolarHBondContact O-N 3.15Å; V896-N899 PolarHBondContact O-N 3.15Å; V896-W900 HydrophobicContact CG1-CZ2 3.66Å; V896-W900 VanDerWaalsContact CG1-NE1 3.32Å; V896-W900 PolarHBondContact O-N 3.07Å; V896-W954 HydrophobicContact CB-CZ3 4Å; V896-W954 HydrophobicContact CG2-CE3 3.75Å; V896-W954 HydrophobicContact CG2-CH2 4.11Å; V896-W954 HydrophobicContact CG2-CZ3 3.33Å
897	T	95	Very high	93.5	Very high	1 Å²	1	42 Å²	42	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-70.2	-20.2	-175.5	57.5	0	0	0	0	113.5	Q868 L871 I893 S894 W900 F901	Q868-T897 VanDerWaalsContact OE1-C 3.28Å; Q868-T897 PolarHBondContact OE1-OG1 2.84Å; L871-T897 HydrophobicContact CD2-CG2 3.9Å; I893-T897 HydrophobicContact CB-CG2 4.3Å; I893-T897 PolarHBondContact O-N 3.23Å; I893-T897 PolarHBondContact O-OG1 3.45Å; S894-T897 WeakPolarHBondContact CA-OG1 3.16Å; T897-W900 HydrophobicContact CG2-CD2 4.15Å; T897-W900 HydrophobicContact CG2-CE3 3.72Å; T897-W900 HydrophobicContact CG2-CH2 4.01Å; T897-W900 HydrophobicContact CG2-CZ2 4.38Å; T897-W900 HydrophobicContact CG2-CZ3 3.68Å; T897-W900 WeakPolarHBondContact O-CB 3.49Å; T897-W900 PolarHBondContact O-N 3.22Å; T897-F901 PolarHBondContact O-N 3.41Å
898	L	94.5	Very high	93.2	Very high	47 Å²	47	35.3 Å²	35.3	25%	0.246	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-46.6	172.6	-179.2	64.2	0	0	0	111.3	A864 Q868 S894 V896 W900 F901 L902	A864-L898 HydrophobicContact CB-CD1 3.7Å; Q868-L898 HydrophobicContact CG-CB 4.2Å; Q868-L898 HydrophobicContact CG-CD1 3.95Å; S894-L898 WeakPolarHBondContact O-CB 3.23Å; S894-L898 PolarHBondContact O-N 3.03Å; V896-L898 VanDerWaalsContact C-N 3.25Å; V896-L898 PolarHBondContact O-N 3.15Å; L898-W900 VanDerWaalsContact C-N 3.29Å; L898-W900 PolarHBondContact O-N 3.4Å; L898-F901 PolarHBondContact O-N 3.49Å; L898-L902 HydrophobicContact CD1-CD1 4.17Å; L898-L902 HydrophobicContact CD1-CG 4.28Å; L898-L902 HydrophobicContact CD2-CD1 4.44Å; L898-L902 HydrophobicContact CG-CD1 3.86Å; L898-L902 HydrophobicContact CG-CG 4.38Å; L898-L902 WeakPolarHBondContact O-CG 3.44Å; L898-L902 PolarHBondContact O-N 3.13Å
899	N	92.3	Very high	93.1	Very high	72 Å²	72	28.6 Å²	28.6	39%	0.385	18%	0.181	S	C	.	.	H	α-helix	trans	-66.3	-33.1	177.6	-172.1	67.9	0	0	0	112	V896 F901 A903	V896-N899 PolarHBondContact O-N 3.15Å; N899-F901 PolarHBondContact O-N 3.47Å; N899-A903 WeakPolarHBondContact O-CB 3.32Å; N899-A903 PolarHBondContact O-N 3.44Å
900	W	95.4	Very high	92.9	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.015	18%	0.182	C	C	.	.	H	α-helix	trans	-59.1	-37.5	174.7	-60.5	-1.7	0	0	0	111.4	V896 T897 L898 V904 F905 S908 A933 I936 L957 T961	V896-W900 HydrophobicContact CG1-CZ2 3.66Å; V896-W900 VanDerWaalsContact CG1-NE1 3.32Å; V896-W900 PolarHBondContact O-N 3.07Å; T897-W900 HydrophobicContact CG2-CD2 4.15Å; T897-W900 HydrophobicContact CG2-CE3 3.72Å; T897-W900 HydrophobicContact CG2-CH2 4.01Å; T897-W900 HydrophobicContact CG2-CZ2 4.38Å; T897-W900 HydrophobicContact CG2-CZ3 3.68Å; T897-W900 WeakPolarHBondContact O-CB 3.49Å; T897-W900 PolarHBondContact O-N 3.22Å; L898-W900 VanDerWaalsContact C-N 3.29Å; L898-W900 PolarHBondContact O-N 3.4Å; W900-V904 CarbonylContact O-C 3.48Å; W900-V904 WeakPolarHBondContact O-CA 3.45Å; W900-V904 PolarHBondContact O-N 2.88Å; W900-F905 HydrophobicContact CB-CD1 3.93Å; W900-F905 HydrophobicContact CB-CE1 3.79Å; W900-F905 HydrophobicContact CB-CG 4.46Å; W900-F905 HydrophobicContact CB-CZ 4.2Å; W900-F905 HydrophobicContact CD2-CD1 4.36Å; W900-F905 AromaticContact CD2-CE1 3.85Å; W900-F905 HydrophobicContact CD2-CE1 3.85Å; W900-F905 HydrophobicContact CE3-CD1 4.5Å; W900-F905 AromaticContact CE3-CE1 3.58Å; W900-F905 HydrophobicContact CE3-CE1 3.58Å; W900-F905 HydrophobicContact CE3-CZ 4.17Å; W900-F905 HydrophobicContact CG-CD1 4.13Å; W900-F905 AromaticContact CG-CE1 3.97Å; W900-F905 HydrophobicContact CG-CE1 3.97Å; W900-F905 HydrophobicContact CZ3-CE1 4.45Å; W900-F905 PolarHBondContact O-N 3.01Å; W900-S908 VanDerWaalsContact CD1-CB 3.47Å; W900-A933 HydrophobicContact CE3-CB 4.01Å; W900-A933 HydrophobicContact CZ3-CB 4.1Å; W900-I936 HydrophobicContact CH2-CG2 4.29Å; W900-L957 HydrophobicContact CH2-CD1 4.26Å; W900-T961 HydrophobicContact CH2-CG2 3.6Å; W900-T961 HydrophobicContact CZ2-CG2 3.19Å
901	F	96	Very high	92.8	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-84.7	-43.1	-178.8	-68.6	10.2	0	0	0	111.7	Y856 D867 L871 T897 L898 N899 A903 V904 F905 L929 F930 A933	Y856-F901 HydrophobicContact CE1-CB 4.43Å; Y856-F901 WeakPolarHBondContact OH-CB 3.04Å; Y856-F901 WeakPolarHBondContact OH-CD2 3.38Å; D867-F901 HydrophobicContact CB-CD2 3.98Å; D867-F901 HydrophobicContact CB-CE2 4.12Å; L871-F901 HydrophobicContact CD1-CZ 4.36Å; L871-F901 HydrophobicContact CD2-CE1 4.47Å; L871-F901 HydrophobicContact CD2-CZ 3.99Å; T897-F901 PolarHBondContact O-N 3.41Å; L898-F901 PolarHBondContact O-N 3.49Å; N899-F901 PolarHBondContact O-N 3.47Å; F901-A903 VanDerWaalsContact C-N 3.25Å; F901-A903 PolarHBondContact O-N 2.94Å; F901-V904 PolarHBondContact O-N 3.08Å; F901-V904 VanDerWaalsContact O-N 3.15Å; F901-F905 HydrophobicContact CE1-CZ 4.43Å; F901-L929 HydrophobicContact CB-CD1 4.29Å; F901-L929 HydrophobicContact CD1-CB 3.91Å; F901-L929 HydrophobicContact CD1-CD1 4.49Å; F901-L929 HydrophobicContact CD2-CB 4.49Å; F901-L929 HydrophobicContact CE1-CB 3.74Å; F901-L929 WeakPolarHBondContact CE1-O 3.2Å; F901-L929 HydrophobicContact CE2-CB 4.34Å; F901-L929 HydrophobicContact CG-CB 4.3Å; F901-L929 HydrophobicContact CG-CD1 4.24Å; F901-L929 HydrophobicContact CZ-CB 3.97Å; F901-F930 HydrophobicContact CE2-CD1 4.01Å; F901-F930 AromaticContact CE2-CE1 3.85Å; F901-F930 HydrophobicContact CE2-CE1 3.85Å; F901-F930 HydrophobicContact CE2-CG 4.46Å; F901-F930 HydrophobicContact CE2-CZ 4.14Å; F901-F930 HydrophobicContact CZ-CD1 4.04Å; F901-F930 HydrophobicContact CZ-CE1 4.34Å; F901-F930 HydrophobicContact CZ-CG 4.32Å; F901-A933 HydrophobicContact CE1-CB 3.89Å; F901-A933 HydrophobicContact CZ-CB 4.26Å
902	L	93.3	Very high	92.5	Very high	18 Å²	18	29.1 Å²	29.1	9%	0.094	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-37.1	178.4	-71.2	174	0	0	0	112.4	I827 Y856 F857 L861 A864 L898	I827-L902 WeakPolarHBondContact CD1-O 3.24Å; Y856-L902 HydrophobicContact CD1-CD2 3.88Å; Y856-L902 HydrophobicContact CE1-CD2 3.83Å; F857-L902 HydrophobicContact CD1-CD2 4.28Å; F857-L902 HydrophobicContact CE1-CD2 3.82Å; F857-L902 HydrophobicContact CZ-CD2 3.98Å; F857-L902 WeakPolarHBondContact CZ-O 3.32Å; L861-L902 HydrophobicContact CD1-CD1 4.17Å; L861-L902 HydrophobicContact CD2-CD2 4.34Å; A864-L902 HydrophobicContact CB-CD2 3.96Å; L898-L902 HydrophobicContact CD1-CD1 4.17Å; L898-L902 HydrophobicContact CD1-CG 4.28Å; L898-L902 HydrophobicContact CD2-CD1 4.44Å; L898-L902 HydrophobicContact CG-CD1 3.86Å; L898-L902 HydrophobicContact CG-CG 4.38Å; L898-L902 WeakPolarHBondContact O-CG 3.44Å; L898-L902 PolarHBondContact O-N 3.13Å
903	A	93.1	Very high	92.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	9.1	-180	0	0	0	0	0	113.2	F826 N899 F901 F905 Y906	F826-A903 HydrophobicContact CD2-CB 4.44Å; N899-A903 WeakPolarHBondContact O-CB 3.32Å; N899-A903 PolarHBondContact O-N 3.44Å; F901-A903 VanDerWaalsContact C-N 3.25Å; F901-A903 PolarHBondContact O-N 2.94Å; A903-F905 PolarHBondContact O-N 3.38Å; A903-Y906 WeakPolarHBondContact O-CB 3.46Å; A903-Y906 PolarHBondContact O-N 2.88Å
904	V	96.1	Very high	92.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	50.9	-176.3	-165.6	0	0	0	0	111	I827 I847 W900 F901 Y906 L914 W918 F921 L929	I827-V904 HydrophobicContact CD1-CG2 4.28Å; I827-V904 HydrophobicContact CG1-CG2 4.3Å; I847-V904 HydrophobicContact CG2-CG2 4.27Å; W900-V904 CarbonylContact O-C 3.48Å; W900-V904 WeakPolarHBondContact O-CA 3.45Å; W900-V904 PolarHBondContact O-N 2.88Å; F901-V904 PolarHBondContact O-N 3.08Å; F901-V904 VanDerWaalsContact O-N 3.15Å; V904-Y906 VanDerWaalsContact C-N 3.26Å; V904-Y906 PolarHBondContact O-N 3.23Å; V904-L914 WeakPolarHBondContact O-CD1 3.35Å; V904-W918 HydrophobicContact CB-CZ2 4.11Å; V904-W918 HydrophobicContact CG1-CZ2 4.39Å; V904-W918 PolarHBondContact O-NE1 3.06Å; V904-F921 HydrophobicContact CG1-CD1 3.81Å; V904-F921 HydrophobicContact CG1-CE1 3.92Å; V904-F921 HydrophobicContact CG1-CG 4.11Å; V904-F921 HydrophobicContact CG1-CZ 4.36Å; V904-F921 HydrophobicContact CG2-CE1 4.35Å; V904-F921 HydrophobicContact CG2-CZ 4.44Å; V904-L929 HydrophobicContact CG1-CD2 4.04Å
905	F	96	Very high	92.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	3.3	-177	-71.8	-88.2	0	0	0	117.3	W900 F901 A903 D907 S908 V909 L914 I917 L929 F932 A933 I936	W900-F905 HydrophobicContact CB-CD1 3.93Å; W900-F905 HydrophobicContact CB-CE1 3.79Å; W900-F905 HydrophobicContact CB-CG 4.46Å; W900-F905 HydrophobicContact CB-CZ 4.2Å; W900-F905 HydrophobicContact CD2-CD1 4.36Å; W900-F905 AromaticContact CD2-CE1 3.85Å; W900-F905 HydrophobicContact CD2-CE1 3.85Å; W900-F905 HydrophobicContact CE3-CD1 4.5Å; W900-F905 AromaticContact CE3-CE1 3.58Å; W900-F905 HydrophobicContact CE3-CE1 3.58Å; W900-F905 HydrophobicContact CE3-CZ 4.17Å; W900-F905 HydrophobicContact CG-CD1 4.13Å; W900-F905 AromaticContact CG-CE1 3.97Å; W900-F905 HydrophobicContact CG-CE1 3.97Å; W900-F905 HydrophobicContact CZ3-CE1 4.45Å; W900-F905 PolarHBondContact O-N 3.01Å; F901-F905 HydrophobicContact CE1-CZ 4.43Å; A903-F905 PolarHBondContact O-N 3.38Å; F905-D907 PolarHBondContact O-N 3.15Å; F905-S908 WeakPolarHBondContact O-CB 3.26Å; F905-S908 PolarHBondContact O-N 3.14Å; F905-S908 VanDerWaalsContact O-N 3.11Å; F905-V909 HydrophobicContact CB-CG2 4.05Å; F905-V909 HydrophobicContact CD1-CG1 4.1Å; F905-L914 VanDerWaalsContact C-CD1 3.48Å; F905-L914 HydrophobicContact CB-CD1 4.01Å; F905-I917 HydrophobicContact CB-CD1 4.02Å; F905-I917 HydrophobicContact CD1-CD1 4.34Å; F905-I917 HydrophobicContact CD2-CD1 4.1Å; F905-I917 HydrophobicContact CD2-CG2 3.97Å; F905-I917 HydrophobicContact CG-CD1 3.9Å; F905-L929 HydrophobicContact CD2-CD2 4.04Å; F905-L929 HydrophobicContact CE2-CB 4.43Å; F905-L929 HydrophobicContact CE2-CD2 3.9Å; F905-F932 HydrophobicContact CE2-CB 4.01Å; F905-F932 HydrophobicContact CZ-CB 3.9Å; F905-A933 HydrophobicContact CZ-CB 4.17Å; F905-I936 HydrophobicContact CD1-CD1 4.25Å; F905-I936 HydrophobicContact CE1-CD1 3.73Å
906	Y	93	Very high	92.8	Very high	22 Å²	22	21.9 Å²	21.9	9%	0.086	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	142.2	174.6	178.2	-88.6	0	0	0	111.3	M787 F826 V830 A903 V904 S908 L914	M787-Y906 HydrophobicContact CE-CD2 3.85Å; M787-Y906 HydrophobicContact CE-CE2 3.31Å; M787-Y906 HydrophobicContact CG-CE2 3.73Å; M787-Y906 WeakPolarHBondContact CG-OH 3.46Å; M787-Y906 PolarHBondContact N-OH 2.71Å; M787-Y906 HydrophobicContact SD-CE2 4.35Å; F826-Y906 HydrophobicContact CB-CD1 3.53Å; F826-Y906 HydrophobicContact CB-CE1 4.09Å; F826-Y906 HydrophobicContact CB-CG 3.93Å; F826-Y906 AromaticContact CD1-CD1 3.41Å; F826-Y906 HydrophobicContact CD1-CD1 3.41Å; F826-Y906 VanDerWaalsContact CD1-CD1 3.41Å; F826-Y906 AromaticContact CD1-CE1 3.07Å; F826-Y906 HydrophobicContact CD1-CE1 3.07Å; F826-Y906 HydrophobicContact CD1-CG 4.44Å; F826-Y906 AromaticContact CD1-CZ 3.91Å; F826-Y906 HydrophobicContact CD2-CD1 4.18Å; F826-Y906 HydrophobicContact CE1-CD1 4.11Å; F826-Y906 AromaticContact CE1-CE1 3.5Å; F826-Y906 HydrophobicContact CE1-CE1 3.5Å; F826-Y906 VanDerWaalsContact CE1-CE1 3.5Å; F826-Y906 AromaticContact CG-CD1 3.44Å; F826-Y906 HydrophobicContact CG-CD1 3.44Å; F826-Y906 VanDerWaalsContact CG-CD1 3.44Å; F826-Y906 AromaticContact CG-CE1 3.67Å; F826-Y906 HydrophobicContact CG-CE1 3.67Å; F826-Y906 HydrophobicContact CG-CG 4.34Å; F826-Y906 HydrophobicContact CZ-CE1 4.37Å; V830-Y906 HydrophobicContact CG2-CD2 3.67Å; V830-Y906 HydrophobicContact CG2-CE2 4.38Å; V830-Y906 HydrophobicContact CG2-CG 4.39Å; A903-Y906 WeakPolarHBondContact O-CB 3.46Å; A903-Y906 PolarHBondContact O-N 2.88Å; V904-Y906 VanDerWaalsContact C-N 3.26Å; V904-Y906 PolarHBondContact O-N 3.23Å; Y906-S908 PolarHBondContact O-N 2.97Å; Y906-S908 PolarHBondContact O-OG 3.28Å; Y906-L914 HydrophobicContact CD2-CD2 3.75Å; Y906-L914 HydrophobicContact CG-CD2 4.46Å
907	D	84.9	Confident	93.1	Very high	105 Å²	105	20.8 Å²	20.8	56%	0.561	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	5	-174.6	-163	40.3	0	0	0	115.8	F905	F905-D907 PolarHBondContact O-N 3.15Å
908	S	88.8	Confident	93.3	Very high	7 Å²	7	20.7 Å²	20.7	5%	0.049	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-32.8	-178.5	-52.6	0	0	0	0	112.4	W900 F905 Y906 T961 R962	W900-S908 VanDerWaalsContact CD1-CB 3.47Å; F905-S908 WeakPolarHBondContact O-CB 3.26Å; F905-S908 PolarHBondContact O-N 3.14Å; F905-S908 VanDerWaalsContact O-N 3.11Å; Y906-S908 PolarHBondContact O-N 2.97Å; Y906-S908 PolarHBondContact O-OG 3.28Å; S908-T961 CarbonylContact O-C 3.55Å; S908-T961 VanDerWaalsContact O-C 3.23Å; S908-T961 WeakPolarHBondContact O-CB 3.2Å; S908-T961 PolarHBondContact O-OG1 3.36Å; S908-R962 PolarHBondContact O-N 2.71Å
909	V	92.4	Very high	93.4	Very high	14 Å²	14	18.5 Å²	18.5	9%	0.085	9%	0.094	C	C	.	.	S	Bend	trans	-128.4	161.5	-177.9	-59.4	0	0	0	0	110.6	F905 T913 L914 I917 I936 T964	F905-V909 HydrophobicContact CB-CG2 4.05Å; F905-V909 HydrophobicContact CD1-CG1 4.1Å; V909-T913 HydrophobicContact CB-CG2 4.2Å; V909-T913 HydrophobicContact CG2-CG2 4.24Å; V909-L914 HydrophobicContact CG2-CB 4.01Å; V909-I917 HydrophobicContact CG2-CD1 4.21Å; V909-I936 HydrophobicContact CG1-CD1 4.03Å; V909-T964 WeakPolarHBondContact CB-OG1 3.24Å; V909-T964 WeakPolarHBondContact CG1-OG1 3.49Å
910	P	89.2	Confident	93.6	Very high	23 Å²	23	15 Å²	15	15%	0.149	8%	0.076	C	C	.	.			trans	-53.3	148.7	170.7	-25.2	34.9	0	0	0	112.3	E912 T913 L914 R962 T964 N965	P910-E912 VanDerWaalsContact C-N 3.33Å; P910-E912 PolarHBondContact O-N 3.11Å; P910-T913 WeakPolarHBondContact O-CA 3.46Å; P910-T913 VanDerWaalsContact O-CB 3.31Å; P910-T913 WeakPolarHBondContact O-CB 3.21Å; P910-T913 PolarHBondContact O-N 3.11Å; P910-L914 PolarHBondContact O-N 3.4Å; P910-R962 WeakPolarHBondContact CG-O 3.32Å; P910-T964 WeakPolarHBondContact CD-OG1 3.25Å; P910-N965 WeakPolarHBondContact CB-OD1 3.2Å; P910-N965 WeakPolarHBondContact CG-OD1 3.29Å
911	F	90.8	Very high	93.7	Very high	36 Å²	36	14.9 Å²	14.9	16%	0.158	8%	0.075	C	C	.	.	H	α-helix	trans	-62.1	-37.9	-174.1	-171.2	-97	0	0	0	113.2	Y668 F670 M787 L833 F834 T913 L914 I915	Y668-F911 AromaticContact CD1-CE1 3.74Å; Y668-F911 HydrophobicContact CD1-CE1 3.74Å; Y668-F911 AromaticContact CD2-CD1 3.64Å; Y668-F911 HydrophobicContact CD2-CD1 3.64Å; Y668-F911 AromaticContact CD2-CE1 3.62Å; Y668-F911 HydrophobicContact CD2-CE1 3.62Å; Y668-F911 HydrophobicContact CE1-CE1 4.18Å; Y668-F911 AromaticContact CE2-CD1 3.99Å; Y668-F911 HydrophobicContact CE2-CD1 3.99Å; Y668-F911 HydrophobicContact CE2-CE1 4.06Å; Y668-F911 AromaticContact CG-CD1 3.96Å; Y668-F911 HydrophobicContact CG-CD1 3.96Å; Y668-F911 AromaticContact CG-CE1 3.44Å; Y668-F911 HydrophobicContact CG-CE1 3.44Å; Y668-F911 VanDerWaalsContact CG-CE1 3.44Å; Y668-F911 HydrophobicContact CG-CZ 4.42Å; F670-F911 HydrophobicContact CD2-CD1 4.29Å; F670-F911 HydrophobicContact CD2-CG 4.28Å; F670-F911 HydrophobicContact CE2-CB 4.4Å; F670-F911 AromaticContact CE2-CD1 3.72Å; F670-F911 HydrophobicContact CE2-CD1 3.72Å; F670-F911 AromaticContact CE2-CD2 3.46Å; F670-F911 HydrophobicContact CE2-CD2 3.46Å; F670-F911 VanDerWaalsContact CE2-CD2 3.46Å; F670-F911 AromaticContact CE2-CE1 3.77Å; F670-F911 HydrophobicContact CE2-CE1 3.77Å; F670-F911 AromaticContact CE2-CE2 3.52Å; F670-F911 HydrophobicContact CE2-CE2 3.52Å; F670-F911 AromaticContact CE2-CG 3.56Å; F670-F911 HydrophobicContact CE2-CG 3.56Å; F670-F911 AromaticContact CE2-CZ 3.68Å; F670-F911 HydrophobicContact CE2-CZ 3.68Å; F670-F911 AromaticContact CZ-CD2 3.59Å; F670-F911 HydrophobicContact CZ-CD2 3.59Å; F670-F911 AromaticContact CZ-CE2 3.63Å; F670-F911 HydrophobicContact CZ-CE2 3.63Å; F670-F911 HydrophobicContact CZ-CG 4.13Å; F670-F911 HydrophobicContact CZ-CZ 4.21Å; M787-F911 HydrophobicContact CE-CE2 4.45Å; L833-F911 HydrophobicContact CD1-CE2 3.76Å; L833-F911 HydrophobicContact CD1-CZ 3.49Å; L833-F911 VanDerWaalsContact CD1-CZ 3.49Å; F834-F911 HydrophobicContact CE2-CZ 4.05Å; F834-F911 HydrophobicContact CZ-CE1 4.13Å; F834-F911 HydrophobicContact CZ-CZ 4.07Å; F911-T913 VanDerWaalsContact C-N 3.25Å; F911-T913 PolarHBondContact O-N 3.24Å; F911-L914 HydrophobicContact CD2-CD2 3.91Å; F911-L914 HydrophobicContact CE2-CD2 4.04Å; F911-L914 WeakPolarHBondContact O-CB 3.46Å; F911-L914 PolarHBondContact O-N 2.59Å; F911-L914 VanDerWaalsContact O-N 3.15Å; F911-I915 HydrophobicContact CD1-CG2 4.04Å; F911-I915 HydrophobicContact CE1-CG2 3.48Å; F911-I915 VanDerWaalsContact CE1-CG2 3.48Å; F911-I915 HydrophobicContact CE2-CG2 4.32Å; F911-I915 HydrophobicContact CZ-CG2 3.65Å; F911-I915 PolarHBondContact O-N 2.98Å
912	E	88.3	Confident	93.7	Very high	61 Å²	61	15 Å²	15	29%	0.285	8%	0.076	S	C	.	.	H	α-helix	trans	-62	-34.4	173.6	-66.1	-70	-176.7	0	0	112.1	Y668 P910 I915 R916	Y668-E912 VanDerWaalsContact CE2-OE1 3.26Å; Y668-E912 WeakPolarHBondContact CE2-OE1 3.39Å; Y668-E912 PolarHBondContact OH-OE2 3.13Å; Y668-E912 VanDerWaalsContact OH-OE2 3.08Å; P910-E912 VanDerWaalsContact C-N 3.33Å; P910-E912 PolarHBondContact O-N 3.11Å; E912-I915 VanDerWaalsContact O-CG1 3.25Å; E912-I915 WeakPolarHBondContact O-CG1 3.37Å; E912-I915 WeakPolarHBondContact OE2-CD1 3.33Å; E912-R916 WeakPolarHBondContact O-CG 3.4Å
913	T	93	Very high	93.8	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-71.8	-40.9	174.1	-46.7	0	0	0	0	110.9	V909 P910 F911 R916 I917 T964 V967 L970	V909-T913 HydrophobicContact CB-CG2 4.2Å; V909-T913 HydrophobicContact CG2-CG2 4.24Å; P910-T913 WeakPolarHBondContact O-CA 3.46Å; P910-T913 VanDerWaalsContact O-CB 3.31Å; P910-T913 WeakPolarHBondContact O-CB 3.21Å; P910-T913 PolarHBondContact O-N 3.11Å; F911-T913 VanDerWaalsContact C-N 3.25Å; F911-T913 PolarHBondContact O-N 3.24Å; T913-R916 PolarHBondContact O-N 3.1Å; T913-I917 HydrophobicContact CG2-CD1 4.26Å; T913-I917 WeakPolarHBondContact O-CG1 3.4Å; T913-I917 PolarHBondContact O-N 2.94Å; T913-T964 WeakPolarHBondContact CG2-O 3.41Å; T913-T964 PolarHBondContact OG1-O 3.4Å; T913-V967 HydrophobicContact CG2-CG2 4.23Å; T913-L970 HydrophobicContact CG2-CD2 3.65Å
914	L	95.9	Very high	93.8	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.01	8%	0.083	C	C	.	.	H	α-helix	trans	-57.1	-53	178.2	176.7	68	0	0	0	111.6	V830 V904 F905 Y906 V909 P910 F911 R916 I917 W918	V830-L914 HydrophobicContact CG2-CD2 4Å; V904-L914 WeakPolarHBondContact O-CD1 3.35Å; F905-L914 VanDerWaalsContact C-CD1 3.48Å; F905-L914 HydrophobicContact CB-CD1 4.01Å; Y906-L914 HydrophobicContact CD2-CD2 3.75Å; Y906-L914 HydrophobicContact CG-CD2 4.46Å; V909-L914 HydrophobicContact CG2-CB 4.01Å; P910-L914 PolarHBondContact O-N 3.4Å; F911-L914 HydrophobicContact CD2-CD2 3.91Å; F911-L914 HydrophobicContact CE2-CD2 4.04Å; F911-L914 WeakPolarHBondContact O-CB 3.46Å; F911-L914 PolarHBondContact O-N 2.59Å; F911-L914 VanDerWaalsContact O-N 3.15Å; L914-R916 PolarHBondContact O-N 2.89Å; L914-I917 WeakPolarHBondContact O-CB 3.26Å; L914-I917 PolarHBondContact O-N 2.61Å; L914-I917 VanDerWaalsContact O-N 3.14Å; L914-W918 PolarHBondContact O-N 3.04Å
915	I	95.4	Very high	93.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63	-30.7	-177.5	63.3	-177.7	0	0	0	111.9	Y668 F834 F911 E912 W918 D919	Y668-I915 HydrophobicContact CE1-CD1 4.15Å; Y668-I915 HydrophobicContact CE2-CD1 4.33Å; Y668-I915 WeakPolarHBondContact OH-CD1 3.16Å; F834-I915 HydrophobicContact CE2-CG2 3.88Å; F834-I915 HydrophobicContact CZ-CG2 3.8Å; F911-I915 HydrophobicContact CD1-CG2 4.04Å; F911-I915 HydrophobicContact CE1-CG2 3.48Å; F911-I915 VanDerWaalsContact CE1-CG2 3.48Å; F911-I915 HydrophobicContact CE2-CG2 4.32Å; F911-I915 HydrophobicContact CZ-CG2 3.65Å; F911-I915 PolarHBondContact O-N 2.98Å; E912-I915 VanDerWaalsContact O-CG1 3.25Å; E912-I915 WeakPolarHBondContact O-CG1 3.37Å; E912-I915 WeakPolarHBondContact OE2-CD1 3.33Å; I915-W918 WeakPolarHBondContact O-CB 3.46Å; I915-W918 PolarHBondContact O-N 3.11Å; I915-D919 VanDerWaalsContact O-CG 3.28Å; I915-D919 PolarHBondContact O-N 3.06Å
916	R	95.1	Very high	93.6	Very high	22 Å²	22	17.1 Å²	17.1	8%	0.083	9%	0.088	C	C	.	.	H	α-helix	trans	-75.7	-34.6	178.3	-64.3	-71.1	-59.1	101.6	8.8	111.8	C726 R727 S728 E912 T913 L914 W918 D919 V920 V967	C726-R916 PolarHBondContact O-NH1 3.32Å; R727-R916 VanDerWaalsContact C-NH2 3.27Å; R727-R916 PolarHBondContact O-NH2 2.98Å; S728-R916 PolarHBondContact O-NH2 3.13Å; E912-R916 WeakPolarHBondContact O-CG 3.4Å; T913-R916 PolarHBondContact O-N 3.1Å; L914-R916 PolarHBondContact O-N 2.89Å; R916-W918 VanDerWaalsContact C-N 3.31Å; R916-D919 IonicContact CZ-OD2 3.13Å; R916-D919 IonicContact NH1-OD2 2.85Å; R916-D919 PolarHBondContact NH1-OD2 2.87Å; R916-V920 WeakPolarHBondContact O-CG2 3.18Å; R916-V967 HydrophobicContact CB-CG1 3.45Å; R916-V967 VanDerWaalsContact CB-CG1 3.45Å; R916-V967 HydrophobicContact CG-CG1 3.77Å
917	I	97.4	Very high	93.6	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.01	9%	0.094	C	C	.	.	H	α-helix	trans	-61.7	-43.4	167.1	-68.7	169.7	0	0	0	109.8	F905 V909 T913 L914 V920 F921 F932	F905-I917 HydrophobicContact CB-CD1 4.02Å; F905-I917 HydrophobicContact CD1-CD1 4.34Å; F905-I917 HydrophobicContact CD2-CD1 4.1Å; F905-I917 HydrophobicContact CD2-CG2 3.97Å; F905-I917 HydrophobicContact CG-CD1 3.9Å; V909-I917 HydrophobicContact CG2-CD1 4.21Å; T913-I917 HydrophobicContact CG2-CD1 4.26Å; T913-I917 WeakPolarHBondContact O-CG1 3.4Å; T913-I917 PolarHBondContact O-N 2.94Å; L914-I917 WeakPolarHBondContact O-CB 3.26Å; L914-I917 PolarHBondContact O-N 2.61Å; L914-I917 VanDerWaalsContact O-N 3.14Å; I917-V920 PolarHBondContact O-N 3.28Å; I917-F921 VanDerWaalsContact O-CB 3.26Å; I917-F921 WeakPolarHBondContact O-CB 3.43Å; I917-F921 PolarHBondContact O-N 3.49Å; I917-F932 HydrophobicContact CB-CD2 4.25Å; I917-F932 HydrophobicContact CB-CE2 4.11Å; I917-F932 HydrophobicContact CB-CZ 4.49Å; I917-F932 HydrophobicContact CD1-CB 4.45Å; I917-F932 HydrophobicContact CD1-CD1 4.45Å; I917-F932 HydrophobicContact CD1-CG 4.26Å; I917-F932 HydrophobicContact CG1-CD1 3.98Å; I917-F932 HydrophobicContact CG1-CD2 3.88Å; I917-F932 HydrophobicContact CG1-CE1 4.03Å; I917-F932 HydrophobicContact CG1-CE2 3.92Å; I917-F932 HydrophobicContact CG1-CG 3.91Å; I917-F932 HydrophobicContact CG1-CZ 3.99Å; I917-F932 HydrophobicContact CG2-CD2 3.75Å; I917-F932 HydrophobicContact CG2-CE2 3.92Å; I917-F932 HydrophobicContact CG2-CG 4.46Å
918	W	97.7	Very high	94.1	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-64.4	-42.4	179.3	-83.9	54.3	0	0	0	113.4	W739 I827 V830 I847 V904 L914 I915 R916 V920 F921 L922	W739-W918 HydrophobicContact CE3-CE3 4.34Å; W739-W918 HydrophobicContact CH2-CB 3.71Å; W739-W918 HydrophobicContact CH2-CD2 4.06Å; W739-W918 AromaticContact CH2-CE3 3.58Å; W739-W918 HydrophobicContact CH2-CE3 3.58Å; W739-W918 HydrophobicContact CH2-CG 4.16Å; W739-W918 HydrophobicContact CH2-CZ3 4.48Å; W739-W918 HydrophobicContact CZ2-CB 3.53Å; W739-W918 HydrophobicContact CZ2-CE3 4.35Å; W739-W918 HydrophobicContact CZ2-CG 4.44Å; W739-W918 HydrophobicContact CZ3-CD2 4.47Å; W739-W918 AromaticContact CZ3-CE3 3.57Å; W739-W918 HydrophobicContact CZ3-CE3 3.57Å; W739-W918 HydrophobicContact CZ3-CZ3 4.09Å; I827-W918 HydrophobicContact CG2-CH2 3.86Å; I827-W918 HydrophobicContact CG2-CZ2 4.4Å; V830-W918 HydrophobicContact CB-CH2 3.67Å; V830-W918 HydrophobicContact CB-CZ2 3.73Å; V830-W918 HydrophobicContact CB-CZ3 4.2Å; V830-W918 HydrophobicContact CG1-CD2 3.79Å; V830-W918 HydrophobicContact CG1-CE3 3.81Å; V830-W918 HydrophobicContact CG1-CH2 3.65Å; V830-W918 HydrophobicContact CG1-CZ2 3.63Å; V830-W918 HydrophobicContact CG1-CZ3 3.74Å; V830-W918 HydrophobicContact CG2-CZ2 4.21Å; I847-W918 HydrophobicContact CD1-CH2 3.75Å; I847-W918 HydrophobicContact CD1-CZ2 4.49Å; I847-W918 HydrophobicContact CD1-CZ3 3.79Å; V904-W918 HydrophobicContact CB-CZ2 4.11Å; V904-W918 HydrophobicContact CG1-CZ2 4.39Å; V904-W918 PolarHBondContact O-NE1 3.06Å; L914-W918 PolarHBondContact O-N 3.04Å; I915-W918 WeakPolarHBondContact O-CB 3.46Å; I915-W918 PolarHBondContact O-N 3.11Å; R916-W918 VanDerWaalsContact C-N 3.31Å; W918-V920 PolarHBondContact O-N 2.96Å; W918-F921 PolarHBondContact O-N 2.92Å; W918-L922 HydrophobicContact CE3-CD1 4.36Å; W918-L922 WeakPolarHBondContact O-CB 3.34Å; W918-L922 WeakPolarHBondContact O-CG 3.38Å; W918-L922 PolarHBondContact O-N 3.19Å
919	D	96.8	Very high	94.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-51.5	-40.8	174.6	-71.3	-21.1	0	0	0	111.9	V730 R735 W739 I915 R916	V730-D919 WeakPolarHBondContact CB-OD1 3.47Å; V730-D919 HydrophobicContact CG2-CB 3.86Å; V730-D919 VanDerWaalsContact CG2-CG 3.43Å; V730-D919 WeakPolarHBondContact CG2-OD1 3.31Å; V730-D919 PolarHBondContact N-OD2 2.72Å; R735-D919 IonicContact NE-OD1 2.9Å; W739-D919 PolarHBondContact NE1-OD1 2.73Å; I915-D919 VanDerWaalsContact O-CG 3.28Å; I915-D919 PolarHBondContact O-N 3.06Å; R916-D919 IonicContact CZ-OD2 3.13Å; R916-D919 IonicContact NH1-OD2 2.85Å; R916-D919 PolarHBondContact NH1-OD2 2.87Å
920	V	97	Very high	94.7	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-83.4	-41.3	-179.1	-173.6	0	0	0	0	111.2	R727 R916 I917 W918 L922 L923 E924 T928 F932 F975	R727-V920 HydrophobicContact CG-CG1 4.29Å; R727-V920 HydrophobicContact CG-CG2 4.08Å; R916-V920 WeakPolarHBondContact O-CG2 3.18Å; I917-V920 PolarHBondContact O-N 3.28Å; W918-V920 PolarHBondContact O-N 2.96Å; V920-L922 PolarHBondContact O-N 2.83Å; V920-L923 PolarHBondContact O-N 2.92Å; V920-E924 HydrophobicContact CG1-CB 4.43Å; V920-E924 HydrophobicContact CG1-CG 4.28Å; V920-E924 WeakPolarHBondContact CG1-OE1 3.4Å; V920-E924 WeakPolarHBondContact O-CB 3.48Å; V920-E924 PolarHBondContact O-N 2.95Å; V920-T928 HydrophobicContact CG1-CG2 3.85Å; V920-F932 HydrophobicContact CB-CE2 4.36Å; V920-F932 HydrophobicContact CB-CZ 4.46Å; V920-F975 HydrophobicContact CG1-CE1 4.46Å; V920-F975 HydrophobicContact CG1-CE2 4.11Å; V920-F975 HydrophobicContact CG1-CZ 3.59Å
921	F	97.4	Very high	95.1	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-61.1	-43.5	179.6	168.8	-104.8	0	0	0	112.6	I847 F851 V904 I917 W918 L923 G925 T928 L929	I847-F921 HydrophobicContact CD1-CE1 4.14Å; I847-F921 HydrophobicContact CG1-CE1 3.89Å; I847-F921 HydrophobicContact CG2-CE1 4.06Å; I847-F921 HydrophobicContact CG2-CZ 4.07Å; F851-F921 HydrophobicContact CB-CE2 4.21Å; F851-F921 HydrophobicContact CB-CZ 3.82Å; F851-F921 HydrophobicContact CD2-CE1 4.09Å; F851-F921 HydrophobicContact CD2-CZ 4.18Å; F851-F921 HydrophobicContact CG-CZ 4.39Å; V904-F921 HydrophobicContact CG1-CD1 3.81Å; V904-F921 HydrophobicContact CG1-CE1 3.92Å; V904-F921 HydrophobicContact CG1-CG 4.11Å; V904-F921 HydrophobicContact CG1-CZ 4.36Å; V904-F921 HydrophobicContact CG2-CE1 4.35Å; V904-F921 HydrophobicContact CG2-CZ 4.44Å; I917-F921 VanDerWaalsContact O-CB 3.26Å; I917-F921 WeakPolarHBondContact O-CB 3.43Å; I917-F921 PolarHBondContact O-N 3.49Å; W918-F921 PolarHBondContact O-N 2.92Å; F921-L923 PolarHBondContact O-N 3.49Å; F921-G925 WeakPolarHBondContact CD2-O 3.3Å; F921-G925 WeakPolarHBondContact O-CA 3.47Å; F921-G925 PolarHBondContact O-N 2.96Å; F921-T928 WeakPolarHBondContact CA-OG1 3.34Å; F921-T928 WeakPolarHBondContact CD2-OG1 3.48Å; F921-L929 HydrophobicContact CD2-CD2 3.96Å; F921-L929 HydrophobicContact CD2-CG 4.11Å; F921-L929 HydrophobicContact CE2-CD1 4.13Å; F921-L929 HydrophobicContact CE2-CD2 4.26Å; F921-L929 HydrophobicContact CE2-CG 4.15Å
922	L	96.4	Very high	95.5	Very high	4 Å²	4	11.7 Å²	11.7	2%	0.021	6%	0.055	C	C	.	.	H	α-helix	trans	-67.4	-15.7	179.5	-67.4	176	0	0	0	113.5	W739 L742 I743 I847 F851 W918 V920	W739-L922 HydrophobicContact CB-CD1 4.02Å; W739-L922 HydrophobicContact CD2-CD1 3.45Å; W739-L922 VanDerWaalsContact CD2-CD1 3.45Å; W739-L922 HydrophobicContact CE3-CD1 3.89Å; W739-L922 HydrophobicContact CG-CD1 3.51Å; W739-L922 HydrophobicContact CZ2-CD1 4.43Å; L742-L922 HydrophobicContact CD1-CB 3.98Å; I743-L922 HydrophobicContact CD1-CD2 4.5Å; I743-L922 HydrophobicContact CG1-CD2 4.33Å; I847-L922 HydrophobicContact CD1-CD2 4.25Å; I847-L922 HydrophobicContact CG1-CD2 4.23Å; F851-L922 HydrophobicContact CD2-CD2 4.37Å; F851-L922 HydrophobicContact CE2-CD2 3.75Å; F851-L922 WeakPolarHBondContact CZ-O 3.49Å; W918-L922 HydrophobicContact CE3-CD1 4.36Å; W918-L922 WeakPolarHBondContact O-CB 3.34Å; W918-L922 WeakPolarHBondContact O-CG 3.38Å; W918-L922 PolarHBondContact O-N 3.19Å; V920-L922 PolarHBondContact O-N 2.83Å
923	L	94.9	Very high	95.9	Very high	18 Å²	18	8.8 Å²	8.8	9%	0.094	4%	0.042	C	C	.	.	H	α-helix	trans	-101	-46.9	176.6	175.3	66	0	0	0	112.6	R719 L722 E723 C726 L742 V920 F921	R719-L923 PolarHBondContact NH2-O 3.36Å; L722-L923 HydrophobicContact CB-CD2 4.3Å; L722-L923 HydrophobicContact CD2-CD1 3.53Å; L722-L923 HydrophobicContact CD2-CD2 4.45Å; L722-L923 HydrophobicContact CG-CD1 3.89Å; L722-L923 HydrophobicContact CG-CD2 3.86Å; E723-L923 HydrophobicContact CB-CD2 4.29Å; E723-L923 HydrophobicContact CG-CD2 3.84Å; C726-L923 HydrophobicContact CB-CD2 3.89Å; L742-L923 HydrophobicContact CD1-CB 4.28Å; L742-L923 HydrophobicContact CD2-CB 4.4Å; L742-L923 HydrophobicContact CD2-CD1 3.77Å; V920-L923 PolarHBondContact O-N 2.92Å; F921-L923 PolarHBondContact O-N 3.49Å
924	E	93.6	Very high	96.1	Very high	30 Å²	30	8.8 Å²	8.8	14%	0.14	4%	0.042	C	C	.	.	H	α-helix	trans	-99.3	-9.8	-169.9	-68.1	-171.5	-127.7	0	0	113.7	E723 R727 V920 T928 F975	E723-E924 HydrophobicContact CG-CG 4.08Å; R727-E924 IonicContact CZ-OE1 3.22Å; R727-E924 IonicContact CZ-OE2 3.15Å; R727-E924 IonicContact NE-OE1 3.93Å; R727-E924 PolarHBondContact NE-OE1 3.28Å; R727-E924 IonicContact NE-OE2 3.07Å; R727-E924 IonicContact NH2-OE1 3.22Å; R727-E924 PolarHBondContact NH2-OE1 3.43Å; R727-E924 IonicContact NH2-OE2 2.68Å; R727-E924 PolarHBondContact NH2-OE2 2.82Å; V920-E924 HydrophobicContact CG1-CB 4.43Å; V920-E924 HydrophobicContact CG1-CG 4.28Å; V920-E924 WeakPolarHBondContact CG1-OE1 3.4Å; V920-E924 WeakPolarHBondContact O-CB 3.48Å; V920-E924 PolarHBondContact O-N 2.95Å; E924-T928 HydrophobicContact CB-CG2 3.49Å; E924-T928 VanDerWaalsContact CB-CG2 3.49Å; E924-F975 WeakPolarHBondContact OE2-CE1 3.43Å
925	G	93.4	Very high	96.2	Very high	9 Å²	9	8.7 Å²	8.7	9%	0.093	4%	0.041	C	C	.	.			trans	84.4	-166.4	174.3	0	0	0	0	0	115	F921 E927 T928	F921-G925 WeakPolarHBondContact CD2-O 3.3Å; F921-G925 WeakPolarHBondContact O-CA 3.47Å; F921-G925 PolarHBondContact O-N 2.96Å; G925-E927 VanDerWaalsContact C-N 3.26Å; G925-E927 PolarHBondContact O-N 2.67Å; G925-T928 WeakPolarHBondContact O-CB 3.46Å; G925-T928 WeakPolarHBondContact O-CG2 3.49Å; G925-T928 PolarHBondContact O-N 3.27Å; G925-T928 PolarHBondContact O-OG1 3.12Å
926	S	94.1	Very high	96.2	Very high	4 Å²	4	8.7 Å²	8.7	3%	0.028	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.2	-170.6	55.1	0	0	0	0	114.9	F851 T928 L929 R991	F851-S926 WeakPolarHBondContact O-CB 3.35Å; F851-S926 PolarHBondContact O-OG 3.07Å; S926-T928 PolarHBondContact O-N 3.16Å; S926-L929 WeakPolarHBondContact O-CB 3.37Å; S926-L929 PolarHBondContact O-N 3.06Å; S926-L929 VanDerWaalsContact O-N 3.08Å; S926-R991 PolarHBondContact OG-NH1 3.23Å; S926-R991 PolarHBondContact OG-NH2 3.37Å
927	E	92.4	Very high	96.2	Very high	43 Å²	43	7.7 Å²	7.7	20%	0.201	4%	0.037	C	C	.	.	H	α-helix	trans	-59.2	-28.9	173.4	-67	83.3	174.7	0	0	112.3	G925 L929 F930 R931 P984 I987	G925-E927 VanDerWaalsContact C-N 3.26Å; G925-E927 PolarHBondContact O-N 2.67Å; E927-L929 VanDerWaalsContact C-N 3.25Å; E927-L929 PolarHBondContact O-N 3.42Å; E927-F930 PolarHBondContact O-N 3.39Å; E927-R931 PolarHBondContact O-N 3.47Å; E927-P984 HydrophobicContact CG-CB 4.4Å; E927-P984 HydrophobicContact CG-CG 4.36Å; E927-I987 HydrophobicContact CB-CD1 4.24Å; E927-I987 HydrophobicContact CG-CD1 3.78Å
928	T	95.4	Very high	96.2	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.006	5%	0.05	C	C	.	.	H	α-helix	trans	-62.3	-32.9	177.1	60.7	0	0	0	0	112.2	V920 F921 E924 G925 S926 F930 R931 F932 F975	V920-T928 HydrophobicContact CG1-CG2 3.85Å; F921-T928 WeakPolarHBondContact CA-OG1 3.34Å; F921-T928 WeakPolarHBondContact CD2-OG1 3.48Å; E924-T928 HydrophobicContact CB-CG2 3.49Å; E924-T928 VanDerWaalsContact CB-CG2 3.49Å; G925-T928 WeakPolarHBondContact O-CB 3.46Å; G925-T928 WeakPolarHBondContact O-CG2 3.49Å; G925-T928 PolarHBondContact O-N 3.27Å; G925-T928 PolarHBondContact O-OG1 3.12Å; S926-T928 PolarHBondContact O-N 3.16Å; T928-F930 VanDerWaalsContact C-N 3.33Å; T928-F930 PolarHBondContact O-N 2.96Å; T928-R931 WeakPolarHBondContact O-CB 3.19Å; T928-R931 PolarHBondContact O-N 2.93Å; T928-R931 VanDerWaalsContact O-N 3.12Å; T928-F932 WeakPolarHBondContact O-CD2 3.36Å; T928-F932 PolarHBondContact O-N 3.22Å; T928-F975 HydrophobicContact CG2-CZ 4.5Å
929	L	97.2	Very high	95.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-62	-42.4	-179.8	-57.9	-179.2	0	0	0	111.3	L852 F901 V904 F905 F921 S926 E927 A933	L852-L929 HydrophobicContact CD2-CD1 4Å; F901-L929 HydrophobicContact CB-CD1 4.29Å; F901-L929 HydrophobicContact CD1-CB 3.91Å; F901-L929 HydrophobicContact CD1-CD1 4.49Å; F901-L929 HydrophobicContact CD2-CB 4.49Å; F901-L929 HydrophobicContact CE1-CB 3.74Å; F901-L929 WeakPolarHBondContact CE1-O 3.2Å; F901-L929 HydrophobicContact CE2-CB 4.34Å; F901-L929 HydrophobicContact CG-CB 4.3Å; F901-L929 HydrophobicContact CG-CD1 4.24Å; F901-L929 HydrophobicContact CZ-CB 3.97Å; V904-L929 HydrophobicContact CG1-CD2 4.04Å; F905-L929 HydrophobicContact CD2-CD2 4.04Å; F905-L929 HydrophobicContact CE2-CB 4.43Å; F905-L929 HydrophobicContact CE2-CD2 3.9Å; F921-L929 HydrophobicContact CD2-CD2 3.96Å; F921-L929 HydrophobicContact CD2-CG 4.11Å; F921-L929 HydrophobicContact CE2-CD1 4.13Å; F921-L929 HydrophobicContact CE2-CD2 4.26Å; F921-L929 HydrophobicContact CE2-CG 4.15Å; S926-L929 WeakPolarHBondContact O-CB 3.37Å; S926-L929 PolarHBondContact O-N 3.06Å; S926-L929 VanDerWaalsContact O-N 3.08Å; E927-L929 VanDerWaalsContact C-N 3.25Å; E927-L929 PolarHBondContact O-N 3.42Å; L929-A933 WeakPolarHBondContact O-CB 3.48Å; L929-A933 PolarHBondContact O-N 3.44Å
930	F	98	Very high	95.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-63.9	-42.8	174.4	-61.1	-85.4	0	0	0	111.9	D867 V870 L871 I874 F901 E927 T928 A933 V934 F981 I987	D867-F930 HydrophobicContact CB-CE1 4.32Å; D867-F930 HydrophobicContact CB-CZ 3.91Å; D867-F930 WeakPolarHBondContact O-CE1 3.41Å; V870-F930 HydrophobicContact CB-CE1 3.86Å; V870-F930 HydrophobicContact CB-CZ 4.24Å; V870-F930 HydrophobicContact CG1-CD1 4.43Å; V870-F930 HydrophobicContact CG1-CE1 3.74Å; V870-F930 HydrophobicContact CG1-CZ 4.06Å; L871-F930 HydrophobicContact CB-CD1 4.02Å; L871-F930 HydrophobicContact CB-CE1 4.13Å; L871-F930 HydrophobicContact CD1-CD1 4.15Å; I874-F930 HydrophobicContact CD1-CB 4.01Å; I874-F930 HydrophobicContact CD1-CD1 3.76Å; I874-F930 HydrophobicContact CD1-CE1 4.46Å; I874-F930 HydrophobicContact CD1-CG 4.02Å; F901-F930 HydrophobicContact CE2-CD1 4.01Å; F901-F930 AromaticContact CE2-CE1 3.85Å; F901-F930 HydrophobicContact CE2-CE1 3.85Å; F901-F930 HydrophobicContact CE2-CG 4.46Å; F901-F930 HydrophobicContact CE2-CZ 4.14Å; F901-F930 HydrophobicContact CZ-CD1 4.04Å; F901-F930 HydrophobicContact CZ-CE1 4.34Å; F901-F930 HydrophobicContact CZ-CG 4.32Å; E927-F930 PolarHBondContact O-N 3.39Å; T928-F930 VanDerWaalsContact C-N 3.33Å; T928-F930 PolarHBondContact O-N 2.96Å; F930-A933 PolarHBondContact O-N 3.27Å; F930-V934 WeakPolarHBondContact O-CB 3.48Å; F930-V934 WeakPolarHBondContact O-CG2 3.41Å; F930-V934 PolarHBondContact O-N 3.46Å; F930-F981 HydrophobicContact CB-CE1 4.16Å; F930-F981 HydrophobicContact CB-CZ 3.92Å; F930-I987 HydrophobicContact CE2-CG2 4.05Å; F930-I987 HydrophobicContact CZ-CG2 4.36Å
931	R	97.3	Very high	95.4	Very high	48 Å²	48	18.6 Å²	18.6	18%	0.181	8%	0.084	C	C	.	.	H	α-helix	trans	-60.2	-49.3	179.4	-68.2	177.8	174.9	-83.3	1.4	111	E927 T928 V934 A935 A974 F975 F981	E927-R931 PolarHBondContact O-N 3.47Å; T928-R931 WeakPolarHBondContact O-CB 3.19Å; T928-R931 PolarHBondContact O-N 2.93Å; T928-R931 VanDerWaalsContact O-N 3.12Å; R931-V934 PolarHBondContact O-N 3.03Å; R931-A935 WeakPolarHBondContact O-CB 3.16Å; R931-A935 PolarHBondContact O-N 3.11Å; R931-A974 HydrophobicContact CB-CB 4.19Å; R931-A974 PolarHBondContact NH1-O 3.35Å; R931-F975 VanDerWaalsContact CD-CE1 3.48Å; R931-F981 HydrophobicContact CB-CZ 4.34Å; R931-F981 HydrophobicContact CG-CD1 3.8Å; R931-F981 HydrophobicContact CG-CD2 4.35Å; R931-F981 HydrophobicContact CG-CE1 3.53Å; R931-F981 HydrophobicContact CG-CE2 4.11Å; R931-F981 HydrophobicContact CG-CG 4.2Å; R931-F981 HydrophobicContact CG-CZ 3.7Å
932	F	97.8	Very high	95	Very high	1 Å²	1	23.8 Å²	23.8	0%	0.004	11%	0.112	C	C	.	.	H	α-helix	trans	-67.1	-41.4	179.9	-73.3	-62	0	0	0	112.2	F905 I917 V920 T928 V934 A935 I936 L970 I971 A974 F975	F905-F932 HydrophobicContact CE2-CB 4.01Å; F905-F932 HydrophobicContact CZ-CB 3.9Å; I917-F932 HydrophobicContact CB-CD2 4.25Å; I917-F932 HydrophobicContact CB-CE2 4.11Å; I917-F932 HydrophobicContact CB-CZ 4.49Å; I917-F932 HydrophobicContact CD1-CB 4.45Å; I917-F932 HydrophobicContact CD1-CD1 4.45Å; I917-F932 HydrophobicContact CD1-CG 4.26Å; I917-F932 HydrophobicContact CG1-CD1 3.98Å; I917-F932 HydrophobicContact CG1-CD2 3.88Å; I917-F932 HydrophobicContact CG1-CE1 4.03Å; I917-F932 HydrophobicContact CG1-CE2 3.92Å; I917-F932 HydrophobicContact CG1-CG 3.91Å; I917-F932 HydrophobicContact CG1-CZ 3.99Å; I917-F932 HydrophobicContact CG2-CD2 3.75Å; I917-F932 HydrophobicContact CG2-CE2 3.92Å; I917-F932 HydrophobicContact CG2-CG 4.46Å; V920-F932 HydrophobicContact CB-CE2 4.36Å; V920-F932 HydrophobicContact CB-CZ 4.46Å; T928-F932 WeakPolarHBondContact O-CD2 3.36Å; T928-F932 PolarHBondContact O-N 3.22Å; F932-V934 PolarHBondContact O-N 2.89Å; F932-A935 PolarHBondContact O-N 2.82Å; F932-I936 VanDerWaalsContact O-CG1 3.28Å; F932-I936 WeakPolarHBondContact O-CG1 3.18Å; F932-I936 PolarHBondContact O-N 2.9Å; F932-L970 HydrophobicContact CD1-CD1 4.5Å; F932-L970 HydrophobicContact CD1-CD2 4.01Å; F932-L970 HydrophobicContact CD1-CG 3.96Å; F932-L970 HydrophobicContact CE1-CD2 4.42Å; F932-L970 HydrophobicContact CE1-CG 4.29Å; F932-I971 HydrophobicContact CE1-CG1 3.98Å; F932-I971 HydrophobicContact CZ-CG1 4.28Å; F932-A974 HydrophobicContact CD1-CB 4.16Å; F932-A974 HydrophobicContact CE1-CB 4.23Å; F932-F975 HydrophobicContact CE1-CE2 4.42Å; F932-F975 HydrophobicContact CE2-CE2 4.43Å; F932-F975 AromaticContact CZ-CE2 3.97Å; F932-F975 HydrophobicContact CZ-CE2 3.97Å
933	A	97.8	Very high	94.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60	-47	176.1	0	0	0	0	0	112.1	L871 W900 F901 F905 L929 F930 A935 I936 L937	L871-A933 HydrophobicContact CD1-CB 3.84Å; L871-A933 HydrophobicContact CD2-CB 4.19Å; W900-A933 HydrophobicContact CE3-CB 4.01Å; W900-A933 HydrophobicContact CZ3-CB 4.1Å; F901-A933 HydrophobicContact CE1-CB 3.89Å; F901-A933 HydrophobicContact CZ-CB 4.26Å; F905-A933 HydrophobicContact CZ-CB 4.17Å; L929-A933 WeakPolarHBondContact O-CB 3.48Å; L929-A933 PolarHBondContact O-N 3.44Å; F930-A933 PolarHBondContact O-N 3.27Å; A933-A935 VanDerWaalsContact C-N 3.34Å; A933-I936 PolarHBondContact O-N 2.96Å; A933-L937 WeakPolarHBondContact O-CG 3.46Å; A933-L937 PolarHBondContact O-N 3.42Å; A933-L937 VanDerWaalsContact O-N 3.15Å
934	V	97.8	Very high	94.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.6	-34.9	178.1	179.7	0	0	0	0	111.1	L871 I874 V875 K878 L879 F930 R931 F932 L937 K938 L978	L871-V934 HydrophobicContact CD1-CG2 3.84Å; I874-V934 HydrophobicContact CB-CG2 4.4Å; I874-V934 HydrophobicContact CG2-CG2 3.77Å; V875-V934 HydrophobicContact CG2-CG2 4.08Å; K878-V934 HydrophobicContact CB-CG1 3.91Å; K878-V934 HydrophobicContact CG-CG1 4.35Å; L879-V934 HydrophobicContact CD1-CG1 4.11Å; L879-V934 HydrophobicContact CG-CG1 4.36Å; F930-V934 WeakPolarHBondContact O-CB 3.48Å; F930-V934 WeakPolarHBondContact O-CG2 3.41Å; F930-V934 PolarHBondContact O-N 3.46Å; R931-V934 PolarHBondContact O-N 3.03Å; F932-V934 PolarHBondContact O-N 2.89Å; V934-L937 PolarHBondContact O-N 3.35Å; V934-K938 VanDerWaalsContact O-CB 3.27Å; V934-K938 WeakPolarHBondContact O-CB 3.46Å; V934-K938 PolarHBondContact O-N 2.82Å; V934-L978 HydrophobicContact CB-CD1 3.96Å; V934-L978 HydrophobicContact CG1-CD1 3.73Å; V934-L978 HydrophobicContact CG1-CD2 3.72Å; V934-L978 HydrophobicContact CG1-CG 4.42Å
935	A	97.5	Very high	94.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.7	-43.2	176.9	0	0	0	0	0	112.1	R931 F932 A933 L937 K938 R939 L970 T973 A974 L978	R931-A935 WeakPolarHBondContact O-CB 3.16Å; R931-A935 PolarHBondContact O-N 3.11Å; F932-A935 PolarHBondContact O-N 2.82Å; A933-A935 VanDerWaalsContact C-N 3.34Å; A935-L937 VanDerWaalsContact C-N 3.32Å; A935-L937 PolarHBondContact O-N 2.8Å; A935-K938 PolarHBondContact O-N 2.9Å; A935-R939 WeakPolarHBondContact O-CG 3.39Å; A935-R939 PolarHBondContact O-N 2.94Å; A935-L970 HydrophobicContact CB-CD1 3.67Å; A935-T973 HydrophobicContact CB-CG2 3.84Å; A935-A974 HydrophobicContact CB-CB 3.8Å; A935-L978 HydrophobicContact CB-CD1 4.14Å
936	I	95.4	Very high	94.2	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-59.2	-45.8	174.3	-68.6	168.4	0	0	0	110.3	W900 F905 V909 F932 A933 N940 T961 T964 L970	W900-I936 HydrophobicContact CH2-CG2 4.29Å; F905-I936 HydrophobicContact CD1-CD1 4.25Å; F905-I936 HydrophobicContact CE1-CD1 3.73Å; V909-I936 HydrophobicContact CG1-CD1 4.03Å; F932-I936 VanDerWaalsContact O-CG1 3.28Å; F932-I936 WeakPolarHBondContact O-CG1 3.18Å; F932-I936 PolarHBondContact O-N 2.9Å; A933-I936 PolarHBondContact O-N 2.96Å; I936-N940 PolarHBondContact O-N 3.47Å; I936-N940 PolarHBondContact O-ND2 2.78Å; I936-T961 HydrophobicContact CG2-CG2 3.76Å; I936-T964 HydrophobicContact CD1-CG2 4.49Å; I936-T964 HydrophobicContact CG1-CG2 4.04Å; I936-T964 HydrophobicContact CG2-CG2 4.36Å; I936-L970 HydrophobicContact CG1-CD1 3.79Å; I936-L970 HydrophobicContact CG1-CD2 4.47Å
937	L	95.9	Very high	93.9	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.9	-41.1	177.4	-68.3	173.8	0	0	0	112.3	V875 L879 L882 I893 A933 V934 A935 N940 Q941 L944 L957	V875-L937 HydrophobicContact CG1-CD1 4.45Å; V875-L937 HydrophobicContact CG2-CD1 3.68Å; L879-L937 HydrophobicContact CD1-CB 3.6Å; L882-L937 HydrophobicContact CD2-CB 4.02Å; L882-L937 HydrophobicContact CD2-CD2 4.32Å; I893-L937 HydrophobicContact CD1-CD1 4.48Å; A933-L937 WeakPolarHBondContact O-CG 3.46Å; A933-L937 PolarHBondContact O-N 3.42Å; A933-L937 VanDerWaalsContact O-N 3.15Å; V934-L937 PolarHBondContact O-N 3.35Å; A935-L937 VanDerWaalsContact C-N 3.32Å; A935-L937 PolarHBondContact O-N 2.8Å; L937-N940 CarbonylContact O-C 3.19Å; L937-N940 PolarHBondContact O-N 2.92Å; L937-Q941 WeakPolarHBondContact O-CA 3.34Å; L937-Q941 PolarHBondContact O-N 2.66Å; L937-L944 HydrophobicContact CD2-CD1 4.16Å; L937-L957 HydrophobicContact CD2-CD1 3.72Å
938	K	95.6	Very high	93.7	Very high	63 Å²	63	34.3 Å²	34.3	27%	0.274	17%	0.169	S	C	.	.	H	α-helix	trans	-63.3	-46.5	179.2	178.2	165.8	168.7	167.1	0	111.7	L879 V934 A935 N940 Q941 T973 E977 L978	L879-K938 HydrophobicContact CD1-CB 4.23Å; L879-K938 HydrophobicContact CD2-CB 3.74Å; L879-K938 HydrophobicContact CD2-CD 4.25Å; L879-K938 HydrophobicContact CD2-CG 3.95Å; V934-K938 VanDerWaalsContact O-CB 3.27Å; V934-K938 WeakPolarHBondContact O-CB 3.46Å; V934-K938 PolarHBondContact O-N 2.82Å; A935-K938 PolarHBondContact O-N 2.9Å; K938-N940 PolarHBondContact O-N 2.87Å; K938-Q941 VanDerWaalsContact O-CB 3.29Å; K938-Q941 WeakPolarHBondContact O-CB 3.44Å; K938-Q941 PolarHBondContact O-N 3.4Å; K938-T973 HydrophobicContact CB-CG2 4.1Å; K938-T973 HydrophobicContact CD-CG2 3.79Å; K938-T973 HydrophobicContact CG-CG2 4.02Å; K938-E977 PolarHBondContact NZ-O 2.7Å; K938-L978 HydrophobicContact CD-CD2 3.52Å; K938-L978 HydrophobicContact CD-CG 4.15Å
939	R	91	Very high	93.4	Very high	103 Å²	103	36.8 Å²	36.8	39%	0.389	18%	0.182	S	C	.	.	H	α-helix	trans	-63.4	-25.6	-179.6	-74.2	-169.6	63.6	150.2	11.6	113.5	A935 D966 G969 T973	A935-R939 WeakPolarHBondContact O-CG 3.39Å; A935-R939 PolarHBondContact O-N 2.94Å; R939-D966 IonicContact CZ-OD2 3.41Å; R939-D966 PolarHBondContact NH1-O 3.29Å; R939-D966 IonicContact NH1-OD2 3.47Å; R939-D966 PolarHBondContact NH1-OD2 3.07Å; R939-D966 IonicContact NH2-OD2 3.5Å; R939-D966 PolarHBondContact NH2-OD2 3.36Å; R939-G969 VanDerWaalsContact NH1-CA 3.26Å; R939-T973 HydrophobicContact CG-CG2 4.09Å
940	N	90.6	Very high	93	Very high	34 Å²	34	39.7 Å²	39.7	18%	0.182	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	12.1	-178.9	-63	-81.2	0	0	0	112.4	I936 L937 K938 D942 M943 L944 A960	I936-N940 PolarHBondContact O-N 3.47Å; I936-N940 PolarHBondContact O-ND2 2.78Å; L937-N940 CarbonylContact O-C 3.19Å; L937-N940 PolarHBondContact O-N 2.92Å; K938-N940 PolarHBondContact O-N 2.87Å; N940-D942 PolarHBondContact O-N 3.04Å; N940-M943 HydrophobicContact CB-CE 4.4Å; N940-M943 PolarHBondContact O-N 3.44Å; N940-L944 HydrophobicContact CB-CD1 4.13Å; N940-L944 HydrophobicContact CB-CG 4.34Å; N940-L944 WeakPolarHBondContact O-CB 3.21Å; N940-L944 VanDerWaalsContact O-CG 3.22Å; N940-L944 WeakPolarHBondContact O-CG 3.36Å; N940-L944 PolarHBondContact O-N 3.38Å; N940-A960 HydrophobicContact CB-CB 3.93Å; N940-A960 VanDerWaalsContact CG-CB 3.44Å; N940-A960 WeakPolarHBondContact OD1-CB 3.27Å
941	Q	93.3	Very high	92.4	Very high	32 Å²	32	44.6 Å²	44.6	15%	0.15	23%	0.225	C	C	.	.	H	α-helix	trans	-58.4	-47.3	-170	180	-175.6	-47.5	0	0	112.1	L879 L882 L937 K938 L944 L945	L879-Q941 VanDerWaalsContact CD2-OE1 3.23Å; L882-Q941 HydrophobicContact CB-CG 4.33Å; L937-Q941 WeakPolarHBondContact O-CA 3.34Å; L937-Q941 PolarHBondContact O-N 2.66Å; K938-Q941 VanDerWaalsContact O-CB 3.29Å; K938-Q941 WeakPolarHBondContact O-CB 3.44Å; K938-Q941 PolarHBondContact O-N 3.4Å; Q941-L944 PolarHBondContact O-N 2.73Å; Q941-L945 HydrophobicContact CG-CD1 3.84Å; Q941-L945 HydrophobicContact CG-CG 4.26Å; Q941-L945 WeakPolarHBondContact O-CB 3.08Å; Q941-L945 VanDerWaalsContact O-CG 3.25Å; Q941-L945 WeakPolarHBondContact O-CG 3.45Å; Q941-L945 PolarHBondContact O-N 2.87Å
942	D	89.2	Confident	91.8	Very high	109 Å²	109	42.4 Å²	42.4	58%	0.583	22%	0.217	S	C	*	.	H	α-helix	trans	-64.1	-46.7	-175.5	-62.6	-38.3	0	0	0	110.9	N940 L944 L945 E946	N940-D942 PolarHBondContact O-N 3.04Å; D942-L944 VanDerWaalsContact C-N 3.31Å; D942-L944 PolarHBondContact O-N 2.74Å; D942-L945 PolarHBondContact O-N 3.37Å; D942-L945 VanDerWaalsContact O-N 3.17Å; D942-E946 WeakPolarHBondContact O-CG 3.07Å; D942-E946 PolarHBondContact O-N 3.5Å; D942-E946 VanDerWaalsContact O-N 3.15Å
943	M	85.6	Confident	91.4	Very high	40 Å²	40	42.4 Å²	42.4	20%	0.197	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-36	176.2	-170.4	-178.5	63.8	0	0	112.8	F626 N940 Q947 C956 A960	F626-M943 HydrophobicContact CD1-SD 4.39Å; F626-M943 HydrophobicContact CE1-CE 4.02Å; F626-M943 HydrophobicContact CE1-SD 3.3Å; F626-M943 WeakPolarHBondContact CE1-SD 3.1Å; F626-M943 HydrophobicContact CZ-CE 3.86Å; F626-M943 HydrophobicContact CZ-SD 3.37Å; F626-M943 WeakPolarHBondContact CZ-SD 3.4Å; N940-M943 HydrophobicContact CB-CE 4.4Å; N940-M943 PolarHBondContact O-N 3.44Å; M943-Q947 WeakPolarHBondContact O-CG 3.37Å; M943-Q947 PolarHBondContact O-NE2 3.13Å; M943-C956 WeakPolarHBondContact CE-SG 3.25Å; M943-A960 HydrophobicContact CE-CB 4.11Å
944	L	91.1	Very high	91	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-72.4	-34.3	176.4	-71.2	171.7	0	0	0	112.6	L882 H885 L937 N940 Q941 D942 E946 Q947 F953 C956 L957	L882-L944 HydrophobicContact CD1-CB 3.83Å; L882-L944 HydrophobicContact CD1-CD1 4.39Å; L882-L944 HydrophobicContact CD2-CD1 4.27Å; H885-L944 PolarHBondContact NE2-O 3.07Å; H885-L944 VanDerWaalsContact NE2-O 3.1Å; L937-L944 HydrophobicContact CD2-CD1 4.16Å; N940-L944 HydrophobicContact CB-CD1 4.13Å; N940-L944 HydrophobicContact CB-CG 4.34Å; N940-L944 WeakPolarHBondContact O-CB 3.21Å; N940-L944 VanDerWaalsContact O-CG 3.22Å; N940-L944 WeakPolarHBondContact O-CG 3.36Å; N940-L944 PolarHBondContact O-N 3.38Å; Q941-L944 PolarHBondContact O-N 2.73Å; D942-L944 VanDerWaalsContact C-N 3.31Å; D942-L944 PolarHBondContact O-N 2.74Å; L944-E946 VanDerWaalsContact C-N 3.31Å; L944-Q947 PolarHBondContact O-N 2.94Å; L944-F953 HydrophobicContact CB-CE2 3.88Å; L944-F953 HydrophobicContact CD2-CD2 4.21Å; L944-F953 HydrophobicContact CD2-CE1 4.49Å; L944-F953 HydrophobicContact CD2-CE2 3.84Å; L944-F953 HydrophobicContact CD2-CZ 3.97Å; L944-F953 HydrophobicContact CG-CE2 4.33Å; L944-C956 HydrophobicContact CD2-CB 4.3Å; L944-L957 HydrophobicContact CD1-CD1 4.23Å; L944-L957 HydrophobicContact CD2-CB 4.01Å; L944-L957 HydrophobicContact CD2-CD1 4.4Å
945	L	93.4	Very high	90.3	Very high	35 Å²	35	49.8 Å²	49.8	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-69.4	-28.5	176.6	-75.7	173.3	0	0	0	112.6	R881 L882 H885 Q941 D942 Q947	R881-L945 HydrophobicContact CB-CD1 4.21Å; R881-L945 HydrophobicContact CB-CD2 4.35Å; L882-L945 HydrophobicContact CD1-CD2 4.44Å; H885-L945 HydrophobicContact CB-CD2 3.68Å; H885-L945 PolarHBondContact CE1-O 3.27Å; H885-L945 PolarHBondContact NE2-O 2.88Å; Q941-L945 HydrophobicContact CG-CD1 3.84Å; Q941-L945 HydrophobicContact CG-CG 4.26Å; Q941-L945 WeakPolarHBondContact O-CB 3.08Å; Q941-L945 VanDerWaalsContact O-CG 3.25Å; Q941-L945 WeakPolarHBondContact O-CG 3.45Å; Q941-L945 PolarHBondContact O-N 2.87Å; D942-L945 PolarHBondContact O-N 3.37Å; D942-L945 VanDerWaalsContact O-N 3.17Å; L945-Q947 VanDerWaalsContact C-N 3.26Å; L945-Q947 PolarHBondContact O-N 2.98Å
946	E	91.7	Very high	89.6	Confident	148 Å²	148	49.8 Å²	49.8	69%	0.692	25%	0.248	S	C	*	.	H	α-helix	trans	-69.4	-22.9	176.2	-72.7	174.9	-175.9	0	0	113.2	D942 L944 S948	D942-E946 WeakPolarHBondContact O-CG 3.07Å; D942-E946 PolarHBondContact O-N 3.5Å; D942-E946 VanDerWaalsContact O-N 3.15Å; L944-E946 VanDerWaalsContact C-N 3.31Å; E946-S948 PolarHBondContact O-N 3.43Å
947	Q	88.7	Confident	89.3	Confident	15 Å²	15	49.8 Å²	49.8	7%	0.07	25%	0.248	C	C	.	.			trans	-72.9	123	-177.8	-50.6	-49.6	-56.4	0	0	110.6	H885 M943 L944 L945 F953 C956	H885-Q947 PolarHBondContact CE1-O 3.11Å; H885-Q947 PolarHBondContact NE2-O 2.94Å; M943-Q947 WeakPolarHBondContact O-CG 3.37Å; M943-Q947 PolarHBondContact O-NE2 3.13Å; L944-Q947 PolarHBondContact O-N 2.94Å; L945-Q947 VanDerWaalsContact C-N 3.26Å; L945-Q947 PolarHBondContact O-N 2.98Å; Q947-F953 HydrophobicContact CB-CB 4.1Å; Q947-F953 HydrophobicContact CB-CD2 4.38Å; Q947-C956 HydrophobicContact CG-CB 3.99Å
948	S	88.5	Confident	88.8	Confident	90 Å²	90	55.6 Å²	55.6	63%	0.629	27%	0.273	S	S	*	.			trans	-97	-16.4	-176	58.4	0	0	0	0	113.9	L889 E946	L889-S948 WeakPolarHBondContact CD2-O 3.38Å; E946-S948 PolarHBondContact O-N 3.43Å
949	D	87.1	Confident	88.1	Confident	53 Å²	53	54 Å²	54	28%	0.283	27%	0.271	S	S	.	.	S	Bend	trans	-122.4	158.6	179.6	73.3	-82.9	0	0	0	112.4	I951 S952 F953	D949-I951 PolarHBondContact OD2-N 2.86Å; D949-I951 VanDerWaalsContact OD2-N 3.11Å; D949-S952 WeakPolarHBondContact OD1-CB 3.33Å; D949-S952 PolarHBondContact OD1-OG 2.87Å; D949-S952 WeakPolarHBondContact OD2-CB 3.37Å; D949-S952 PolarHBondContact OD2-N 3.46Å; D949-S952 PolarHBondContact OD2-OG 2.88Å; D949-S952 VanDerWaalsContact OD2-OG 3.04Å; D949-F953 WeakPolarHBondContact O-CB 3.31Å; D949-F953 PolarHBondContact O-N 2.95Å; D949-F953 VanDerWaalsContact O-N 3.09Å
950	T	89.3	Confident	87.6	Confident	61 Å²	61	49.3 Å²	49.3	37%	0.374	26%	0.255	S	S	.	.	H	α-helix	trans	-68.2	-37.1	-175.2	52.7	0	0	0	0	113	L889 I891 F953 W954	L889-T950 HydrophobicContact CB-CG2 4.29Å; L889-T950 WeakPolarHBondContact O-CG2 3.33Å; I891-T950 HydrophobicContact CD1-CG2 4.13Å; I891-T950 HydrophobicContact CG1-CG2 3.86Å; T950-F953 PolarHBondContact O-N 3.46Å; T950-W954 PolarHBondContact O-N 3.29Å
951	I	85.7	Confident	87.5	Confident	104 Å²	104	48 Å²	48	53%	0.533	25%	0.248	S	C	.	.	H	α-helix	trans	-69.6	-47.1	-176.6	-62.3	173.4	0	0	0	109.8	D949 F953 W954 K955	D949-I951 PolarHBondContact OD2-N 2.86Å; D949-I951 VanDerWaalsContact OD2-N 3.11Å; I951-F953 VanDerWaalsContact C-N 3.35Å; I951-W954 PolarHBondContact O-N 3.08Å; I951-K955 HydrophobicContact CG2-CD 4.34Å; I951-K955 WeakPolarHBondContact O-CG 3.45Å; I951-K955 PolarHBondContact O-N 3.41Å
952	S	84.2	Confident	87	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.014	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-40.8	176	-57.2	0	0	0	0	111.5	H622 D949 W954 K955 C956	H622-S952 PolarHBondContact CD2-OG 3.25Å; D949-S952 WeakPolarHBondContact OD1-CB 3.33Å; D949-S952 PolarHBondContact OD1-OG 2.87Å; D949-S952 WeakPolarHBondContact OD2-CB 3.37Å; D949-S952 PolarHBondContact OD2-N 3.46Å; D949-S952 PolarHBondContact OD2-OG 2.88Å; D949-S952 VanDerWaalsContact OD2-OG 3.04Å; S952-W954 VanDerWaalsContact C-N 3.34Å; S952-W954 PolarHBondContact O-N 3.19Å; S952-K955 PolarHBondContact O-N 2.94Å; S952-C956 WeakPolarHBondContact O-CB 3.17Å; S952-C956 PolarHBondContact O-N 2.97Å
953	F	90.2	Very high	86.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.5	-48.2	173.3	-176.1	-82.6	0	0	0	111.5	L882 L886 L889 I891 L944 Q947 D949 T950 I951 C956 L957	L882-F953 HydrophobicContact CD1-CE2 4.12Å; L882-F953 HydrophobicContact CD1-CZ 4.47Å; L886-F953 HydrophobicContact CD2-CE1 3.61Å; L886-F953 HydrophobicContact CD2-CE2 3.94Å; L886-F953 HydrophobicContact CD2-CZ 3.28Å; L886-F953 HydrophobicContact CG-CZ 4.24Å; L889-F953 HydrophobicContact CD1-CB 4.36Å; L889-F953 HydrophobicContact CD1-CD2 4.22Å; L889-F953 HydrophobicContact CD1-CG 4.49Å; I891-F953 HydrophobicContact CD1-CB 3.57Å; I891-F953 HydrophobicContact CD1-CD1 3.38Å; I891-F953 HydrophobicContact CD1-CD2 4.12Å; I891-F953 HydrophobicContact CD1-CE1 4.12Å; I891-F953 HydrophobicContact CD1-CG 3.4Å; I891-F953 HydrophobicContact CG2-CD1 4.07Å; I891-F953 HydrophobicContact CG2-CE1 3.97Å; L944-F953 HydrophobicContact CB-CE2 3.88Å; L944-F953 HydrophobicContact CD2-CD2 4.21Å; L944-F953 HydrophobicContact CD2-CE1 4.49Å; L944-F953 HydrophobicContact CD2-CE2 3.84Å; L944-F953 HydrophobicContact CD2-CZ 3.97Å; L944-F953 HydrophobicContact CG-CE2 4.33Å; Q947-F953 HydrophobicContact CB-CB 4.1Å; Q947-F953 HydrophobicContact CB-CD2 4.38Å; D949-F953 WeakPolarHBondContact O-CB 3.31Å; D949-F953 PolarHBondContact O-N 2.95Å; D949-F953 VanDerWaalsContact O-N 3.09Å; T950-F953 PolarHBondContact O-N 3.46Å; I951-F953 VanDerWaalsContact C-N 3.35Å; F953-C956 PolarHBondContact O-N 3.5Å; F953-L957 HydrophobicContact CE1-CB 4.38Å; F953-L957 HydrophobicContact CE1-CD2 4.05Å; F953-L957 WeakPolarHBondContact O-CB 3.45Å; F953-L957 PolarHBondContact O-N 3.49Å
954	W	89.1	Confident	86.5	Confident	63 Å²	63	50.2 Å²	50.2	24%	0.239	25%	0.25	C	C	.	.	H	α-helix	trans	-66.1	-42	179.5	-73.9	126.1	0	0	0	113.3	I891 D892 A895 V896 T950 I951 S952 C956 L957 K958	I891-W954 HydrophobicContact CG2-CH2 3.72Å; I891-W954 HydrophobicContact CG2-CZ2 3.44Å; I891-W954 VanDerWaalsContact CG2-CZ2 3.44Å; I891-W954 HydrophobicContact CG2-CZ3 4.42Å; D892-W954 VanDerWaalsContact O-CH2 3.3Å; D892-W954 WeakPolarHBondContact O-CH2 3.33Å; A895-W954 HydrophobicContact CB-CH2 3.86Å; A895-W954 HydrophobicContact CB-CZ2 4.11Å; V896-W954 HydrophobicContact CB-CZ3 4Å; V896-W954 HydrophobicContact CG2-CE3 3.75Å; V896-W954 HydrophobicContact CG2-CH2 4.11Å; V896-W954 HydrophobicContact CG2-CZ3 3.33Å; T950-W954 PolarHBondContact O-N 3.29Å; I951-W954 PolarHBondContact O-N 3.08Å; S952-W954 VanDerWaalsContact C-N 3.34Å; S952-W954 PolarHBondContact O-N 3.19Å; W954-C956 VanDerWaalsContact C-N 3.32Å; W954-L957 HydrophobicContact CE3-CD2 4.07Å; W954-L957 HydrophobicContact CZ3-CD2 3.84Å; W954-L957 PolarHBondContact O-N 2.91Å; W954-K958 WeakPolarHBondContact O-CB 3.11Å; W954-K958 WeakPolarHBondContact O-CG 3.43Å; W954-K958 PolarHBondContact O-N 3.03Å
955	K	82.8	Confident	86.1	Confident	92 Å²	92	51.9 Å²	51.9	40%	0.4	26%	0.259	S	S	.	.	H	α-helix	trans	-58.5	-47.8	174	-75.6	179.2	175.4	-179.9	0	110.3	D619 I951 S952 K958 A959	D619-K955 IonicContact OD2-NZ 3.11Å; D619-K955 PolarHBondContact OD2-NZ 3.46Å; I951-K955 HydrophobicContact CG2-CD 4.34Å; I951-K955 WeakPolarHBondContact O-CG 3.45Å; I951-K955 PolarHBondContact O-N 3.41Å; S952-K955 PolarHBondContact O-N 2.94Å; K955-K958 PolarHBondContact O-N 3.34Å; K955-A959 WeakPolarHBondContact O-CB 3.2Å; K955-A959 PolarHBondContact O-N 3Å
956	C	83.7	Confident	85.6	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-47.2	179.1	-177.3	0	0	0	0	112	L624 M943 L944 Q947 S952 F953 W954 K958 A959 A960	L624-C956 HydrophobicContact CD2-CB 4.15Å; M943-C956 WeakPolarHBondContact CE-SG 3.25Å; L944-C956 HydrophobicContact CD2-CB 4.3Å; Q947-C956 HydrophobicContact CG-CB 3.99Å; S952-C956 WeakPolarHBondContact O-CB 3.17Å; S952-C956 PolarHBondContact O-N 2.97Å; F953-C956 PolarHBondContact O-N 3.5Å; W954-C956 VanDerWaalsContact C-N 3.32Å; C956-K958 PolarHBondContact O-N 2.86Å; C956-A959 PolarHBondContact O-N 3.31Å; C956-A960 VanDerWaalsContact O-CB 3.27Å; C956-A960 WeakPolarHBondContact O-CB 3.41Å; C956-A960 PolarHBondContact O-N 3.49Å
957	L	89.5	Confident	85.5	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-42.3	178.1	-178.6	61.3	0	0	0	112.6	W900 L937 L944 F953 W954 A960 T961	W900-L957 HydrophobicContact CH2-CD1 4.26Å; L937-L957 HydrophobicContact CD2-CD1 3.72Å; L944-L957 HydrophobicContact CD1-CD1 4.23Å; L944-L957 HydrophobicContact CD2-CB 4.01Å; L944-L957 HydrophobicContact CD2-CD1 4.4Å; F953-L957 HydrophobicContact CE1-CB 4.38Å; F953-L957 HydrophobicContact CE1-CD2 4.05Å; F953-L957 WeakPolarHBondContact O-CB 3.45Å; F953-L957 PolarHBondContact O-N 3.49Å; W954-L957 HydrophobicContact CE3-CD2 4.07Å; W954-L957 HydrophobicContact CZ3-CD2 3.84Å; W954-L957 PolarHBondContact O-N 2.91Å; L957-A960 WeakPolarHBondContact O-CB 3.39Å; L957-A960 PolarHBondContact O-N 3.23Å; L957-T961 HydrophobicContact CD1-CG2 4.42Å; L957-T961 VanDerWaalsContact O-CG2 3.29Å; L957-T961 WeakPolarHBondContact O-CG2 3.26Å; L957-T961 PolarHBondContact O-N 2.92Å
958	K	85.4	Confident	85.5	Confident	121 Å²	121	49.2 Å²	49.2	53%	0.526	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-39.8	176.2	-76.4	-177.6	177.7	-177.5	0	112.2	W954 K955 C956 T961 R962	W954-K958 WeakPolarHBondContact O-CB 3.11Å; W954-K958 WeakPolarHBondContact O-CG 3.43Å; W954-K958 PolarHBondContact O-N 3.03Å; K955-K958 PolarHBondContact O-N 3.34Å; C956-K958 PolarHBondContact O-N 2.86Å; K958-T961 PolarHBondContact O-OG1 2.89Å; K958-R962 WeakPolarHBondContact O-CB 3.46Å; K958-R962 WeakPolarHBondContact O-CG 3.27Å; K958-R962 PolarHBondContact O-N 2.88Å
959	A	79.3	Confident	85.6	Confident	29 Å²	29	45.7 Å²	45.7	24%	0.24	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-48	174.1	0	0	0	0	0	110.5	F626 K955 C956 T961 R962 L963	F626-A959 HydrophobicContact CZ-CB 4.42Å; K955-A959 WeakPolarHBondContact O-CB 3.2Å; K955-A959 PolarHBondContact O-N 3Å; C956-A959 PolarHBondContact O-N 3.31Å; A959-T961 VanDerWaalsContact C-N 3.27Å; A959-T961 PolarHBondContact O-N 3.19Å; A959-R962 PolarHBondContact O-N 3.24Å; A959-L963 WeakPolarHBondContact O-CB 3.12Å; A959-L963 WeakPolarHBondContact O-CG 3.39Å; A959-L963 PolarHBondContact O-N 3.06Å
960	A	81.8	Confident	85.9	Confident	5 Å²	5	43.2 Å²	43.2	4%	0.041	22%	0.215	C	C	.	.	H	α-helix	trans	-53	-42.2	178.3	0	0	0	0	0	112.6	N940 M943 C956 L957 T964	N940-A960 HydrophobicContact CB-CB 3.93Å; N940-A960 VanDerWaalsContact CG-CB 3.44Å; N940-A960 WeakPolarHBondContact OD1-CB 3.27Å; M943-A960 HydrophobicContact CE-CB 4.11Å; C956-A960 VanDerWaalsContact O-CB 3.27Å; C956-A960 WeakPolarHBondContact O-CB 3.41Å; C956-A960 PolarHBondContact O-N 3.49Å; L957-A960 WeakPolarHBondContact O-CB 3.39Å; L957-A960 PolarHBondContact O-N 3.23Å; A960-T964 WeakPolarHBondContact O-CG2 3.34Å
961	T	87.4	Confident	86.1	Confident	6 Å²	6	41 Å²	41	4%	0.037	20%	0.201	C	C	.	.	H	α-helix	trans	-74.2	-43.1	179.9	66.8	0	0	0	0	112.4	W900 S908 I936 L957 K958 A959 L963 T964	W900-T961 HydrophobicContact CH2-CG2 3.6Å; W900-T961 HydrophobicContact CZ2-CG2 3.19Å; S908-T961 CarbonylContact O-C 3.55Å; S908-T961 VanDerWaalsContact O-C 3.23Å; S908-T961 WeakPolarHBondContact O-CB 3.2Å; S908-T961 PolarHBondContact O-OG1 3.36Å; I936-T961 HydrophobicContact CG2-CG2 3.76Å; L957-T961 HydrophobicContact CD1-CG2 4.42Å; L957-T961 VanDerWaalsContact O-CG2 3.29Å; L957-T961 WeakPolarHBondContact O-CG2 3.26Å; L957-T961 PolarHBondContact O-N 2.92Å; K958-T961 PolarHBondContact O-OG1 2.89Å; A959-T961 VanDerWaalsContact C-N 3.27Å; A959-T961 PolarHBondContact O-N 3.19Å; T961-L963 PolarHBondContact O-N 3.43Å; T961-L963 VanDerWaalsContact O-N 3.16Å; T961-T964 PolarHBondContact O-N 3.39Å; T961-T964 PolarHBondContact O-OG1 2.83Å
962	R	82.5	Confident	86.6	Confident	161 Å²	161	41 Å²	41	61%	0.608	20%	0.197	S	C	*	.	H	α-helix	trans	-65	-17.1	178.8	-73.7	-179.3	172.7	-156.8	-5.6	113.7	S908 P910 K958 A959	S908-R962 PolarHBondContact O-N 2.71Å; P910-R962 WeakPolarHBondContact CG-O 3.32Å; K958-R962 WeakPolarHBondContact O-CB 3.46Å; K958-R962 WeakPolarHBondContact O-CG 3.27Å; K958-R962 PolarHBondContact O-N 2.88Å; A959-R962 PolarHBondContact O-N 3.24Å
963	L	79.4	Confident	87.1	Confident	51 Å²	51	41.2 Å²	41.2	27%	0.267	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	15.7	-177.4	-61.8	177.2	0	0	0	113.3	G614 A959 T961 N965	G614-L963 VanDerWaalsContact CA-CD2 3.43Å; A959-L963 WeakPolarHBondContact O-CB 3.12Å; A959-L963 WeakPolarHBondContact O-CG 3.39Å; A959-L963 PolarHBondContact O-N 3.06Å; T961-L963 PolarHBondContact O-N 3.43Å; T961-L963 VanDerWaalsContact O-N 3.16Å; L963-N965 PolarHBondContact O-N 3.38Å
964	T	86.1	Confident	87.4	Confident	16 Å²	16	41.2 Å²	41.2	10%	0.098	20%	0.198	C	C	.	.			trans	-74.4	49.5	178.5	48	0	0	0	0	113.3	V909 P910 T913 I936 A960 T961	V909-T964 WeakPolarHBondContact CB-OG1 3.24Å; V909-T964 WeakPolarHBondContact CG1-OG1 3.49Å; P910-T964 WeakPolarHBondContact CD-OG1 3.25Å; T913-T964 WeakPolarHBondContact CG2-O 3.41Å; T913-T964 PolarHBondContact OG1-O 3.4Å; I936-T964 HydrophobicContact CD1-CG2 4.49Å; I936-T964 HydrophobicContact CG1-CG2 4.04Å; I936-T964 HydrophobicContact CG2-CG2 4.36Å; A960-T964 WeakPolarHBondContact O-CG2 3.34Å; T961-T964 PolarHBondContact O-N 3.39Å; T961-T964 PolarHBondContact O-OG1 2.83Å
965	N	82.3	Confident	87.7	Confident	35 Å²	35	38.9 Å²	38.9	19%	0.187	19%	0.19	C	C	.	.			trans	-72.7	-26	-178.4	-62.7	-52.9	0	0	0	113.4	H682 P910 L963 V967	H682-N965 VanDerWaalsContact CE1-CG 3.45Å; H682-N965 PolarHBondContact CE1-ND2 3.15Å; H682-N965 PolarHBondContact NE2-ND2 3.32Å; P910-N965 WeakPolarHBondContact CB-OD1 3.2Å; P910-N965 WeakPolarHBondContact CG-OD1 3.29Å; L963-N965 PolarHBondContact O-N 3.38Å; N965-V967 VanDerWaalsContact C-N 3.31Å; N965-V967 PolarHBondContact O-N 3.42Å
966	D	83.9	Confident	88.2	Confident	50 Å²	50	39.4 Å²	39.4	27%	0.267	19%	0.194	S	C	.	.			trans	-79.5	79.7	175	175.7	24.6	0	0	0	111.2	A611 R939 G969 L970	A611-D966 HydrophobicContact CB-CB 4.06Å; R939-D966 IonicContact CZ-OD2 3.41Å; R939-D966 PolarHBondContact NH1-O 3.29Å; R939-D966 IonicContact NH1-OD2 3.47Å; R939-D966 PolarHBondContact NH1-OD2 3.07Å; R939-D966 IonicContact NH2-OD2 3.5Å; R939-D966 PolarHBondContact NH2-OD2 3.36Å; D966-G969 PolarHBondContact OD1-N 3.18Å; D966-G969 WeakPolarHBondContact OD2-CA 3.29Å; D966-L970 WeakPolarHBondContact O-CB 3.34Å; D966-L970 PolarHBondContact O-N 3.29Å
967	V	88	Confident	88.7	Confident	20 Å²	20	43.5 Å²	43.5	12%	0.121	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-40.9	-179.3	-171	0	0	0	0	112	T913 R916 N965 L970 I971	T913-V967 HydrophobicContact CG2-CG2 4.23Å; R916-V967 HydrophobicContact CB-CG1 3.45Å; R916-V967 VanDerWaalsContact CB-CG1 3.45Å; R916-V967 HydrophobicContact CG-CG1 3.77Å; N965-V967 VanDerWaalsContact C-N 3.31Å; N965-V967 PolarHBondContact O-N 3.42Å; V967-L970 WeakPolarHBondContact O-CB 3.22Å; V967-L970 PolarHBondContact O-N 3.47Å; V967-L970 VanDerWaalsContact O-N 3.08Å; V967-I971 HydrophobicContact CG1-CD1 4.05Å; V967-I971 HydrophobicContact CG1-CG1 4.4Å; V967-I971 WeakPolarHBondContact O-CG1 3.17Å; V967-I971 PolarHBondContact O-N 3.5Å
968	D	89.3	Confident	88.9	Confident	72 Å²	72	43.6 Å²	43.6	39%	0.385	21%	0.213	S	C	.	.	H	α-helix	trans	-65.6	-45.3	-177.1	-66.2	-34.4	0	0	0	110.9	K607 L970 I971 K972	K607-D968 WeakPolarHBondContact CE-OD2 3.02Å; K607-D968 IonicContact NZ-OD2 2.86Å; K607-D968 PolarHBondContact NZ-OD2 2.71Å; D968-L970 VanDerWaalsContact C-N 3.25Å; D968-L970 PolarHBondContact O-N 2.63Å; D968-I971 PolarHBondContact O-N 3.01Å; D968-K972 WeakPolarHBondContact O-CB 3.27Å; D968-K972 PolarHBondContact O-N 2.91Å
969	G	89.7	Confident	89.2	Confident	16 Å²	16	45.9 Å²	45.9	17%	0.165	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-33.5	172.7	0	0	0	0	0	112	R939 D966 K972 T973	R939-G969 VanDerWaalsContact NH1-CA 3.26Å; D966-G969 PolarHBondContact OD1-N 3.18Å; D966-G969 WeakPolarHBondContact OD2-CA 3.29Å; G969-K972 PolarHBondContact O-N 3.23Å; G969-T973 PolarHBondContact O-N 3.29Å; G969-T973 PolarHBondContact O-OG1 2.94Å; G969-T973 VanDerWaalsContact O-OG1 3.11Å
970	L	93.9	Very high	89.7	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-67	-45.1	178.1	177.5	64.6	0	0	0	111	T913 F932 A935 I936 D966 V967 D968 K972 T973 A974	T913-L970 HydrophobicContact CG2-CD2 3.65Å; F932-L970 HydrophobicContact CD1-CD1 4.5Å; F932-L970 HydrophobicContact CD1-CD2 4.01Å; F932-L970 HydrophobicContact CD1-CG 3.96Å; F932-L970 HydrophobicContact CE1-CD2 4.42Å; F932-L970 HydrophobicContact CE1-CG 4.29Å; A935-L970 HydrophobicContact CB-CD1 3.67Å; I936-L970 HydrophobicContact CG1-CD1 3.79Å; I936-L970 HydrophobicContact CG1-CD2 4.47Å; D966-L970 WeakPolarHBondContact O-CB 3.34Å; D966-L970 PolarHBondContact O-N 3.29Å; V967-L970 WeakPolarHBondContact O-CB 3.22Å; V967-L970 PolarHBondContact O-N 3.47Å; V967-L970 VanDerWaalsContact O-N 3.08Å; D968-L970 VanDerWaalsContact C-N 3.25Å; D968-L970 PolarHBondContact O-N 2.63Å; L970-K972 VanDerWaalsContact C-N 3.35Å; L970-T973 PolarHBondContact O-N 2.89Å; L970-A974 VanDerWaalsContact O-CB 3.26Å; L970-A974 WeakPolarHBondContact O-CB 3.44Å; L970-A974 PolarHBondContact O-N 3.25Å
971	I	94.8	Very high	90.3	Very high	15 Å²	15	50.5 Å²	50.5	8%	0.077	24%	0.244	C	C	.	.	H	α-helix	trans	-63.5	-43	175.5	-69.4	177.3	0	0	0	110.2	R727 F932 V967 D968 T973 A974 F975	R727-I971 HydrophobicContact CB-CG2 4.17Å; R727-I971 WeakPolarHBondContact O-CD1 3.02Å; F932-I971 HydrophobicContact CE1-CG1 3.98Å; F932-I971 HydrophobicContact CZ-CG1 4.28Å; V967-I971 HydrophobicContact CG1-CD1 4.05Å; V967-I971 HydrophobicContact CG1-CG1 4.4Å; V967-I971 WeakPolarHBondContact O-CG1 3.17Å; V967-I971 PolarHBondContact O-N 3.5Å; D968-I971 PolarHBondContact O-N 3.01Å; I971-T973 PolarHBondContact O-N 2.91Å; I971-A974 PolarHBondContact O-N 3.24Å; I971-F975 HydrophobicContact CG2-CD2 3.94Å; I971-F975 WeakPolarHBondContact O-CD2 3.13Å; I971-F975 PolarHBondContact O-N 3.33Å
972	K	94.3	Very high	90.6	Very high	105 Å²	105	50.9 Å²	50.9	46%	0.457	25%	0.246	S	C	.	.	H	α-helix	trans	-58.2	-48.3	174.8	-172.3	-178.7	178.4	-176.6	0	111.7	D968 G969 L970 A974 E976 E977	D968-K972 WeakPolarHBondContact O-CB 3.27Å; D968-K972 PolarHBondContact O-N 2.91Å; G969-K972 PolarHBondContact O-N 3.23Å; L970-K972 VanDerWaalsContact C-N 3.35Å; K972-A974 VanDerWaalsContact C-N 3.34Å; K972-A974 PolarHBondContact O-N 2.79Å; K972-E976 WeakPolarHBondContact CE-OE2 3.43Å; K972-E976 HydrophobicContact CG-CB 4.27Å; K972-E976 HydrophobicContact CG-CG 4.22Å; K972-E976 WeakPolarHBondContact CG-OE2 3.32Å; K972-E976 WeakPolarHBondContact O-CA 3.11Å; K972-E976 WeakPolarHBondContact O-CB 3.23Å; K972-E976 PolarHBondContact O-N 3.08Å; K972-E977 PolarHBondContact O-N 2.82Å
973	T	95.4	Very high	91	Very high	5 Å²	5	50.4 Å²	50.4	3%	0.031	25%	0.249	C	C	.	.	I	π-helix	trans	-60.8	-44.6	175.5	-61.5	0	0	0	0	111.2	A935 K938 R939 G969 L970 I971 F975 E977 L978	A935-T973 HydrophobicContact CB-CG2 3.84Å; K938-T973 HydrophobicContact CB-CG2 4.1Å; K938-T973 HydrophobicContact CD-CG2 3.79Å; K938-T973 HydrophobicContact CG-CG2 4.02Å; R939-T973 HydrophobicContact CG-CG2 4.09Å; G969-T973 PolarHBondContact O-N 3.29Å; G969-T973 PolarHBondContact O-OG1 2.94Å; G969-T973 VanDerWaalsContact O-OG1 3.11Å; L970-T973 PolarHBondContact O-N 2.89Å; I971-T973 PolarHBondContact O-N 2.91Å; T973-F975 PolarHBondContact O-N 3.19Å; T973-E977 WeakPolarHBondContact CB-OE2 3.38Å; T973-E977 HydrophobicContact CG2-CB 4.49Å; T973-E977 WeakPolarHBondContact CG2-OE2 3.46Å; T973-E977 PolarHBondContact O-N 3.29Å; T973-E977 PolarHBondContact OG1-OE2 2.67Å; T973-L978 VanDerWaalsContact O-CG 3.27Å; T973-L978 WeakPolarHBondContact O-CG 3.32Å; T973-L978 PolarHBondContact O-N 3.48Å; T973-L978 VanDerWaalsContact O-N 3.13Å
974	A	96.6	Very high	91.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-64.5	-39.4	-177.2	0	0	0	0	0	114.1	R931 F932 A935 L970 I971 K972	R931-A974 HydrophobicContact CB-CB 4.19Å; R931-A974 PolarHBondContact NH1-O 3.35Å; F932-A974 HydrophobicContact CD1-CB 4.16Å; F932-A974 HydrophobicContact CE1-CB 4.23Å; A935-A974 HydrophobicContact CB-CB 3.8Å; L970-A974 VanDerWaalsContact O-CB 3.26Å; L970-A974 WeakPolarHBondContact O-CB 3.44Å; L970-A974 PolarHBondContact O-N 3.25Å; I971-A974 PolarHBondContact O-N 3.24Å; K972-A974 VanDerWaalsContact C-N 3.34Å; K972-A974 PolarHBondContact O-N 2.79Å
975	F	94.8	Very high	91.8	Very high	14 Å²	14	58.1 Å²	58.1	6%	0.061	29%	0.289	C	S	.	.	I	π-helix	trans	-111.1	-18.5	-170.8	-69.8	-84.8	0	0	0	114.4	V920 E924 T928 R931 F932 I971 T973 R979	V920-F975 HydrophobicContact CG1-CE1 4.46Å; V920-F975 HydrophobicContact CG1-CE2 4.11Å; V920-F975 HydrophobicContact CG1-CZ 3.59Å; E924-F975 WeakPolarHBondContact OE2-CE1 3.43Å; T928-F975 HydrophobicContact CG2-CZ 4.5Å; R931-F975 VanDerWaalsContact CD-CE1 3.48Å; F932-F975 HydrophobicContact CE1-CE2 4.42Å; F932-F975 HydrophobicContact CE2-CE2 4.43Å; F932-F975 AromaticContact CZ-CE2 3.97Å; F932-F975 HydrophobicContact CZ-CE2 3.97Å; I971-F975 HydrophobicContact CG2-CD2 3.94Å; I971-F975 WeakPolarHBondContact O-CD2 3.13Å; I971-F975 PolarHBondContact O-N 3.33Å; T973-F975 PolarHBondContact O-N 3.19Å; F975-R979 WeakPolarHBondContact O-CG 3.39Å; F975-R979 PolarHBondContact O-NE 3.24Å; F975-R979 PolarHBondContact O-NH2 2.99Å
976	E	94.6	Very high	92.3	Very high	104 Å²	104	60 Å²	60	49%	0.486	30%	0.298	S	S	.	.	I	π-helix	trans	-110.6	-59.9	178.7	-51.4	-174.7	-179.5	0	0	111.3	K972 L978 R979	K972-E976 WeakPolarHBondContact CE-OE2 3.43Å; K972-E976 HydrophobicContact CG-CB 4.27Å; K972-E976 HydrophobicContact CG-CG 4.22Å; K972-E976 WeakPolarHBondContact CG-OE2 3.32Å; K972-E976 WeakPolarHBondContact O-CA 3.11Å; K972-E976 WeakPolarHBondContact O-CB 3.23Å; K972-E976 PolarHBondContact O-N 3.08Å; E976-L978 VanDerWaalsContact C-N 3.31Å; E976-L978 PolarHBondContact O-N 3.23Å; E976-R979 WeakPolarHBondContact O-CB 3.47Å; E976-R979 WeakPolarHBondContact O-CG 3.44Å; E976-R979 PolarHBondContact O-N 2.99Å
977	E	94.4	Very high	92.9	Very high	87 Å²	87	57.6 Å²	57.6	41%	0.407	29%	0.286	S	S	.	.	I	π-helix	trans	-74.2	-20.2	-169.7	-54.5	175.1	174.1	0	0	113.7	K938 K972 T973 R979	K938-E977 PolarHBondContact NZ-O 2.7Å; K972-E977 PolarHBondContact O-N 2.82Å; T973-E977 WeakPolarHBondContact CB-OE2 3.38Å; T973-E977 HydrophobicContact CG2-CB 4.49Å; T973-E977 WeakPolarHBondContact CG2-OE2 3.46Å; T973-E977 PolarHBondContact O-N 3.29Å; T973-E977 PolarHBondContact OG1-OE2 2.67Å; E977-R979 VanDerWaalsContact C-N 3.35Å
978	L	93.9	Very high	93.1	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.016	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	0.7	176.5	-73.3	176.5	0	0	0	113.5	K878 V934 A935 K938 T973 E976 P980 F981	K878-L978 HydrophobicContact CB-CD2 4.28Å; K878-L978 HydrophobicContact CD-CD2 4.25Å; K878-L978 WeakPolarHBondContact CE-O 3.41Å; K878-L978 HydrophobicContact CG-CD2 4.44Å; K878-L978 PolarHBondContact NZ-O 2.96Å; V934-L978 HydrophobicContact CB-CD1 3.96Å; V934-L978 HydrophobicContact CG1-CD1 3.73Å; V934-L978 HydrophobicContact CG1-CD2 3.72Å; V934-L978 HydrophobicContact CG1-CG 4.42Å; A935-L978 HydrophobicContact CB-CD1 4.14Å; K938-L978 HydrophobicContact CD-CD2 3.52Å; K938-L978 HydrophobicContact CD-CG 4.15Å; T973-L978 VanDerWaalsContact O-CG 3.27Å; T973-L978 WeakPolarHBondContact O-CG 3.32Å; T973-L978 PolarHBondContact O-N 3.48Å; T973-L978 VanDerWaalsContact O-N 3.13Å; E976-L978 VanDerWaalsContact C-N 3.31Å; E976-L978 PolarHBondContact O-N 3.23Å; L978-P980 CarbonylContact O-C 3.27Å; L978-F981 HydrophobicContact CB-CD2 4.07Å; L978-F981 HydrophobicContact CD1-CE2 4.28Å
979	R	91.2	Very high	93.5	Very high	168 Å²	168	60.2 Å²	60.2	63%	0.634	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-66.3	144.9	177.5	-67.7	-173.2	-150	166.6	13.7	111.9	F975 E976 E977	F975-R979 WeakPolarHBondContact O-CG 3.39Å; F975-R979 PolarHBondContact O-NE 3.24Å; F975-R979 PolarHBondContact O-NH2 2.99Å; E976-R979 WeakPolarHBondContact O-CB 3.47Å; E976-R979 WeakPolarHBondContact O-CG 3.44Å; E976-R979 PolarHBondContact O-N 2.99Å; E977-R979 VanDerWaalsContact C-N 3.35Å
980	P	90.2	Very high	93.8	Very high	113 Å²	113	60.9 Å²	60.9	73%	0.734	31%	0.308	S	S	*	.	S	Bend	cis	-76.1	125.7	-8	29.8	-32.8	0	0	0	111.4	K878 L978	K878-P980 VanDerWaalsContact CE-O 3.32Å; K878-P980 WeakPolarHBondContact CE-O 3.42Å; K878-P980 PolarHBondContact NZ-O 2.91Å; L978-P980 CarbonylContact O-C 3.27Å
981	F	93.7	Very high	93.9	Very high	19 Å²	19	62.7 Å²	62.7	8%	0.083	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-86.2	150.1	176.9	-157.7	-100.6	0	0	0	110.5	I874 F930 R931 L978 K983 I987	I874-F981 HydrophobicContact CD1-CE1 4.49Å; I874-F981 HydrophobicContact CD1-CZ 4.31Å; I874-F981 HydrophobicContact CG2-CE2 3.88Å; I874-F981 HydrophobicContact CG2-CZ 3.88Å; F930-F981 HydrophobicContact CB-CE1 4.16Å; F930-F981 HydrophobicContact CB-CZ 3.92Å; R931-F981 HydrophobicContact CB-CZ 4.34Å; R931-F981 HydrophobicContact CG-CD1 3.8Å; R931-F981 HydrophobicContact CG-CD2 4.35Å; R931-F981 HydrophobicContact CG-CE1 3.53Å; R931-F981 HydrophobicContact CG-CE2 4.11Å; R931-F981 HydrophobicContact CG-CG 4.2Å; R931-F981 HydrophobicContact CG-CZ 3.7Å; L978-F981 HydrophobicContact CB-CD2 4.07Å; L978-F981 HydrophobicContact CD1-CE2 4.28Å; F981-K983 PolarHBondContact O-N 2.79Å; F981-I987 HydrophobicContact CE1-CD1 4.41Å
982	P	92.5	Very high	93.9	Very high	13 Å²	13	64.9 Å²	64.9	8%	0.084	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-48.7	129.6	174.1	-31.2	37.6	0	0	0	112.2	I874 L986 I987	I874-P982 HydrophobicContact CD1-CG 4.36Å; I874-P982 HydrophobicContact CG1-CG 4.13Å; I874-P982 HydrophobicContact CG2-CG 4.44Å; P982-L986 HydrophobicContact CB-CD2 4.1Å; P982-I987 HydrophobicContact CB-CD1 4.35Å; P982-I987 HydrophobicContact CB-CG1 3.97Å
983	K	91.7	Very high	94	Very high	151 Å²	151	66.4 Å²	66.4	66%	0.657	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-68.2	154.3	177.7	-67.2	-175.5	179.1	-178.7	0	110.3	F981 Q985 L986 I987	F981-K983 PolarHBondContact O-N 2.79Å; K983-Q985 PolarHBondContact O-N 3.12Å; K983-Q985 VanDerWaalsContact O-N 3.15Å; K983-L986 WeakPolarHBondContact O-CA 3.41Å; K983-L986 WeakPolarHBondContact O-CB 3.04Å; K983-L986 PolarHBondContact O-N 3.36Å; K983-I987 PolarHBondContact O-N 2.83Å; K983-I987 VanDerWaalsContact O-N 3.09Å
984	P	90.3	Very high	94	Very high	77 Å²	77	67 Å²	67	50%	0.5	34%	0.341	S	S	.	.	H	α-helix	trans	-49.9	-41.7	176.9	-30.6	36.6	0	0	0	113.7	E927 L986 I987 A988	E927-P984 HydrophobicContact CG-CB 4.4Å; E927-P984 HydrophobicContact CG-CG 4.36Å; P984-L986 VanDerWaalsContact C-N 3.33Å; P984-L986 PolarHBondContact O-N 2.96Å; P984-I987 PolarHBondContact O-N 3.37Å; P984-A988 WeakPolarHBondContact O-CB 3.22Å; P984-A988 PolarHBondContact O-N 3.47Å
985	Q	91.7	Very high	93.9	Very high	153 Å²	153	71 Å²	71	72%	0.715	36%	0.357	S	S	*	.	H	α-helix	trans	-59.5	-40.1	176.3	-67.5	168.2	-13.6	0	0	112.8	K983 A988 T989	K983-Q985 PolarHBondContact O-N 3.12Å; K983-Q985 VanDerWaalsContact O-N 3.15Å; Q985-A988 PolarHBondContact O-N 3.11Å; Q985-T989 PolarHBondContact O-N 2.95Å; Q985-T989 PolarHBondContact O-OG1 3.4Å
986	L	94	Very high	93.8	Very high	73 Å²	73	75 Å²	75	38%	0.382	38%	0.376	S	S	.	.	H	α-helix	trans	-71.4	-39.6	178.6	179.4	58.6	0	0	0	111.3	P982 K983 P984 A988 T989 R990	P982-L986 HydrophobicContact CB-CD2 4.1Å; K983-L986 WeakPolarHBondContact O-CA 3.41Å; K983-L986 WeakPolarHBondContact O-CB 3.04Å; K983-L986 PolarHBondContact O-N 3.36Å; P984-L986 VanDerWaalsContact C-N 3.33Å; P984-L986 PolarHBondContact O-N 2.96Å; L986-A988 VanDerWaalsContact C-N 3.33Å; L986-T989 PolarHBondContact O-N 3.29Å; L986-R990 HydrophobicContact CD1-CG 4.48Å; L986-R990 WeakPolarHBondContact O-CG 3.42Å; L986-R990 PolarHBondContact O-N 3.27Å
987	I	95.1	Very high	93.6	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-61.6	-44.9	174.2	-65.6	173.4	0	0	0	109.7	V870 E927 F930 F981 P982 K983 P984 T989 R990 R991	V870-I987 HydrophobicContact CG1-CG2 4.36Å; E927-I987 HydrophobicContact CB-CD1 4.24Å; E927-I987 HydrophobicContact CG-CD1 3.78Å; F930-I987 HydrophobicContact CE2-CG2 4.05Å; F930-I987 HydrophobicContact CZ-CG2 4.36Å; F981-I987 HydrophobicContact CE1-CD1 4.41Å; P982-I987 HydrophobicContact CB-CD1 4.35Å; P982-I987 HydrophobicContact CB-CG1 3.97Å; K983-I987 PolarHBondContact O-N 2.83Å; K983-I987 VanDerWaalsContact O-N 3.09Å; P984-I987 PolarHBondContact O-N 3.37Å; I987-T989 PolarHBondContact O-N 3.32Å; I987-R990 PolarHBondContact O-N 3.47Å; I987-R991 HydrophobicContact CG2-CG 4.41Å; I987-R991 WeakPolarHBondContact O-CB 3.36Å; I987-R991 WeakPolarHBondContact O-CG 3.3Å; I987-R991 PolarHBondContact O-N 3.44Å
988	A	93.9	Very high	93.3	Very high	53 Å²	53	69.8 Å²	69.8	44%	0.438	35%	0.353	S	S	.	.	H	α-helix	trans	-60.4	-43.8	175.7	0	0	0	0	0	112.4	P984 Q985 L986 R990 R991 A992	P984-A988 WeakPolarHBondContact O-CB 3.22Å; P984-A988 PolarHBondContact O-N 3.47Å; Q985-A988 PolarHBondContact O-N 3.11Å; L986-A988 VanDerWaalsContact C-N 3.33Å; A988-R990 PolarHBondContact O-N 3.23Å; A988-R991 WeakPolarHBondContact O-CB 3.08Å; A988-R991 PolarHBondContact O-N 3.02Å; A988-A992 PolarHBondContact O-N 3.48Å
989	T	95.9	Very high	92.9	Very high	94 Å²	94	71 Å²	71	58%	0.577	36%	0.362	S	S	*	.	H	α-helix	trans	-61.7	-42.8	175.4	-57.9	0	0	0	0	112	Q985 L986 I987 A992 Y993	Q985-T989 PolarHBondContact O-N 2.95Å; Q985-T989 PolarHBondContact O-OG1 3.4Å; L986-T989 PolarHBondContact O-N 3.29Å; I987-T989 PolarHBondContact O-N 3.32Å; T989-A992 PolarHBondContact O-N 3.15Å; T989-Y993 PolarHBondContact O-N 3.18Å
990	R	97.3	Very high	92.7	Very high	31 Å²	31	68.4 Å²	68.4	12%	0.117	36%	0.355	C	S	.	.	H	α-helix	trans	-65.7	-41.3	176.5	-69.8	172.4	-179.1	-172.5	1.7	111.8	V870 E873 E877 L986 I987 A988 Y993 H994	V870-R990 HydrophobicContact CG1-CB 4.23Å; V870-R990 HydrophobicContact CG2-CB 3.88Å; E873-R990 WeakPolarHBondContact OE2-CD 3.33Å; E873-R990 WeakPolarHBondContact OE2-CG 3.25Å; E873-R990 IonicContact OE2-NE 3.53Å; E877-R990 VanDerWaalsContact CD-NH2 3.28Å; E877-R990 IonicContact OE1-CZ 2.68Å; E877-R990 IonicContact OE1-NH1 3.21Å; E877-R990 IonicContact OE1-NH2 3.75Å; E877-R990 PolarHBondContact OE1-NH2 3.21Å; E877-R990 IonicContact OE2-CZ 3.05Å; E877-R990 IonicContact OE2-NH1 2.73Å; E877-R990 PolarHBondContact OE2-NH1 3.05Å; E877-R990 IonicContact OE2-NH2 3.07Å; E877-R990 PolarHBondContact OE2-NH2 3.48Å; E877-R990 VanDerWaalsContact OE2-NH2 3.15Å; L986-R990 HydrophobicContact CD1-CG 4.48Å; L986-R990 WeakPolarHBondContact O-CG 3.42Å; L986-R990 PolarHBondContact O-N 3.27Å; I987-R990 PolarHBondContact O-N 3.47Å; A988-R990 PolarHBondContact O-N 3.23Å; R990-Y993 PolarHBondContact O-N 3.47Å; R990-H994 PolarHBondContact O-CD2 3.19Å; R990-H994 VanDerWaalsContact O-CD2 3.23Å; R990-H994 PolarHBondContact O-N 2.83Å
991	R	96.1	Very high	92.2	Very high	38 Å²	38	69.5 Å²	69.5	14%	0.143	35%	0.348	C	S	.	.	H	α-helix	trans	-56.9	-49.8	173.4	-77.6	174.4	165.3	164.4	-10.4	110.8	V866 D867 V870 S926 I987 A988 Y993 H994 Y995	V866-R991 HydrophobicContact CG1-CB 3.97Å; V866-R991 HydrophobicContact CG1-CG 4.03Å; V866-R991 WeakPolarHBondContact CG1-O 3.41Å; D867-R991 IonicContact OD1-CZ 3.28Å; D867-R991 IonicContact OD1-NE 3.35Å; D867-R991 PolarHBondContact OD1-NE 2.89Å; D867-R991 IonicContact OD1-NH2 3.61Å; D867-R991 PolarHBondContact OD1-NH2 3.45Å; D867-R991 IonicContact OD2-CZ 3.89Å; D867-R991 IonicContact OD2-NE 3.49Å; D867-R991 IonicContact OD2-NH2 3.91Å; D867-R991 PolarHBondContact OD2-NH2 2.98Å; V870-R991 HydrophobicContact CG2-CG 4.08Å; S926-R991 PolarHBondContact OG-NH1 3.23Å; S926-R991 PolarHBondContact OG-NH2 3.37Å; I987-R991 HydrophobicContact CG2-CG 4.41Å; I987-R991 WeakPolarHBondContact O-CB 3.36Å; I987-R991 WeakPolarHBondContact O-CG 3.3Å; I987-R991 PolarHBondContact O-N 3.44Å; A988-R991 WeakPolarHBondContact O-CB 3.08Å; A988-R991 PolarHBondContact O-N 3.02Å; R991-Y993 PolarHBondContact O-N 2.79Å; R991-H994 PolarHBondContact O-N 3.45Å; R991-Y995 WeakPolarHBondContact O-CB 3.4Å; R991-Y995 PolarHBondContact O-N 3.24Å
992	A	95.1	Very high	91.4	Very high	62 Å²	62	72 Å²	72	51%	0.512	36%	0.361	S	S	.	.	H	α-helix	trans	-60.1	-44.1	179.1	0	0	0	0	0	112.4	A988 T989 Y995 E996	A988-A992 PolarHBondContact O-N 3.48Å; T989-A992 PolarHBondContact O-N 3.15Å; A992-Y995 PolarHBondContact O-N 3.38Å; A992-E996 PolarHBondContact O-N 2.99Å; A992-E996 VanDerWaalsContact O-N 3.07Å
993	Y	96.1	Very high	90.8	Very high	136 Å²	136	75.2 Å²	75.2	53%	0.533	38%	0.384	S	S	.	.	H	α-helix	trans	-60.3	-51.4	177	174.1	-104.2	0	0	0	112.5	T989 R990 R991 Y995 E996 I997	T989-Y993 PolarHBondContact O-N 3.18Å; R990-Y993 PolarHBondContact O-N 3.47Å; R991-Y993 PolarHBondContact O-N 2.79Å; Y993-Y995 VanDerWaalsContact C-N 3.35Å; Y993-Y995 PolarHBondContact O-N 3.41Å; Y993-E996 PolarHBondContact O-N 3.06Å; Y993-I997 HydrophobicContact CD1-CD1 4.06Å; Y993-I997 HydrophobicContact CD2-CD1 4.48Å; Y993-I997 HydrophobicContact CE1-CD1 3.48Å; Y993-I997 VanDerWaalsContact CE1-CD1 3.48Å; Y993-I997 HydrophobicContact CE2-CD1 3.96Å; Y993-I997 VanDerWaalsContact CZ-CD1 3.43Å; Y993-I997 PolarHBondContact O-N 2.99Å
994	H	95.8	Very high	90.1	Very high	18 Å²	18	73.8 Å²	73.8	8%	0.083	38%	0.382	C	S	.	.	H	α-helix	trans	-69.3	-33.8	-179.7	-77	-55.7	0	0	0	112.7	V866 L869 E873 R990 R991 I997 L998	V866-H994 HydrophobicContact CB-CB 4.49Å; V866-H994 HydrophobicContact CG1-CB 3.99Å; V866-H994 HydrophobicContact CG2-CB 4.31Å; L869-H994 HydrophobicContact CB-CB 4.35Å; L869-H994 HydrophobicContact CD1-CB 4.08Å; E873-H994 VanDerWaalsContact CD-NE2 3.32Å; E873-H994 IonicContact OE1-CD2 2.67Å; E873-H994 IonicContact OE1-CE1 2.76Å; E873-H994 PolarHBondContact OE1-CE1 3.4Å; E873-H994 VanDerWaalsContact OE1-CE1 3.29Å; E873-H994 IonicContact OE1-NE2 3.1Å; E873-H994 PolarHBondContact OE1-NE2 3.48Å; E873-H994 IonicContact OE2-NE2 2.68Å; R990-H994 PolarHBondContact O-CD2 3.19Å; R990-H994 VanDerWaalsContact O-CD2 3.23Å; R990-H994 PolarHBondContact O-N 2.83Å; R991-H994 PolarHBondContact O-N 3.45Å; H994-I997 PolarHBondContact O-N 3.45Å; H994-L998 WeakPolarHBondContact O-CB 3.45Å; H994-L998 PolarHBondContact O-N 2.84Å
995	Y	93.9	Very high	89	Confident	83 Å²	83	73.9 Å²	73.9	33%	0.325	37%	0.374	S	S	.	.	H	α-helix	trans	-61	-44.9	174.2	-177.6	-93.1	0	0	0	111.1	I862 D863 V866 R991 A992 Y993 I997 L998 S999	I862-Y995 HydrophobicContact CD1-CE2 4.28Å; I862-Y995 HydrophobicContact CG1-CE2 4.5Å; I862-Y995 HydrophobicContact CG2-CD2 4.34Å; I862-Y995 HydrophobicContact CG2-CE2 3.74Å; D863-Y995 WeakPolarHBondContact OD1-CD2 3.31Å; D863-Y995 WeakPolarHBondContact OD1-CE2 3.44Å; V866-Y995 HydrophobicContact CG2-CD2 4.26Å; R991-Y995 WeakPolarHBondContact O-CB 3.4Å; R991-Y995 PolarHBondContact O-N 3.24Å; A992-Y995 PolarHBondContact O-N 3.38Å; Y993-Y995 VanDerWaalsContact C-N 3.35Å; Y993-Y995 PolarHBondContact O-N 3.41Å; Y995-I997 VanDerWaalsContact C-N 3.3Å; Y995-I997 PolarHBondContact O-N 3.38Å; Y995-L998 PolarHBondContact O-N 2.92Å; Y995-S999 WeakPolarHBondContact O-CB 3.37Å; Y995-S999 PolarHBondContact O-N 2.88Å; Y995-S999 PolarHBondContact O-OG 3.02Å
996	E	92.1	Very high	87.9	Confident	100 Å²	100	72.8 Å²	72.8	47%	0.467	37%	0.368	S	S	.	.	H	α-helix	trans	-60.3	-41.2	177.4	-168.7	-176.6	169.2	0	0	111.6	A992 Y993 S999 K1000	A992-E996 PolarHBondContact O-N 2.99Å; A992-E996 VanDerWaalsContact O-N 3.07Å; Y993-E996 PolarHBondContact O-N 3.06Å; E996-S999 PolarHBondContact O-OG 3.37Å; E996-K1000 HydrophobicContact CG-CD 4.35Å; E996-K1000 WeakPolarHBondContact O-CB 3.39Å; E996-K1000 VanDerWaalsContact O-CG 3.23Å; E996-K1000 WeakPolarHBondContact O-CG 3.41Å; E996-K1000 PolarHBondContact O-N 3.47Å; E996-K1000 VanDerWaalsContact O-N 3.15Å; E996-K1000 WeakPolarHBondContact OE1-CE 3.04Å; E996-K1000 IonicContact OE1-NZ 3.58Å; E996-K1000 PolarHBondContact OE1-NZ 3.37Å
997	I	90.5	Very high	86.6	Confident	56 Å²	56	70.3 Å²	70.3	29%	0.287	36%	0.36	S	S	.	.	H	α-helix	trans	-66.8	-51.4	178.4	-65.9	170.6	0	0	0	111	Y993 H994 Y995 K1000 K1001	Y993-I997 HydrophobicContact CD1-CD1 4.06Å; Y993-I997 HydrophobicContact CD2-CD1 4.48Å; Y993-I997 HydrophobicContact CE1-CD1 3.48Å; Y993-I997 VanDerWaalsContact CE1-CD1 3.48Å; Y993-I997 HydrophobicContact CE2-CD1 3.96Å; Y993-I997 VanDerWaalsContact CZ-CD1 3.43Å; Y993-I997 PolarHBondContact O-N 2.99Å; H994-I997 PolarHBondContact O-N 3.45Å; Y995-I997 VanDerWaalsContact C-N 3.3Å; Y995-I997 PolarHBondContact O-N 3.38Å; I997-K1000 PolarHBondContact O-N 3.29Å; I997-K1001 HydrophobicContact CG2-CD 4.38Å; I997-K1001 WeakPolarHBondContact O-CG 3.2Å; I997-K1001 PolarHBondContact O-N 3.43Å
998	L	88.4	Confident	85.1	Confident	25 Å²	25	74.9 Å²	74.9	13%	0.131	38%	0.378	C	S	.	.	H	α-helix	trans	-68.1	-40.2	-177.2	-74.2	177.2	0	0	0	111.4	I862 Q865 V866 L869 H994 Y995 K1000 K1001 M1002	I862-L998 HydrophobicContact CD1-CB 4.26Å; I862-L998 HydrophobicContact CG1-CB 4.1Å; Q865-L998 HydrophobicContact CB-CD1 3.87Å; V866-L998 HydrophobicContact CG2-CD1 3.76Å; L869-L998 HydrophobicContact CD1-CD1 3.66Å; L869-L998 HydrophobicContact CD1-CD2 4.27Å; L869-L998 HydrophobicContact CD1-CG 3.96Å; H994-L998 WeakPolarHBondContact O-CB 3.45Å; H994-L998 PolarHBondContact O-N 2.84Å; Y995-L998 PolarHBondContact O-N 2.92Å; L998-K1000 VanDerWaalsContact C-N 3.35Å; L998-K1000 PolarHBondContact O-N 3.38Å; L998-K1001 PolarHBondContact O-N 3.36Å; L998-M1002 VanDerWaalsContact O-CB 3.26Å; L998-M1002 WeakPolarHBondContact O-CB 2.79Å; L998-M1002 PolarHBondContact O-N 2.94Å
999	S	86.2	Confident	83.1	Confident	27 Å²	27	76.9 Å²	76.9	19%	0.189	37%	0.374	C	S	.	.	H	α-helix	trans	-65.9	-37.2	178.9	61.3	0	0	0	0	111.8	Y995 E996 S1003	Y995-S999 WeakPolarHBondContact O-CB 3.37Å; Y995-S999 PolarHBondContact O-N 2.88Å; Y995-S999 PolarHBondContact O-OG 3.02Å; E996-S999 PolarHBondContact O-OG 3.37Å; S999-S1003 WeakPolarHBondContact O-CB 3.5Å; S999-S1003 PolarHBondContact O-N 3.24Å; S999-S1003 PolarHBondContact O-OG 3.41Å
1000	K	86	Confident	80.9	Confident	115 Å²	115	76.8 Å²	76.8	50%	0.5	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-49.5	170.5	-75.4	174.7	-173.2	172.6	0	111.3	E996 I997 L998 M1002 S1003 I1004	E996-K1000 HydrophobicContact CG-CD 4.35Å; E996-K1000 WeakPolarHBondContact O-CB 3.39Å; E996-K1000 VanDerWaalsContact O-CG 3.23Å; E996-K1000 WeakPolarHBondContact O-CG 3.41Å; E996-K1000 PolarHBondContact O-N 3.47Å; E996-K1000 VanDerWaalsContact O-N 3.15Å; E996-K1000 WeakPolarHBondContact OE1-CE 3.04Å; E996-K1000 IonicContact OE1-NZ 3.58Å; E996-K1000 PolarHBondContact OE1-NZ 3.37Å; I997-K1000 PolarHBondContact O-N 3.29Å; L998-K1000 VanDerWaalsContact C-N 3.35Å; L998-K1000 PolarHBondContact O-N 3.38Å; K1000-M1002 VanDerWaalsContact C-N 3.3Å; K1000-M1002 PolarHBondContact O-N 3.08Å; K1000-S1003 PolarHBondContact O-N 2.93Å; K1000-I1004 WeakPolarHBondContact O-CB 3.5Å; K1000-I1004 VanDerWaalsContact O-CG1 3.24Å; K1000-I1004 WeakPolarHBondContact O-CG1 3.35Å; K1000-I1004 PolarHBondContact O-N 2.87Å
1001	K	79.8	Confident	78.8	Confident	136 Å²	136	79.8 Å²	79.8	59%	0.591	39%	0.385	S	S	*	.	H	α-helix	trans	-58.3	-43	177.2	-75.1	-177.4	179	-173.2	0	112	I997 L998 I1004 K1005	I997-K1001 HydrophobicContact CG2-CD 4.38Å; I997-K1001 WeakPolarHBondContact O-CG 3.2Å; I997-K1001 PolarHBondContact O-N 3.43Å; L998-K1001 PolarHBondContact O-N 3.36Å; K1001-I1004 PolarHBondContact O-N 3.26Å; K1001-K1005 WeakPolarHBondContact O-CB 3.08Å; K1001-K1005 PolarHBondContact O-N 2.89Å
1002	M	77.5	Confident	76.6	Confident	72 Å²	72	81.3 Å²	81.3	36%	0.355	40%	0.399	S	S	.	.	H	α-helix	trans	-73.3	-33.2	-179.2	-148.6	157.2	-156.2	0	0	111.7	I862 L998 K1000 K1006	I862-M1002 HydrophobicContact CB-SD 4.4Å; I862-M1002 HydrophobicContact CD1-SD 4.09Å; I862-M1002 HydrophobicContact CG1-SD 4.3Å; L998-M1002 VanDerWaalsContact O-CB 3.26Å; L998-M1002 WeakPolarHBondContact O-CB 2.79Å; L998-M1002 PolarHBondContact O-N 2.94Å; K1000-M1002 VanDerWaalsContact C-N 3.3Å; K1000-M1002 PolarHBondContact O-N 3.08Å; M1002-K1006 WeakPolarHBondContact O-CB 3.4Å; M1002-K1006 PolarHBondContact O-N 3.38Å
1003	S	79.2	Confident	74.2	Confident	79 Å²	79	85.1 Å²	85.1	55%	0.552	41%	0.407	S	S	*	.	H	α-helix	trans	-69.8	-38.1	172	-60.7	0	0	0	0	112	S999 K1000 G1007	S999-S1003 WeakPolarHBondContact O-CB 3.5Å; S999-S1003 PolarHBondContact O-N 3.24Å; S999-S1003 PolarHBondContact O-OG 3.41Å; K1000-S1003 PolarHBondContact O-N 2.93Å; S1003-G1007 WeakPolarHBondContact O-CA 3.22Å; S1003-G1007 PolarHBondContact O-N 3.21Å
1004	I	77.1	Confident	71.6	Confident	122 Å²	122	85.7 Å²	85.7	63%	0.626	41%	0.413	S	S	*	.	H	α-helix	trans	-64.9	-48.1	172.5	-67.8	162.8	0	0	0	109.7	K1000 K1001 K1006 G1007 Y1008	K1000-I1004 WeakPolarHBondContact O-CB 3.5Å; K1000-I1004 VanDerWaalsContact O-CG1 3.24Å; K1000-I1004 WeakPolarHBondContact O-CG1 3.35Å; K1000-I1004 PolarHBondContact O-N 2.87Å; K1001-I1004 PolarHBondContact O-N 3.26Å; I1004-K1006 PolarHBondContact O-N 3.02Å; I1004-G1007 CarbonylContact O-C 3.23Å; I1004-G1007 PolarHBondContact O-N 3.35Å; I1004-Y1008 WeakPolarHBondContact O-CB 3.12Å; I1004-Y1008 PolarHBondContact O-N 3.38Å
1005	K	68.3	Low	68.7	Low	78 Å²	78	93.1 Å²	93.1	34%	0.339	45%	0.447	S	S	.	.	H	α-helix	trans	-61.3	-44.9	176.8	-167.2	173.7	177.1	-178.1	0	110.7	E318 K1001 G1007 Y1008 W1009	E318-K1005 IonicContact OE1-NZ 3.45Å; E318-K1005 PolarHBondContact OE1-NZ 3.24Å; K1001-K1005 WeakPolarHBondContact O-CB 3.08Å; K1001-K1005 PolarHBondContact O-N 2.89Å; K1005-G1007 PolarHBondContact O-N 2.98Å; K1005-Y1008 WeakPolarHBondContact O-CB 3.44Å; K1005-Y1008 PolarHBondContact O-N 3.28Å; K1005-W1009 PolarHBondContact O-N 2.84Å
1006	K	67.3	Low	65.9	Low	131 Å²	131	92.8 Å²	92.8	57%	0.57	46%	0.457	S	S	*	.	H	α-helix	trans	-63.6	-39.4	175.2	-172	177.5	-176.7	178.9	0	111.8	M1002 I1004 W1009 Q1010	M1002-K1006 WeakPolarHBondContact O-CB 3.4Å; M1002-K1006 PolarHBondContact O-N 3.38Å; I1004-K1006 PolarHBondContact O-N 3.02Å; K1006-W1009 PolarHBondContact O-N 3.17Å; K1006-Q1010 HydrophobicContact CG-CG 4.4Å; K1006-Q1010 WeakPolarHBondContact O-CB 3.45Å; K1006-Q1010 WeakPolarHBondContact O-CG 3.19Å; K1006-Q1010 PolarHBondContact O-N 3.45Å
1007	G	67.3	Low	63.5	Low	21 Å²	21	92.4 Å²	92.4	22%	0.216	46%	0.464	C	S	.	.	H	α-helix	trans	-65.4	-41.7	174.5	0	0	0	0	0	111.9	S1003 I1004 K1005 Q1010 N1011	S1003-G1007 WeakPolarHBondContact O-CA 3.22Å; S1003-G1007 PolarHBondContact O-N 3.21Å; I1004-G1007 CarbonylContact O-C 3.23Å; I1004-G1007 PolarHBondContact O-N 3.35Å; K1005-G1007 PolarHBondContact O-N 2.98Å; G1007-Q1010 CarbonylContact O-C 3.51Å; G1007-Q1010 PolarHBondContact O-N 3.43Å; G1007-N1011 VanDerWaalsContact O-CB 3.27Å; G1007-N1011 WeakPolarHBondContact O-CB 3.39Å; G1007-N1011 PolarHBondContact O-N 3.18Å; G1007-N1011 PolarHBondContact O-ND2 2.88Å; G1007-N1011 PolarHBondContact O-OD1 3.3Å
1008	Y	63.8	Low	60.8	Low	96 Å²	96	96.3 Å²	96.3	38%	0.376	49%	0.485	S	S	.	.	H	α-helix	trans	-60	-51.9	171.8	-175.8	-89.7	0	0	0	110.4	E321 I1004 K1005 Q1010 N1011 V1012	E321-Y1008 PolarHBondContact OE1-OH 3.43Å; I1004-Y1008 WeakPolarHBondContact O-CB 3.12Å; I1004-Y1008 PolarHBondContact O-N 3.38Å; K1005-Y1008 WeakPolarHBondContact O-CB 3.44Å; K1005-Y1008 PolarHBondContact O-N 3.28Å; Y1008-Q1010 VanDerWaalsContact C-N 3.32Å; Y1008-Q1010 PolarHBondContact O-N 3.09Å; Y1008-N1011 PolarHBondContact O-N 2.99Å; Y1008-N1011 VanDerWaalsContact O-N 3.15Å; Y1008-V1012 HydrophobicContact CD1-CG2 3.94Å; Y1008-V1012 HydrophobicContact CE1-CG2 3.73Å; Y1008-V1012 WeakPolarHBondContact O-CB 3.29Å; Y1008-V1012 VanDerWaalsContact O-CG2 3.23Å; Y1008-V1012 WeakPolarHBondContact O-CG2 3.47Å; Y1008-V1012 PolarHBondContact O-N 3.15Å
1009	W	50.5	Low	58.1	Low	94 Å²	94	102.9 Å²	102.9	36%	0.356	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-37	175.5	-74.1	112.6	0	0	0	113	K1005 K1006 M1013	K1005-W1009 PolarHBondContact O-N 2.84Å; K1006-W1009 PolarHBondContact O-N 3.17Å; W1009-M1013 VanDerWaalsContact O-CB 3.31Å; W1009-M1013 WeakPolarHBondContact O-CB 3.31Å; W1009-M1013 VanDerWaalsContact O-CG 3.23Å; W1009-M1013 WeakPolarHBondContact O-CG 3.38Å; W1009-M1013 PolarHBondContact O-N 3.17Å
1010	Q	51	Low	55.5	Low	92 Å²	92	105.6 Å²	105.6	43%	0.43	52%	0.523	S	S	.	.	H	α-helix	trans	-70	-35.2	175.4	-79.7	179.9	-7.8	0	0	112	K1006 G1007 Y1008 M1013 K1014	K1006-Q1010 HydrophobicContact CG-CG 4.4Å; K1006-Q1010 WeakPolarHBondContact O-CB 3.45Å; K1006-Q1010 WeakPolarHBondContact O-CG 3.19Å; K1006-Q1010 PolarHBondContact O-N 3.45Å; G1007-Q1010 CarbonylContact O-C 3.51Å; G1007-Q1010 PolarHBondContact O-N 3.43Å; Y1008-Q1010 VanDerWaalsContact C-N 3.32Å; Y1008-Q1010 PolarHBondContact O-N 3.09Å; Q1010-M1013 CarbonylContact O-C 3.59Å; Q1010-M1013 PolarHBondContact O-N 3.48Å; Q1010-K1014 WeakPolarHBondContact O-CA 3.4Å; Q1010-K1014 WeakPolarHBondContact O-CB 3.47Å; Q1010-K1014 WeakPolarHBondContact O-CG 3.27Å; Q1010-K1014 PolarHBondContact O-N 3.34Å
1011	N	52.5	Low	53.2	Low	95 Å²	95	106.5 Å²	106.5	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-71.3	-43.2	174.5	-69.2	-11.6	0	0	0	109.9	G1007 Y1008 M1013 K1014 E1015	G1007-N1011 VanDerWaalsContact O-CB 3.27Å; G1007-N1011 WeakPolarHBondContact O-CB 3.39Å; G1007-N1011 PolarHBondContact O-N 3.18Å; G1007-N1011 PolarHBondContact O-ND2 2.88Å; G1007-N1011 PolarHBondContact O-OD1 3.3Å; Y1008-N1011 PolarHBondContact O-N 2.99Å; Y1008-N1011 VanDerWaalsContact O-N 3.15Å; N1011-M1013 PolarHBondContact O-N 2.95Å; N1011-K1014 CarbonylContact O-C 3.58Å; N1011-K1014 PolarHBondContact O-N 3.28Å; N1011-E1015 WeakPolarHBondContact O-CB 3.48Å; N1011-E1015 WeakPolarHBondContact O-CG 3.41Å; N1011-E1015 PolarHBondContact O-N 3.47Å
1012	V	50.8	Low	51.1	Low	70 Å²	70	109.1 Å²	109.1	42%	0.424	55%	0.547	S	S	.	.	H	α-helix	trans	-59.3	-35.5	171.2	172	0	0	0	0	111.2	Y1008	Y1008-V1012 HydrophobicContact CD1-CG2 3.94Å; Y1008-V1012 HydrophobicContact CE1-CG2 3.73Å; Y1008-V1012 WeakPolarHBondContact O-CB 3.29Å; Y1008-V1012 VanDerWaalsContact O-CG2 3.23Å; Y1008-V1012 WeakPolarHBondContact O-CG2 3.47Å; Y1008-V1012 PolarHBondContact O-N 3.15Å
1013	M	43.4	Very low	48.9	Very low	141 Å²	141	109.6 Å²	109.6	70%	0.695	55%	0.551	S	S	*	*	H	α-helix	trans	-78.1	-36.9	173.4	-73.4	-141.5	178.8	0	0	113.7	W1009 Q1010 N1011 S1016	W1009-M1013 VanDerWaalsContact O-CB 3.31Å; W1009-M1013 WeakPolarHBondContact O-CB 3.31Å; W1009-M1013 VanDerWaalsContact O-CG 3.23Å; W1009-M1013 WeakPolarHBondContact O-CG 3.38Å; W1009-M1013 PolarHBondContact O-N 3.17Å; Q1010-M1013 CarbonylContact O-C 3.59Å; Q1010-M1013 PolarHBondContact O-N 3.48Å; N1011-M1013 PolarHBondContact O-N 2.95Å; M1013-S1016 PolarHBondContact O-N 2.9Å; M1013-S1016 PolarHBondContact O-OG 3.1Å
1014	K	42.3	Very low	46.8	Very low	149 Å²	149	112 Å²	112	65%	0.648	55%	0.553	S	S	*	*	H	α-helix	trans	-81.7	-17.3	-178.9	-77.9	-179.8	176.7	-175.5	0	114	Q1010 N1011 S1016	Q1010-K1014 WeakPolarHBondContact O-CA 3.4Å; Q1010-K1014 WeakPolarHBondContact O-CB 3.47Å; Q1010-K1014 WeakPolarHBondContact O-CG 3.27Å; Q1010-K1014 PolarHBondContact O-N 3.34Å; N1011-K1014 CarbonylContact O-C 3.58Å; N1011-K1014 PolarHBondContact O-N 3.28Å; K1014-S1016 CarbonylContact C-O 3.49Å; K1014-S1016 CarbonylContact O-C 3.6Å; K1014-S1016 PolarHBondContact O-N 3.09Å
1015	E	35.6	Very low	44.9	Very low	173 Å²	173	112.9 Å²	112.9	81%	0.808	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	12.8	162	-76.5	-177.1	-175.4	0	0	112.3	N1011	N1011-E1015 WeakPolarHBondContact O-CB 3.48Å; N1011-E1015 WeakPolarHBondContact O-CG 3.41Å; N1011-E1015 PolarHBondContact O-N 3.47Å
1016	S	33.8	Very low	43.3	Very low	76 Å²	76	115.7 Å²	115.7	53%	0.531	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-136.3	134.9	147.7	57	0	0	0	0	108.9	M1013 K1014	M1013-S1016 PolarHBondContact O-N 2.9Å; M1013-S1016 PolarHBondContact O-OG 3.1Å; K1014-S1016 CarbonylContact C-O 3.49Å; K1014-S1016 CarbonylContact O-C 3.6Å; K1014-S1016 PolarHBondContact O-N 3.09Å
1017	P	41.7	Very low	41.8	Very low	93 Å²	93	111.2 Å²	111.2	60%	0.604	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	cis	-134.6	37.5	6.3	38.7	-16.2	0	0	0	115.2
1018	D	35.2	Very low	40.3	Very low	137 Å²	137	117.8 Å²	117.8	73%	0.733	58%	0.582	S	S	*	*	S	Bend	trans	-107.1	-8.2	-176.1	-78.2	-24.2	0	0	0	116.8	F1020	D1018-F1020 PolarHBondContact O-N 2.9Å
1019	E	30.6	Very low	38.8	Very low	164 Å²	164	120 Å²	120	77%	0.766	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	17.6	162.5	-76.6	-163.3	165.1	0	0	113
1020	F	31.2	Very low	37.9	Very low	83 Å²	83	123.7 Å²	123.7	36%	0.364	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-0.8	-179.1	-124.1	-83.6	0	0	0	114.7	D1018 Q1024 V1027	D1018-F1020 PolarHBondContact O-N 2.9Å; F1020-Q1024 VanDerWaalsContact O-CG 3.3Å; F1020-Q1024 WeakPolarHBondContact O-CG 3.27Å; F1020-V1027 HydrophobicContact CD1-CB 4.41Å; F1020-V1027 HydrophobicContact CD1-CG2 4.33Å; F1020-V1027 HydrophobicContact CD2-CG1 4.43Å; F1020-V1027 HydrophobicContact CD2-CG2 4.07Å; F1020-V1027 HydrophobicContact CE1-CB 3.62Å; F1020-V1027 HydrophobicContact CE1-CG1 3.88Å; F1020-V1027 HydrophobicContact CE1-CG2 4Å; F1020-V1027 HydrophobicContact CE2-CB 3.8Å; F1020-V1027 HydrophobicContact CE2-CG1 3.35Å; F1020-V1027 HydrophobicContact CE2-CG2 3.75Å; F1020-V1027 HydrophobicContact CG-CG2 4.4Å; F1020-V1027 HydrophobicContact CZ-CB 3.31Å; F1020-V1027 HydrophobicContact CZ-CG1 3.02Å; F1020-V1027 HydrophobicContact CZ-CG2 3.75Å
1021	I	38.3	Very low	37.2	Very low	135 Å²	135	128.9 Å²	128.9	69%	0.692	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-23.3	-177.7	-62.5	-177.5	0	0	0	114
1022	E	35.4	Very low	36.3	Very low	191 Å²	191	127.4 Å²	127.4	89%	0.893	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-7.2	172.4	-80.5	-170.9	160	0	0	115.2
1023	N	30.9	Very low	35.5	Very low	81 Å²	81	129.5 Å²	129.5	43%	0.433	64%	0.64	S	S	.	*			trans	-112.4	33	174.8	-81.5	-34.3	0	0	0	113.7	N1025 H1026 V1027	N1023-N1025 PolarHBondContact O-N 3.49Å; N1023-H1026 HydrophobicContact CB-CB 4.46Å; N1023-H1026 PolarHBondContact O-N 2.85Å; N1023-V1027 PolarHBondContact O-N 3.35Å
1024	Q	35.6	Very low	35.2	Very low	129 Å²	129	130.5 Å²	130.5	60%	0.603	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-16	173.6	-75.2	-163.8	-8.8	0	0	113.8	F1020	F1020-Q1024 VanDerWaalsContact O-CG 3.3Å; F1020-Q1024 WeakPolarHBondContact O-CG 3.27Å
1025	N	36.8	Very low	35.3	Very low	142 Å²	142	129.3 Å²	129.3	76%	0.759	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-16.5	172.3	-67.6	-19.9	0	0	0	114.3	N1023	N1023-N1025 PolarHBondContact O-N 3.49Å
1026	H	35.3	Very low	36	Very low	136 Å²	136	126.9 Å²	126.9	63%	0.63	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-20.1	-179.9	-90.1	-57.2	0	0	0	115	N1023 H1029	N1023-H1026 HydrophobicContact CB-CB 4.46Å; N1023-H1026 PolarHBondContact O-N 2.85Å; H1026-H1029 PolarHBondContact O-N 3.45Å
1027	V	35.3	Very low	37.4	Very low	38 Å²	38	129.4 Å²	129.4	23%	0.23	63%	0.633	C	S	.	*	T	Hydrogen-bonded Turn	trans	-86.4	-9	177.2	-158.4	0	0	0	0	114.6	F1020 N1023 H1029	F1020-V1027 HydrophobicContact CD1-CB 4.41Å; F1020-V1027 HydrophobicContact CD1-CG2 4.33Å; F1020-V1027 HydrophobicContact CD2-CG1 4.43Å; F1020-V1027 HydrophobicContact CD2-CG2 4.07Å; F1020-V1027 HydrophobicContact CE1-CB 3.62Å; F1020-V1027 HydrophobicContact CE1-CG1 3.88Å; F1020-V1027 HydrophobicContact CE1-CG2 4Å; F1020-V1027 HydrophobicContact CE2-CB 3.8Å; F1020-V1027 HydrophobicContact CE2-CG1 3.35Å; F1020-V1027 HydrophobicContact CE2-CG2 3.75Å; F1020-V1027 HydrophobicContact CG-CG2 4.4Å; F1020-V1027 HydrophobicContact CZ-CB 3.31Å; F1020-V1027 HydrophobicContact CZ-CG1 3.02Å; F1020-V1027 HydrophobicContact CZ-CG2 3.75Å; N1023-V1027 PolarHBondContact O-N 3.35Å; V1027-H1029 PolarHBondContact O-N 3.25Å
1028	Q	37.4	Very low	39	Very low	159 Å²	159	126 Å²	126	74%	0.743	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-21.8	162.4	-70.8	-171.1	-2.7	0	0	112.2
1029	H	32.3	Very low	41.3	Very low	141 Å²	141	120.8 Å²	120.8	65%	0.653	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-10.5	-179.2	-84.6	-65.4	0	0	0	116.1	H1026 V1027 S1032	H1026-H1029 PolarHBondContact O-N 3.45Å; V1027-H1029 PolarHBondContact O-N 3.25Å; H1029-S1032 PolarHBondContact O-OG 2.8Å
1030	K	31.1	Very low	44	Very low	173 Å²	173	113 Å²	113	75%	0.752	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-9.8	173	-89.4	-173.9	178.9	178.1	0	114.7	S1032	K1030-S1032 PolarHBondContact O-N 3.49Å
1031	R	35.3	Very low	46.7	Very low	200 Å²	200	109.2 Å²	109.2	76%	0.755	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.6	167.2	-81.1	-176	174.6	-179.2	-2.3	113
1032	S	34	Very low	49.1	Very low	64 Å²	64	102.9 Å²	102.9	45%	0.448	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	7.3	-174.6	63.5	0	0	0	0	116.1	H1029 K1030	H1029-S1032 PolarHBondContact O-OG 2.8Å; K1030-S1032 PolarHBondContact O-N 3.49Å
1033	T	34.2	Very low	51.7	Low	114 Å²	114	94.4 Å²	94.4	70%	0.699	46%	0.462	S	S	*	.	S	Bend	trans	-115.7	-3.1	-179.2	50.3	0	0	0	0	116.3
1034	K	37.9	Very low	54.6	Low	163 Å²	163	91.7 Å²	91.7	71%	0.709	45%	0.448	S	S	*	.			trans	-115	28.8	169.7	-80.6	-167.2	-179.5	-178.7	0	113.4	N1036	K1034-N1036 PolarHBondContact O-N 2.87Å
1035	E	43.8	Very low	57.1	Low	124 Å²	124	86.2 Å²	86.2	58%	0.579	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-6	-179.3	-76.5	-169.6	157.3	0	0	115	N1421	E1035-N1421 PolarHBondContact O-ND2 2.88Å
1036	N	49.6	Very low	59.3	Low	121 Å²	121	80.4 Å²	80.4	65%	0.647	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	16.4	-171.3	-75.4	-3.6	0	0	0	117.4	K1034	K1034-N1036 PolarHBondContact O-N 2.87Å
1037	Q	63.5	Low	61.5	Low	129 Å²	129	75.8 Å²	75.8	60%	0.603	37%	0.37	S	S	*	.			trans	-118.2	2.9	-172.5	-71.3	-171.5	-19.6	0	0	117.5	V1039	Q1037-V1039 PolarHBondContact O-N 2.83Å
1038	A	75.4	Confident	63.6	Low	22 Å²	22	77.8 Å²	77.8	18%	0.182	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-67.7	121.8	178.1	0	0	0	0	0	110.8	Y1055 Y1419 F1420	A1038-Y1055 HydrophobicContact CB-CD2 3.99Å; A1038-Y1419 CarbonylContact O-C 3.59Å; A1038-Y1419 WeakPolarHBondContact O-CA 3.44Å; A1038-F1420 HydrophobicContact CB-CB 4.27Å; A1038-F1420 WeakPolarHBondContact O-CB 3.48Å; A1038-F1420 PolarHBondContact O-N 3.34Å
1039	V	84	Confident	65.6	Low	27 Å²	27	74.5 Å²	74.5	16%	0.164	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	138.4	-177.4	174.1	0	0	0	0	109.4	Q1037 Q1041 Y1055 G1056 T1418 Y1419	Q1037-V1039 PolarHBondContact O-N 2.83Å; V1039-Q1041 WeakPolarHBondContact O-CG 3.17Å; V1039-Q1041 PolarHBondContact O-N 3.01Å; V1039-Y1055 CarbonylContact O-C 3.54Å; V1039-Y1055 WeakPolarHBondContact O-CA 3.32Å; V1039-Y1055 WeakPolarHBondContact O-CB 3.05Å; V1039-G1056 PolarHBondContact N-O 3.43Å; V1039-G1056 PolarHBondContact O-N 3.42Å; V1039-T1418 CarbonylContact C-O 3.54Å; V1039-T1418 WeakPolarHBondContact CA-O 3.29Å; V1039-T1418 HydrophobicContact CG1-CG2 4.35Å; V1039-Y1419 HydrophobicContact CG2-CD1 3.86Å; V1039-Y1419 HydrophobicContact CG2-CE1 3.86Å
1040	I	86.6	Confident	68.1	Low	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	120.7	169.7	-56.2	-179.5	0	0	0	108.4	I1053 R1399 F1400 C1416 T1418 F1420 A1425 V1426	I1040-I1053 HydrophobicContact CG2-CG2 3.85Å; I1040-R1399 PolarHBondContact O-NE 3.41Å; I1040-F1400 HydrophobicContact CB-CE2 4.21Å; I1040-F1400 HydrophobicContact CG2-CD2 3.82Å; I1040-F1400 HydrophobicContact CG2-CE2 3.62Å; I1040-F1400 WeakPolarHBondContact O-CE2 3.2Å; I1040-C1416 HydrophobicContact CD1-CB 3.91Å; I1040-C1416 HydrophobicContact CG2-CB 4.47Å; I1040-T1418 PolarHBondContact N-O 3.43Å; I1040-F1420 HydrophobicContact CG1-CB 3.93Å; I1040-F1420 HydrophobicContact CG1-CD2 4.22Å; I1040-A1425 HydrophobicContact CD1-CB 4.26Å; I1040-V1426 HydrophobicContact CD1-CG2 4.2Å
1041	Q	88	Confident	70.8	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.019	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-39.3	-169.6	-59.9	177.4	-2.2	0	0	113.2	V1039 C1054 D1057 S1061 R1083 V1084 F1400	V1039-Q1041 WeakPolarHBondContact O-CG 3.17Å; V1039-Q1041 PolarHBondContact O-N 3.01Å; Q1041-C1054 PolarHBondContact N-O 2.94Å; Q1041-D1057 PolarHBondContact NE2-O 2.98Å; Q1041-S1061 PolarHBondContact NE2-OG 2.76Å; Q1041-S1061 PolarHBondContact OE1-OG 2.84Å; Q1041-R1083 HydrophobicContact CG-CG 4.37Å; Q1041-V1084 WeakPolarHBondContact CB-O 3.48Å; Q1041-V1084 PolarHBondContact OE1-O 3.44Å; Q1041-F1400 VanDerWaalsContact C-CZ 3.49Å; Q1041-F1400 WeakPolarHBondContact O-CZ 3.41Å
1042	A	89.2	Confident	73.3	Confident	3 Å²	3	52.2 Å²	52.2	3%	0.025	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	151.8	-179.1	0	0	0	0	0	110.5	C1054 V1084 I1087	A1042-C1054 HydrophobicContact CB-CB 4.23Å; A1042-C1054 PolarHBondContact N-O 3.21Å; A1042-C1054 PolarHBondContact O-N 3.47Å; A1042-V1084 HydrophobicContact CB-CG1 3.86Å; A1042-I1087 HydrophobicContact CB-CB 3.79Å; A1042-I1087 HydrophobicContact CB-CG2 3.49Å; A1042-I1087 VanDerWaalsContact CB-CG2 3.49Å
1043	I	90.7	Very high	75.9	Confident	13 Å²	13	49.1 Å²	49.1	7%	0.067	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	141.1	-178.3	178.1	166.4	0	0	0	111	L1051 W1052 I1053 I1087 F1400 V1402 I1414 C1416	I1043-L1051 HydrophobicContact CD1-CD1 3.88Å; I1043-L1051 HydrophobicContact CD1-CD2 3.44Å; I1043-L1051 VanDerWaalsContact CD1-CD2 3.44Å; I1043-L1051 HydrophobicContact CD1-CG 3.95Å; I1043-L1051 HydrophobicContact CG1-CD1 3.61Å; I1043-L1051 HydrophobicContact CG1-CD2 3.97Å; I1043-L1051 HydrophobicContact CG1-CG 3.88Å; I1043-W1052 VanDerWaalsContact CA-O 3.23Å; I1043-W1052 WeakPolarHBondContact CA-O 2.95Å; I1043-W1052 WeakPolarHBondContact CG1-O 3.24Å; I1043-I1053 HydrophobicContact CD1-CD1 4.21Å; I1043-I1053 HydrophobicContact CD1-CG1 4.02Å; I1043-I1053 HydrophobicContact CG1-CG1 4.2Å; I1043-I1087 WeakPolarHBondContact O-CG2 3.17Å; I1043-F1400 HydrophobicContact CG2-CB 3.37Å; I1043-F1400 HydrophobicContact CG2-CD1 3.66Å; I1043-F1400 HydrophobicContact CG2-CD2 3.99Å; I1043-F1400 HydrophobicContact CG2-CE1 4.48Å; I1043-F1400 HydrophobicContact CG2-CG 3.38Å; I1043-V1402 HydrophobicContact CD1-CG2 3.79Å; I1043-V1402 HydrophobicContact CG1-CG1 4.38Å; I1043-V1402 HydrophobicContact CG1-CG2 4.04Å; I1043-V1402 HydrophobicContact CG2-CG1 3.8Å; I1043-I1414 HydrophobicContact CD1-CG2 4.31Å; I1043-C1416 WeakPolarHBondContact CD1-SG 3.22Å
1044	T	90.5	Very high	78.5	Confident	23 Å²	23	43.7 Å²	43.7	14%	0.141	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	152.9	171.5	-162.9	0	0	0	0	113	L1051 W1052 I1087 A1089	T1044-L1051 WeakPolarHBondContact O-CD1 3.24Å; T1044-W1052 PolarHBondContact N-O 3.35Å; T1044-W1052 PolarHBondContact O-N 3.17Å; T1044-I1087 HydrophobicContact CG2-CD1 3.79Å; T1044-I1087 HydrophobicContact CG2-CG1 3.76Å; T1044-I1087 HydrophobicContact CG2-CG2 4.2Å; T1044-A1089 HydrophobicContact CG2-CB 4.06Å
1045	F	88	Confident	80.8	Confident	14 Å²	14	36.6 Å²	36.6	6%	0.061	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128	167.6	-75.4	-78.8	0	0	0	109.5	L1051 V1068 A1089 V1402 K1404 L1412 I1414	F1045-L1051 HydrophobicContact CB-CD1 4.49Å; F1045-L1051 HydrophobicContact CD1-CB 3.92Å; F1045-L1051 HydrophobicContact CD1-CD1 3.7Å; F1045-L1051 HydrophobicContact CD1-CG 4.49Å; F1045-L1051 HydrophobicContact CD2-CD1 3.7Å; F1045-L1051 HydrophobicContact CE1-CB 3.83Å; F1045-L1051 HydrophobicContact CE1-CD1 3.68Å; F1045-L1051 HydrophobicContact CE1-CG 4.33Å; F1045-L1051 HydrophobicContact CE2-CD1 3.71Å; F1045-L1051 HydrophobicContact CG-CD1 3.69Å; F1045-L1051 HydrophobicContact CZ-CD1 3.68Å; F1045-V1068 HydrophobicContact CE1-CG2 4.03Å; F1045-A1089 WeakPolarHBondContact O-CB 3.3Å; F1045-V1402 HydrophobicContact CD2-CB 4.19Å; F1045-V1402 HydrophobicContact CD2-CG2 4.16Å; F1045-V1402 HydrophobicContact CE2-CB 3.95Å; F1045-V1402 HydrophobicContact CE2-CG2 3.61Å; F1045-V1402 HydrophobicContact CZ-CG2 4.38Å; F1045-K1404 HydrophobicContact CB-CD 3.92Å; F1045-K1404 HydrophobicContact CD1-CB 4Å; F1045-K1404 HydrophobicContact CD1-CG 4.38Å; F1045-K1404 HydrophobicContact CD2-CB 3.85Å; F1045-K1404 HydrophobicContact CE1-CB 4.12Å; F1045-K1404 HydrophobicContact CE2-CB 3.95Å; F1045-K1404 HydrophobicContact CG-CB 3.87Å; F1045-K1404 HydrophobicContact CG-CD 4.18Å; F1045-K1404 HydrophobicContact CG-CG 4.3Å; F1045-K1404 HydrophobicContact CZ-CB 4.09Å; F1045-L1412 HydrophobicContact CE1-CD2 3.4Å; F1045-L1412 VanDerWaalsContact CE1-CD2 3.4Å; F1045-L1412 HydrophobicContact CZ-CD2 3.37Å; F1045-L1412 HydrophobicContact CZ-CG 4.23Å; F1045-I1414 HydrophobicContact CE1-CD1 4.12Å; F1045-I1414 HydrophobicContact CZ-CD1 3.62Å; F1045-I1414 HydrophobicContact CZ-CG1 4.05Å
1046	Y	84.2	Confident	82.7	Confident	20 Å²	20	31.2 Å²	31.2	8%	0.078	16%	0.163	C	C	.	.	S	Bend	trans	-101.4	-24.6	172.8	73.3	-96.4	0	0	0	112.1	H1050 W1052 E1065 N1092 I1095 V1109	Y1046-H1050 HydrophobicContact CD1-CB 4.15Å; Y1046-H1050 HydrophobicContact CE1-CB 3.25Å; Y1046-H1050 HydrophobicContact CE2-CB 4.02Å; Y1046-H1050 AromaticContact CZ-CG 3.82Å; Y1046-H1050 PolarHBondContact N-O 3.48Å; Y1046-H1050 WeakPolarHBondContact OH-CB 3.24Å; Y1046-H1050 VanDerWaalsContact OH-CG 3.3Å; Y1046-W1052 AromaticContact CD1-CD1 3.32Å; Y1046-W1052 AromaticContact CD1-CG 4Å; Y1046-W1052 HydrophobicContact CD1-CG 4Å; Y1046-W1052 AromaticContact CD1-NE1 3.48Å; Y1046-W1052 AromaticContact CE1-CD1 3.26Å; Y1046-W1052 HydrophobicContact CE1-CG 4.32Å; Y1046-W1052 AromaticContact CE1-NE1 3.16Å; Y1046-E1065 PolarHBondContact OH-OE1 2.86Å; Y1046-N1092 WeakPolarHBondContact O-CA 3.47Å; Y1046-N1092 PolarHBondContact O-OD1 2.92Å; Y1046-I1095 HydrophobicContact CG-CD1 4.44Å; Y1046-V1109 HydrophobicContact CD1-CG1 4.48Å; Y1046-V1109 HydrophobicContact CD2-CG1 4.01Å; Y1046-V1109 HydrophobicContact CD2-CG2 4.27Å; Y1046-V1109 HydrophobicContact CE1-CG1 4.1Å; Y1046-V1109 HydrophobicContact CE2-CG1 3.63Å; Y1046-V1109 HydrophobicContact CG-CG1 4.41Å; Y1046-V1109 HydrophobicContact CG-CG2 4.2Å
1047	D	80.2	Confident	84	Confident	39 Å²	39	29.5 Å²	29.5	21%	0.209	15%	0.154	C	C	.	.	S	Bend	trans	-135.3	-159.8	169.2	74.9	17.3	0	0	0	111.5	E1049 H1050 K1404	D1047-E1049 PolarHBondContact OD1-N 3.32Å; D1047-H1050 WeakPolarHBondContact OD1-CA 3.37Å; D1047-H1050 VanDerWaalsContact OD1-CB 3.25Å; D1047-H1050 WeakPolarHBondContact OD1-CB 3.41Å; D1047-H1050 IonicContact OD1-CG 2.9Å; D1047-H1050 PolarHBondContact OD1-N 3.39Å; D1047-H1050 IonicContact OD1-ND1 2.76Å; D1047-H1050 PolarHBondContact OD1-ND1 2.92Å; D1047-H1050 IonicContact OD2-CE1 3.05Å; D1047-H1050 IonicContact OD2-CG 3.26Å; D1047-H1050 IonicContact OD2-ND1 3.85Å; D1047-H1050 PolarHBondContact OD2-ND1 3.03Å; D1047-K1404 WeakPolarHBondContact O-CE 3.28Å; D1047-K1404 PolarHBondContact O-NZ 3.49Å; D1047-K1404 VanDerWaalsContact O-NZ 3.17Å
1048	N	79.8	Confident	84.3	Confident	80 Å²	80	31.8 Å²	31.8	43%	0.428	16%	0.162	S	C	.	.	S	Bend	trans	-84.7	-18.4	-178.7	-70.3	-15.4	0	0	0	114.2	K1404	N1048-K1404 WeakPolarHBondContact OD1-CE 3.37Å
1049	E	80.2	Confident	83.9	Confident	91 Å²	91	36.2 Å²	36.2	43%	0.425	18%	0.182	S	C	.	.	S	Bend	trans	-122.4	-11.9	-171.5	-61.8	-167.5	176.8	0	0	113.3	D1047 V1068 T1069	D1047-E1049 PolarHBondContact OD1-N 3.32Å; E1049-V1068 VanDerWaalsContact O-CB 3.22Å; E1049-V1068 WeakPolarHBondContact O-CB 3.34Å; E1049-V1068 VanDerWaalsContact O-CG2 3.27Å; E1049-V1068 WeakPolarHBondContact O-CG2 3.45Å; E1049-V1068 PolarHBondContact O-N 3.02Å; E1049-T1069 HydrophobicContact CB-CG2 4.12Å; E1049-T1069 VanDerWaalsContact CD-CG2 3.48Å; E1049-T1069 HydrophobicContact CG-CG2 3.81Å; E1049-T1069 WeakPolarHBondContact OE2-CG2 3.17Å
1050	H	84.5	Confident	83.5	Confident	44 Å²	44	40.9 Å²	40.9	20%	0.204	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.7	-170.1	-53.5	81.5	0	0	0	110.9	Y1046 D1047 E1065 V1066	Y1046-H1050 HydrophobicContact CD1-CB 4.15Å; Y1046-H1050 HydrophobicContact CE1-CB 3.25Å; Y1046-H1050 HydrophobicContact CE2-CB 4.02Å; Y1046-H1050 AromaticContact CZ-CG 3.82Å; Y1046-H1050 PolarHBondContact N-O 3.48Å; Y1046-H1050 WeakPolarHBondContact OH-CB 3.24Å; Y1046-H1050 VanDerWaalsContact OH-CG 3.3Å; D1047-H1050 WeakPolarHBondContact OD1-CA 3.37Å; D1047-H1050 VanDerWaalsContact OD1-CB 3.25Å; D1047-H1050 WeakPolarHBondContact OD1-CB 3.41Å; D1047-H1050 IonicContact OD1-CG 2.9Å; D1047-H1050 PolarHBondContact OD1-N 3.39Å; D1047-H1050 IonicContact OD1-ND1 2.76Å; D1047-H1050 PolarHBondContact OD1-ND1 2.92Å; D1047-H1050 IonicContact OD2-CE1 3.05Å; D1047-H1050 IonicContact OD2-CG 3.26Å; D1047-H1050 IonicContact OD2-ND1 3.85Å; D1047-H1050 PolarHBondContact OD2-ND1 3.03Å; H1050-E1065 IonicContact CD2-OE1 2.81Å; H1050-E1065 PolarHBondContact CD2-OE1 3.36Å; H1050-E1065 IonicContact CG-OE1 3.54Å; H1050-V1066 WeakPolarHBondContact CA-O 3.18Å
1051	L	87.2	Confident	83.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.9	-174.2	173.4	89.3	0	0	0	108.8	I1043 T1044 F1045 I1053 E1065 V1066 V1402 I1414	I1043-L1051 HydrophobicContact CD1-CD1 3.88Å; I1043-L1051 HydrophobicContact CD1-CD2 3.44Å; I1043-L1051 VanDerWaalsContact CD1-CD2 3.44Å; I1043-L1051 HydrophobicContact CD1-CG 3.95Å; I1043-L1051 HydrophobicContact CG1-CD1 3.61Å; I1043-L1051 HydrophobicContact CG1-CD2 3.97Å; I1043-L1051 HydrophobicContact CG1-CG 3.88Å; T1044-L1051 WeakPolarHBondContact O-CD1 3.24Å; F1045-L1051 HydrophobicContact CB-CD1 4.49Å; F1045-L1051 HydrophobicContact CD1-CB 3.92Å; F1045-L1051 HydrophobicContact CD1-CD1 3.7Å; F1045-L1051 HydrophobicContact CD1-CG 4.49Å; F1045-L1051 HydrophobicContact CD2-CD1 3.7Å; F1045-L1051 HydrophobicContact CE1-CB 3.83Å; F1045-L1051 HydrophobicContact CE1-CD1 3.68Å; F1045-L1051 HydrophobicContact CE1-CG 4.33Å; F1045-L1051 HydrophobicContact CE2-CD1 3.71Å; F1045-L1051 HydrophobicContact CG-CD1 3.69Å; F1045-L1051 HydrophobicContact CZ-CD1 3.68Å; L1051-I1053 HydrophobicContact CD2-CD1 4.18Å; L1051-I1053 HydrophobicContact CD2-CG1 4.12Å; L1051-E1065 CarbonylContact O-C 3.39Å; L1051-E1065 WeakPolarHBondContact O-CA 3.31Å; L1051-V1066 HydrophobicContact CB-CB 4.02Å; L1051-V1066 HydrophobicContact CB-CG1 4.47Å; L1051-V1066 HydrophobicContact CD2-CB 3.95Å; L1051-V1066 HydrophobicContact CD2-CG1 4.16Å; L1051-V1066 HydrophobicContact CD2-CG2 4.21Å; L1051-V1066 HydrophobicContact CG-CB 4.48Å; L1051-V1066 PolarHBondContact N-O 2.73Å; L1051-V1066 PolarHBondContact O-N 2.87Å; L1051-V1402 HydrophobicContact CD1-CG2 3.91Å; L1051-I1414 HydrophobicContact CD1-CD1 4.49Å; L1051-I1414 HydrophobicContact CD2-CD1 3.48Å; L1051-I1414 VanDerWaalsContact CD2-CD1 3.48Å; L1051-I1414 HydrophobicContact CD2-CG2 4.22Å; L1051-I1414 HydrophobicContact CG-CD1 4.39Å
1052	W	87.6	Confident	83.1	Confident	1 Å²	1	43.8 Å²	43.8	0%	0.004	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	136.5	175.9	-84.3	24.3	0	0	0	111.6	I1043 T1044 Y1046 I1063 I1076 I1087 I1095 Y1107 V1109	I1043-W1052 VanDerWaalsContact CA-O 3.23Å; I1043-W1052 WeakPolarHBondContact CA-O 2.95Å; I1043-W1052 WeakPolarHBondContact CG1-O 3.24Å; T1044-W1052 PolarHBondContact N-O 3.35Å; T1044-W1052 PolarHBondContact O-N 3.17Å; Y1046-W1052 AromaticContact CD1-CD1 3.32Å; Y1046-W1052 AromaticContact CD1-CG 4Å; Y1046-W1052 HydrophobicContact CD1-CG 4Å; Y1046-W1052 AromaticContact CD1-NE1 3.48Å; Y1046-W1052 AromaticContact CE1-CD1 3.26Å; Y1046-W1052 HydrophobicContact CE1-CG 4.32Å; Y1046-W1052 AromaticContact CE1-NE1 3.16Å; W1052-I1063 HydrophobicContact CD2-CG2 3.98Å; W1052-I1063 HydrophobicContact CE3-CG2 3.69Å; W1052-I1063 HydrophobicContact CG-CG2 4.46Å; W1052-I1063 HydrophobicContact CH2-CG2 4.47Å; W1052-I1063 HydrophobicContact CZ3-CD1 4.03Å; W1052-I1063 HydrophobicContact CZ3-CG2 3.98Å; W1052-I1076 HydrophobicContact CH2-CD1 4.26Å; W1052-I1076 HydrophobicContact CZ2-CD1 3.7Å; W1052-I1087 HydrophobicContact CB-CD1 4.45Å; W1052-I1095 HydrophobicContact CD2-CD1 3.37Å; W1052-I1095 HydrophobicContact CE3-CD1 3.23Å; W1052-I1095 HydrophobicContact CE3-CG1 4.48Å; W1052-I1095 HydrophobicContact CE3-CG2 4.42Å; W1052-I1095 HydrophobicContact CG-CD1 3.97Å; W1052-I1095 HydrophobicContact CH2-CD1 4.12Å; W1052-I1095 HydrophobicContact CZ2-CD1 4.24Å; W1052-I1095 HydrophobicContact CZ3-CD1 3.64Å; W1052-Y1107 AromaticContact CH2-CD1 3.29Å; W1052-Y1107 HydrophobicContact CH2-CD1 3.29Å; W1052-Y1107 AromaticContact CH2-CE1 3.37Å; W1052-Y1107 HydrophobicContact CH2-CE1 3.37Å; W1052-Y1107 HydrophobicContact CH2-CG 4.18Å; W1052-Y1107 HydrophobicContact CZ2-CD1 4.4Å; W1052-Y1107 HydrophobicContact CZ2-CE1 4.26Å; W1052-Y1107 AromaticContact CZ3-CD1 3.76Å; W1052-Y1107 HydrophobicContact CZ3-CD1 3.76Å; W1052-Y1107 HydrophobicContact CZ3-CE1 4.17Å; W1052-Y1107 HydrophobicContact CZ3-CG 4.23Å; W1052-V1109 HydrophobicContact CH2-CG2 4.05Å; W1052-V1109 HydrophobicContact CZ2-CB 4.01Å; W1052-V1109 HydrophobicContact CZ2-CG1 3.79Å; W1052-V1109 HydrophobicContact CZ2-CG2 3.68Å
1053	I	88.4	Confident	82.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	117.8	175.9	-58.1	-172.1	0	0	0	108.5	I1040 I1043 L1051 Y1055 I1063 S1064 V1066 M1073 F1420 V1426	I1040-I1053 HydrophobicContact CG2-CG2 3.85Å; I1043-I1053 HydrophobicContact CD1-CD1 4.21Å; I1043-I1053 HydrophobicContact CD1-CG1 4.02Å; I1043-I1053 HydrophobicContact CG1-CG1 4.2Å; L1051-I1053 HydrophobicContact CD2-CD1 4.18Å; L1051-I1053 HydrophobicContact CD2-CG1 4.12Å; I1053-Y1055 HydrophobicContact CG2-CD1 4.34Å; I1053-I1063 WeakPolarHBondContact O-CA 3.23Å; I1053-S1064 PolarHBondContact N-O 3.26Å; I1053-S1064 PolarHBondContact O-N 2.83Å; I1053-V1066 HydrophobicContact CD1-CG2 3.58Å; I1053-V1066 HydrophobicContact CG1-CG2 4.05Å; I1053-M1073 HydrophobicContact CD1-SD 4.08Å; I1053-F1420 HydrophobicContact CG2-CD2 4.13Å; I1053-F1420 HydrophobicContact CG2-CE2 4.11Å; I1053-V1426 HydrophobicContact CD1-CG1 4.06Å; I1053-V1426 HydrophobicContact CD1-CG2 3.67Å
1054	C	89.2	Confident	82.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.7	167	-62.7	0	0	0	0	109	Q1041 A1042 Q1062 V1084	Q1041-C1054 PolarHBondContact N-O 2.94Å; A1042-C1054 HydrophobicContact CB-CB 4.23Å; A1042-C1054 PolarHBondContact N-O 3.21Å; A1042-C1054 PolarHBondContact O-N 3.47Å; C1054-Q1062 WeakPolarHBondContact CA-O 3.25Å; C1054-V1084 HydrophobicContact CB-CB 4.12Å; C1054-V1084 HydrophobicContact CB-CG1 4.33Å; C1054-V1084 HydrophobicContact CB-CG2 4.21Å
1055	Y	86.8	Confident	82.4	Confident	14 Å²	14	43.8 Å²	43.8	6%	0.055	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	152.8	180	63.5	-78.9	0	0	0	110.5	A1038 V1039 I1053 S1061 Q1062 S1064 S1075 F1420	A1038-Y1055 HydrophobicContact CB-CD2 3.99Å; V1039-Y1055 CarbonylContact O-C 3.54Å; V1039-Y1055 WeakPolarHBondContact O-CA 3.32Å; V1039-Y1055 WeakPolarHBondContact O-CB 3.05Å; I1053-Y1055 HydrophobicContact CG2-CD1 4.34Å; Y1055-S1061 CarbonylContact O-C 3.55Å; Y1055-S1061 WeakPolarHBondContact O-CA 3.44Å; Y1055-Q1062 HydrophobicContact CD2-CB 4.46Å; Y1055-Q1062 HydrophobicContact CE1-CB 3.93Å; Y1055-Q1062 HydrophobicContact CE2-CB 3.86Å; Y1055-Q1062 PolarHBondContact N-O 3.1Å; Y1055-Q1062 PolarHBondContact O-N 2.99Å; Y1055-Q1062 PolarHBondContact OH-OE1 3.43Å; Y1055-S1064 WeakPolarHBondContact CE1-OG 3.43Å; Y1055-S1064 PolarHBondContact OH-OG 2.95Å; Y1055-S1075 PolarHBondContact OH-OG 3.32Å; Y1055-F1420 HydrophobicContact CD1-CD1 4.39Å; Y1055-F1420 AromaticContact CD1-CD2 3.59Å; Y1055-F1420 HydrophobicContact CD1-CD2 3.59Å; Y1055-F1420 HydrophobicContact CD1-CE1 4.25Å; Y1055-F1420 AromaticContact CD1-CE2 3.39Å; Y1055-F1420 HydrophobicContact CD1-CE2 3.39Å; Y1055-F1420 HydrophobicContact CD1-CG 4.09Å; Y1055-F1420 AromaticContact CD1-CZ 3.75Å; Y1055-F1420 HydrophobicContact CD1-CZ 3.75Å; Y1055-F1420 HydrophobicContact CD2-CB 4.01Å; Y1055-F1420 AromaticContact CD2-CD1 3.47Å; Y1055-F1420 HydrophobicContact CD2-CD1 3.47Å; Y1055-F1420 VanDerWaalsContact CD2-CD1 3.47Å; Y1055-F1420 AromaticContact CD2-CD2 3.93Å; Y1055-F1420 HydrophobicContact CD2-CD2 3.93Å; Y1055-F1420 AromaticContact CD2-CE1 3.83Å; Y1055-F1420 HydrophobicContact CD2-CE1 3.83Å; Y1055-F1420 HydrophobicContact CD2-CE2 4.23Å; Y1055-F1420 AromaticContact CD2-CG 3.53Å; Y1055-F1420 HydrophobicContact CD2-CG 3.53Å; Y1055-F1420 HydrophobicContact CD2-CZ 4.18Å; Y1055-F1420 HydrophobicContact CE1-CD2 4.26Å; Y1055-F1420 HydrophobicContact CE1-CE1 4.02Å; Y1055-F1420 AromaticContact CE1-CE2 3.67Å; Y1055-F1420 HydrophobicContact CE1-CE2 3.67Å; Y1055-F1420 AromaticContact CE1-CZ 3.53Å; Y1055-F1420 HydrophobicContact CE1-CZ 3.53Å; Y1055-F1420 AromaticContact CE2-CD1 3.64Å; Y1055-F1420 HydrophobicContact CE2-CD1 3.64Å; Y1055-F1420 AromaticContact CE2-CE1 3.55Å; Y1055-F1420 HydrophobicContact CE2-CE1 3.55Å; Y1055-F1420 HydrophobicContact CE2-CE2 4.44Å; Y1055-F1420 HydrophobicContact CE2-CG 4.15Å; Y1055-F1420 AromaticContact CE2-CZ 3.96Å; Y1055-F1420 HydrophobicContact CE2-CZ 3.96Å; Y1055-F1420 HydrophobicContact CG-CB 4.02Å; Y1055-F1420 AromaticContact CG-CD1 3.88Å; Y1055-F1420 HydrophobicContact CG-CD1 3.88Å; Y1055-F1420 AromaticContact CG-CD2 3.42Å; Y1055-F1420 HydrophobicContact CG-CD2 3.42Å; Y1055-F1420 VanDerWaalsContact CG-CD2 3.42Å; Y1055-F1420 HydrophobicContact CG-CE1 4.18Å; Y1055-F1420 AromaticContact CG-CE2 3.71Å; Y1055-F1420 HydrophobicContact CG-CE2 3.71Å; Y1055-F1420 AromaticContact CG-CG 3.5Å; Y1055-F1420 HydrophobicContact CG-CG 3.5Å; Y1055-F1420 VanDerWaalsContact CG-CG 3.5Å; Y1055-F1420 HydrophobicContact CG-CZ 4.08Å; Y1055-F1420 AromaticContact CZ-CE1 3.65Å; Y1055-F1420 AromaticContact CZ-CZ 3.63Å
1056	G	83.2	Confident	82.2	Confident	11 Å²	11	43.1 Å²	43.1	11%	0.113	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.3	-159.5	-178.8	0	0	0	0	0	112.5	V1039 Y1060	V1039-G1056 PolarHBondContact N-O 3.43Å; V1039-G1056 PolarHBondContact O-N 3.42Å; G1056-Y1060 WeakPolarHBondContact CA-O 3.39Å
1057	D	76.8	Confident	82.3	Confident	85 Å²	85	43.5 Å²	43.5	46%	0.455	21%	0.21	S	C	.	.			trans	-108.3	-151.3	-179.8	68.7	14.7	0	0	0	111.4	Q1041 L1059 Y1060	Q1041-D1057 PolarHBondContact NE2-O 2.98Å; D1057-L1059 WeakPolarHBondContact OD1-CA 2.92Å; D1057-L1059 PolarHBondContact OD1-N 3.26Å; D1057-Y1060 PolarHBondContact N-O 3.49Å; D1057-Y1060 PolarHBondContact OD1-N 2.74Å
1058	K	68.9	Low	82.2	Confident	177 Å²	177	41.9 Å²	41.9	77%	0.77	20%	0.201	S	C	*	.	S	Bend	trans	-80.8	-23.2	178	-65.8	-177	-178.4	178.5	0	112.9
1059	L	68.8	Low	82.2	Confident	114 Å²	114	42.1 Å²	42.1	60%	0.597	21%	0.206	S	C	*	.	S	Bend	trans	-99.8	-40.9	-171.1	-63	174.4	0	0	0	111.4	D1057 E1081 S1082	D1057-L1059 WeakPolarHBondContact OD1-CA 2.92Å; D1057-L1059 PolarHBondContact OD1-N 3.26Å; L1059-E1081 CarbonylContact O-C 3.58Å; L1059-E1081 VanDerWaalsContact O-C 3.27Å; L1059-S1082 WeakPolarHBondContact O-CA 3.41Å; L1059-S1082 PolarHBondContact O-N 2.89Å
1060	Y	74.4	Confident	82	Confident	126 Å²	126	40.9 Å²	40.9	49%	0.494	21%	0.208	S	C	.	.			trans	-133.5	148.8	-174.7	-56.2	-82.2	0	0	0	112	G1056 D1057 L1080	G1056-Y1060 WeakPolarHBondContact CA-O 3.39Å; D1057-Y1060 PolarHBondContact N-O 3.49Å; D1057-Y1060 PolarHBondContact OD1-N 2.74Å; Y1060-L1080 VanDerWaalsContact CA-O 3.31Å; Y1060-L1080 WeakPolarHBondContact CA-O 3.37Å
1061	S	83.2	Confident	81.7	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.4	171.8	-46	0	0	0	0	110.5	Q1041 Y1055 L1080 S1082 R1083 V1084	Q1041-S1061 PolarHBondContact NE2-OG 2.76Å; Q1041-S1061 PolarHBondContact OE1-OG 2.84Å; Y1055-S1061 CarbonylContact O-C 3.55Å; Y1055-S1061 WeakPolarHBondContact O-CA 3.44Å; S1061-L1080 PolarHBondContact N-O 2.89Å; S1061-L1080 PolarHBondContact O-N 3.08Å; S1061-S1082 WeakPolarHBondContact CB-O 3.27Å; S1061-S1082 PolarHBondContact OG-O 2.92Å; S1061-R1083 VanDerWaalsContact OG-CA 3.23Å; S1061-R1083 WeakPolarHBondContact OG-CA 3.35Å; S1061-V1084 PolarHBondContact OG-N 3.36Å
1062	Q	84	Confident	81.3	Confident	65 Å²	65	41.2 Å²	41.2	30%	0.304	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	157.6	170.5	-74.9	179.1	-4.6	0	0	110.1	C1054 Y1055 E1079	C1054-Q1062 WeakPolarHBondContact CA-O 3.25Å; Y1055-Q1062 HydrophobicContact CD2-CB 4.46Å; Y1055-Q1062 HydrophobicContact CE1-CB 3.93Å; Y1055-Q1062 HydrophobicContact CE2-CB 3.86Å; Y1055-Q1062 PolarHBondContact N-O 3.1Å; Y1055-Q1062 PolarHBondContact O-N 2.99Å; Y1055-Q1062 PolarHBondContact OH-OE1 3.43Å; Q1062-E1079 HydrophobicContact CG-CG 3.81Å; Q1062-E1079 PolarHBondContact NE2-OE1 3.37Å
1063	I	85.1	Confident	81	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.5	176.8	-49.5	178.4	0	0	0	108.7	W1052 I1053 I1076 Y1078 L1080	W1052-I1063 HydrophobicContact CD2-CG2 3.98Å; W1052-I1063 HydrophobicContact CE3-CG2 3.69Å; W1052-I1063 HydrophobicContact CG-CG2 4.46Å; W1052-I1063 HydrophobicContact CH2-CG2 4.47Å; W1052-I1063 HydrophobicContact CZ3-CD1 4.03Å; W1052-I1063 HydrophobicContact CZ3-CG2 3.98Å; I1053-I1063 WeakPolarHBondContact O-CA 3.23Å; I1063-I1076 HydrophobicContact CB-CD1 4.41Å; I1063-I1076 HydrophobicContact CG2-CD1 3.82Å; I1063-I1076 PolarHBondContact O-N 2.9Å; I1063-Y1078 HydrophobicContact CD1-CD1 4.15Å; I1063-L1080 HydrophobicContact CD1-CD1 4.07Å; I1063-L1080 HydrophobicContact CG1-CD1 4.25Å
1064	S	84.8	Confident	80.6	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	139	169	-81.2	0	0	0	0	109.9	I1053 Y1055 Q1074 S1075	I1053-S1064 PolarHBondContact N-O 3.26Å; I1053-S1064 PolarHBondContact O-N 2.83Å; Y1055-S1064 WeakPolarHBondContact CE1-OG 3.43Å; Y1055-S1064 PolarHBondContact OH-OG 2.95Å; S1064-Q1074 CarbonylContact C-O 3.59Å; S1064-Q1074 WeakPolarHBondContact CA-O 3.19Å; S1064-S1075 WeakPolarHBondContact OG-CA 3.38Å
1065	E	85.8	Confident	80.1	Confident	36 Å²	36	45.8 Å²	45.8	17%	0.168	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	135.2	170.1	176.3	169.9	-132	0	0	109.7	Y1046 H1050 L1051 V1067 M1073 Q1074 I1076	Y1046-E1065 PolarHBondContact OH-OE1 2.86Å; H1050-E1065 IonicContact CD2-OE1 2.81Å; H1050-E1065 PolarHBondContact CD2-OE1 3.36Å; H1050-E1065 IonicContact CG-OE1 3.54Å; L1051-E1065 CarbonylContact O-C 3.39Å; L1051-E1065 WeakPolarHBondContact O-CA 3.31Å; E1065-V1067 HydrophobicContact CG-CG2 4.41Å; E1065-M1073 CarbonylContact O-C 3.6Å; E1065-M1073 VanDerWaalsContact O-CA 3.3Å; E1065-M1073 WeakPolarHBondContact O-CA 3.31Å; E1065-Q1074 PolarHBondContact N-O 3.17Å; E1065-Q1074 PolarHBondContact O-N 2.97Å; E1065-I1076 HydrophobicContact CB-CD1 4.19Å; E1065-I1076 HydrophobicContact CB-CG1 4.2Å
1066	V	84	Confident	79.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	113	173.4	170.6	0	0	0	0	107.8	H1050 L1051 I1053 V1068 C1072 M1073 I1444	H1050-V1066 WeakPolarHBondContact CA-O 3.18Å; L1051-V1066 HydrophobicContact CB-CB 4.02Å; L1051-V1066 HydrophobicContact CB-CG1 4.47Å; L1051-V1066 HydrophobicContact CD2-CB 3.95Å; L1051-V1066 HydrophobicContact CD2-CG1 4.16Å; L1051-V1066 HydrophobicContact CD2-CG2 4.21Å; L1051-V1066 HydrophobicContact CG-CB 4.48Å; L1051-V1066 PolarHBondContact N-O 2.73Å; L1051-V1066 PolarHBondContact O-N 2.87Å; I1053-V1066 HydrophobicContact CD1-CG2 3.58Å; I1053-V1066 HydrophobicContact CG1-CG2 4.05Å; V1066-V1068 HydrophobicContact CG1-CG2 4.46Å; V1066-V1068 PolarHBondContact O-N 3.39Å; V1066-C1072 CarbonylContact C-O 3.33Å; V1066-C1072 WeakPolarHBondContact CA-O 3.48Å; V1066-M1073 HydrophobicContact CG2-CB 3.88Å; V1066-M1073 HydrophobicContact CG2-CG 3.61Å; V1066-M1073 HydrophobicContact CG2-SD 3.7Å; V1066-I1444 HydrophobicContact CG1-CD1 3.52Å; V1066-I1444 HydrophobicContact CG1-CG2 3.93Å
1067	V	84.5	Confident	79	Confident	28 Å²	28	48.5 Å²	48.5	17%	0.17	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	105.6	170.9	-172.7	0	0	0	0	107.4	E1065 T1069 S1070 N1071 C1072	E1065-V1067 HydrophobicContact CG-CG2 4.41Å; V1067-T1069 VanDerWaalsContact C-N 3.35Å; V1067-T1069 PolarHBondContact O-N 2.74Å; V1067-S1070 VanDerWaalsContact CB-OG 3.24Å; V1067-S1070 WeakPolarHBondContact CB-OG 3.3Å; V1067-S1070 WeakPolarHBondContact CG1-OG 3.49Å; V1067-S1070 PolarHBondContact O-OG 3Å; V1067-N1071 PolarHBondContact O-N 3.16Å; V1067-N1071 VanDerWaalsContact O-N 3.1Å; V1067-C1072 PolarHBondContact N-O 2.95Å; V1067-C1072 PolarHBondContact O-N 2.69Å; V1067-C1072 VanDerWaalsContact O-N 3.09Å
1068	V	79.3	Confident	78.9	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.024	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-37.5	-171.9	176.2	0	0	0	0	111.4	F1045 E1049 V1066 N1071 L1412 I1414 K1428	F1045-V1068 HydrophobicContact CE1-CG2 4.03Å; E1049-V1068 VanDerWaalsContact O-CB 3.22Å; E1049-V1068 WeakPolarHBondContact O-CB 3.34Å; E1049-V1068 VanDerWaalsContact O-CG2 3.27Å; E1049-V1068 WeakPolarHBondContact O-CG2 3.45Å; E1049-V1068 PolarHBondContact O-N 3.02Å; V1066-V1068 HydrophobicContact CG1-CG2 4.46Å; V1066-V1068 PolarHBondContact O-N 3.39Å; V1068-N1071 PolarHBondContact O-N 3.3Å; V1068-N1071 PolarHBondContact O-OD1 3.04Å; V1068-L1412 HydrophobicContact CB-CD2 4.05Å; V1068-L1412 HydrophobicContact CG1-CD1 3.32Å; V1068-L1412 HydrophobicContact CG1-CD2 3.4Å; V1068-L1412 VanDerWaalsContact CG1-CD2 3.4Å; V1068-L1412 HydrophobicContact CG1-CG 3.95Å; V1068-L1412 HydrophobicContact CG2-CD2 3.64Å; V1068-I1414 HydrophobicContact CG2-CD1 4.12Å; V1068-K1428 HydrophobicContact CG1-CD 4.02Å; V1068-K1428 PolarHBondContact O-NZ 3.43Å
1069	T	79.2	Confident	79.3	Confident	86 Å²	86	44.4 Å²	44.4	53%	0.528	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-40.3	-176.4	45.7	0	0	0	0	111.8	E1049 V1067	E1049-T1069 HydrophobicContact CB-CG2 4.12Å; E1049-T1069 VanDerWaalsContact CD-CG2 3.48Å; E1049-T1069 HydrophobicContact CG-CG2 3.81Å; E1049-T1069 WeakPolarHBondContact OE2-CG2 3.17Å; V1067-T1069 VanDerWaalsContact C-N 3.35Å; V1067-T1069 PolarHBondContact O-N 2.74Å
1070	S	77.2	Confident	79.9	Confident	65 Å²	65	39.2 Å²	39.2	46%	0.455	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-1.9	174.7	50.9	0	0	0	0	114.1	V1067 C1072	V1067-S1070 VanDerWaalsContact CB-OG 3.24Å; V1067-S1070 WeakPolarHBondContact CB-OG 3.3Å; V1067-S1070 WeakPolarHBondContact CG1-OG 3.49Å; V1067-S1070 PolarHBondContact O-OG 3Å; S1070-C1072 PolarHBondContact O-N 3.33Å; S1070-C1072 PolarHBondContact OG-SG 3.39Å
1071	N	77.3	Confident	80.1	Confident	25 Å²	25	41.3 Å²	41.3	13%	0.134	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	38.4	-171.6	-70	-13	0	0	0	111.8	V1067 V1068 K1428 E1442 Y1445	V1067-N1071 PolarHBondContact O-N 3.16Å; V1067-N1071 VanDerWaalsContact O-N 3.1Å; V1068-N1071 PolarHBondContact O-N 3.3Å; V1068-N1071 PolarHBondContact O-OD1 3.04Å; N1071-K1428 WeakPolarHBondContact OD1-CD 3.37Å; N1071-K1428 PolarHBondContact OD1-NZ 3.17Å; N1071-E1442 PolarHBondContact ND2-OE2 2.69Å; N1071-Y1445 HydrophobicContact CB-CD2 4.48Å; N1071-Y1445 PolarHBondContact O-N 3.49Å
1072	C	78.8	Confident	80	Confident	26 Å²	26	41.9 Å²	41.9	18%	0.176	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	145	-179.1	77.2	0	0	0	0	112.2	V1066 V1067 S1070 Y1445	V1066-C1072 CarbonylContact C-O 3.33Å; V1066-C1072 WeakPolarHBondContact CA-O 3.48Å; V1067-C1072 PolarHBondContact N-O 2.95Å; V1067-C1072 PolarHBondContact O-N 2.69Å; V1067-C1072 VanDerWaalsContact O-N 3.09Å; S1070-C1072 PolarHBondContact O-N 3.33Å; S1070-C1072 PolarHBondContact OG-SG 3.39Å; C1072-Y1445 CarbonylContact C-O 3.2Å; C1072-Y1445 VanDerWaalsContact CA-O 3.29Å; C1072-Y1445 WeakPolarHBondContact CA-O 3.37Å
1073	M	81.5	Confident	79.9	Confident	6 Å²	6	41.7 Å²	41.7	3%	0.03	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	133.8	175.8	-176.4	166.6	61.9	0	0	109.6	I1053 E1065 V1066 F1420 I1444 Y1445 V1446 F1447	I1053-M1073 HydrophobicContact CD1-SD 4.08Å; E1065-M1073 CarbonylContact O-C 3.6Å; E1065-M1073 VanDerWaalsContact O-CA 3.3Å; E1065-M1073 WeakPolarHBondContact O-CA 3.31Å; V1066-M1073 HydrophobicContact CG2-CB 3.88Å; V1066-M1073 HydrophobicContact CG2-CG 3.61Å; V1066-M1073 HydrophobicContact CG2-SD 3.7Å; M1073-F1420 HydrophobicContact CE-CD2 4.34Å; M1073-F1420 HydrophobicContact CE-CE1 3.98Å; M1073-F1420 HydrophobicContact CE-CE2 3.43Å; M1073-F1420 VanDerWaalsContact CE-CE2 3.43Å; M1073-F1420 HydrophobicContact CE-CZ 3.21Å; M1073-F1420 HydrophobicContact SD-CD2 4.48Å; M1073-F1420 HydrophobicContact SD-CE2 3.37Å; M1073-F1420 WeakPolarHBondContact SD-CE2 3.17Å; M1073-F1420 HydrophobicContact SD-CZ 3.55Å; M1073-F1420 VanDerWaalsContact SD-CZ 3.55Å; M1073-I1444 HydrophobicContact CB-CG2 4.1Å; M1073-Y1445 PolarHBondContact N-O 3.16Å; M1073-V1446 HydrophobicContact CE-CG2 3.6Å; M1073-F1447 PolarHBondContact O-N 2.69Å
1074	Q	79.7	Confident	80.1	Confident	49 Å²	49	41.7 Å²	41.7	23%	0.229	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	131.9	-178.9	-173.7	178.2	63.5	0	0	110.6	S1064 E1065 R1449	S1064-Q1074 CarbonylContact C-O 3.59Å; S1064-Q1074 WeakPolarHBondContact CA-O 3.19Å; E1065-Q1074 PolarHBondContact N-O 3.17Å; E1065-Q1074 PolarHBondContact O-N 2.97Å; Q1074-R1449 VanDerWaalsContact CD-NH2 3.3Å; Q1074-R1449 HydrophobicContact CG-CG 4.25Å
1075	S	78.8	Confident	80.3	Confident	41 Å²	41	43.4 Å²	43.4	29%	0.287	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	133.8	172	-172.8	0	0	0	0	110.9	Y1055 S1064 G1077	Y1055-S1075 PolarHBondContact OH-OG 3.32Å; S1064-S1075 WeakPolarHBondContact OG-CA 3.38Å; S1075-G1077 VanDerWaalsContact C-N 3.27Å; S1075-G1077 PolarHBondContact OG-N 3.38Å
1076	I	75.9	Confident	80.6	Confident	20 Å²	20	42.1 Å²	42.1	10%	0.103	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-20.9	177.9	-61.2	-179.2	0	0	0	110.7	W1052 I1063 E1065 Y1078 N1112	W1052-I1076 HydrophobicContact CH2-CD1 4.26Å; W1052-I1076 HydrophobicContact CZ2-CD1 3.7Å; I1063-I1076 HydrophobicContact CB-CD1 4.41Å; I1063-I1076 HydrophobicContact CG2-CD1 3.82Å; I1063-I1076 PolarHBondContact O-N 2.9Å; E1065-I1076 HydrophobicContact CB-CD1 4.19Å; E1065-I1076 HydrophobicContact CB-CG1 4.2Å; I1076-Y1078 VanDerWaalsContact C-N 3.29Å; I1076-N1112 WeakPolarHBondContact CG2-OD1 3.32Å
1077	G	70.7	Confident	81	Confident	63 Å²	63	43.2 Å²	43.2	65%	0.649	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	77.8	10.7	-177.7	0	0	0	0	0	114.2	S1075	S1075-G1077 VanDerWaalsContact C-N 3.27Å; S1075-G1077 PolarHBondContact OG-N 3.38Å
1078	Y	74.4	Confident	81.3	Confident	62 Å²	62	42.7 Å²	42.7	24%	0.243	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	124.6	174.6	-171	-93.4	0	0	0	110.2	I1063 I1076 L1080 Y1107	I1063-Y1078 HydrophobicContact CD1-CD1 4.15Å; I1076-Y1078 VanDerWaalsContact C-N 3.29Å; Y1078-L1080 HydrophobicContact CD1-CD2 4.46Å; Y1078-L1080 HydrophobicContact CD1-CG 4.37Å; Y1078-L1080 HydrophobicContact CE1-CD2 3.73Å; Y1078-L1080 HydrophobicContact CE1-CG 4.09Å; Y1078-Y1107 HydrophobicContact CD1-CD2 4.38Å; Y1078-Y1107 AromaticContact CD1-CE2 3.62Å; Y1078-Y1107 HydrophobicContact CD1-CE2 3.62Å; Y1078-Y1107 HydrophobicContact CD2-CE2 4.1Å; Y1078-Y1107 HydrophobicContact CE1-CD2 4.09Å; Y1078-Y1107 AromaticContact CE1-CE2 3.62Å; Y1078-Y1107 HydrophobicContact CE1-CE2 3.62Å; Y1078-Y1107 HydrophobicContact CE2-CE2 4.1Å; Y1078-Y1107 AromaticContact CG-CE2 3.87Å; Y1078-Y1107 HydrophobicContact CG-CE2 3.87Å; Y1078-Y1107 AromaticContact CZ-CE2 3.88Å
1079	E	78.9	Confident	81.8	Confident	113 Å²	113	43.4 Å²	43.4	53%	0.528	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.1	179.6	-71.8	-175.6	167.7	0	0	110.9	Q1062	Q1062-E1079 HydrophobicContact CG-CG 3.81Å; Q1062-E1079 PolarHBondContact NE2-OE1 3.37Å
1080	L	80.1	Confident	82.3	Confident	5 Å²	5	39.9 Å²	39.9	3%	0.026	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.2	171.4	-67.3	160.9	0	0	0	108.6	Y1060 S1061 I1063 Y1078 S1082 V1084 L1097 M1099	Y1060-L1080 VanDerWaalsContact CA-O 3.31Å; Y1060-L1080 WeakPolarHBondContact CA-O 3.37Å; S1061-L1080 PolarHBondContact N-O 2.89Å; S1061-L1080 PolarHBondContact O-N 3.08Å; I1063-L1080 HydrophobicContact CD1-CD1 4.07Å; I1063-L1080 HydrophobicContact CG1-CD1 4.25Å; Y1078-L1080 HydrophobicContact CD1-CD2 4.46Å; Y1078-L1080 HydrophobicContact CD1-CG 4.37Å; Y1078-L1080 HydrophobicContact CE1-CD2 3.73Å; Y1078-L1080 HydrophobicContact CE1-CG 4.09Å; L1080-S1082 PolarHBondContact O-N 3.44Å; L1080-V1084 HydrophobicContact CD1-CG2 3.47Å; L1080-V1084 VanDerWaalsContact CD1-CG2 3.47Å; L1080-L1097 HydrophobicContact CD1-CD1 3.97Å; L1080-L1097 HydrophobicContact CD2-CD1 4.42Å; L1080-M1099 HydrophobicContact CD2-SD 4.21Å
1081	E	78.1	Confident	82.7	Confident	170 Å²	170	38.8 Å²	38.8	79%	0.794	22%	0.218	S	C	*	.	S	Bend	trans	-74.2	22.6	179.6	-58.6	175.5	172.6	0	0	113.7	L1059	L1059-E1081 CarbonylContact O-C 3.58Å; L1059-E1081 VanDerWaalsContact O-C 3.27Å
1082	S	81.5	Confident	82.8	Confident	12 Å²	12	43.1 Å²	43.1	8%	0.084	24%	0.242	C	C	.	.	S	Bend	trans	-159.9	160.2	174.8	-166.5	0	0	0	0	110.8	L1059 S1061 L1080 V1084 S1101	L1059-S1082 WeakPolarHBondContact O-CA 3.41Å; L1059-S1082 PolarHBondContact O-N 2.89Å; S1061-S1082 WeakPolarHBondContact CB-O 3.27Å; S1061-S1082 PolarHBondContact OG-O 2.92Å; L1080-S1082 PolarHBondContact O-N 3.44Å; S1082-V1084 PolarHBondContact O-N 2.86Å; S1082-S1101 WeakPolarHBondContact CB-OG 3.35Å; S1082-S1101 WeakPolarHBondContact OG-CB 3.37Å; S1082-S1101 PolarHBondContact OG-N 3.2Å; S1082-S1101 VanDerWaalsContact OG-N 3.11Å; S1082-S1101 PolarHBondContact OG-OG 2.82Å
1083	R	83.2	Confident	83.2	Confident	61 Å²	61	44.2 Å²	44.2	23%	0.23	24%	0.244	C	C	.	.			trans	-64.5	126.7	168.8	177.5	159.5	-179.8	-175.9	11.4	111.3	Q1041 S1061 M1100	Q1041-R1083 HydrophobicContact CG-CG 4.37Å; S1061-R1083 VanDerWaalsContact OG-CA 3.23Å; S1061-R1083 WeakPolarHBondContact OG-CA 3.35Å; R1083-M1100 HydrophobicContact CB-CB 4.31Å; R1083-M1100 HydrophobicContact CB-CG 4.13Å; R1083-M1100 HydrophobicContact CB-SD 3.9Å; R1083-M1100 VanDerWaalsContact CD-SD 3.52Å; R1083-M1100 HydrophobicContact CG-CG 4.15Å; R1083-M1100 HydrophobicContact CG-SD 3.65Å; R1083-M1100 PolarHBondContact O-N 3.26Å
1084	V	88.9	Confident	83.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	127.4	169.9	-178.5	0	0	0	0	108.7	Q1041 A1042 C1054 S1061 L1080 S1082 C1086 L1097	Q1041-V1084 WeakPolarHBondContact CB-O 3.48Å; Q1041-V1084 PolarHBondContact OE1-O 3.44Å; A1042-V1084 HydrophobicContact CB-CG1 3.86Å; C1054-V1084 HydrophobicContact CB-CB 4.12Å; C1054-V1084 HydrophobicContact CB-CG1 4.33Å; C1054-V1084 HydrophobicContact CB-CG2 4.21Å; S1061-V1084 PolarHBondContact OG-N 3.36Å; L1080-V1084 HydrophobicContact CD1-CG2 3.47Å; L1080-V1084 VanDerWaalsContact CD1-CG2 3.47Å; S1082-V1084 PolarHBondContact O-N 2.86Å; V1084-C1086 WeakPolarHBondContact CG1-O 3.26Å; V1084-L1097 HydrophobicContact CG1-CD2 4.03Å
1085	S	89	Confident	84.1	Confident	39 Å²	39	41.8 Å²	41.8	27%	0.273	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-36.9	178.6	42.4	0	0	0	0	112.2	G1098 V1124	S1085-G1098 PolarHBondContact N-O 3.11Å; S1085-G1098 VanDerWaalsContact OG-C 3.31Å; S1085-G1098 PolarHBondContact OG-O 2.87Å; S1085-V1124 WeakPolarHBondContact CB-O 3.4Å; S1085-V1124 PolarHBondContact OG-O 3.19Å
1086	C	90.9	Very high	84.9	Confident	9 Å²	9	39.9 Å²	39.9	6%	0.061	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	158.7	177.3	56.8	0	0	0	0	111.2	V1084 G1098 I1127	V1084-C1086 WeakPolarHBondContact CG1-O 3.26Å; C1086-G1098 PolarHBondContact N-O 2.89Å; C1086-G1098 PolarHBondContact O-N 2.8Å; C1086-I1127 VanDerWaalsContact SG-CD1 3.53Å
1087	I	92.4	Very high	85.7	Confident	24 Å²	24	38.9 Å²	38.9	12%	0.123	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141.7	-177.9	-171.3	168.8	0	0	0	109.5	A1042 I1043 T1044 W1052 I1095 L1096 L1097	A1042-I1087 HydrophobicContact CB-CB 3.79Å; A1042-I1087 HydrophobicContact CB-CG2 3.49Å; A1042-I1087 VanDerWaalsContact CB-CG2 3.49Å; I1043-I1087 WeakPolarHBondContact O-CG2 3.17Å; T1044-I1087 HydrophobicContact CG2-CD1 3.79Å; T1044-I1087 HydrophobicContact CG2-CG1 3.76Å; T1044-I1087 HydrophobicContact CG2-CG2 4.2Å; W1052-I1087 HydrophobicContact CB-CD1 4.45Å; I1087-I1095 HydrophobicContact CD1-CG2 3.76Å; I1087-I1095 HydrophobicContact CG1-CG2 3.52Å; I1087-L1096 CarbonylContact C-O 3.5Å; I1087-L1096 WeakPolarHBondContact CA-O 3.46Å; I1087-L1097 HydrophobicContact CB-CD2 4.12Å; I1087-L1097 HydrophobicContact CD1-CD2 3.58Å; I1087-L1097 HydrophobicContact CG1-CD2 3.59Å
1088	C	92	Very high	86.7	Confident	16 Å²	16	35.9 Å²	35.9	11%	0.108	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	125.6	179.3	-166	0	0	0	0	110.2	F1090 L1096 I1127 F1129	C1088-F1090 PolarHBondContact O-N 3.48Å; C1088-L1096 HydrophobicContact CB-CB 4.46Å; C1088-L1096 PolarHBondContact N-O 2.7Å; C1088-L1096 PolarHBondContact O-N 2.97Å; C1088-I1127 HydrophobicContact CB-CB 4.03Å; C1088-I1127 HydrophobicContact CB-CG2 3.82Å; C1088-F1129 VanDerWaalsContact SG-CD1 3.55Å
1089	A	90.2	Very high	87.4	Confident	20 Å²	20	33.1 Å²	33.1	17%	0.165	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	101.4	175.3	0	0	0	0	0	109.2	T1044 F1045 F1129	T1044-A1089 HydrophobicContact CG2-CB 4.06Å; F1045-A1089 WeakPolarHBondContact O-CB 3.3Å; A1089-F1129 WeakPolarHBondContact O-CE1 3.28Å
1090	F	88.2	Confident	87.5	Confident	11 Å²	11	32.1 Å²	32.1	5%	0.048	17%	0.169	C	C	.	.			trans	-75.5	-35.1	-177.7	176.5	-104.4	0	0	0	112	C1088 I1094 L1096 F1129 Y1131 N1138 V1140 I1155	C1088-F1090 PolarHBondContact O-N 3.48Å; F1090-I1094 HydrophobicContact CB-CB 4.48Å; F1090-I1094 HydrophobicContact CB-CG2 4.34Å; F1090-I1094 WeakPolarHBondContact CB-O 3.5Å; F1090-I1094 HydrophobicContact CD1-CB 4.15Å; F1090-I1094 HydrophobicContact CD1-CD1 4.4Å; F1090-I1094 HydrophobicContact CD1-CG2 4.2Å; F1090-I1094 PolarHBondContact N-O 3.29Å; F1090-L1096 HydrophobicContact CB-CD1 4.08Å; F1090-L1096 HydrophobicContact CB-CG 4.04Å; F1090-L1096 HydrophobicContact CD2-CD1 4.33Å; F1090-L1096 HydrophobicContact CG-CD1 4.41Å; F1090-F1129 HydrophobicContact CD2-CB 4.09Å; F1090-F1129 HydrophobicContact CD2-CD1 4.23Å; F1090-F1129 HydrophobicContact CD2-CD2 4.19Å; F1090-F1129 AromaticContact CD2-CG 3.89Å; F1090-F1129 HydrophobicContact CD2-CG 3.89Å; F1090-F1129 HydrophobicContact CE2-CB 4.35Å; F1090-F1129 HydrophobicContact CE2-CD2 4.47Å; F1090-F1129 HydrophobicContact CE2-CG 4.41Å; F1090-Y1131 WeakPolarHBondContact CD1-OH 3.36Å; F1090-Y1131 HydrophobicContact CE1-CE1 4.35Å; F1090-Y1131 WeakPolarHBondContact CE1-OH 3.31Å; F1090-Y1131 HydrophobicContact CE2-CE1 4.01Å; F1090-Y1131 HydrophobicContact CE2-CE2 4.33Å; F1090-Y1131 AromaticContact CE2-CZ 3.62Å; F1090-Y1131 VanDerWaalsContact CE2-OH 3.31Å; F1090-Y1131 WeakPolarHBondContact CE2-OH 3.49Å; F1090-Y1131 AromaticContact CZ-CE1 3.7Å; F1090-Y1131 HydrophobicContact CZ-CE1 3.7Å; F1090-Y1131 AromaticContact CZ-CZ 3.57Å; F1090-Y1131 WeakPolarHBondContact CZ-OH 3.44Å; F1090-Y1131 PolarHBondContact O-OH 3.45Å; F1090-N1138 HydrophobicContact CE2-CB 4.32Å; F1090-N1138 HydrophobicContact CZ-CB 4.22Å; F1090-V1140 HydrophobicContact CD2-CG2 4.13Å; F1090-V1140 HydrophobicContact CE2-CG2 4.02Å; F1090-I1155 HydrophobicContact CD1-CG2 4.26Å; F1090-I1155 HydrophobicContact CE1-CG2 3.93Å; F1090-I1155 HydrophobicContact CE2-CG2 4.21Å; F1090-I1155 HydrophobicContact CZ-CB 4.24Å; F1090-I1155 HydrophobicContact CZ-CG2 3.9Å; F1090-I1155 WeakPolarHBondContact CZ-O 3.49Å
1091	S	85.5	Confident	87.6	Confident	42 Å²	42	34 Å²	34	29%	0.294	18%	0.183	S	C	.	.	S	Bend	trans	-148.5	179	170.4	71.1	0	0	0	0	109.7	E1093 I1094	S1091-E1093 PolarHBondContact O-N 3.13Å; S1091-E1093 VanDerWaalsContact O-N 3.16Å; S1091-E1093 PolarHBondContact OG-N 2.87Å; S1091-I1094 PolarHBondContact N-O 2.82Å; S1091-I1094 VanDerWaalsContact N-O 3.09Å; S1091-I1094 PolarHBondContact OG-N 3.48Å
1092	N	81	Confident	88	Confident	117 Å²	117	30.5 Å²	30.5	63%	0.626	17%	0.165	S	C	*	.	S	Bend	trans	-65.2	-13.8	173.8	-62.3	0.9	0	0	0	112.6	Y1046	Y1046-N1092 WeakPolarHBondContact O-CA 3.47Å; Y1046-N1092 PolarHBondContact O-OD1 2.92Å
1093	E	86.1	Confident	88.4	Confident	48 Å²	48	32.6 Å²	32.6	22%	0.224	17%	0.173	C	C	.	.	S	Bend	trans	-109.9	-33.7	178.9	-175.5	172.2	172.2	0	0	112.8	S1091 S1108 V1109 I1110 R1111 F1157	S1091-E1093 PolarHBondContact O-N 3.13Å; S1091-E1093 VanDerWaalsContact O-N 3.16Å; S1091-E1093 PolarHBondContact OG-N 2.87Å; E1093-S1108 CarbonylContact O-C 3.59Å; E1093-S1108 VanDerWaalsContact O-CA 3.27Å; E1093-S1108 WeakPolarHBondContact O-CA 3.01Å; E1093-S1108 PolarHBondContact OE1-OG 2.56Å; E1093-V1109 PolarHBondContact O-N 3.43Å; E1093-I1110 HydrophobicContact CB-CD1 4Å; E1093-I1110 HydrophobicContact CB-CG1 4.4Å; E1093-I1110 HydrophobicContact CG-CB 4.18Å; E1093-I1110 HydrophobicContact CG-CD1 3.77Å; E1093-I1110 HydrophobicContact CG-CG1 3.94Å; E1093-R1111 IonicContact OE1-NE 3.86Å; E1093-F1157 HydrophobicContact CG-CE1 4.24Å; E1093-F1157 HydrophobicContact CG-CZ 4.1Å; E1093-F1157 VanDerWaalsContact OE1-CE1 3.28Å; E1093-F1157 WeakPolarHBondContact OE1-CE1 3.39Å; E1093-F1157 WeakPolarHBondContact OE1-CZ 3.33Å; E1093-F1157 WeakPolarHBondContact OE2-CZ 3.35Å
1094	I	90	Very high	88.8	Confident	5 Å²	5	29.7 Å²	29.7	3%	0.026	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	123.3	-172.3	-56.1	178.1	0	0	0	110.3	F1090 S1091 L1096 A1106 Y1107 I1115 F1157	F1090-I1094 HydrophobicContact CB-CB 4.48Å; F1090-I1094 HydrophobicContact CB-CG2 4.34Å; F1090-I1094 WeakPolarHBondContact CB-O 3.5Å; F1090-I1094 HydrophobicContact CD1-CB 4.15Å; F1090-I1094 HydrophobicContact CD1-CD1 4.4Å; F1090-I1094 HydrophobicContact CD1-CG2 4.2Å; F1090-I1094 PolarHBondContact N-O 3.29Å; S1091-I1094 PolarHBondContact N-O 2.82Å; S1091-I1094 VanDerWaalsContact N-O 3.09Å; S1091-I1094 PolarHBondContact OG-N 3.48Å; I1094-L1096 HydrophobicContact CG2-CD2 4.26Å; I1094-A1106 HydrophobicContact CG2-CB 4.28Å; I1094-Y1107 WeakPolarHBondContact CA-O 3.38Å; I1094-I1115 HydrophobicContact CB-CD1 4.41Å; I1094-I1115 HydrophobicContact CD1-CD1 4.32Å; I1094-I1115 HydrophobicContact CG1-CD1 3.86Å; I1094-I1115 HydrophobicContact CG2-CD1 4.05Å; I1094-F1157 HydrophobicContact CD1-CD1 4.32Å; I1094-F1157 HydrophobicContact CD1-CD2 4.29Å; I1094-F1157 HydrophobicContact CD1-CE1 4.18Å; I1094-F1157 HydrophobicContact CD1-CE2 4.14Å; I1094-F1157 HydrophobicContact CD1-CG 4.37Å; I1094-F1157 HydrophobicContact CD1-CZ 4.07Å; I1094-F1157 HydrophobicContact CG1-CE1 4.19Å; I1094-F1157 HydrophobicContact CG1-CZ 4.22Å
1095	I	91.4	Very high	88.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.6	171.9	-65.1	174.8	0	0	0	108.9	Y1046 W1052 I1087 L1097 A1106 Y1107 V1109	Y1046-I1095 HydrophobicContact CG-CD1 4.44Å; W1052-I1095 HydrophobicContact CD2-CD1 3.37Å; W1052-I1095 HydrophobicContact CE3-CD1 3.23Å; W1052-I1095 HydrophobicContact CE3-CG1 4.48Å; W1052-I1095 HydrophobicContact CE3-CG2 4.42Å; W1052-I1095 HydrophobicContact CG-CD1 3.97Å; W1052-I1095 HydrophobicContact CH2-CD1 4.12Å; W1052-I1095 HydrophobicContact CZ2-CD1 4.24Å; W1052-I1095 HydrophobicContact CZ3-CD1 3.64Å; I1087-I1095 HydrophobicContact CD1-CG2 3.76Å; I1087-I1095 HydrophobicContact CG1-CG2 3.52Å; I1095-L1097 HydrophobicContact CG2-CD2 4.25Å; I1095-L1097 HydrophobicContact CG2-CG 4.37Å; I1095-A1106 CarbonylContact O-C 3.57Å; I1095-A1106 WeakPolarHBondContact O-CA 3.46Å; I1095-Y1107 PolarHBondContact N-O 2.91Å; I1095-Y1107 PolarHBondContact O-N 2.96Å; I1095-V1109 HydrophobicContact CD1-CG2 3.37Å; I1095-V1109 HydrophobicContact CG1-CG2 3.8Å
1096	L	94.1	Very high	89.1	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	132.6	174.5	-57.5	178.1	0	0	0	109.7	I1087 C1088 F1090 I1094 C1105 A1106 W1116 V1140 I1155	I1087-L1096 CarbonylContact C-O 3.5Å; I1087-L1096 WeakPolarHBondContact CA-O 3.46Å; C1088-L1096 HydrophobicContact CB-CB 4.46Å; C1088-L1096 PolarHBondContact N-O 2.7Å; C1088-L1096 PolarHBondContact O-N 2.97Å; F1090-L1096 HydrophobicContact CB-CD1 4.08Å; F1090-L1096 HydrophobicContact CB-CG 4.04Å; F1090-L1096 HydrophobicContact CD2-CD1 4.33Å; F1090-L1096 HydrophobicContact CG-CD1 4.41Å; I1094-L1096 HydrophobicContact CG2-CD2 4.26Å; L1096-C1105 CarbonylContact C-O 3.55Å; L1096-C1105 WeakPolarHBondContact CA-O 3.42Å; L1096-A1106 HydrophobicContact CD2-CB 3.75Å; L1096-W1116 HydrophobicContact CD2-CH2 3.8Å; L1096-W1116 HydrophobicContact CD2-CZ2 4.1Å; L1096-V1140 HydrophobicContact CD1-CG1 3.9Å; L1096-V1140 HydrophobicContact CD1-CG2 3.84Å; L1096-I1155 HydrophobicContact CD2-CG2 4.45Å
1097	L	93.2	Very high	89.1	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	114.8	-177	-63.3	166.7	0	0	0	108.8	L1080 V1084 I1087 I1095 C1105	L1080-L1097 HydrophobicContact CD1-CD1 3.97Å; L1080-L1097 HydrophobicContact CD2-CD1 4.42Å; V1084-L1097 HydrophobicContact CG1-CD2 4.03Å; I1087-L1097 HydrophobicContact CB-CD2 4.12Å; I1087-L1097 HydrophobicContact CD1-CD2 3.58Å; I1087-L1097 HydrophobicContact CG1-CD2 3.59Å; I1095-L1097 HydrophobicContact CG2-CD2 4.25Å; I1095-L1097 HydrophobicContact CG2-CG 4.37Å; L1097-C1105 HydrophobicContact CB-CB 4.19Å; L1097-C1105 PolarHBondContact N-O 3.3Å; L1097-C1105 PolarHBondContact O-N 3.34Å
1098	G	92.4	Very high	88.8	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	126	167.6	0	0	0	0	0	109.4	S1085 C1086	S1085-G1098 PolarHBondContact N-O 3.11Å; S1085-G1098 VanDerWaalsContact OG-C 3.31Å; S1085-G1098 PolarHBondContact OG-O 2.87Å; C1086-G1098 PolarHBondContact N-O 2.89Å; C1086-G1098 PolarHBondContact O-N 2.8Å
1099	M	87.6	Confident	88.3	Confident	4 Å²	4	26.4 Å²	26.4	2%	0.02	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	148.5	-178.2	-55.1	-163.3	-62.3	0	0	111.5	L1080 S1101 K1102 Q1103 C1105 Q1117	L1080-M1099 HydrophobicContact CD2-SD 4.21Å; M1099-S1101 PolarHBondContact O-N 2.94Å; M1099-K1102 PolarHBondContact O-N 2.89Å; M1099-Q1103 HydrophobicContact CB-CB 4.44Å; M1099-Q1103 HydrophobicContact CE-CB 3.44Å; M1099-Q1103 VanDerWaalsContact CE-CB 3.44Å; M1099-Q1103 HydrophobicContact CE-CG 4.33Å; M1099-Q1103 PolarHBondContact N-O 3.2Å; M1099-C1105 HydrophobicContact CE-CB 4.24Å; M1099-C1105 HydrophobicContact SD-CB 4.37Å; M1099-Q1117 HydrophobicContact CE-CG 4.15Å
1100	M	82.6	Confident	87.8	Confident	92 Å²	92	31.5 Å²	31.5	45%	0.453	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.2	173.9	-68.9	-167.3	65.2	0	0	113	R1083 K1102 S1123	R1083-M1100 HydrophobicContact CB-CB 4.31Å; R1083-M1100 HydrophobicContact CB-CG 4.13Å; R1083-M1100 HydrophobicContact CB-SD 3.9Å; R1083-M1100 VanDerWaalsContact CD-SD 3.52Å; R1083-M1100 HydrophobicContact CG-CG 4.15Å; R1083-M1100 HydrophobicContact CG-SD 3.65Å; R1083-M1100 PolarHBondContact O-N 3.26Å; M1100-K1102 PolarHBondContact O-N 3.05Å; M1100-K1102 VanDerWaalsContact O-N 3.14Å; M1100-S1123 PolarHBondContact O-OG 3.02Å; M1100-S1123 VanDerWaalsContact O-OG 3.08Å
1101	S	80.6	Confident	87.5	Confident	45 Å²	45	37.8 Å²	37.8	32%	0.315	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	15.5	171.5	57.9	0	0	0	0	114.1	S1082 M1099 Q1103	S1082-S1101 WeakPolarHBondContact CB-OG 3.35Å; S1082-S1101 WeakPolarHBondContact OG-CB 3.37Å; S1082-S1101 PolarHBondContact OG-N 3.2Å; S1082-S1101 VanDerWaalsContact OG-N 3.11Å; S1082-S1101 PolarHBondContact OG-OG 2.82Å; M1099-S1101 PolarHBondContact O-N 2.94Å; S1101-Q1103 PolarHBondContact OG-OE1 2.81Å
1102	K	88.3	Confident	87.3	Confident	95 Å²	95	39.7 Å²	39.7	41%	0.413	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	44.1	-178	-44.4	178.9	175.2	-176.3	0	112.4	M1099 M1100 I1120	M1099-K1102 PolarHBondContact O-N 2.89Å; M1100-K1102 PolarHBondContact O-N 3.05Å; M1100-K1102 VanDerWaalsContact O-N 3.14Å; K1102-I1120 WeakPolarHBondContact CB-O 3.24Å; K1102-I1120 PolarHBondContact O-N 3.45Å
1103	Q	89.5	Confident	87.5	Confident	56 Å²	56	36.3 Å²	36.3	26%	0.262	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.9	-177.1	-73	173	-25.1	0	0	110.2	M1099 S1101 Q1117 I1118	M1099-Q1103 HydrophobicContact CB-CB 4.44Å; M1099-Q1103 HydrophobicContact CE-CB 3.44Å; M1099-Q1103 VanDerWaalsContact CE-CB 3.44Å; M1099-Q1103 HydrophobicContact CE-CG 4.33Å; M1099-Q1103 PolarHBondContact N-O 3.2Å; S1101-Q1103 PolarHBondContact OG-OE1 2.81Å; Q1103-Q1117 HydrophobicContact CB-CG 4.23Å; Q1103-Q1117 HydrophobicContact CG-CG 4.49Å; Q1103-Q1117 VanDerWaalsContact NE2-NE2 3.16Å; Q1103-I1118 VanDerWaalsContact CA-O 3.28Å; Q1103-I1118 WeakPolarHBondContact CA-O 3.34Å
1104	L	91.8	Very high	87.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.1	168.7	-177.5	68.9	0	0	0	108.1	W1116 Q1117 I1118 I1120 I1127 I1152	L1104-W1116 HydrophobicContact CD2-CH2 4.48Å; L1104-W1116 HydrophobicContact CD2-CZ3 4.44Å; L1104-W1116 HydrophobicContact CG-CZ3 4.31Å; L1104-Q1117 WeakPolarHBondContact O-CA 3.46Å; L1104-I1118 HydrophobicContact CB-CD1 4.34Å; L1104-I1118 HydrophobicContact CB-CG1 3.93Å; L1104-I1118 HydrophobicContact CD2-CD1 4.3Å; L1104-I1118 PolarHBondContact N-O 3.44Å; L1104-I1118 WeakPolarHBondContact O-CG1 3.35Å; L1104-I1118 PolarHBondContact O-N 3.11Å; L1104-I1120 HydrophobicContact CB-CD1 4.15Å; L1104-I1120 HydrophobicContact CB-CG1 3.84Å; L1104-I1127 HydrophobicContact CD1-CD1 3.53Å; L1104-I1127 HydrophobicContact CD1-CG1 4.47Å; L1104-I1152 HydrophobicContact CD2-CD1 3.43Å; L1104-I1152 VanDerWaalsContact CD2-CD1 3.43Å
1105	C	91.3	Very high	87.5	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.8	-175.6	176.2	0	0	0	0	109.8	L1096 L1097 M1099 Q1117	L1096-C1105 CarbonylContact C-O 3.55Å; L1096-C1105 WeakPolarHBondContact CA-O 3.42Å; L1097-C1105 HydrophobicContact CB-CB 4.19Å; L1097-C1105 PolarHBondContact N-O 3.3Å; L1097-C1105 PolarHBondContact O-N 3.34Å; M1099-C1105 HydrophobicContact CE-CB 4.24Å; M1099-C1105 HydrophobicContact SD-CB 4.37Å; C1105-Q1117 HydrophobicContact CB-CB 4.38Å; C1105-Q1117 HydrophobicContact CB-CG 4.31Å
1106	A	92.5	Very high	87.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.2	168.2	0	0	0	0	0	110.2	I1094 I1095 L1096 I1115 W1116	I1094-A1106 HydrophobicContact CG2-CB 4.28Å; I1095-A1106 CarbonylContact O-C 3.57Å; I1095-A1106 WeakPolarHBondContact O-CA 3.46Å; L1096-A1106 HydrophobicContact CD2-CB 3.75Å; A1106-I1115 HydrophobicContact CB-CB 4.18Å; A1106-I1115 HydrophobicContact CB-CD1 4.29Å; A1106-I1115 WeakPolarHBondContact O-CB 3.29Å; A1106-I1115 PolarHBondContact O-N 3.26Å; A1106-W1116 HydrophobicContact CB-CD2 3.52Å; A1106-W1116 HydrophobicContact CB-CE3 3.8Å; A1106-W1116 HydrophobicContact CB-CG 4.21Å; A1106-W1116 HydrophobicContact CB-CH2 3.65Å; A1106-W1116 HydrophobicContact CB-CZ2 3.35Å; A1106-W1116 HydrophobicContact CB-CZ3 3.85Å; A1106-W1116 PolarHBondContact N-O 2.94Å; A1106-W1116 PolarHBondContact O-N 3.27Å
1107	Y	89.6	Confident	87.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.6	-178.2	-166.4	-77.2	0	0	0	110.4	W1052 Y1078 I1094 I1095 N1112 S1113	W1052-Y1107 AromaticContact CH2-CD1 3.29Å; W1052-Y1107 HydrophobicContact CH2-CD1 3.29Å; W1052-Y1107 AromaticContact CH2-CE1 3.37Å; W1052-Y1107 HydrophobicContact CH2-CE1 3.37Å; W1052-Y1107 HydrophobicContact CH2-CG 4.18Å; W1052-Y1107 HydrophobicContact CZ2-CD1 4.4Å; W1052-Y1107 HydrophobicContact CZ2-CE1 4.26Å; W1052-Y1107 AromaticContact CZ3-CD1 3.76Å; W1052-Y1107 HydrophobicContact CZ3-CD1 3.76Å; W1052-Y1107 HydrophobicContact CZ3-CE1 4.17Å; W1052-Y1107 HydrophobicContact CZ3-CG 4.23Å; Y1078-Y1107 HydrophobicContact CD1-CD2 4.38Å; Y1078-Y1107 AromaticContact CD1-CE2 3.62Å; Y1078-Y1107 HydrophobicContact CD1-CE2 3.62Å; Y1078-Y1107 HydrophobicContact CD2-CE2 4.1Å; Y1078-Y1107 HydrophobicContact CE1-CD2 4.09Å; Y1078-Y1107 AromaticContact CE1-CE2 3.62Å; Y1078-Y1107 HydrophobicContact CE1-CE2 3.62Å; Y1078-Y1107 HydrophobicContact CE2-CE2 4.1Å; Y1078-Y1107 AromaticContact CG-CE2 3.87Å; Y1078-Y1107 HydrophobicContact CG-CE2 3.87Å; Y1078-Y1107 AromaticContact CZ-CE2 3.88Å; I1094-Y1107 WeakPolarHBondContact CA-O 3.38Å; I1095-Y1107 PolarHBondContact N-O 2.91Å; I1095-Y1107 PolarHBondContact O-N 2.96Å; Y1107-N1112 VanDerWaalsContact CZ-C 3.44Å; Y1107-N1112 WeakPolarHBondContact OH-CA 3.45Å; Y1107-N1112 PolarHBondContact OH-O 2.85Å; Y1107-N1112 VanDerWaalsContact OH-O 3.09Å; Y1107-N1112 PolarHBondContact OH-OD1 3.4Å; Y1107-S1113 VanDerWaalsContact CZ-N 3.33Å; Y1107-S1113 PolarHBondContact OH-N 2.97Å
1108	S	87.3	Confident	87.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.2	174.6	174.3	0	0	0	0	110	E1093 I1110 R1111 N1112 S1113	E1093-S1108 CarbonylContact O-C 3.59Å; E1093-S1108 VanDerWaalsContact O-CA 3.27Å; E1093-S1108 WeakPolarHBondContact O-CA 3.01Å; E1093-S1108 PolarHBondContact OE1-OG 2.56Å; S1108-I1110 VanDerWaalsContact C-N 3.32Å; S1108-I1110 PolarHBondContact O-N 2.99Å; S1108-R1111 WeakPolarHBondContact OG-CB 3.19Å; S1108-R1111 WeakPolarHBondContact OG-CG 3.45Å; S1108-R1111 PolarHBondContact OG-N 3.45Å; S1108-R1111 VanDerWaalsContact OG-N 3.13Å; S1108-N1112 WeakPolarHBondContact O-CA 3.49Å; S1108-N1112 PolarHBondContact O-N 3.29Å; S1108-S1113 PolarHBondContact N-O 3.37Å; S1108-S1113 PolarHBondContact O-N 3Å
1109	V	80.6	Confident	87.1	Confident	20 Å²	20	48 Å²	48	12%	0.121	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-45.3	177	-178.5	0	0	0	0	110.4	Y1046 W1052 E1093 I1095 N1112	Y1046-V1109 HydrophobicContact CD1-CG1 4.48Å; Y1046-V1109 HydrophobicContact CD2-CG1 4.01Å; Y1046-V1109 HydrophobicContact CD2-CG2 4.27Å; Y1046-V1109 HydrophobicContact CE1-CG1 4.1Å; Y1046-V1109 HydrophobicContact CE2-CG1 3.63Å; Y1046-V1109 HydrophobicContact CG-CG1 4.41Å; Y1046-V1109 HydrophobicContact CG-CG2 4.2Å; W1052-V1109 HydrophobicContact CH2-CG2 4.05Å; W1052-V1109 HydrophobicContact CZ2-CB 4.01Å; W1052-V1109 HydrophobicContact CZ2-CG1 3.79Å; W1052-V1109 HydrophobicContact CZ2-CG2 3.68Å; E1093-V1109 PolarHBondContact O-N 3.43Å; I1095-V1109 HydrophobicContact CD1-CG2 3.37Å; I1095-V1109 HydrophobicContact CG1-CG2 3.8Å; V1109-N1112 PolarHBondContact O-N 2.94Å
1110	I	80.6	Confident	87.2	Confident	126 Å²	126	48.2 Å²	48.2	65%	0.646	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-43.2	-175.8	-59.6	178	0	0	0	111.3	E1093 S1108 N1112	E1093-I1110 HydrophobicContact CB-CD1 4Å; E1093-I1110 HydrophobicContact CB-CG1 4.4Å; E1093-I1110 HydrophobicContact CG-CB 4.18Å; E1093-I1110 HydrophobicContact CG-CD1 3.77Å; E1093-I1110 HydrophobicContact CG-CG1 3.94Å; S1108-I1110 VanDerWaalsContact C-N 3.32Å; S1108-I1110 PolarHBondContact O-N 2.99Å; I1110-N1112 PolarHBondContact O-N 3.26Å
1111	R	82.3	Confident	87.4	Confident	143 Å²	143	48.4 Å²	48.4	54%	0.54	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-4.2	-179.7	-57.4	176.2	-171.6	174.5	1.7	112.9	E1093 S1108 S1113	E1093-R1111 IonicContact OE1-NE 3.86Å; S1108-R1111 WeakPolarHBondContact OG-CB 3.19Å; S1108-R1111 WeakPolarHBondContact OG-CG 3.45Å; S1108-R1111 PolarHBondContact OG-N 3.45Å; S1108-R1111 VanDerWaalsContact OG-N 3.13Å; R1111-S1113 VanDerWaalsContact CB-OG 3.31Å; R1111-S1113 WeakPolarHBondContact CB-OG 3.34Å; R1111-S1113 PolarHBondContact O-N 3.47Å; R1111-S1113 VanDerWaalsContact O-N 3.1Å; R1111-S1113 PolarHBondContact O-OG 2.85Å
1112	N	80.7	Confident	87.8	Confident	82 Å²	82	47.1 Å²	47.1	44%	0.439	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.9	42.6	-175.1	-160.4	36.6	0	0	0	112.9	I1076 Y1107 S1108 V1109 I1110	I1076-N1112 WeakPolarHBondContact CG2-OD1 3.32Å; Y1107-N1112 VanDerWaalsContact CZ-C 3.44Å; Y1107-N1112 WeakPolarHBondContact OH-CA 3.45Å; Y1107-N1112 PolarHBondContact OH-O 2.85Å; Y1107-N1112 VanDerWaalsContact OH-O 3.09Å; Y1107-N1112 PolarHBondContact OH-OD1 3.4Å; S1108-N1112 WeakPolarHBondContact O-CA 3.49Å; S1108-N1112 PolarHBondContact O-N 3.29Å; V1109-N1112 PolarHBondContact O-N 2.94Å; I1110-N1112 PolarHBondContact O-N 3.26Å
1113	S	84.6	Confident	87.9	Confident	47 Å²	47	43.5 Å²	43.5	33%	0.329	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	154.3	-173.6	48	0	0	0	0	112.6	Y1107 S1108 R1111 I1115	Y1107-S1113 VanDerWaalsContact CZ-N 3.33Å; Y1107-S1113 PolarHBondContact OH-N 2.97Å; S1108-S1113 PolarHBondContact N-O 3.37Å; S1108-S1113 PolarHBondContact O-N 3Å; R1111-S1113 VanDerWaalsContact CB-OG 3.31Å; R1111-S1113 WeakPolarHBondContact CB-OG 3.34Å; R1111-S1113 PolarHBondContact O-N 3.47Å; R1111-S1113 VanDerWaalsContact O-N 3.1Å; R1111-S1113 PolarHBondContact O-OG 2.85Å; S1113-I1115 PolarHBondContact O-N 3.07Å
1114	K	87.7	Confident	88	Confident	92 Å²	92	40.8 Å²	40.8	40%	0.4	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.3	173.7	-176	169.6	78.7	-178.6	0	110.3	Q1117	K1114-Q1117 HydrophobicContact CD-CB 3.99Å; K1114-Q1117 VanDerWaalsContact CD-OE1 3.31Å
1115	I	89.7	Confident	88.1	Confident	39 Å²	39	42.3 Å²	42.3	20%	0.2	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-58.6	178	-52	176.8	0	0	0	109	I1094 A1106 S1113 F1157	I1094-I1115 HydrophobicContact CB-CD1 4.41Å; I1094-I1115 HydrophobicContact CD1-CD1 4.32Å; I1094-I1115 HydrophobicContact CG1-CD1 3.86Å; I1094-I1115 HydrophobicContact CG2-CD1 4.05Å; A1106-I1115 HydrophobicContact CB-CB 4.18Å; A1106-I1115 HydrophobicContact CB-CD1 4.29Å; A1106-I1115 WeakPolarHBondContact O-CB 3.29Å; A1106-I1115 PolarHBondContact O-N 3.26Å; S1113-I1115 PolarHBondContact O-N 3.07Å; I1115-F1157 HydrophobicContact CD1-CD1 4.1Å; I1115-F1157 HydrophobicContact CD1-CE1 4.33Å; I1115-F1157 HydrophobicContact CG2-CB 4.45Å; I1115-F1157 HydrophobicContact CG2-CD1 4.37Å; I1115-F1157 WeakPolarHBondContact CG2-O 3.45Å
1116	W	92.2	Very high	88.2	Confident	12 Å²	12	43.2 Å²	43.2	5%	0.045	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	163.1	178.5	47.5	-108.5	0	0	0	109.9	L1096 L1104 A1106 I1118 I1155 G1156 E1158 E1159	L1096-W1116 HydrophobicContact CD2-CH2 3.8Å; L1096-W1116 HydrophobicContact CD2-CZ2 4.1Å; L1104-W1116 HydrophobicContact CD2-CH2 4.48Å; L1104-W1116 HydrophobicContact CD2-CZ3 4.44Å; L1104-W1116 HydrophobicContact CG-CZ3 4.31Å; A1106-W1116 HydrophobicContact CB-CD2 3.52Å; A1106-W1116 HydrophobicContact CB-CE3 3.8Å; A1106-W1116 HydrophobicContact CB-CG 4.21Å; A1106-W1116 HydrophobicContact CB-CH2 3.65Å; A1106-W1116 HydrophobicContact CB-CZ2 3.35Å; A1106-W1116 HydrophobicContact CB-CZ3 3.85Å; A1106-W1116 PolarHBondContact N-O 2.94Å; A1106-W1116 PolarHBondContact O-N 3.27Å; W1116-I1118 HydrophobicContact CE3-CG1 4.42Å; W1116-I1118 HydrophobicContact CE3-CG2 4.28Å; W1116-I1118 HydrophobicContact CZ3-CD1 4.33Å; W1116-I1118 HydrophobicContact CZ3-CG1 4.14Å; W1116-I1155 HydrophobicContact CH2-CD1 4.26Å; W1116-I1155 HydrophobicContact CH2-CG1 4.39Å; W1116-I1155 HydrophobicContact CZ2-CG1 4.21Å; W1116-I1155 HydrophobicContact CZ2-CG2 3.94Å; W1116-G1156 PolarHBondContact NE1-O 2.84Å; W1116-E1158 PolarHBondContact NE1-O 3.3Å; W1116-E1159 HydrophobicContact CB-CB 3.99Å; W1116-E1159 HydrophobicContact CB-CG 4.17Å; W1116-E1159 HydrophobicContact CG-CB 4.2Å
1117	Q	90.1	Very high	88.4	Confident	53 Å²	53	43.8 Å²	43.8	25%	0.248	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	120	178.2	174.4	-178.1	-37.6	0	0	108.6	M1099 Q1103 L1104 C1105 K1114	M1099-Q1117 HydrophobicContact CE-CG 4.15Å; Q1103-Q1117 HydrophobicContact CB-CG 4.23Å; Q1103-Q1117 HydrophobicContact CG-CG 4.49Å; Q1103-Q1117 VanDerWaalsContact NE2-NE2 3.16Å; L1104-Q1117 WeakPolarHBondContact O-CA 3.46Å; C1105-Q1117 HydrophobicContact CB-CB 4.38Å; C1105-Q1117 HydrophobicContact CB-CG 4.31Å; K1114-Q1117 HydrophobicContact CD-CB 3.99Å; K1114-Q1117 VanDerWaalsContact CD-OE1 3.31Å
1118	I	90.5	Very high	88.6	Confident	4 Å²	4	45 Å²	45	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.6	-175.7	57.8	169.4	0	0	0	110.3	Q1103 L1104 W1116 I1120 I1152 E1159 P1160 I1164	Q1103-I1118 VanDerWaalsContact CA-O 3.28Å; Q1103-I1118 WeakPolarHBondContact CA-O 3.34Å; L1104-I1118 HydrophobicContact CB-CD1 4.34Å; L1104-I1118 HydrophobicContact CB-CG1 3.93Å; L1104-I1118 HydrophobicContact CD2-CD1 4.3Å; L1104-I1118 PolarHBondContact N-O 3.44Å; L1104-I1118 WeakPolarHBondContact O-CG1 3.35Å; L1104-I1118 PolarHBondContact O-N 3.11Å; W1116-I1118 HydrophobicContact CE3-CG1 4.42Å; W1116-I1118 HydrophobicContact CE3-CG2 4.28Å; W1116-I1118 HydrophobicContact CZ3-CD1 4.33Å; W1116-I1118 HydrophobicContact CZ3-CG1 4.14Å; I1118-I1120 HydrophobicContact CD1-CD1 3.87Å; I1118-I1120 HydrophobicContact CG1-CD1 4.22Å; I1118-I1152 HydrophobicContact CD1-CD1 3.9Å; I1118-E1159 HydrophobicContact CG2-CG 3.64Å; I1118-E1159 WeakPolarHBondContact CG2-OE1 3.33Å; I1118-P1160 HydrophobicContact CD1-CG 4.08Å; I1118-I1164 HydrophobicContact CD1-CD1 3.63Å
1119	P	89.2	Confident	88.9	Confident	97 Å²	97	47.6 Å²	47.6	63%	0.63	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	142.2	168.9	31.2	-32.9	0	0	0	110.3
1120	I	90	Very high	89.4	Confident	10 Å²	10	46.9 Å²	46.9	5%	0.051	24%	0.24	C	C	.	.			trans	-125.1	158.6	176.2	-56.8	-74.7	0	0	0	107.7	K1102 L1104 I1118 D1122 V1124 L1144 V1150 Y1166	K1102-I1120 WeakPolarHBondContact CB-O 3.24Å; K1102-I1120 PolarHBondContact O-N 3.45Å; L1104-I1120 HydrophobicContact CB-CD1 4.15Å; L1104-I1120 HydrophobicContact CB-CG1 3.84Å; I1118-I1120 HydrophobicContact CD1-CD1 3.87Å; I1118-I1120 HydrophobicContact CG1-CD1 4.22Å; I1120-D1122 VanDerWaalsContact C-N 3.28Å; I1120-D1122 PolarHBondContact O-N 2.82Å; I1120-V1124 HydrophobicContact CG1-CG2 4.49Å; I1120-L1144 HydrophobicContact CG2-CD1 3.6Å; I1120-L1144 HydrophobicContact CG2-CD2 3.6Å; I1120-L1144 HydrophobicContact CG2-CG 4.25Å; I1120-V1150 HydrophobicContact CD1-CG1 4.3Å; I1120-V1150 HydrophobicContact CG2-CG2 3.82Å; I1120-Y1166 HydrophobicContact CG2-CE1 4.09Å
1121	H	85.9	Confident	89.8	Confident	95 Å²	95	46 Å²	46	44%	0.44	23%	0.229	S	C	.	.	S	Bend	trans	-57	-35.5	-176.7	-71.6	-175.2	0	0	0	114.8	L1144 E1148 Y1166	H1121-L1144 HydrophobicContact CB-CD1 4.12Å; H1121-E1148 WeakPolarHBondContact CB-OE2 3.38Å; H1121-E1148 IonicContact CG-OE2 3.1Å; H1121-E1148 IonicContact ND1-OE1 2.94Å; H1121-E1148 IonicContact ND1-OE2 3.52Å; H1121-E1148 PolarHBondContact ND1-OE2 3.4Å; H1121-Y1166 HydrophobicContact CB-CD1 4.39Å; H1121-Y1166 HydrophobicContact CB-CE1 3.95Å; H1121-Y1166 AromaticContact CD2-CE1 3.53Å; H1121-Y1166 AromaticContact CD2-CZ 3.49Å; H1121-Y1166 VanDerWaalsContact CD2-CZ 3.49Å; H1121-Y1166 AromaticContact CE1-CD1 3.56Å; H1121-Y1166 AromaticContact CE1-CD2 3.73Å; H1121-Y1166 AromaticContact CE1-CE1 3.75Å; H1121-Y1166 AromaticContact CE1-CE2 3.91Å; H1121-Y1166 AromaticContact CE1-CG 3.56Å; H1121-Y1166 AromaticContact CE1-CZ 3.91Å; H1121-Y1166 AromaticContact CG-CD1 3.73Å; H1121-Y1166 AromaticContact CG-CE1 3.39Å; H1121-Y1166 AromaticContact CG-CZ 3.88Å; H1121-Y1166 AromaticContact ND1-CD1 3.36Å; H1121-Y1166 WeakPolarHBondContact ND1-CD1 3.33Å; H1121-Y1166 AromaticContact ND1-CE1 3.54Å; H1121-Y1166 AromaticContact ND1-CG 3.81Å; H1121-Y1166 AromaticContact NE2-CD2 3.9Å; H1121-Y1166 AromaticContact NE2-CE1 3.77Å; H1121-Y1166 AromaticContact NE2-CE2 3.6Å; H1121-Y1166 AromaticContact NE2-CZ 3.54Å
1122	D	90	Very high	90	Very high	19 Å²	19	40.9 Å²	40.9	10%	0.102	21%	0.211	C	C	.	.	S	Bend	trans	-151.4	-179.8	179.1	-156.6	4.6	0	0	0	111.5	R777 I1120 V1124 L1144 T1145 N1146	R777-D1122 IonicContact NH1-OD2 2.73Å; I1120-D1122 VanDerWaalsContact C-N 3.28Å; I1120-D1122 PolarHBondContact O-N 2.82Å; D1122-V1124 PolarHBondContact O-N 3.41Å; D1122-L1144 HydrophobicContact CB-CB 4.47Å; D1122-T1145 PolarHBondContact OD1-OG1 3.5Å; D1122-T1145 PolarHBondContact OD2-OG1 2.97Å; D1122-N1146 HydrophobicContact CB-CB 4Å; D1122-N1146 WeakPolarHBondContact OD2-CB 3.29Å; D1122-N1146 PolarHBondContact OD2-N 3.5Å
1123	S	90	Very high	90	Very high	18 Å²	18	43.8 Å²	43.8	13%	0.126	23%	0.226	C	C	.	.			trans	-60.5	133.1	179.3	-56	0	0	0	0	111	M1100 L1144 T1145	M1100-S1123 PolarHBondContact O-OG 3.02Å; M1100-S1123 VanDerWaalsContact O-OG 3.08Å; S1123-L1144 WeakPolarHBondContact O-CA 3.22Å; S1123-T1145 WeakPolarHBondContact CB-OG1 3.37Å; S1123-T1145 PolarHBondContact N-OG1 3.32Å; S1123-T1145 PolarHBondContact O-N 3.15Å; S1123-T1145 PolarHBondContact O-OG1 3.42Å
1124	V	92.7	Very high	89.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	121.6	180	-173	0	0	0	0	109.5	S1085 I1120 D1122 I1127 A1142 L1144	S1085-V1124 WeakPolarHBondContact CB-O 3.4Å; S1085-V1124 PolarHBondContact OG-O 3.19Å; I1120-V1124 HydrophobicContact CG1-CG2 4.49Å; D1122-V1124 PolarHBondContact O-N 3.41Å; V1124-I1127 HydrophobicContact CG1-CD1 3.81Å; V1124-I1127 HydrophobicContact CG1-CG1 3.5Å; V1124-I1127 VanDerWaalsContact CG1-CG1 3.5Å; V1124-A1142 HydrophobicContact CG1-CB 3.8Å; V1124-L1144 HydrophobicContact CB-CD2 4.29Å; V1124-L1144 HydrophobicContact CG1-CD2 4.48Å; V1124-L1144 HydrophobicContact CG2-CD2 3.85Å
1125	S	92.1	Very high	89	Confident	31 Å²	31	49.6 Å²	49.6	22%	0.217	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-37.7	-174	48	0	0	0	0	114	G1143 I1174	S1125-G1143 PolarHBondContact N-O 2.97Å; S1125-G1143 VanDerWaalsContact OG-C 3.27Å; S1125-G1143 PolarHBondContact OG-O 3.15Å; S1125-I1174 WeakPolarHBondContact CB-O 3.2Å; S1125-I1174 PolarHBondContact OG-O 3.47Å
1126	D	94.9	Very high	88.6	Confident	20 Å²	20	56 Å²	56	11%	0.107	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	148.4	177.3	-154.6	13.4	0	0	0	109.2	A1142 G1143 S1176 V1177 K1218	D1126-A1142 WeakPolarHBondContact O-CA 3.5Å; D1126-G1143 PolarHBondContact O-N 2.97Å; D1126-S1176 VanDerWaalsContact OD2-CA 3.24Å; D1126-S1176 WeakPolarHBondContact OD2-CA 3.43Å; D1126-S1176 PolarHBondContact OD2-OG 3.18Å; D1126-S1176 VanDerWaalsContact OD2-OG 3.12Å; D1126-V1177 HydrophobicContact CB-CG2 4.41Å; D1126-V1177 PolarHBondContact OD2-N 2.84Å; D1126-K1218 VanDerWaalsContact CG-NZ 3.31Å; D1126-K1218 IonicContact OD1-NZ 3.87Å; D1126-K1218 PolarHBondContact OD1-NZ 3.39Å; D1126-K1218 VanDerWaalsContact OD1-NZ 3.11Å; D1126-K1218 IonicContact OD2-NZ 3.58Å; D1126-K1218 PolarHBondContact OD2-NZ 3.27Å
1127	I	95.3	Very high	88.2	Confident	11 Å²	11	57.3 Å²	57.3	6%	0.056	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135.1	-177.6	-60.6	162.3	0	0	0	109.5	C1086 C1088 L1104 V1124 V1140 Y1141 A1142	C1086-I1127 VanDerWaalsContact SG-CD1 3.53Å; C1088-I1127 HydrophobicContact CB-CB 4.03Å; C1088-I1127 HydrophobicContact CB-CG2 3.82Å; L1104-I1127 HydrophobicContact CD1-CD1 3.53Å; L1104-I1127 HydrophobicContact CD1-CG1 4.47Å; V1124-I1127 HydrophobicContact CG1-CD1 3.81Å; V1124-I1127 HydrophobicContact CG1-CG1 3.5Å; V1124-I1127 VanDerWaalsContact CG1-CG1 3.5Å; I1127-V1140 HydrophobicContact CG2-CG1 3.75Å; I1127-Y1141 WeakPolarHBondContact CA-O 3.48Å; I1127-A1142 HydrophobicContact CG1-CB 4.16Å
1128	T	94.3	Very high	88.2	Confident	27 Å²	27	55.6 Å²	55.6	17%	0.166	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	168.4	168.3	-162.3	0	0	0	0	110.5	Y1141 V1177 L1179 L1184	T1128-Y1141 HydrophobicContact CG2-CD2 3.95Å; T1128-Y1141 PolarHBondContact N-O 2.89Å; T1128-Y1141 PolarHBondContact O-N 3.5Å; T1128-V1177 HydrophobicContact CG2-CB 4.3Å; T1128-V1177 HydrophobicContact CG2-CG1 3.63Å; T1128-L1179 HydrophobicContact CG2-CB 4.44Å; T1128-L1184 HydrophobicContact CG2-CD1 3.93Å
1129	F	93.5	Very high	88.3	Confident	53 Å²	53	56.5 Å²	56.5	23%	0.232	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	156.7	179.6	66.1	-91.6	0	0	0	111.6	C1088 A1089 F1090 Y1131 K1139 V1140 L1179	C1088-F1129 VanDerWaalsContact SG-CD1 3.55Å; A1089-F1129 WeakPolarHBondContact O-CE1 3.28Å; F1090-F1129 HydrophobicContact CD2-CB 4.09Å; F1090-F1129 HydrophobicContact CD2-CD1 4.23Å; F1090-F1129 HydrophobicContact CD2-CD2 4.19Å; F1090-F1129 AromaticContact CD2-CG 3.89Å; F1090-F1129 HydrophobicContact CD2-CG 3.89Å; F1090-F1129 HydrophobicContact CE2-CB 4.35Å; F1090-F1129 HydrophobicContact CE2-CD2 4.47Å; F1090-F1129 HydrophobicContact CE2-CG 4.41Å; F1129-Y1131 AromaticContact CD2-CD2 3.61Å; F1129-Y1131 HydrophobicContact CD2-CD2 3.61Å; F1129-Y1131 AromaticContact CD2-CE2 3.42Å; F1129-Y1131 HydrophobicContact CD2-CE2 3.42Å; F1129-Y1131 VanDerWaalsContact CD2-CE2 3.42Å; F1129-Y1131 AromaticContact CE2-CD2 3.5Å; F1129-Y1131 HydrophobicContact CE2-CD2 3.5Å; F1129-Y1131 VanDerWaalsContact CE2-CD2 3.5Å; F1129-Y1131 AromaticContact CE2-CE2 3.19Å; F1129-Y1131 HydrophobicContact CE2-CE2 3.19Å; F1129-Y1131 HydrophobicContact CZ-CE2 4.22Å; F1129-K1139 CarbonylContact C-O 3.58Å; F1129-K1139 VanDerWaalsContact CA-O 3.23Å; F1129-K1139 WeakPolarHBondContact CA-O 3.4Å; F1129-V1140 HydrophobicContact CB-CG2 3.95Å; F1129-L1179 WeakPolarHBondContact O-CD2 3.2Å
1130	A	91.6	Very high	88.5	Confident	6 Å²	6	51.9 Å²	51.9	5%	0.05	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.5	173	0	0	0	0	0	110.1	F1132 N1138 K1139 Y1141 L1179	A1130-F1132 HydrophobicContact CB-CE1 4.3Å; A1130-F1132 HydrophobicContact CB-CE2 3.92Å; A1130-F1132 HydrophobicContact CB-CZ 3.68Å; A1130-N1138 CarbonylContact O-C 3.48Å; A1130-N1138 VanDerWaalsContact O-CA 3.29Å; A1130-N1138 WeakPolarHBondContact O-CA 3.45Å; A1130-K1139 PolarHBondContact N-O 3.35Å; A1130-K1139 PolarHBondContact O-N 3.06Å; A1130-Y1141 HydrophobicContact CB-CE2 3.87Å; A1130-L1179 HydrophobicContact CB-CD1 4.39Å; A1130-L1179 HydrophobicContact CB-CD2 3.66Å
1131	Y	89.1	Confident	88.8	Confident	106 Å²	106	51.4 Å²	51.4	42%	0.416	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	127.8	168.6	-72.9	-78	0	0	0	109.7	F1090 F1129 N1138	F1090-Y1131 WeakPolarHBondContact CD1-OH 3.36Å; F1090-Y1131 HydrophobicContact CE1-CE1 4.35Å; F1090-Y1131 WeakPolarHBondContact CE1-OH 3.31Å; F1090-Y1131 HydrophobicContact CE2-CE1 4.01Å; F1090-Y1131 HydrophobicContact CE2-CE2 4.33Å; F1090-Y1131 AromaticContact CE2-CZ 3.62Å; F1090-Y1131 VanDerWaalsContact CE2-OH 3.31Å; F1090-Y1131 WeakPolarHBondContact CE2-OH 3.49Å; F1090-Y1131 AromaticContact CZ-CE1 3.7Å; F1090-Y1131 HydrophobicContact CZ-CE1 3.7Å; F1090-Y1131 AromaticContact CZ-CZ 3.57Å; F1090-Y1131 WeakPolarHBondContact CZ-OH 3.44Å; F1090-Y1131 PolarHBondContact O-OH 3.45Å; F1129-Y1131 AromaticContact CD2-CD2 3.61Å; F1129-Y1131 HydrophobicContact CD2-CD2 3.61Å; F1129-Y1131 AromaticContact CD2-CE2 3.42Å; F1129-Y1131 HydrophobicContact CD2-CE2 3.42Å; F1129-Y1131 VanDerWaalsContact CD2-CE2 3.42Å; F1129-Y1131 AromaticContact CE2-CD2 3.5Å; F1129-Y1131 HydrophobicContact CE2-CD2 3.5Å; F1129-Y1131 VanDerWaalsContact CE2-CD2 3.5Å; F1129-Y1131 AromaticContact CE2-CE2 3.19Å; F1129-Y1131 HydrophobicContact CE2-CE2 3.19Å; F1129-Y1131 HydrophobicContact CZ-CE2 4.22Å; Y1131-N1138 HydrophobicContact CD1-CB 3.52Å; Y1131-N1138 HydrophobicContact CE1-CB 3.68Å; Y1131-N1138 HydrophobicContact CG-CB 4.39Å
1132	F	87.1	Confident	89.3	Confident	36 Å²	36	46.9 Å²	46.9	16%	0.158	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	89.7	178.6	-58.3	-73.6	0	0	0	109.3	A1130 H1134 D1135 H1136 T1137 K1139 A1197 K1198	A1130-F1132 HydrophobicContact CB-CE1 4.3Å; A1130-F1132 HydrophobicContact CB-CE2 3.92Å; A1130-F1132 HydrophobicContact CB-CZ 3.68Å; F1132-H1134 VanDerWaalsContact C-N 3.25Å; F1132-H1134 PolarHBondContact O-N 3.17Å; F1132-H1134 VanDerWaalsContact O-N 3.14Å; F1132-D1135 PolarHBondContact O-N 2.93Å; F1132-D1135 VanDerWaalsContact O-N 3.08Å; F1132-H1136 PolarHBondContact O-N 2.59Å; F1132-T1137 PolarHBondContact N-O 2.79Å; F1132-K1139 HydrophobicContact CD2-CG 4.49Å; F1132-K1139 HydrophobicContact CE2-CB 4.1Å; F1132-K1139 HydrophobicContact CE2-CD 4.06Å; F1132-K1139 HydrophobicContact CE2-CG 3.82Å; F1132-A1197 HydrophobicContact CZ-CB 4.32Å; F1132-K1198 HydrophobicContact CD1-CB 4.05Å; F1132-K1198 HydrophobicContact CD1-CD 4.13Å; F1132-K1198 HydrophobicContact CD1-CG 3.96Å; F1132-K1198 HydrophobicContact CE1-CB 3.51Å; F1132-K1198 HydrophobicContact CE1-CD 4.46Å; F1132-K1198 HydrophobicContact CE1-CG 3.9Å; F1132-K1198 HydrophobicContact CG-CG 4.31Å; F1132-K1198 VanDerWaalsContact CZ-CA 3.46Å; F1132-K1198 HydrophobicContact CZ-CB 3.82Å; F1132-K1198 HydrophobicContact CZ-CG 4.18Å
1133	L	79	Confident	89.5	Confident	144 Å²	144	46 Å²	46	75%	0.754	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-37.7	-172.1	-71.4	168.3	0	0	0	114.2	D1135	L1133-D1135 VanDerWaalsContact C-N 3.33Å; L1133-D1135 PolarHBondContact O-N 2.98Å
1134	H	78	Confident	89.8	Confident	182 Å²	182	45.1 Å²	45.1	84%	0.843	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-28.9	-177.7	-68	-61.6	0	0	0	114	F1132	F1132-H1134 VanDerWaalsContact C-N 3.25Å; F1132-H1134 PolarHBondContact O-N 3.17Å; F1132-H1134 VanDerWaalsContact O-N 3.14Å
1135	D	74.8	Confident	89.7	Confident	78 Å²	78	46.8 Å²	46.8	42%	0.417	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-6.6	-176.6	-62.8	19.5	0	0	0	111.2	F1132 L1133 T1137 K1198	F1132-D1135 PolarHBondContact O-N 2.93Å; F1132-D1135 VanDerWaalsContact O-N 3.08Å; L1133-D1135 VanDerWaalsContact C-N 3.33Å; L1133-D1135 PolarHBondContact O-N 2.98Å; D1135-T1137 HydrophobicContact CB-CG2 4.05Å; D1135-T1137 PolarHBondContact O-N 3.38Å; D1135-T1137 VanDerWaalsContact O-N 3.15Å; D1135-K1198 IonicContact OD1-NZ 3.03Å; D1135-K1198 PolarHBondContact OD1-NZ 3Å; D1135-K1198 WeakPolarHBondContact OD2-CE 3.35Å; D1135-K1198 IonicContact OD2-NZ 3.55Å; D1135-K1198 PolarHBondContact OD2-NZ 3.43Å
1136	H	80.2	Confident	89.4	Confident	173 Å²	173	47 Å²	47	80%	0.801	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	25.9	-168.5	-58.5	-69.3	0	0	0	113.8	F1132	F1132-H1136 PolarHBondContact O-N 2.59Å
1137	T	84.6	Confident	89	Confident	40 Å²	40	46 Å²	46	25%	0.245	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	157.3	177.9	57.7	0	0	0	0	111.2	F1132 D1135 N1154	F1132-T1137 PolarHBondContact N-O 2.79Å; D1135-T1137 HydrophobicContact CB-CG2 4.05Å; D1135-T1137 PolarHBondContact O-N 3.38Å; D1135-T1137 VanDerWaalsContact O-N 3.15Å; T1137-N1154 VanDerWaalsContact CA-OD1 3.32Å; T1137-N1154 WeakPolarHBondContact CA-OD1 3.29Å; T1137-N1154 VanDerWaalsContact CB-OD1 3.25Å; T1137-N1154 WeakPolarHBondContact CB-OD1 3.37Å; T1137-N1154 WeakPolarHBondContact CG2-OD1 3.43Å
1138	N	90	Very high	88.9	Confident	18 Å²	18	46.4 Å²	46.4	10%	0.096	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.2	171.3	70.7	74.1	0	0	0	110.2	F1090 A1130 Y1131 N1154 I1155	F1090-N1138 HydrophobicContact CE2-CB 4.32Å; F1090-N1138 HydrophobicContact CZ-CB 4.22Å; A1130-N1138 CarbonylContact O-C 3.48Å; A1130-N1138 VanDerWaalsContact O-CA 3.29Å; A1130-N1138 WeakPolarHBondContact O-CA 3.45Å; Y1131-N1138 HydrophobicContact CD1-CB 3.52Å; Y1131-N1138 HydrophobicContact CE1-CB 3.68Å; Y1131-N1138 HydrophobicContact CG-CB 4.39Å; N1138-N1154 PolarHBondContact N-OD1 2.85Å; N1138-N1154 PolarHBondContact O-N 3.36Å; N1138-I1155 PolarHBondContact ND2-O 3.36Å; N1138-I1155 PolarHBondContact OD1-N 2.73Å
1139	K	91.8	Very high	88.9	Confident	23 Å²	23	45.1 Å²	45.1	10%	0.1	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	133.9	172.2	-64.9	-166.9	-170.9	-156.9	0	109.7	F1129 A1130 F1132 Y1141 V1151 I1152 E1153 K1198	F1129-K1139 CarbonylContact C-O 3.58Å; F1129-K1139 VanDerWaalsContact CA-O 3.23Å; F1129-K1139 WeakPolarHBondContact CA-O 3.4Å; A1130-K1139 PolarHBondContact N-O 3.35Å; A1130-K1139 PolarHBondContact O-N 3.06Å; F1132-K1139 HydrophobicContact CD2-CG 4.49Å; F1132-K1139 HydrophobicContact CE2-CB 4.1Å; F1132-K1139 HydrophobicContact CE2-CD 4.06Å; F1132-K1139 HydrophobicContact CE2-CG 3.82Å; K1139-Y1141 HydrophobicContact CB-CE1 4.04Å; K1139-Y1141 HydrophobicContact CB-CE2 4.11Å; K1139-Y1141 VanDerWaalsContact CB-OH 3.3Å; K1139-Y1141 WeakPolarHBondContact CB-OH 3.41Å; K1139-Y1141 HydrophobicContact CD-CE1 4.38Å; K1139-V1151 HydrophobicContact CD-CG1 4.14Å; K1139-I1152 CarbonylContact C-O 3.54Å; K1139-I1152 WeakPolarHBondContact CA-O 3.44Å; K1139-E1153 HydrophobicContact CD-CG 4.22Å; K1139-E1153 WeakPolarHBondContact CE-OE1 3.32Å; K1139-E1153 HydrophobicContact CG-CG 4.09Å; K1139-E1153 IonicContact NZ-OE1 3.53Å; K1139-E1153 PolarHBondContact NZ-OE1 2.82Å; K1139-K1198 WeakPolarHBondContact CE-O 3.5Å; K1139-K1198 PolarHBondContact NZ-O 3.18Å
1140	V	94.3	Very high	89	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136	170.1	177.1	0	0	0	0	108.3	F1090 L1096 I1127 F1129 V1151 I1152 I1155	F1090-V1140 HydrophobicContact CD2-CG2 4.13Å; F1090-V1140 HydrophobicContact CE2-CG2 4.02Å; L1096-V1140 HydrophobicContact CD1-CG1 3.9Å; L1096-V1140 HydrophobicContact CD1-CG2 3.84Å; I1127-V1140 HydrophobicContact CG2-CG1 3.75Å; F1129-V1140 HydrophobicContact CB-CG2 3.95Å; V1140-V1151 WeakPolarHBondContact O-CA 3.46Å; V1140-I1152 HydrophobicContact CB-CB 4.45Å; V1140-I1152 PolarHBondContact N-O 2.97Å; V1140-I1152 PolarHBondContact O-N 3.08Å; V1140-I1155 HydrophobicContact CB-CD1 3.61Å; V1140-I1155 HydrophobicContact CG1-CD1 4.24Å; V1140-I1155 HydrophobicContact CG2-CB 4.18Å; V1140-I1155 HydrophobicContact CG2-CD1 3.35Å; V1140-I1155 HydrophobicContact CG2-CG1 4.31Å; V1140-I1155 HydrophobicContact CG2-CG2 4.48Å
1141	Y	96.2	Very high	89	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.9	178.2	-47.5	-80.7	0	0	0	108.1	I1127 T1128 A1130 K1139 V1150 V1151 L1184 A1197 M1200	I1127-Y1141 WeakPolarHBondContact CA-O 3.48Å; T1128-Y1141 HydrophobicContact CG2-CD2 3.95Å; T1128-Y1141 PolarHBondContact N-O 2.89Å; T1128-Y1141 PolarHBondContact O-N 3.5Å; A1130-Y1141 HydrophobicContact CB-CE2 3.87Å; K1139-Y1141 HydrophobicContact CB-CE1 4.04Å; K1139-Y1141 HydrophobicContact CB-CE2 4.11Å; K1139-Y1141 VanDerWaalsContact CB-OH 3.3Å; K1139-Y1141 WeakPolarHBondContact CB-OH 3.41Å; K1139-Y1141 HydrophobicContact CD-CE1 4.38Å; Y1141-V1150 CarbonylContact C-O 3.51Å; Y1141-V1150 WeakPolarHBondContact CA-O 3.46Å; Y1141-V1151 HydrophobicContact CD1-CG1 4.08Å; Y1141-V1151 HydrophobicContact CD1-CG2 4.09Å; Y1141-V1151 HydrophobicContact CE1-CG1 3.9Å; Y1141-V1151 HydrophobicContact CE1-CG2 4.46Å; Y1141-L1184 HydrophobicContact CD1-CD1 4.39Å; Y1141-L1184 HydrophobicContact CD1-CD2 3.49Å; Y1141-L1184 VanDerWaalsContact CD1-CD2 3.49Å; Y1141-L1184 HydrophobicContact CD2-CD1 3.75Å; Y1141-L1184 HydrophobicContact CD2-CD2 4.36Å; Y1141-L1184 HydrophobicContact CE1-CD2 3.94Å; Y1141-L1184 HydrophobicContact CE2-CD1 4.25Å; Y1141-L1184 HydrophobicContact CG-CD1 3.82Å; Y1141-L1184 HydrophobicContact CG-CD2 3.73Å; Y1141-L1184 HydrophobicContact CG-CG 4.44Å; Y1141-A1197 PolarHBondContact OH-O 2.93Å; Y1141-M1200 HydrophobicContact CD1-SD 4.19Å; Y1141-M1200 HydrophobicContact CE1-SD 3.57Å; Y1141-M1200 VanDerWaalsContact CE1-SD 3.57Å
1142	A	95.7	Very high	89.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	116.4	179.3	0	0	0	0	0	109.2	V1124 D1126 I1127 V1150	V1124-A1142 HydrophobicContact CG1-CB 3.8Å; D1126-A1142 WeakPolarHBondContact O-CA 3.5Å; I1127-A1142 HydrophobicContact CG1-CB 4.16Å; A1142-V1150 HydrophobicContact CB-CB 4.18Å; A1142-V1150 PolarHBondContact N-O 3.31Å; A1142-V1150 PolarHBondContact O-N 3.3Å
1143	G	95.5	Very high	89.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	138.2	172.3	0	0	0	0	0	110.1	S1125 D1126	S1125-G1143 PolarHBondContact N-O 2.97Å; S1125-G1143 VanDerWaalsContact OG-C 3.27Å; S1125-G1143 PolarHBondContact OG-O 3.15Å; D1126-G1143 PolarHBondContact O-N 2.97Å
1144	L	95.1	Very high	89.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	159.7	179.7	-55.5	-169.2	0	0	0	112.8	I1120 H1121 D1122 S1123 V1124 N1146 G1147 E1148 V1150 Y1166 I1174	I1120-L1144 HydrophobicContact CG2-CD1 3.6Å; I1120-L1144 HydrophobicContact CG2-CD2 3.6Å; I1120-L1144 HydrophobicContact CG2-CG 4.25Å; H1121-L1144 HydrophobicContact CB-CD1 4.12Å; D1122-L1144 HydrophobicContact CB-CB 4.47Å; S1123-L1144 WeakPolarHBondContact O-CA 3.22Å; V1124-L1144 HydrophobicContact CB-CD2 4.29Å; V1124-L1144 HydrophobicContact CG1-CD2 4.48Å; V1124-L1144 HydrophobicContact CG2-CD2 3.85Å; L1144-N1146 WeakPolarHBondContact CB-OD1 3.42Å; L1144-N1146 PolarHBondContact O-N 3.24Å; L1144-G1147 PolarHBondContact O-N 3.36Å; L1144-E1148 VanDerWaalsContact CB-O 3.3Å; L1144-E1148 WeakPolarHBondContact CB-O 3.45Å; L1144-E1148 HydrophobicContact CD1-CB 4.2Å; L1144-E1148 WeakPolarHBondContact CG-O 3.47Å; L1144-E1148 PolarHBondContact N-O 2.95Å; L1144-V1150 HydrophobicContact CD1-CG2 3.53Å; L1144-V1150 HydrophobicContact CD2-CG2 3.83Å; L1144-V1150 HydrophobicContact CG-CG2 3.69Å; L1144-Y1166 HydrophobicContact CD1-CE1 4.37Å; L1144-I1174 PolarHBondContact O-N 3.44Å
1145	T	89.9	Confident	89.9	Confident	34 Å²	34	27 Å²	27	21%	0.209	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9	177.2	52.3	0	0	0	0	115	R777 D1122 S1123 P1173	R777-T1145 PolarHBondContact NH1-O 3.34Å; R777-T1145 VanDerWaalsContact NH1-O 3.14Å; D1122-T1145 PolarHBondContact OD1-OG1 3.5Å; D1122-T1145 PolarHBondContact OD2-OG1 2.97Å; S1123-T1145 WeakPolarHBondContact CB-OG1 3.37Å; S1123-T1145 PolarHBondContact N-OG1 3.32Å; S1123-T1145 PolarHBondContact O-N 3.15Å; S1123-T1145 PolarHBondContact O-OG1 3.42Å; T1145-P1173 VanDerWaalsContact O-CG 3.32Å; T1145-P1173 WeakPolarHBondContact O-CG 3.39Å
1146	N	85.8	Confident	90.3	Very high	35 Å²	35	24.3 Å²	24.3	19%	0.187	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-4.8	172.8	66	-5.4	0	0	0	113	D1122 L1144 E1148	D1122-N1146 HydrophobicContact CB-CB 4Å; D1122-N1146 WeakPolarHBondContact OD2-CB 3.29Å; D1122-N1146 PolarHBondContact OD2-N 3.5Å; L1144-N1146 WeakPolarHBondContact CB-OD1 3.42Å; L1144-N1146 PolarHBondContact O-N 3.24Å; N1146-E1148 VanDerWaalsContact ND2-CD 3.26Å; N1146-E1148 PolarHBondContact ND2-OE2 3.06Å; N1146-E1148 WeakPolarHBondContact OD1-CB 3.47Å; N1146-E1148 PolarHBondContact OD1-N 3.48Å
1147	G	87.8	Confident	90.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	91.8	5.9	-178.9	0	0	0	0	0	115.4	L1144 I1169 S1170 I1172	L1144-G1147 PolarHBondContact O-N 3.36Å; G1147-I1169 PolarHBondContact O-N 2.86Å; G1147-S1170 CarbonylContact C-O 3.52Å; G1147-S1170 VanDerWaalsContact CA-O 3.26Å; G1147-S1170 WeakPolarHBondContact CA-O 3.42Å; G1147-S1170 PolarHBondContact O-N 3.15Å; G1147-I1172 WeakPolarHBondContact CA-O 3.46Å
1148	E	93.4	Very high	90.4	Very high	20 Å²	20	26.2 Å²	26.2	9%	0.093	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	142.9	171.4	-60.9	177.6	154.7	0	0	111.3	H1121 L1144 N1146 I1167 T1168 I1174	H1121-E1148 WeakPolarHBondContact CB-OE2 3.38Å; H1121-E1148 IonicContact CG-OE2 3.1Å; H1121-E1148 IonicContact ND1-OE1 2.94Å; H1121-E1148 IonicContact ND1-OE2 3.52Å; H1121-E1148 PolarHBondContact ND1-OE2 3.4Å; L1144-E1148 VanDerWaalsContact CB-O 3.3Å; L1144-E1148 WeakPolarHBondContact CB-O 3.45Å; L1144-E1148 HydrophobicContact CD1-CB 4.2Å; L1144-E1148 WeakPolarHBondContact CG-O 3.47Å; L1144-E1148 PolarHBondContact N-O 2.95Å; N1146-E1148 VanDerWaalsContact ND2-CD 3.26Å; N1146-E1148 PolarHBondContact ND2-OE2 3.06Å; N1146-E1148 WeakPolarHBondContact OD1-CB 3.47Å; N1146-E1148 PolarHBondContact OD1-N 3.48Å; E1148-I1167 CarbonylContact C-O 3.58Å; E1148-I1167 WeakPolarHBondContact CA-O 3.32Å; E1148-T1168 HydrophobicContact CG-CG2 4.27Å; E1148-I1174 VanDerWaalsContact C-CD1 3.5Å; E1148-I1174 VanDerWaalsContact O-CD1 3.27Å; E1148-I1174 WeakPolarHBondContact O-CD1 3.44Å
1149	L	94.6	Very high	90.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.6	168.2	178.6	72.8	0	0	0	108.5	V1151 I1167 I1169 I1174 V1177 L1184 M1200	L1149-V1151 HydrophobicContact CD2-CG2 4.3Å; L1149-V1151 HydrophobicContact CG-CG2 4.39Å; L1149-I1167 HydrophobicContact CB-CB 4.45Å; L1149-I1167 PolarHBondContact N-O 3.25Å; L1149-I1167 PolarHBondContact O-N 3.42Å; L1149-I1169 HydrophobicContact CB-CD1 3.5Å; L1149-I1169 VanDerWaalsContact CB-CD1 3.5Å; L1149-I1169 HydrophobicContact CB-CG1 4.03Å; L1149-I1169 HydrophobicContact CD2-CD1 3.94Å; L1149-I1169 HydrophobicContact CG-CD1 4.24Å; L1149-I1174 HydrophobicContact CB-CD1 3.94Å; L1149-I1174 HydrophobicContact CD1-CD1 4.49Å; L1149-V1177 HydrophobicContact CD1-CG1 4.49Å; L1149-V1177 HydrophobicContact CD1-CG2 4.39Å; L1149-L1184 HydrophobicContact CD2-CD2 3.71Å; L1149-M1200 HydrophobicContact CD2-CE 3.6Å
1150	V	94	Very high	89.6	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	128.7	172.5	-172.6	0	0	0	0	108.9	I1120 Y1141 A1142 L1144 I1152 I1164 Y1165 Y1166	I1120-V1150 HydrophobicContact CD1-CG1 4.3Å; I1120-V1150 HydrophobicContact CG2-CG2 3.82Å; Y1141-V1150 CarbonylContact C-O 3.51Å; Y1141-V1150 WeakPolarHBondContact CA-O 3.46Å; A1142-V1150 HydrophobicContact CB-CB 4.18Å; A1142-V1150 PolarHBondContact N-O 3.31Å; A1142-V1150 PolarHBondContact O-N 3.3Å; L1144-V1150 HydrophobicContact CD1-CG2 3.53Å; L1144-V1150 HydrophobicContact CD2-CG2 3.83Å; L1144-V1150 HydrophobicContact CG-CG2 3.69Å; V1150-I1152 HydrophobicContact CG1-CD1 4.23Å; V1150-I1152 HydrophobicContact CG1-CG1 3.8Å; V1150-I1164 HydrophobicContact CG1-CG2 3.57Å; V1150-Y1165 CarbonylContact C-O 3.58Å; V1150-Y1165 WeakPolarHBondContact CA-O 3.49Å; V1150-Y1166 HydrophobicContact CB-CE1 4.5Å; V1150-Y1166 HydrophobicContact CG1-CE1 4.28Å; V1150-Y1166 HydrophobicContact CG2-CD1 3.66Å; V1150-Y1166 HydrophobicContact CG2-CE1 3.5Å
1151	V	92.6	Very high	88.3	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.018	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	119.3	173.5	-172.2	0	0	0	0	107.7	K1139 V1140 Y1141 L1149 Y1165 I1167 M1200	K1139-V1151 HydrophobicContact CD-CG1 4.14Å; V1140-V1151 WeakPolarHBondContact O-CA 3.46Å; Y1141-V1151 HydrophobicContact CD1-CG1 4.08Å; Y1141-V1151 HydrophobicContact CD1-CG2 4.09Å; Y1141-V1151 HydrophobicContact CE1-CG1 3.9Å; Y1141-V1151 HydrophobicContact CE1-CG2 4.46Å; L1149-V1151 HydrophobicContact CD2-CG2 4.3Å; L1149-V1151 HydrophobicContact CG-CG2 4.39Å; V1151-Y1165 PolarHBondContact N-O 3.37Å; V1151-Y1165 PolarHBondContact O-N 3.49Å; V1151-I1167 HydrophobicContact CG2-CD1 3.79Å; V1151-M1200 HydrophobicContact CG2-CE 3.9Å; V1151-M1200 HydrophobicContact CG2-CG 4.49Å; V1151-M1200 HydrophobicContact CG2-SD 4.31Å
1152	I	91.6	Very high	86.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.9	177.8	-47.3	179.5	0	0	0	108.7	L1104 I1118 K1139 V1140 V1150 I1155 P1160 S1163 I1164	L1104-I1152 HydrophobicContact CD2-CD1 3.43Å; L1104-I1152 VanDerWaalsContact CD2-CD1 3.43Å; I1118-I1152 HydrophobicContact CD1-CD1 3.9Å; K1139-I1152 CarbonylContact C-O 3.54Å; K1139-I1152 WeakPolarHBondContact CA-O 3.44Å; V1140-I1152 HydrophobicContact CB-CB 4.45Å; V1140-I1152 PolarHBondContact N-O 2.97Å; V1140-I1152 PolarHBondContact O-N 3.08Å; V1150-I1152 HydrophobicContact CG1-CD1 4.23Å; V1150-I1152 HydrophobicContact CG1-CG1 3.8Å; I1152-I1155 HydrophobicContact CB-CD1 3.6Å; I1152-I1155 HydrophobicContact CB-CG1 4.27Å; I1152-I1155 HydrophobicContact CD1-CD1 4.07Å; I1152-I1155 HydrophobicContact CG1-CD1 4.4Å; I1152-I1155 HydrophobicContact CG2-CD1 3.49Å; I1152-I1155 VanDerWaalsContact CG2-CD1 3.49Å; I1152-I1155 HydrophobicContact CG2-CG1 3.64Å; I1152-P1160 HydrophobicContact CG2-CB 3.57Å; I1152-P1160 HydrophobicContact CG2-CG 3.77Å; I1152-S1163 WeakPolarHBondContact CA-O 3.25Å; I1152-I1164 HydrophobicContact CD1-CG1 4.44Å; I1152-I1164 HydrophobicContact CG1-CG1 4.16Å; I1152-I1164 HydrophobicContact CG1-CG2 4.27Å; I1152-I1164 HydrophobicContact CG2-CG1 4.06Å
1153	E	88.1	Confident	86.1	Confident	47 Å²	47	46.4 Å²	46.4	22%	0.22	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	141	-178.1	-52.7	-170.3	147.3	0	0	111.5	K1139 S1163 Y1165	K1139-E1153 HydrophobicContact CD-CG 4.22Å; K1139-E1153 WeakPolarHBondContact CE-OE1 3.32Å; K1139-E1153 HydrophobicContact CG-CG 4.09Å; K1139-E1153 IonicContact NZ-OE1 3.53Å; K1139-E1153 PolarHBondContact NZ-OE1 2.82Å; E1153-S1163 PolarHBondContact N-O 3.36Å; E1153-S1163 VanDerWaalsContact O-CB 3.32Å; E1153-S1163 WeakPolarHBondContact O-CB 3.45Å; E1153-S1163 PolarHBondContact O-OG 2.89Å; E1153-Y1165 HydrophobicContact CG-CD2 4.27Å; E1153-Y1165 HydrophobicContact CG-CE2 3.84Å
1154	N	85.2	Confident	85.7	Confident	91 Å²	91	48.4 Å²	48.4	49%	0.487	24%	0.238	S	C	.	.	S	Bend	trans	57.5	49	173.2	-58	-40.5	0	0	0	114.5	T1137 N1138	T1137-N1154 VanDerWaalsContact CA-OD1 3.32Å; T1137-N1154 WeakPolarHBondContact CA-OD1 3.29Å; T1137-N1154 VanDerWaalsContact CB-OD1 3.25Å; T1137-N1154 WeakPolarHBondContact CB-OD1 3.37Å; T1137-N1154 WeakPolarHBondContact CG2-OD1 3.43Å; N1138-N1154 PolarHBondContact N-OD1 2.85Å; N1138-N1154 PolarHBondContact O-N 3.36Å
1155	I	86	Confident	85.3	Confident	5 Å²	5	54 Å²	54	3%	0.026	26%	0.26	C	S	.	.			trans	-65.4	142.2	172.3	-85.8	165	0	0	0	111.1	F1090 L1096 W1116 N1138 V1140 I1152 P1160	F1090-I1155 HydrophobicContact CD1-CG2 4.26Å; F1090-I1155 HydrophobicContact CE1-CG2 3.93Å; F1090-I1155 HydrophobicContact CE2-CG2 4.21Å; F1090-I1155 HydrophobicContact CZ-CB 4.24Å; F1090-I1155 HydrophobicContact CZ-CG2 3.9Å; F1090-I1155 WeakPolarHBondContact CZ-O 3.49Å; L1096-I1155 HydrophobicContact CD2-CG2 4.45Å; W1116-I1155 HydrophobicContact CH2-CD1 4.26Å; W1116-I1155 HydrophobicContact CH2-CG1 4.39Å; W1116-I1155 HydrophobicContact CZ2-CG1 4.21Å; W1116-I1155 HydrophobicContact CZ2-CG2 3.94Å; N1138-I1155 PolarHBondContact ND2-O 3.36Å; N1138-I1155 PolarHBondContact OD1-N 2.73Å; V1140-I1155 HydrophobicContact CB-CD1 3.61Å; V1140-I1155 HydrophobicContact CG1-CD1 4.24Å; V1140-I1155 HydrophobicContact CG2-CB 4.18Å; V1140-I1155 HydrophobicContact CG2-CD1 3.35Å; V1140-I1155 HydrophobicContact CG2-CG1 4.31Å; V1140-I1155 HydrophobicContact CG2-CG2 4.48Å; I1152-I1155 HydrophobicContact CB-CD1 3.6Å; I1152-I1155 HydrophobicContact CB-CG1 4.27Å; I1152-I1155 HydrophobicContact CD1-CD1 4.07Å; I1152-I1155 HydrophobicContact CG1-CD1 4.4Å; I1152-I1155 HydrophobicContact CG2-CD1 3.49Å; I1152-I1155 VanDerWaalsContact CG2-CD1 3.49Å; I1152-I1155 HydrophobicContact CG2-CG1 3.64Å; I1155-P1160 HydrophobicContact CG1-CG 4.3Å
1156	G	84.3	Confident	85.2	Confident	21 Å²	21	55.7 Å²	55.7	22%	0.216	26%	0.264	C	S	.	.	S	Bend	trans	-162.8	-143.6	173.9	0	0	0	0	0	111.3	W1116 E1158	W1116-G1156 PolarHBondContact NE1-O 2.84Å; G1156-E1158 VanDerWaalsContact C-N 3.29Å
1157	F	84.6	Confident	85.3	Confident	84 Å²	84	56.4 Å²	56.4	37%	0.368	27%	0.267	S	S	.	.	S	Bend	trans	-73.5	-22.8	174.8	-69.2	-80.8	0	0	0	113.5	E1093 I1094 I1115	E1093-F1157 HydrophobicContact CG-CE1 4.24Å; E1093-F1157 HydrophobicContact CG-CZ 4.1Å; E1093-F1157 VanDerWaalsContact OE1-CE1 3.28Å; E1093-F1157 WeakPolarHBondContact OE1-CE1 3.39Å; E1093-F1157 WeakPolarHBondContact OE1-CZ 3.33Å; E1093-F1157 WeakPolarHBondContact OE2-CZ 3.35Å; I1094-F1157 HydrophobicContact CD1-CD1 4.32Å; I1094-F1157 HydrophobicContact CD1-CD2 4.29Å; I1094-F1157 HydrophobicContact CD1-CE1 4.18Å; I1094-F1157 HydrophobicContact CD1-CE2 4.14Å; I1094-F1157 HydrophobicContact CD1-CG 4.37Å; I1094-F1157 HydrophobicContact CD1-CZ 4.07Å; I1094-F1157 HydrophobicContact CG1-CE1 4.19Å; I1094-F1157 HydrophobicContact CG1-CZ 4.22Å; I1115-F1157 HydrophobicContact CD1-CD1 4.1Å; I1115-F1157 HydrophobicContact CD1-CE1 4.33Å; I1115-F1157 HydrophobicContact CG2-CB 4.45Å; I1115-F1157 HydrophobicContact CG2-CD1 4.37Å; I1115-F1157 WeakPolarHBondContact CG2-O 3.45Å
1158	E	82.9	Confident	85.3	Confident	169 Å²	169	60.3 Å²	60.3	79%	0.79	29%	0.291	S	S	*	.	S	Bend	trans	-85.4	145.8	177	-63.6	-174.6	179.3	0	0	110.3	W1116 G1156	W1116-E1158 PolarHBondContact NE1-O 3.3Å; G1156-E1158 VanDerWaalsContact C-N 3.29Å
1159	E	83.3	Confident	84.9	Confident	83 Å²	83	60.4 Å²	60.4	39%	0.388	29%	0.292	S	S	.	.			trans	-69.5	129.2	177.6	-175.8	-175.2	179.7	0	0	110.2	W1116 I1118 R1161	W1116-E1159 HydrophobicContact CB-CB 3.99Å; W1116-E1159 HydrophobicContact CB-CG 4.17Å; W1116-E1159 HydrophobicContact CG-CB 4.2Å; I1118-E1159 HydrophobicContact CG2-CG 3.64Å; I1118-E1159 WeakPolarHBondContact CG2-OE1 3.33Å; E1159-R1161 PolarHBondContact O-N 3.09Å; E1159-R1161 VanDerWaalsContact O-N 3.09Å; E1159-R1161 IonicContact OE2-NE 3.93Å
1160	P	80.4	Confident	84.2	Confident	9 Å²	9	61.3 Å²	61.3	6%	0.058	30%	0.298	C	S	.	.			trans	-75.4	99.1	178.1	30	-32.6	0	0	0	110	I1118 I1152 I1155 S1163 I1164	I1118-P1160 HydrophobicContact CD1-CG 4.08Å; I1152-P1160 HydrophobicContact CG2-CB 3.57Å; I1152-P1160 HydrophobicContact CG2-CG 3.77Å; I1155-P1160 HydrophobicContact CG1-CG 4.3Å; P1160-S1163 WeakPolarHBondContact CB-OG 3.33Å; P1160-I1164 HydrophobicContact CB-CG1 4.46Å; P1160-I1164 WeakPolarHBondContact O-CD1 3.41Å
1161	R	67.2	Low	83.6	Confident	193 Å²	193	66.6 Å²	66.6	73%	0.728	32%	0.321	S	S	*	.	S	Bend	trans	-84.5	-43.9	-176.8	-68.3	-176.4	-180	174.4	1.7	113.9	E1159	E1159-R1161 PolarHBondContact O-N 3.09Å; E1159-R1161 VanDerWaalsContact O-N 3.09Å; E1159-R1161 IonicContact OE2-NE 3.93Å
1162	D	67.5	Low	83.2	Confident	156 Å²	156	70.3 Å²	70.3	83%	0.834	34%	0.34	S	S	*	.	S	Bend	trans	-123.8	15.9	-172.3	-60.2	-45.7	0	0	0	113.4
1163	S	78.4	Confident	83.1	Confident	25 Å²	25	72.5 Å²	72.5	18%	0.175	35%	0.354	C	S	.	.			trans	-115.1	23.9	-175.5	61.3	0	0	0	0	113.7	I1152 E1153 P1160	I1152-S1163 WeakPolarHBondContact CA-O 3.25Å; E1153-S1163 PolarHBondContact N-O 3.36Å; E1153-S1163 VanDerWaalsContact O-CB 3.32Å; E1153-S1163 WeakPolarHBondContact O-CB 3.45Å; E1153-S1163 PolarHBondContact O-OG 2.89Å; P1160-S1163 WeakPolarHBondContact CB-OG 3.33Å
1164	I	87.2	Confident	83.4	Confident	41 Å²	41	70.2 Å²	70.2	21%	0.21	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.5	-178.7	-54.2	171.6	0	0	0	109.5	I1118 V1150 I1152 P1160 Y1166	I1118-I1164 HydrophobicContact CD1-CD1 3.63Å; V1150-I1164 HydrophobicContact CG1-CG2 3.57Å; I1152-I1164 HydrophobicContact CD1-CG1 4.44Å; I1152-I1164 HydrophobicContact CG1-CG1 4.16Å; I1152-I1164 HydrophobicContact CG1-CG2 4.27Å; I1152-I1164 HydrophobicContact CG2-CG1 4.06Å; P1160-I1164 HydrophobicContact CB-CG1 4.46Å; P1160-I1164 WeakPolarHBondContact O-CD1 3.41Å; I1164-Y1166 HydrophobicContact CG2-CD2 4.31Å; I1164-Y1166 HydrophobicContact CG2-CE2 3.6Å
1165	Y	86.8	Confident	83.8	Confident	117 Å²	117	67.3 Å²	67.3	46%	0.459	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	139.6	178.1	-51.7	-85.8	0	0	0	110.2	V1150 V1151 E1153	V1150-Y1165 CarbonylContact C-O 3.58Å; V1150-Y1165 WeakPolarHBondContact CA-O 3.49Å; V1151-Y1165 PolarHBondContact N-O 3.37Å; V1151-Y1165 PolarHBondContact O-N 3.49Å; E1153-Y1165 HydrophobicContact CG-CD2 4.27Å; E1153-Y1165 HydrophobicContact CG-CE2 3.84Å
1166	Y	88.3	Confident	84.2	Confident	71 Å²	71	67.1 Å²	67.1	28%	0.278	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	123.3	177.9	-65.7	-94.9	0	0	0	109.3	I1120 H1121 L1144 V1150 I1164	I1120-Y1166 HydrophobicContact CG2-CE1 4.09Å; H1121-Y1166 HydrophobicContact CB-CD1 4.39Å; H1121-Y1166 HydrophobicContact CB-CE1 3.95Å; H1121-Y1166 AromaticContact CD2-CE1 3.53Å; H1121-Y1166 AromaticContact CD2-CZ 3.49Å; H1121-Y1166 VanDerWaalsContact CD2-CZ 3.49Å; H1121-Y1166 AromaticContact CE1-CD1 3.56Å; H1121-Y1166 AromaticContact CE1-CD2 3.73Å; H1121-Y1166 AromaticContact CE1-CE1 3.75Å; H1121-Y1166 AromaticContact CE1-CE2 3.91Å; H1121-Y1166 AromaticContact CE1-CG 3.56Å; H1121-Y1166 AromaticContact CE1-CZ 3.91Å; H1121-Y1166 AromaticContact CG-CD1 3.73Å; H1121-Y1166 AromaticContact CG-CE1 3.39Å; H1121-Y1166 AromaticContact CG-CZ 3.88Å; H1121-Y1166 AromaticContact ND1-CD1 3.36Å; H1121-Y1166 WeakPolarHBondContact ND1-CD1 3.33Å; H1121-Y1166 AromaticContact ND1-CE1 3.54Å; H1121-Y1166 AromaticContact ND1-CG 3.81Å; H1121-Y1166 AromaticContact NE2-CD2 3.9Å; H1121-Y1166 AromaticContact NE2-CE1 3.77Å; H1121-Y1166 AromaticContact NE2-CE2 3.6Å; H1121-Y1166 AromaticContact NE2-CZ 3.54Å; L1144-Y1166 HydrophobicContact CD1-CE1 4.37Å; V1150-Y1166 HydrophobicContact CB-CE1 4.5Å; V1150-Y1166 HydrophobicContact CG1-CE1 4.28Å; V1150-Y1166 HydrophobicContact CG2-CD1 3.66Å; V1150-Y1166 HydrophobicContact CG2-CE1 3.5Å; I1164-Y1166 HydrophobicContact CG2-CD2 4.31Å; I1164-Y1166 HydrophobicContact CG2-CE2 3.6Å
1167	I	86.4	Confident	84.8	Confident	49 Å²	49	66.4 Å²	66.4	25%	0.251	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	109	177.5	-58.4	171.2	0	0	0	107.5	E1148 L1149 V1151 I1169 M1200	E1148-I1167 CarbonylContact C-O 3.58Å; E1148-I1167 WeakPolarHBondContact CA-O 3.32Å; L1149-I1167 HydrophobicContact CB-CB 4.45Å; L1149-I1167 PolarHBondContact N-O 3.25Å; L1149-I1167 PolarHBondContact O-N 3.42Å; V1151-I1167 HydrophobicContact CG2-CD1 3.79Å; I1167-I1169 HydrophobicContact CG2-CG1 4.29Å; I1167-I1169 PolarHBondContact O-N 2.63Å; I1167-I1169 VanDerWaalsContact O-N 3.15Å; I1167-M1200 HydrophobicContact CD1-CB 4.41Å; I1167-M1200 HydrophobicContact CD1-CE 3.6Å; I1167-M1200 HydrophobicContact CD1-CG 4.47Å
1168	T	88.1	Confident	85.3	Confident	82 Å²	82	63.5 Å²	63.5	50%	0.503	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	107.2	174.4	-47.2	0	0	0	0	109.4	E1148	E1148-T1168 HydrophobicContact CG-CG2 4.27Å
1169	I	85.8	Confident	85.8	Confident	22 Å²	22	57.6 Å²	57.6	11%	0.113	28%	0.283	C	S	.	.			trans	-88.5	-39	178.2	-61	-179.8	0	0	0	110.3	G1147 L1149 I1167 I1174 C1186 F1193 F1195	G1147-I1169 PolarHBondContact O-N 2.86Å; L1149-I1169 HydrophobicContact CB-CD1 3.5Å; L1149-I1169 VanDerWaalsContact CB-CD1 3.5Å; L1149-I1169 HydrophobicContact CB-CG1 4.03Å; L1149-I1169 HydrophobicContact CD2-CD1 3.94Å; L1149-I1169 HydrophobicContact CG-CD1 4.24Å; I1167-I1169 HydrophobicContact CG2-CG1 4.29Å; I1167-I1169 PolarHBondContact O-N 2.63Å; I1167-I1169 VanDerWaalsContact O-N 3.15Å; I1169-I1174 HydrophobicContact CD1-CD1 3.94Å; I1169-C1186 HydrophobicContact CD1-CB 3.7Å; I1169-F1193 HydrophobicContact CG2-CB 3.55Å; I1169-F1193 HydrophobicContact CG2-CD1 3.58Å; I1169-F1193 HydrophobicContact CG2-CD2 3.2Å; I1169-F1193 HydrophobicContact CG2-CE1 4.01Å; I1169-F1193 HydrophobicContact CG2-CE2 3.67Å; I1169-F1193 HydrophobicContact CG2-CG 3.14Å; I1169-F1193 HydrophobicContact CG2-CZ 4.04Å; I1169-F1195 HydrophobicContact CD1-CE2 3.59Å; I1169-F1195 HydrophobicContact CD1-CZ 3.96Å; I1169-F1195 HydrophobicContact CG1-CE2 4.13Å; I1169-F1195 HydrophobicContact CG1-CZ 3.96Å
1170	S	80.3	Confident	86.1	Confident	19 Å²	19	53.7 Å²	53.7	13%	0.133	27%	0.265	C	S	.	.			trans	-160.6	-178.2	-176.5	68.5	0	0	0	0	110.6	G1147 I1172 S1188	G1147-S1170 CarbonylContact C-O 3.52Å; G1147-S1170 VanDerWaalsContact CA-O 3.26Å; G1147-S1170 WeakPolarHBondContact CA-O 3.42Å; G1147-S1170 PolarHBondContact O-N 3.15Å; S1170-I1172 PolarHBondContact OG-N 3.31Å; S1170-I1172 PolarHBondContact OG-O 2.87Å; S1170-I1172 VanDerWaalsContact OG-O 3.06Å; S1170-S1188 WeakPolarHBondContact OG-CB 3.43Å; S1170-S1188 PolarHBondContact OG-OG 2.81Å
1171	F	81.2	Confident	86.3	Confident	112 Å²	112	59.8 Å²	59.8	49%	0.491	29%	0.29	S	S	.	.	S	Bend	trans	-104.1	3.4	171.4	-56.1	-75.8	0	0	0	113.4	I796	I796-F1171 HydrophobicContact CD1-CE2 4.1Å
1172	I	84	Confident	87.3	Confident	80 Å²	80	54 Å²	54	41%	0.41	28%	0.279	S	S	.	.	S	Bend	trans	-100.8	142.8	178.2	-59.4	172.4	0	0	0	107.3	G1147 S1170 I1174 S1188	G1147-I1172 WeakPolarHBondContact CA-O 3.46Å; S1170-I1172 PolarHBondContact OG-N 3.31Å; S1170-I1172 PolarHBondContact OG-O 2.87Å; S1170-I1172 VanDerWaalsContact OG-O 3.06Å; I1172-I1174 PolarHBondContact O-N 3.5Å; I1172-S1188 WeakPolarHBondContact CB-OG 3.26Å; I1172-S1188 PolarHBondContact O-OG 3.18Å
1173	P	89	Confident	88.5	Confident	46 Å²	46	48.2 Å²	48.2	30%	0.299	25%	0.247	S	C	.	.			trans	-49.8	131	177.3	-27.2	30.8	0	0	0	112.6	T1145 S1175	T1145-P1173 VanDerWaalsContact O-CG 3.32Å; T1145-P1173 WeakPolarHBondContact O-CG 3.39Å; P1173-S1175 PolarHBondContact O-N 3.13Å; P1173-S1175 VanDerWaalsContact O-N 3.12Å
1174	I	94.5	Very high	89.4	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	110.8	168.8	-61.8	-178.4	0	0	0	106.8	S1125 L1144 E1148 L1149 I1169 I1172 V1177 A1187	S1125-I1174 WeakPolarHBondContact CB-O 3.2Å; S1125-I1174 PolarHBondContact OG-O 3.47Å; L1144-I1174 PolarHBondContact O-N 3.44Å; E1148-I1174 VanDerWaalsContact C-CD1 3.5Å; E1148-I1174 VanDerWaalsContact O-CD1 3.27Å; E1148-I1174 WeakPolarHBondContact O-CD1 3.44Å; L1149-I1174 HydrophobicContact CB-CD1 3.94Å; L1149-I1174 HydrophobicContact CD1-CD1 4.49Å; I1169-I1174 HydrophobicContact CD1-CD1 3.94Å; I1172-I1174 PolarHBondContact O-N 3.5Å; I1174-V1177 HydrophobicContact CG2-CG2 3.59Å; I1174-A1187 CarbonylContact C-O 3.56Å; I1174-A1187 WeakPolarHBondContact CA-O 3.29Å; I1174-A1187 WeakPolarHBondContact CG2-O 3.33Å
1175	S	93.6	Very high	89.8	Confident	30 Å²	30	45.1 Å²	45.1	21%	0.21	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-27.3	-173.4	59.4	0	0	0	0	113.3	P1173 A1187 I1216	P1173-S1175 PolarHBondContact O-N 3.13Å; P1173-S1175 VanDerWaalsContact O-N 3.12Å; S1175-A1187 PolarHBondContact N-O 3.34Å; S1175-I1216 WeakPolarHBondContact CB-O 3.46Å; S1175-I1216 PolarHBondContact OG-O 3.31Å
1176	S	94.9	Very high	90.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	142.3	177.9	-167.2	0	0	0	0	111.7	D1126 A1187 I1219	D1126-S1176 VanDerWaalsContact OD2-CA 3.24Å; D1126-S1176 WeakPolarHBondContact OD2-CA 3.43Å; D1126-S1176 PolarHBondContact OD2-OG 3.18Å; D1126-S1176 VanDerWaalsContact OD2-OG 3.12Å; S1176-A1187 PolarHBondContact O-N 3.49Å; S1176-I1219 PolarHBondContact OG-N 3Å
1177	V	96.1	Very high	90.7	Very high	7 Å²	7	36.1 Å²	36.1	4%	0.042	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.8	174.9	-171.7	0	0	0	0	108.9	D1126 T1128 L1149 I1174 L1184 W1185	D1126-V1177 HydrophobicContact CB-CG2 4.41Å; D1126-V1177 PolarHBondContact OD2-N 2.84Å; T1128-V1177 HydrophobicContact CG2-CB 4.3Å; T1128-V1177 HydrophobicContact CG2-CG1 3.63Å; L1149-V1177 HydrophobicContact CD1-CG1 4.49Å; L1149-V1177 HydrophobicContact CD1-CG2 4.39Å; I1174-V1177 HydrophobicContact CG2-CG2 3.59Å; V1177-L1184 HydrophobicContact CG1-CD1 3.61Å; V1177-L1184 HydrophobicContact CG1-CG 4.24Å; V1177-W1185 WeakPolarHBondContact CA-O 3.35Å
1178	L	95.5	Very high	91	Very high	23 Å²	23	34 Å²	34	12%	0.12	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	127.1	-177.6	175.4	69.5	0	0	0	110.9	W1185 I1219 L1221 V1226	L1178-W1185 HydrophobicContact CB-CB 4.29Å; L1178-W1185 PolarHBondContact N-O 2.89Å; L1178-W1185 PolarHBondContact O-N 2.62Å; L1178-I1219 HydrophobicContact CB-CB 4.36Å; L1178-I1219 HydrophobicContact CB-CG2 4.27Å; L1178-I1219 HydrophobicContact CD2-CB 4.29Å; L1178-I1219 HydrophobicContact CD2-CG2 3.49Å; L1178-I1219 VanDerWaalsContact CD2-CG2 3.49Å; L1178-L1221 HydrophobicContact CD1-CB 4.13Å; L1178-L1221 HydrophobicContact CD2-CB 4.14Å; L1178-V1226 HydrophobicContact CD2-CG1 4Å
1179	L	93.8	Very high	91.2	Very high	44 Å²	44	30.1 Å²	30.1	23%	0.23	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	114	166.7	-175	70.3	0	0	0	109.7	T1128 F1129 A1130 A1197	T1128-L1179 HydrophobicContact CG2-CB 4.44Å; F1129-L1179 WeakPolarHBondContact O-CD2 3.2Å; A1130-L1179 HydrophobicContact CB-CD1 4.39Å; A1130-L1179 HydrophobicContact CB-CD2 3.66Å; L1179-A1197 HydrophobicContact CD1-CB 3.5Å
1180	A	89.1	Confident	91.3	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	108.9	176.3	0	0	0	0	0	110.2	S1182 Q1183 L1221	A1180-S1182 PolarHBondContact O-N 2.94Å; A1180-S1182 VanDerWaalsContact O-N 3.07Å; A1180-Q1183 PolarHBondContact N-O 3.45Å; A1180-Q1183 WeakPolarHBondContact O-CB 3.45Å; A1180-Q1183 PolarHBondContact O-N 2.81Å; A1180-L1221 HydrophobicContact CB-CD1 4.21Å; A1180-L1221 HydrophobicContact CB-CD2 4.29Å
1181	K	85.2	Confident	92	Very high	138 Å²	138	29.8 Å²	29.8	60%	0.6	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	-109.4	-172.9	-53.1	176.7	-175.2	176.3	0	110.6	D1242	K1181-D1242 IonicContact NZ-OD1 2.71Å; K1181-D1242 PolarHBondContact NZ-OD1 3.15Å; K1181-D1242 IonicContact NZ-OD2 3.41Å; K1181-D1242 PolarHBondContact NZ-OD2 3.21Å
1182	S	87.9	Confident	92.6	Very high	71 Å²	71	24.5 Å²	24.5	50%	0.497	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	8.6	177.1	-53.6	0	0	0	0	113	A1180 A1197	A1180-S1182 PolarHBondContact O-N 2.94Å; A1180-S1182 VanDerWaalsContact O-N 3.07Å; S1182-A1197 PolarHBondContact O-N 3.33Å
1183	Q	93	Very high	93.2	Very high	35 Å²	35	21.9 Å²	21.9	16%	0.164	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.5	-179.3	-63.7	175.6	-0.1	0	0	110.6	A1180 I1194 F1195 P1241	A1180-Q1183 PolarHBondContact N-O 3.45Å; A1180-Q1183 WeakPolarHBondContact O-CB 3.45Å; A1180-Q1183 PolarHBondContact O-N 2.81Å; Q1183-I1194 HydrophobicContact CB-CG2 3.96Å; Q1183-I1194 HydrophobicContact CG-CG2 4.21Å; Q1183-F1195 CarbonylContact C-O 3.56Å; Q1183-F1195 WeakPolarHBondContact CA-O 3.24Å; Q1183-P1241 PolarHBondContact OE1-O 3.48Å
1184	L	96.1	Very high	93.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.1	170.5	-175.4	72.3	0	0	0	108.8	T1128 Y1141 L1149 V1177 I1194 F1195 A1197 M1200	T1128-L1184 HydrophobicContact CG2-CD1 3.93Å; Y1141-L1184 HydrophobicContact CD1-CD1 4.39Å; Y1141-L1184 HydrophobicContact CD1-CD2 3.49Å; Y1141-L1184 VanDerWaalsContact CD1-CD2 3.49Å; Y1141-L1184 HydrophobicContact CD2-CD1 3.75Å; Y1141-L1184 HydrophobicContact CD2-CD2 4.36Å; Y1141-L1184 HydrophobicContact CE1-CD2 3.94Å; Y1141-L1184 HydrophobicContact CE2-CD1 4.25Å; Y1141-L1184 HydrophobicContact CG-CD1 3.82Å; Y1141-L1184 HydrophobicContact CG-CD2 3.73Å; Y1141-L1184 HydrophobicContact CG-CG 4.44Å; L1149-L1184 HydrophobicContact CD2-CD2 3.71Å; V1177-L1184 HydrophobicContact CG1-CD1 3.61Å; V1177-L1184 HydrophobicContact CG1-CG 4.24Å; L1184-I1194 CarbonylContact O-C 3.49Å; L1184-I1194 VanDerWaalsContact O-CA 3.31Å; L1184-I1194 WeakPolarHBondContact O-CA 3.44Å; L1184-F1195 HydrophobicContact CB-CB 4.41Å; L1184-F1195 PolarHBondContact N-O 2.82Å; L1184-F1195 PolarHBondContact O-N 3.37Å; L1184-A1197 HydrophobicContact CB-CB 4.5Å; L1184-M1200 HydrophobicContact CD2-CE 3.99Å; L1184-M1200 HydrophobicContact CD2-SD 4.22Å
1185	W	96.9	Very high	93.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.9	-179.4	-69.5	50.8	0	0	0	109.1	V1177 L1178 I1192 I1194 I1206 V1226 P1241 L1244	V1177-W1185 WeakPolarHBondContact CA-O 3.35Å; L1178-W1185 HydrophobicContact CB-CB 4.29Å; L1178-W1185 PolarHBondContact N-O 2.89Å; L1178-W1185 PolarHBondContact O-N 2.62Å; W1185-I1192 HydrophobicContact CB-CG2 4.17Å; W1185-I1192 HydrophobicContact CD2-CG2 4.3Å; W1185-I1192 HydrophobicContact CE3-CD1 4.42Å; W1185-I1192 HydrophobicContact CE3-CG2 3.72Å; W1185-I1192 HydrophobicContact CZ3-CG2 4.46Å; W1185-I1194 HydrophobicContact CD2-CD1 3.95Å; W1185-I1194 HydrophobicContact CD2-CG1 4.05Å; W1185-I1194 HydrophobicContact CE3-CD1 4.22Å; W1185-I1194 HydrophobicContact CE3-CG1 4.49Å; W1185-I1194 HydrophobicContact CG-CG1 4.19Å; W1185-I1194 HydrophobicContact CH2-CD1 4Å; W1185-I1194 HydrophobicContact CZ2-CD1 3.74Å; W1185-I1194 HydrophobicContact CZ3-CD1 4.23Å; W1185-I1206 HydrophobicContact CH2-CD1 4.34Å; W1185-I1206 HydrophobicContact CZ3-CD1 4.38Å; W1185-V1226 HydrophobicContact CE3-CG1 4.22Å; W1185-V1226 HydrophobicContact CH2-CG2 4.38Å; W1185-V1226 HydrophobicContact CZ2-CG2 4.4Å; W1185-V1226 HydrophobicContact CZ3-CB 4.48Å; W1185-V1226 HydrophobicContact CZ3-CG1 4.17Å; W1185-P1241 HydrophobicContact CZ2-CB 4.25Å; W1185-L1244 HydrophobicContact CH2-CD2 3.47Å; W1185-L1244 VanDerWaalsContact CH2-CD2 3.47Å; W1185-L1244 HydrophobicContact CZ2-CD2 3.3Å
1186	C	96.8	Very high	93.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	109.2	-179.5	-61.6	0	0	0	0	109.7	I1169 I1192 F1193	I1169-C1186 HydrophobicContact CD1-CB 3.7Å; C1186-I1192 WeakPolarHBondContact O-CA 3.21Å; C1186-F1193 PolarHBondContact N-O 3.01Å; C1186-F1193 PolarHBondContact O-N 3.24Å
1187	A	96.3	Very high	93.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	127	177.5	0	0	0	0	0	110.5	I1174 S1175 S1176 I1216 I1219	I1174-A1187 CarbonylContact C-O 3.56Å; I1174-A1187 WeakPolarHBondContact CA-O 3.29Å; I1174-A1187 WeakPolarHBondContact CG2-O 3.33Å; S1175-A1187 PolarHBondContact N-O 3.34Å; S1176-A1187 PolarHBondContact O-N 3.49Å; A1187-I1216 HydrophobicContact CB-CB 3.94Å; A1187-I1216 HydrophobicContact CB-CD1 3.89Å; A1187-I1216 HydrophobicContact CB-CG2 3.73Å; A1187-I1219 HydrophobicContact CB-CD1 3.41Å; A1187-I1219 VanDerWaalsContact CB-CD1 3.41Å; A1187-I1219 HydrophobicContact CB-CG1 4.06Å
1188	S	93.1	Very high	92.6	Very high	3 Å²	3	26 Å²	26	2%	0.021	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	118.1	172.5	178.9	0	0	0	0	110.3	S1170 I1172 S1190 S1191	S1170-S1188 WeakPolarHBondContact OG-CB 3.43Å; S1170-S1188 PolarHBondContact OG-OG 2.81Å; I1172-S1188 WeakPolarHBondContact CB-OG 3.26Å; I1172-S1188 PolarHBondContact O-OG 3.18Å; S1188-S1190 PolarHBondContact O-N 3.46Å; S1188-S1191 PolarHBondContact N-O 3.49Å; S1188-S1191 PolarHBondContact O-N 3.42Å; S1188-S1191 VanDerWaalsContact O-O 3.09Å
1189	G	91.4	Very high	92.1	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.01	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	-126.3	-170.4	0	0	0	0	0	111.4	D1214 I1216	G1189-D1214 CarbonylContact C-O 3.56Å; G1189-I1216 WeakPolarHBondContact O-CG1 3.17Å; G1189-I1216 PolarHBondContact O-N 3.04Å
1190	S	89.4	Confident	91.8	Very high	16 Å²	16	27.7 Å²	27.7	11%	0.112	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	1.5	175.1	59.2	0	0	0	0	113.6	S1188 I1208 D1214	S1188-S1190 PolarHBondContact O-N 3.46Å; S1190-I1208 VanDerWaalsContact O-CG1 3.29Å; S1190-I1208 WeakPolarHBondContact O-CG1 3.18Å; S1190-I1208 PolarHBondContact O-N 3.21Å; S1190-D1214 WeakPolarHBondContact CA-O 3.09Å; S1190-D1214 WeakPolarHBondContact CB-O 3.44Å; S1190-D1214 PolarHBondContact N-O 3.46Å
1191	S	94	Very high	91.4	Very high	19 Å²	19	32.4 Å²	32.4	13%	0.133	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	152	-177.3	-71.8	0	0	0	0	112.6	S1188 Q1205 I1206	S1188-S1191 PolarHBondContact N-O 3.49Å; S1188-S1191 PolarHBondContact O-N 3.42Å; S1188-S1191 VanDerWaalsContact O-O 3.09Å; S1191-Q1205 PolarHBondContact OG-NE2 3.44Å; S1191-Q1205 VanDerWaalsContact OG-NE2 3.13Å; S1191-I1206 CarbonylContact C-O 3.57Å; S1191-I1206 VanDerWaalsContact CA-O 3.32Å; S1191-I1206 WeakPolarHBondContact CA-O 3.41Å
1192	I	94.9	Very high	91.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	123	174.5	-57.3	172.8	0	0	0	107.9	W1185 C1186 I1194 Q1205 I1206 I1208 I1216 I1219 I1228	W1185-I1192 HydrophobicContact CB-CG2 4.17Å; W1185-I1192 HydrophobicContact CD2-CG2 4.3Å; W1185-I1192 HydrophobicContact CE3-CD1 4.42Å; W1185-I1192 HydrophobicContact CE3-CG2 3.72Å; W1185-I1192 HydrophobicContact CZ3-CG2 4.46Å; C1186-I1192 WeakPolarHBondContact O-CA 3.21Å; I1192-I1194 HydrophobicContact CG2-CG1 4.14Å; I1192-Q1205 CarbonylContact O-C 3.58Å; I1192-Q1205 VanDerWaalsContact O-CA 3.28Å; I1192-Q1205 WeakPolarHBondContact O-CA 3.38Å; I1192-I1206 PolarHBondContact N-O 3.48Å; I1192-I1206 PolarHBondContact O-N 2.97Å; I1192-I1208 HydrophobicContact CD1-CG2 3.89Å; I1192-I1216 HydrophobicContact CD1-CD1 3.91Å; I1192-I1216 HydrophobicContact CG1-CD1 3.42Å; I1192-I1216 VanDerWaalsContact CG1-CD1 3.42Å; I1192-I1219 HydrophobicContact CD1-CD1 3.79Å; I1192-I1219 HydrophobicContact CG1-CD1 3.99Å; I1192-I1219 HydrophobicContact CG2-CD1 4.24Å; I1192-I1228 HydrophobicContact CD1-CD1 3.53Å
1193	F	95.8	Very high	91.4	Very high	24 Å²	24	35.2 Å²	35.2	11%	0.105	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	126.5	177.3	-60.5	-97.7	0	0	0	108.8	I1169 C1186 F1195 Y1202 Q1205	I1169-F1193 HydrophobicContact CG2-CB 3.55Å; I1169-F1193 HydrophobicContact CG2-CD1 3.58Å; I1169-F1193 HydrophobicContact CG2-CD2 3.2Å; I1169-F1193 HydrophobicContact CG2-CE1 4.01Å; I1169-F1193 HydrophobicContact CG2-CE2 3.67Å; I1169-F1193 HydrophobicContact CG2-CG 3.14Å; I1169-F1193 HydrophobicContact CG2-CZ 4.04Å; C1186-F1193 PolarHBondContact N-O 3.01Å; C1186-F1193 PolarHBondContact O-N 3.24Å; F1193-F1195 HydrophobicContact CB-CE2 3.69Å; F1193-F1195 HydrophobicContact CB-CZ 4.16Å; F1193-Y1202 HydrophobicContact CD1-CE2 4.32Å; F1193-Q1205 HydrophobicContact CD1-CB 4.15Å; F1193-Q1205 HydrophobicContact CD1-CG 4.02Å; F1193-Q1205 HydrophobicContact CE1-CB 4.28Å; F1193-Q1205 VanDerWaalsContact CE1-CD 3.41Å; F1193-Q1205 HydrophobicContact CE1-CG 3.82Å; F1193-Q1205 HydrophobicContact CZ-CG 4.18Å
1194	I	94.2	Very high	91.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.1	-174.2	-56.4	174.7	0	0	0	109	Q1183 L1184 W1185 I1192 Y1203 K1204 I1206 L1244	Q1183-I1194 HydrophobicContact CB-CG2 3.96Å; Q1183-I1194 HydrophobicContact CG-CG2 4.21Å; L1184-I1194 CarbonylContact O-C 3.49Å; L1184-I1194 VanDerWaalsContact O-CA 3.31Å; L1184-I1194 WeakPolarHBondContact O-CA 3.44Å; W1185-I1194 HydrophobicContact CD2-CD1 3.95Å; W1185-I1194 HydrophobicContact CD2-CG1 4.05Å; W1185-I1194 HydrophobicContact CE3-CD1 4.22Å; W1185-I1194 HydrophobicContact CE3-CG1 4.49Å; W1185-I1194 HydrophobicContact CG-CG1 4.19Å; W1185-I1194 HydrophobicContact CH2-CD1 4Å; W1185-I1194 HydrophobicContact CZ2-CD1 3.74Å; W1185-I1194 HydrophobicContact CZ3-CD1 4.23Å; I1192-I1194 HydrophobicContact CG2-CG1 4.14Å; I1194-Y1203 HydrophobicContact CB-CD1 4.49Å; I1194-Y1203 HydrophobicContact CG2-CD1 4.13Å; I1194-Y1203 WeakPolarHBondContact O-CA 3.44Å; I1194-Y1203 WeakPolarHBondContact O-CB 3.43Å; I1194-Y1203 PolarHBondContact O-N 3.02Å; I1194-K1204 WeakPolarHBondContact CB-O 3.34Å; I1194-K1204 PolarHBondContact N-O 3.47Å; I1194-K1204 PolarHBondContact O-N 3.49Å; I1194-I1206 HydrophobicContact CD1-CD1 3.63Å; I1194-I1206 HydrophobicContact CD1-CG1 4.26Å; I1194-L1244 HydrophobicContact CD1-CD1 3.77Å; I1194-L1244 HydrophobicContact CD1-CD2 3.56Å; I1194-L1244 HydrophobicContact CD1-CG 4.32Å
1195	F	94.6	Very high	90.9	Very high	15 Å²	15	42.7 Å²	42.7	7%	0.066	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	154.9	176.9	-56.8	-93.4	0	0	0	110.3	I1169 Q1183 L1184 F1193 A1197 M1200 D1201 Y1202	I1169-F1195 HydrophobicContact CD1-CE2 3.59Å; I1169-F1195 HydrophobicContact CD1-CZ 3.96Å; I1169-F1195 HydrophobicContact CG1-CE2 4.13Å; I1169-F1195 HydrophobicContact CG1-CZ 3.96Å; Q1183-F1195 CarbonylContact C-O 3.56Å; Q1183-F1195 WeakPolarHBondContact CA-O 3.24Å; L1184-F1195 HydrophobicContact CB-CB 4.41Å; L1184-F1195 PolarHBondContact N-O 2.82Å; L1184-F1195 PolarHBondContact O-N 3.37Å; F1193-F1195 HydrophobicContact CB-CE2 3.69Å; F1193-F1195 HydrophobicContact CB-CZ 4.16Å; F1195-A1197 PolarHBondContact O-N 2.91Å; F1195-M1200 HydrophobicContact CB-CE 4.17Å; F1195-M1200 HydrophobicContact CD1-CE 4.46Å; F1195-M1200 HydrophobicContact CG-CE 4.19Å; F1195-D1201 CarbonylContact C-O 3.55Å; F1195-D1201 VanDerWaalsContact CA-O 3.28Å; F1195-D1201 WeakPolarHBondContact CA-O 3.41Å; F1195-Y1202 HydrophobicContact CD1-CD2 4.28Å; F1195-Y1202 AromaticContact CE1-CD2 3.78Å; F1195-Y1202 HydrophobicContact CE1-CD2 3.78Å; F1195-Y1202 HydrophobicContact CE1-CG 4.4Å; F1195-Y1202 HydrophobicContact CZ-CD2 4.09Å
1196	H	89.9	Confident	90.6	Very high	76 Å²	76	43.4 Å²	43.4	35%	0.352	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	121.7	165.5	-175.7	-94	0	0	0	109.2	K1198 T1199 M1200 D1201	H1196-K1198 VanDerWaalsContact C-N 3.34Å; H1196-K1198 PolarHBondContact O-N 3.2Å; H1196-T1199 WeakPolarHBondContact CB-OG1 3.33Å; H1196-T1199 PolarHBondContact ND1-N 3.38Å; H1196-T1199 PolarHBondContact ND1-OG1 3.05Å; H1196-T1199 PolarHBondContact O-N 2.68Å; H1196-M1200 WeakPolarHBondContact O-CA 3.38Å; H1196-M1200 PolarHBondContact O-N 3.37Å; H1196-D1201 HydrophobicContact CB-CB 4.34Å; H1196-D1201 PolarHBondContact N-O 3.07Å
1197	A	91.2	Very high	90.2	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.017	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-40.8	-168.6	0	0	0	0	0	113	F1132 Y1141 L1179 S1182 L1184 F1195	F1132-A1197 HydrophobicContact CZ-CB 4.32Å; Y1141-A1197 PolarHBondContact OH-O 2.93Å; L1179-A1197 HydrophobicContact CD1-CB 3.5Å; S1182-A1197 PolarHBondContact O-N 3.33Å; L1184-A1197 HydrophobicContact CB-CB 4.5Å; F1195-A1197 PolarHBondContact O-N 2.91Å
1198	K	85.4	Confident	89.8	Confident	76 Å²	76	47 Å²	47	33%	0.33	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-47.4	-176.4	-168.5	177.9	177.7	177.2	0	112.9	F1132 D1135 K1139 H1196	F1132-K1198 HydrophobicContact CD1-CB 4.05Å; F1132-K1198 HydrophobicContact CD1-CD 4.13Å; F1132-K1198 HydrophobicContact CD1-CG 3.96Å; F1132-K1198 HydrophobicContact CE1-CB 3.51Å; F1132-K1198 HydrophobicContact CE1-CD 4.46Å; F1132-K1198 HydrophobicContact CE1-CG 3.9Å; F1132-K1198 HydrophobicContact CG-CG 4.31Å; F1132-K1198 VanDerWaalsContact CZ-CA 3.46Å; F1132-K1198 HydrophobicContact CZ-CB 3.82Å; F1132-K1198 HydrophobicContact CZ-CG 4.18Å; D1135-K1198 IonicContact OD1-NZ 3.03Å; D1135-K1198 PolarHBondContact OD1-NZ 3Å; D1135-K1198 WeakPolarHBondContact OD2-CE 3.35Å; D1135-K1198 IonicContact OD2-NZ 3.55Å; D1135-K1198 PolarHBondContact OD2-NZ 3.43Å; K1139-K1198 WeakPolarHBondContact CE-O 3.5Å; K1139-K1198 PolarHBondContact NZ-O 3.18Å; H1196-K1198 VanDerWaalsContact C-N 3.34Å; H1196-K1198 PolarHBondContact O-N 3.2Å
1199	T	85.1	Confident	89.3	Confident	72 Å²	72	47.5 Å²	47.5	44%	0.442	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-14.3	-169.6	52.6	0	0	0	0	112.5	H1196 D1201	H1196-T1199 WeakPolarHBondContact CB-OG1 3.33Å; H1196-T1199 PolarHBondContact ND1-N 3.38Å; H1196-T1199 PolarHBondContact ND1-OG1 3.05Å; H1196-T1199 PolarHBondContact O-N 2.68Å; T1199-D1201 WeakPolarHBondContact CB-OD2 3.38Å; T1199-D1201 PolarHBondContact O-N 3.49Å; T1199-D1201 VanDerWaalsContact OG1-CG 3.23Å; T1199-D1201 PolarHBondContact OG1-OD2 3Å
1200	M	88.4	Confident	88.4	Confident	31 Å²	31	55.5 Å²	55.5	15%	0.153	27%	0.273	C	S	.	.			trans	58.7	19.2	-170.3	-64.7	-55.6	-61.7	0	0	114.2	Y1141 L1149 V1151 I1167 L1184 F1195 H1196 Y1202	Y1141-M1200 HydrophobicContact CD1-SD 4.19Å; Y1141-M1200 HydrophobicContact CE1-SD 3.57Å; Y1141-M1200 VanDerWaalsContact CE1-SD 3.57Å; L1149-M1200 HydrophobicContact CD2-CE 3.6Å; V1151-M1200 HydrophobicContact CG2-CE 3.9Å; V1151-M1200 HydrophobicContact CG2-CG 4.49Å; V1151-M1200 HydrophobicContact CG2-SD 4.31Å; I1167-M1200 HydrophobicContact CD1-CB 4.41Å; I1167-M1200 HydrophobicContact CD1-CE 3.6Å; I1167-M1200 HydrophobicContact CD1-CG 4.47Å; L1184-M1200 HydrophobicContact CD2-CE 3.99Å; L1184-M1200 HydrophobicContact CD2-SD 4.22Å; F1195-M1200 HydrophobicContact CB-CE 4.17Å; F1195-M1200 HydrophobicContact CD1-CE 4.46Å; F1195-M1200 HydrophobicContact CG-CE 4.19Å; H1196-M1200 WeakPolarHBondContact O-CA 3.38Å; H1196-M1200 PolarHBondContact O-N 3.37Å; M1200-Y1202 PolarHBondContact O-N 3.2Å
1201	D	79.6	Confident	87.7	Confident	100 Å²	100	57.7 Å²	57.7	54%	0.535	28%	0.284	S	S	.	.			trans	-65.1	128.7	174.3	-61.6	-41.4	0	0	0	109.9	F1195 H1196 T1199 Y1203	F1195-D1201 CarbonylContact C-O 3.55Å; F1195-D1201 VanDerWaalsContact CA-O 3.28Å; F1195-D1201 WeakPolarHBondContact CA-O 3.41Å; H1196-D1201 HydrophobicContact CB-CB 4.34Å; H1196-D1201 PolarHBondContact N-O 3.07Å; T1199-D1201 WeakPolarHBondContact CB-OD2 3.38Å; T1199-D1201 PolarHBondContact O-N 3.49Å; T1199-D1201 VanDerWaalsContact OG1-CG 3.23Å; T1199-D1201 PolarHBondContact OG1-OD2 3Å; D1201-Y1203 PolarHBondContact O-N 2.94Å
1202	Y	87.6	Confident	86.5	Confident	129 Å²	129	61.8 Å²	61.8	51%	0.506	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	130.2	175.1	173.9	-102.2	0	0	0	110.7	F1193 F1195 M1200 Q1205	F1193-Y1202 HydrophobicContact CD1-CE2 4.32Å; F1195-Y1202 HydrophobicContact CD1-CD2 4.28Å; F1195-Y1202 AromaticContact CE1-CD2 3.78Å; F1195-Y1202 HydrophobicContact CE1-CD2 3.78Å; F1195-Y1202 HydrophobicContact CE1-CG 4.4Å; F1195-Y1202 HydrophobicContact CZ-CD2 4.09Å; M1200-Y1202 PolarHBondContact O-N 3.2Å; Y1202-Q1205 VanDerWaalsContact OH-CB 3.25Å; Y1202-Q1205 WeakPolarHBondContact OH-CB 3.42Å; Y1202-Q1205 PolarHBondContact OH-N 3.42Å
1203	Y	85.1	Confident	85.6	Confident	140 Å²	140	67.5 Å²	67.5	55%	0.549	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-60.7	-179.9	-173.5	-109.5	0	0	0	111.9	I1194 D1201 L1244	I1194-Y1203 HydrophobicContact CB-CD1 4.49Å; I1194-Y1203 HydrophobicContact CG2-CD1 4.13Å; I1194-Y1203 WeakPolarHBondContact O-CA 3.44Å; I1194-Y1203 WeakPolarHBondContact O-CB 3.43Å; I1194-Y1203 PolarHBondContact O-N 3.02Å; D1201-Y1203 PolarHBondContact O-N 2.94Å; Y1203-L1244 HydrophobicContact CD1-CD1 3.87Å; Y1203-L1244 HydrophobicContact CE1-CD1 3.49Å; Y1203-L1244 VanDerWaalsContact CE1-CD1 3.49Å; Y1203-L1244 HydrophobicContact CE1-CG 4.39Å
1204	K	89.1	Confident	85	Confident	104 Å²	104	67.9 Å²	67.9	45%	0.452	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	155	-174.8	-164.4	169.9	-178.4	-178.9	0	112.4	I1194 L1244	I1194-K1204 WeakPolarHBondContact CB-O 3.34Å; I1194-K1204 PolarHBondContact N-O 3.47Å; I1194-K1204 PolarHBondContact O-N 3.49Å; K1204-L1244 HydrophobicContact CB-CD1 4.09Å; K1204-L1244 HydrophobicContact CD-CD1 3.8Å; K1204-L1244 HydrophobicContact CG-CD1 4.44Å
1205	Q	90.9	Very high	84.7	Confident	88 Å²	88	70.3 Å²	70.3	41%	0.411	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137	165.5	-179.4	-176.6	-5.2	0	0	110.2	S1191 I1192 F1193 Y1202	S1191-Q1205 PolarHBondContact OG-NE2 3.44Å; S1191-Q1205 VanDerWaalsContact OG-NE2 3.13Å; I1192-Q1205 CarbonylContact O-C 3.58Å; I1192-Q1205 VanDerWaalsContact O-CA 3.28Å; I1192-Q1205 WeakPolarHBondContact O-CA 3.38Å; F1193-Q1205 HydrophobicContact CD1-CB 4.15Å; F1193-Q1205 HydrophobicContact CD1-CG 4.02Å; F1193-Q1205 HydrophobicContact CE1-CB 4.28Å; F1193-Q1205 VanDerWaalsContact CE1-CD 3.41Å; F1193-Q1205 HydrophobicContact CE1-CG 3.82Å; F1193-Q1205 HydrophobicContact CZ-CG 4.18Å; Y1202-Q1205 VanDerWaalsContact OH-CB 3.25Å; Y1202-Q1205 WeakPolarHBondContact OH-CB 3.42Å; Y1202-Q1205 PolarHBondContact OH-N 3.42Å
1206	I	90	Very high	84.7	Confident	14 Å²	14	69.6 Å²	69.6	7%	0.072	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.6	176.2	-52.2	173.2	0	0	0	108	W1185 S1191 I1192 I1194 W1239 L1244	W1185-I1206 HydrophobicContact CH2-CD1 4.34Å; W1185-I1206 HydrophobicContact CZ3-CD1 4.38Å; S1191-I1206 CarbonylContact C-O 3.57Å; S1191-I1206 VanDerWaalsContact CA-O 3.32Å; S1191-I1206 WeakPolarHBondContact CA-O 3.41Å; I1192-I1206 PolarHBondContact N-O 3.48Å; I1192-I1206 PolarHBondContact O-N 2.97Å; I1194-I1206 HydrophobicContact CD1-CD1 3.63Å; I1194-I1206 HydrophobicContact CD1-CG1 4.26Å; I1206-W1239 HydrophobicContact CD1-CZ3 4.41Å; I1206-W1239 HydrophobicContact CG2-CE3 4.42Å; I1206-W1239 HydrophobicContact CG2-CH2 3.48Å; I1206-W1239 VanDerWaalsContact CG2-CH2 3.48Å; I1206-W1239 HydrophobicContact CG2-CZ2 4.4Å; I1206-W1239 HydrophobicContact CG2-CZ3 3.5Å; I1206-L1244 HydrophobicContact CD1-CB 3.79Å; I1206-L1244 HydrophobicContact CD1-CD1 4.07Å; I1206-L1244 HydrophobicContact CD1-CD2 3.99Å; I1206-L1244 HydrophobicContact CD1-CG 4.17Å
1207	S	89.4	Confident	84.8	Confident	63 Å²	63	68 Å²	68	44%	0.441	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128.8	166.3	-171.2	0	0	0	0	109.8	S1209	S1207-S1209 PolarHBondContact OG-O 2.94Å
1208	I	86.9	Confident	84.8	Confident	14 Å²	14	71 Å²	71	7%	0.072	36%	0.361	C	S	.	.	S	Bend	trans	-92.1	-12.8	178.5	64.8	150.8	0	0	0	113	S1190 I1192 I1216 I1228 V1230 W1239	S1190-I1208 VanDerWaalsContact O-CG1 3.29Å; S1190-I1208 WeakPolarHBondContact O-CG1 3.18Å; S1190-I1208 PolarHBondContact O-N 3.21Å; I1192-I1208 HydrophobicContact CD1-CG2 3.89Å; I1208-I1216 HydrophobicContact CD1-CD1 4.01Å; I1208-I1216 HydrophobicContact CD1-CG1 3.44Å; I1208-I1216 VanDerWaalsContact CD1-CG1 3.44Å; I1208-I1216 HydrophobicContact CG1-CD1 4.06Å; I1208-I1216 HydrophobicContact CG1-CG1 3.97Å; I1208-I1228 HydrophobicContact CD1-CG2 4.11Å; I1208-I1228 HydrophobicContact CG2-CD1 4.27Å; I1208-V1230 HydrophobicContact CD1-CG2 3.33Å; I1208-W1239 HydrophobicContact CB-CZ2 4.36Å; I1208-W1239 HydrophobicContact CG2-CH2 4.46Å; I1208-W1239 HydrophobicContact CG2-CZ2 3.78Å
1209	S	82.1	Confident	85.3	Confident	13 Å²	13	67.5 Å²	67.5	9%	0.091	35%	0.346	C	S	.	.			trans	-147.4	144.8	-178.7	-171.1	0	0	0	0	111.2	S1207 N1211 D1214	S1207-S1209 PolarHBondContact OG-O 2.94Å; S1209-N1211 VanDerWaalsContact C-N 3.27Å; S1209-N1211 PolarHBondContact OG-N 3.41Å; S1209-D1214 WeakPolarHBondContact CB-OD2 3.27Å; S1209-D1214 PolarHBondContact OG-OD2 2.99Å
1210	N	73.4	Confident	85.7	Confident	168 Å²	168	65 Å²	65	90%	0.898	33%	0.331	S	S	*	.	S	Bend	trans	-80.7	-13.4	172.1	-65.7	-9.4	0	0	0	111.8	P1212	N1210-P1212 WeakPolarHBondContact O-CD 3.49Å
1211	N	74.5	Confident	85.9	Confident	63 Å²	63	67 Å²	67	34%	0.337	34%	0.343	S	S	.	.			trans	-82	116	175.9	-173.9	-5.2	0	0	0	109.6	S1209 L1213 D1214	S1209-N1211 VanDerWaalsContact C-N 3.27Å; S1209-N1211 PolarHBondContact OG-N 3.41Å; N1211-L1213 PolarHBondContact O-N 3.04Å; N1211-L1213 WeakPolarHBondContact OD1-CB 3.28Å; N1211-L1213 PolarHBondContact OD1-N 3.19Å; N1211-D1214 PolarHBondContact O-N 3.28Å
1212	P	68.4	Low	86.4	Confident	105 Å²	105	62.9 Å²	62.9	68%	0.682	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.8	179.8	29.3	-36.1	0	0	0	113.5	N1210	N1210-P1212 WeakPolarHBondContact O-CD 3.49Å
1213	L	75.4	Confident	86.3	Confident	120 Å²	120	60.8 Å²	60.8	63%	0.628	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.8	177.6	-59.6	177.6	0	0	0	113.3	N1211 V1215	N1211-L1213 PolarHBondContact O-N 3.04Å; N1211-L1213 WeakPolarHBondContact OD1-CB 3.28Å; N1211-L1213 PolarHBondContact OD1-N 3.19Å; L1213-V1215 PolarHBondContact O-N 3.36Å
1214	D	83.2	Confident	86.3	Confident	32 Å²	32	55 Å²	55	17%	0.171	30%	0.299	C	S	.	.			trans	-70.6	129.7	178.3	-75.6	-10.2	0	0	0	110.2	G1189 S1190 S1209 N1211 V1230	G1189-D1214 CarbonylContact C-O 3.56Å; S1190-D1214 WeakPolarHBondContact CA-O 3.09Å; S1190-D1214 WeakPolarHBondContact CB-O 3.44Å; S1190-D1214 PolarHBondContact N-O 3.46Å; S1209-D1214 WeakPolarHBondContact CB-OD2 3.27Å; S1209-D1214 PolarHBondContact OG-OD2 2.99Å; N1211-D1214 PolarHBondContact O-N 3.28Å; D1214-V1230 HydrophobicContact CB-CG1 4.07Å
1215	V	89	Confident	86.4	Confident	51 Å²	51	50.3 Å²	50.3	31%	0.309	28%	0.28	S	S	.	.			trans	-117.7	120.8	177.2	-177.7	0	0	0	0	109.2	L1213 L1217 R1231	L1213-V1215 PolarHBondContact O-N 3.36Å; V1215-L1217 PolarHBondContact O-N 3.43Å; V1215-R1231 WeakPolarHBondContact O-CB 3.36Å; V1215-R1231 PolarHBondContact O-N 3.41Å
1216	I	93.8	Very high	86.5	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	126.9	173.2	-65.9	162	0	0	0	108.4	S1175 A1187 G1189 I1192 I1208 I1219 I1228	S1175-I1216 WeakPolarHBondContact CB-O 3.46Å; S1175-I1216 PolarHBondContact OG-O 3.31Å; A1187-I1216 HydrophobicContact CB-CB 3.94Å; A1187-I1216 HydrophobicContact CB-CD1 3.89Å; A1187-I1216 HydrophobicContact CB-CG2 3.73Å; G1189-I1216 WeakPolarHBondContact O-CG1 3.17Å; G1189-I1216 PolarHBondContact O-N 3.04Å; I1192-I1216 HydrophobicContact CD1-CD1 3.91Å; I1192-I1216 HydrophobicContact CG1-CD1 3.42Å; I1192-I1216 VanDerWaalsContact CG1-CD1 3.42Å; I1208-I1216 HydrophobicContact CD1-CD1 4.01Å; I1208-I1216 HydrophobicContact CD1-CG1 3.44Å; I1208-I1216 VanDerWaalsContact CD1-CG1 3.44Å; I1208-I1216 HydrophobicContact CG1-CD1 4.06Å; I1208-I1216 HydrophobicContact CG1-CG1 3.97Å; I1216-I1219 HydrophobicContact CG2-CD1 4.31Å; I1216-I1219 HydrophobicContact CG2-CG1 3.77Å; I1216-I1228 HydrophobicContact CG1-CG2 4.47Å; I1216-I1228 HydrophobicContact CG2-CG2 3.97Å
1217	L	92.3	Very high	86.8	Confident	41 Å²	41	45.6 Å²	45.6	22%	0.215	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-51.9	179.9	175.3	65.4	0	0	0	111.4	V1215 A1229 R1231 V1273	V1215-L1217 PolarHBondContact O-N 3.43Å; L1217-A1229 HydrophobicContact CB-CB 4.45Å; L1217-A1229 WeakPolarHBondContact CB-O 3.47Å; L1217-A1229 HydrophobicContact CD2-CB 4.42Å; L1217-A1229 PolarHBondContact N-O 3.46Å; L1217-R1231 HydrophobicContact CB-CB 4.21Å; L1217-R1231 HydrophobicContact CD1-CB 4.44Å; L1217-R1231 HydrophobicContact CD1-CG 4.46Å; L1217-V1273 VanDerWaalsContact CD2-O 3.3Å; L1217-V1273 WeakPolarHBondContact CD2-O 3.43Å
1218	K	92.4	Very high	87.1	Confident	65 Å²	65	42.6 Å²	42.6	28%	0.283	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	145.3	-177.9	-164	70.9	-174.2	174.2	0	110.2	D1126 A1229 I1276	D1126-K1218 VanDerWaalsContact CG-NZ 3.31Å; D1126-K1218 IonicContact OD1-NZ 3.87Å; D1126-K1218 PolarHBondContact OD1-NZ 3.39Å; D1126-K1218 VanDerWaalsContact OD1-NZ 3.11Å; D1126-K1218 IonicContact OD2-NZ 3.58Å; D1126-K1218 PolarHBondContact OD2-NZ 3.27Å; K1218-A1229 PolarHBondContact N-O 3.16Å; K1218-A1229 PolarHBondContact O-N 3.11Å; K1218-A1229 VanDerWaalsContact O-N 3.13Å; K1218-I1276 HydrophobicContact CB-CG1 4.39Å
1219	I	95	Very high	87.4	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.015	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.5	170.5	-50.8	179.3	0	0	0	107.5	S1176 L1178 A1187 I1192 I1216 V1226 W1227 I1228	S1176-I1219 PolarHBondContact OG-N 3Å; L1178-I1219 HydrophobicContact CB-CB 4.36Å; L1178-I1219 HydrophobicContact CB-CG2 4.27Å; L1178-I1219 HydrophobicContact CD2-CB 4.29Å; L1178-I1219 HydrophobicContact CD2-CG2 3.49Å; L1178-I1219 VanDerWaalsContact CD2-CG2 3.49Å; A1187-I1219 HydrophobicContact CB-CD1 3.41Å; A1187-I1219 VanDerWaalsContact CB-CD1 3.41Å; A1187-I1219 HydrophobicContact CB-CG1 4.06Å; I1192-I1219 HydrophobicContact CD1-CD1 3.79Å; I1192-I1219 HydrophobicContact CG1-CD1 3.99Å; I1192-I1219 HydrophobicContact CG2-CD1 4.24Å; I1216-I1219 HydrophobicContact CG2-CD1 4.31Å; I1216-I1219 HydrophobicContact CG2-CG1 3.77Å; I1219-V1226 HydrophobicContact CG2-CG1 3.23Å; I1219-W1227 WeakPolarHBondContact CA-O 3.29Å; I1219-I1228 HydrophobicContact CG2-CG1 4.27Å
1220	C	92.9	Very high	87.8	Confident	19 Å²	19	41.4 Å²	41.4	13%	0.128	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.7	-179.1	-65.9	0	0	0	0	110.9	W1227 I1276 P1278	C1220-W1227 PolarHBondContact N-O 3.37Å; C1220-W1227 PolarHBondContact O-N 3.06Å; C1220-I1276 HydrophobicContact CB-CD1 4.33Å; C1220-I1276 PolarHBondContact SG-O 3.37Å; C1220-I1276 VanDerWaalsContact SG-O 3.39Å; C1220-P1278 HydrophobicContact CB-CG 3.89Å
1221	L	93	Very high	88.5	Confident	75 Å²	75	42.1 Å²	42.1	39%	0.393	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	130.4	173.2	-176.4	65.3	0	0	0	110.3	L1178 A1180 V1226 P1278	L1178-L1221 HydrophobicContact CD1-CB 4.13Å; L1178-L1221 HydrophobicContact CD2-CB 4.14Å; A1180-L1221 HydrophobicContact CB-CD1 4.21Å; A1180-L1221 HydrophobicContact CB-CD2 4.29Å; L1221-V1226 HydrophobicContact CD1-CG2 3.95Å; L1221-P1278 WeakPolarHBondContact O-CG 3.42Å
1222	G	89.9	Confident	89	Confident	12 Å²	12	40.4 Å²	40.4	12%	0.124	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	175.6	168.6	0	0	0	0	0	112.2	N1224 G1225	G1222-N1224 PolarHBondContact O-N 3.45Å; G1222-N1224 VanDerWaalsContact O-N 3.11Å; G1222-G1225 PolarHBondContact N-O 3.07Å; G1222-G1225 PolarHBondContact O-N 2.95Å; G1222-G1225 VanDerWaalsContact O-N 3.13Å; G1222-G1225 VanDerWaalsContact O-O 3.09Å
1223	D	86.1	Confident	90	Very high	86 Å²	86	35.7 Å²	35.7	46%	0.46	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.5	-176.8	-72.6	4.5	0	0	0	114.4	D1280	D1223-D1280 WeakPolarHBondContact OD2-CA 3.44Å
1224	N	85.6	Confident	90.7	Very high	18 Å²	18	30.1 Å²	30.1	10%	0.096	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-5.5	-177.3	-61.1	-54.9	0	0	0	113.3	G1222 L1238 Y1383	G1222-N1224 PolarHBondContact O-N 3.45Å; G1222-N1224 VanDerWaalsContact O-N 3.11Å; N1224-L1238 HydrophobicContact CB-CD2 4.22Å; N1224-Y1383 HydrophobicContact CB-CD1 4.27Å; N1224-Y1383 HydrophobicContact CB-CE1 3.69Å
1225	G	90.1	Very high	91	Very high	5 Å²	5	28.6 Å²	28.6	5%	0.052	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	139	-163.6	-176.2	0	0	0	0	0	113.3	G1222 W1239	G1222-G1225 PolarHBondContact N-O 3.07Å; G1222-G1225 PolarHBondContact O-N 2.95Å; G1222-G1225 VanDerWaalsContact O-N 3.13Å; G1222-G1225 VanDerWaalsContact O-O 3.09Å; G1225-W1239 CarbonylContact C-O 3.51Å; G1225-W1239 WeakPolarHBondContact CA-O 3.4Å
1226	V	93.6	Very high	91.2	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	118.2	-177.6	178.5	0	0	0	0	109.8	L1178 W1185 I1219 L1221 I1228 L1238 W1239 P1241	L1178-V1226 HydrophobicContact CD2-CG1 4Å; W1185-V1226 HydrophobicContact CE3-CG1 4.22Å; W1185-V1226 HydrophobicContact CH2-CG2 4.38Å; W1185-V1226 HydrophobicContact CZ2-CG2 4.4Å; W1185-V1226 HydrophobicContact CZ3-CB 4.48Å; W1185-V1226 HydrophobicContact CZ3-CG1 4.17Å; I1219-V1226 HydrophobicContact CG2-CG1 3.23Å; L1221-V1226 HydrophobicContact CD1-CG2 3.95Å; V1226-I1228 HydrophobicContact CG1-CG1 4.23Å; V1226-L1238 CarbonylContact O-C 3.58Å; V1226-W1239 HydrophobicContact CB-CB 4.34Å; V1226-W1239 PolarHBondContact N-O 3.18Å; V1226-W1239 PolarHBondContact O-N 3.13Å; V1226-P1241 HydrophobicContact CG2-CB 3.91Å; V1226-P1241 HydrophobicContact CG2-CG 4.44Å
1227	W	95.7	Very high	91.1	Very high	3 Å²	3	26.2 Å²	26.2	1%	0.011	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	137.5	175.7	-71.1	92	0	0	0	111.1	I1219 C1220 I1236 E1237 L1238 L1248 I1276 P1278 L1283 I1297 L1385	I1219-W1227 WeakPolarHBondContact CA-O 3.29Å; C1220-W1227 PolarHBondContact N-O 3.37Å; C1220-W1227 PolarHBondContact O-N 3.06Å; W1227-I1236 HydrophobicContact CE3-CD1 4.29Å; W1227-I1236 HydrophobicContact CZ3-CD1 3.87Å; W1227-E1237 CarbonylContact C-O 3.59Å; W1227-E1237 VanDerWaalsContact CA-O 3.29Å; W1227-E1237 WeakPolarHBondContact CA-O 3.21Å; W1227-L1238 HydrophobicContact CD2-CB 4.33Å; W1227-L1238 HydrophobicContact CD2-CD1 3.9Å; W1227-L1238 HydrophobicContact CE3-CB 4.09Å; W1227-L1238 HydrophobicContact CE3-CD1 4.5Å; W1227-L1238 HydrophobicContact CG-CD1 4.11Å; W1227-L1238 HydrophobicContact CH2-CB 4.05Å; W1227-L1238 HydrophobicContact CH2-CD2 4.26Å; W1227-L1238 HydrophobicContact CZ2-CB 4.3Å; W1227-L1238 HydrophobicContact CZ2-CD1 4.05Å; W1227-L1238 HydrophobicContact CZ2-CD2 3.99Å; W1227-L1238 HydrophobicContact CZ2-CG 4.33Å; W1227-L1238 HydrophobicContact CZ3-CB 3.94Å; W1227-L1248 HydrophobicContact CH2-CD1 4.45Å; W1227-L1248 HydrophobicContact CH2-CD2 4.5Å; W1227-L1248 HydrophobicContact CZ3-CD1 4.29Å; W1227-I1276 HydrophobicContact CB-CD1 3.96Å; W1227-P1278 HydrophobicContact CG-CB 4.38Å; W1227-L1283 HydrophobicContact CD2-CD1 4.08Å; W1227-L1283 HydrophobicContact CD2-CD2 4.06Å; W1227-L1283 HydrophobicContact CE3-CD2 3.76Å; W1227-L1283 HydrophobicContact CG-CD1 4.22Å; W1227-L1283 HydrophobicContact CH2-CD2 3.84Å; W1227-L1283 HydrophobicContact CZ2-CD2 4.11Å; W1227-L1283 HydrophobicContact CZ3-CD2 3.65Å; W1227-I1297 HydrophobicContact CZ2-CD1 3.84Å; W1227-I1297 HydrophobicContact CZ2-CG1 4.45Å; W1227-L1385 HydrophobicContact CH2-CD1 4.12Å; W1227-L1385 HydrophobicContact CH2-CD2 4.02Å; W1227-L1385 HydrophobicContact CH2-CG 4.48Å; W1227-L1385 HydrophobicContact CZ3-CD1 4.47Å
1228	I	95.5	Very high	91.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.5	-177.2	-49	-174.6	0	0	0	109.5	I1192 I1208 I1216 I1219 V1226 E1237 W1239	I1192-I1228 HydrophobicContact CD1-CD1 3.53Å; I1208-I1228 HydrophobicContact CD1-CG2 4.11Å; I1208-I1228 HydrophobicContact CG2-CD1 4.27Å; I1216-I1228 HydrophobicContact CG1-CG2 4.47Å; I1216-I1228 HydrophobicContact CG2-CG2 3.97Å; I1219-I1228 HydrophobicContact CG2-CG1 4.27Å; V1226-I1228 HydrophobicContact CG1-CG1 4.23Å; I1228-E1237 HydrophobicContact CB-CB 4.29Å; I1228-E1237 PolarHBondContact N-O 3.45Å; I1228-E1237 PolarHBondContact O-N 2.99Å; I1228-W1239 VanDerWaalsContact CD1-CD1 3.43Å; I1228-W1239 HydrophobicContact CD1-CD2 4.42Å; I1228-W1239 HydrophobicContact CD1-CG 3.93Å
1229	A	94	Very high	91.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.4	171.2	0	0	0	0	0	110.1	L1217 K1218 I1236 V1273 I1276	L1217-A1229 HydrophobicContact CB-CB 4.45Å; L1217-A1229 WeakPolarHBondContact CB-O 3.47Å; L1217-A1229 HydrophobicContact CD2-CB 4.42Å; L1217-A1229 PolarHBondContact N-O 3.46Å; K1218-A1229 PolarHBondContact N-O 3.16Å; K1218-A1229 PolarHBondContact O-N 3.11Å; K1218-A1229 VanDerWaalsContact O-N 3.13Å; A1229-I1236 HydrophobicContact CB-CG2 4.37Å; A1229-V1273 HydrophobicContact CB-CG1 3.89Å; A1229-I1276 HydrophobicContact CB-CD1 4.04Å; A1229-I1276 HydrophobicContact CB-CG1 4.34Å; A1229-I1276 HydrophobicContact CB-CG2 4.17Å
1230	V	90.6	Very high	90.8	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.012	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	140	176.2	171.6	0	0	0	0	109.9	I1208 D1214 G1232 S1233	I1208-V1230 HydrophobicContact CD1-CG2 3.33Å; D1214-V1230 HydrophobicContact CB-CG1 4.07Å; V1230-G1232 PolarHBondContact O-N 3.46Å; V1230-S1233 PolarHBondContact O-N 3.28Å
1231	R	87.3	Confident	90.6	Very high	183 Å²	183	23.4 Å²	23.4	69%	0.691	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	129.3	-176.9	-173.3	176.4	-178.2	136.4	-2.4	109.8	V1215 L1217 S1233	V1215-R1231 WeakPolarHBondContact O-CB 3.36Å; V1215-R1231 PolarHBondContact O-N 3.41Å; L1217-R1231 HydrophobicContact CB-CB 4.21Å; L1217-R1231 HydrophobicContact CD1-CB 4.44Å; L1217-R1231 HydrophobicContact CD1-CG 4.46Å; R1231-S1233 VanDerWaalsContact C-N 3.27Å; R1231-S1233 PolarHBondContact O-N 3.12Å
1232	G	86	Confident	90.2	Very high	28 Å²	28	24.3 Å²	24.3	29%	0.289	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.2	-18.7	179.6	0	0	0	0	0	114.6	V1230 R1272	V1230-G1232 PolarHBondContact O-N 3.46Å; G1232-R1272 VanDerWaalsContact O-CB 3.27Å; G1232-R1272 WeakPolarHBondContact O-CB 3.47Å
1233	S	88.8	Confident	89.9	Confident	5 Å²	5	30.2 Å²	30.2	4%	0.035	15%	0.145	C	C	.	.			trans	-92.5	153.5	-176.4	-174.2	0	0	0	0	112.6	V1230 R1231 V1235 E1264 R1272 V1273	V1230-S1233 PolarHBondContact O-N 3.28Å; R1231-S1233 VanDerWaalsContact C-N 3.27Å; R1231-S1233 PolarHBondContact O-N 3.12Å; S1233-V1235 VanDerWaalsContact C-N 3.34Å; S1233-V1235 WeakPolarHBondContact OG-CB 3.26Å; S1233-V1235 PolarHBondContact OG-N 2.91Å; S1233-V1235 VanDerWaalsContact OG-N 3.1Å; S1233-E1264 WeakPolarHBondContact CB-OE1 3.27Å; S1233-E1264 PolarHBondContact OG-OE1 3.41Å; S1233-R1272 WeakPolarHBondContact O-CA 3.44Å; S1233-V1273 PolarHBondContact O-N 3.42Å
1234	S	89.3	Confident	89.9	Confident	4 Å²	4	26.7 Å²	26.7	3%	0.028	13%	0.127	C	C	.	.	S	Bend	trans	-94.1	9.7	167.7	62.7	0	0	0	0	113.4	N1251 I1252 V1253	S1234-N1251 PolarHBondContact OG-OD1 3.39Å; S1234-I1252 WeakPolarHBondContact O-CB 3.4Å; S1234-I1252 WeakPolarHBondContact O-CD1 2.88Å; S1234-I1252 PolarHBondContact O-N 2.8Å; S1234-V1253 VanDerWaalsContact CB-CG2 3.45Å
1235	V	90	Very high	89.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135.2	-176.1	-175.6	0	0	0	0	110.7	S1233 L1249 F1250 N1251 L1258 P1262	S1233-V1235 VanDerWaalsContact C-N 3.34Å; S1233-V1235 WeakPolarHBondContact OG-CB 3.26Å; S1233-V1235 PolarHBondContact OG-N 2.91Å; S1233-V1235 VanDerWaalsContact OG-N 3.1Å; V1235-L1249 HydrophobicContact CG1-CD1 3.29Å; V1235-L1249 HydrophobicContact CG1-CG 3.75Å; V1235-F1250 WeakPolarHBondContact CA-O 3.3Å; V1235-N1251 HydrophobicContact CG2-CB 4.17Å; V1235-L1258 HydrophobicContact CG1-CD1 4.29Å; V1235-L1258 HydrophobicContact CG2-CD1 4.1Å; V1235-P1262 HydrophobicContact CG2-CG 4.28Å
1236	I	93.1	Very high	89.7	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	154.1	175.8	52.4	166.2	0	0	0	111.3	W1227 A1229 F1250 I1252 V1273 I1276 L1283 I1285 L1385	W1227-I1236 HydrophobicContact CE3-CD1 4.29Å; W1227-I1236 HydrophobicContact CZ3-CD1 3.87Å; A1229-I1236 HydrophobicContact CB-CG2 4.37Å; I1236-F1250 HydrophobicContact CD1-CD1 4.17Å; I1236-F1250 HydrophobicContact CG1-CB 4.14Å; I1236-F1250 HydrophobicContact CG1-CD1 4.25Å; I1236-F1250 WeakPolarHBondContact CG1-O 3.33Å; I1236-F1250 PolarHBondContact N-O 3.11Å; I1236-F1250 PolarHBondContact O-N 2.86Å; I1236-I1252 HydrophobicContact CB-CD1 4.36Å; I1236-I1252 HydrophobicContact CD1-CD1 4.11Å; I1236-I1252 HydrophobicContact CD1-CG1 4.15Å; I1236-I1252 HydrophobicContact CG1-CD1 3.93Å; I1236-I1252 HydrophobicContact CG1-CG1 4.07Å; I1236-I1252 HydrophobicContact CG2-CD1 3.63Å; I1236-V1273 HydrophobicContact CG2-CG2 4.06Å; I1236-I1276 HydrophobicContact CG2-CG2 4.23Å; I1236-L1283 HydrophobicContact CD1-CD2 3.4Å; I1236-I1285 HydrophobicContact CD1-CD1 3.83Å; I1236-L1385 HydrophobicContact CD1-CD1 4.49Å
1237	E	92.6	Very high	89.3	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.5	-177.6	-70	174.4	-126.9	0	0	111.6	W1227 I1228 W1239 L1248 L1249 R1261	W1227-E1237 CarbonylContact C-O 3.59Å; W1227-E1237 VanDerWaalsContact CA-O 3.29Å; W1227-E1237 WeakPolarHBondContact CA-O 3.21Å; I1228-E1237 HydrophobicContact CB-CB 4.29Å; I1228-E1237 PolarHBondContact N-O 3.45Å; I1228-E1237 PolarHBondContact O-N 2.99Å; E1237-W1239 PolarHBondContact OE2-NE1 3.16Å; E1237-L1248 WeakPolarHBondContact CA-O 3.17Å; E1237-L1249 HydrophobicContact CG-CD1 3.24Å; E1237-R1261 IonicContact OE1-CZ 2.95Å; E1237-R1261 VanDerWaalsContact OE1-CZ 3.24Å; E1237-R1261 IonicContact OE1-NH1 3.26Å; E1237-R1261 PolarHBondContact OE1-NH1 3.18Å; E1237-R1261 IonicContact OE1-NH2 2.79Å; E1237-R1261 PolarHBondContact OE1-NH2 3.18Å; E1237-R1261 VanDerWaalsContact OE1-NH2 3.11Å
1238	L	92.6	Very high	88.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.9	168.1	-179.3	60	0	0	0	109.2	N1224 V1226 W1227 I1247 L1248 Y1383	N1224-L1238 HydrophobicContact CB-CD2 4.22Å; V1226-L1238 CarbonylContact O-C 3.58Å; W1227-L1238 HydrophobicContact CD2-CB 4.33Å; W1227-L1238 HydrophobicContact CD2-CD1 3.9Å; W1227-L1238 HydrophobicContact CE3-CB 4.09Å; W1227-L1238 HydrophobicContact CE3-CD1 4.5Å; W1227-L1238 HydrophobicContact CG-CD1 4.11Å; W1227-L1238 HydrophobicContact CH2-CB 4.05Å; W1227-L1238 HydrophobicContact CH2-CD2 4.26Å; W1227-L1238 HydrophobicContact CZ2-CB 4.3Å; W1227-L1238 HydrophobicContact CZ2-CD1 4.05Å; W1227-L1238 HydrophobicContact CZ2-CD2 3.99Å; W1227-L1238 HydrophobicContact CZ2-CG 4.33Å; W1227-L1238 HydrophobicContact CZ3-CB 3.94Å; L1238-I1247 HydrophobicContact CB-CB 4.39Å; L1238-I1247 HydrophobicContact CD2-CB 4.38Å; L1238-I1247 HydrophobicContact CD2-CD1 4.25Å; L1238-I1247 HydrophobicContact CD2-CG2 4.26Å; L1238-I1247 HydrophobicContact CG-CB 4.22Å; L1238-I1247 HydrophobicContact CG-CD1 4.13Å; L1238-I1247 WeakPolarHBondContact O-CB 3.45Å; L1238-I1247 PolarHBondContact O-N 3.38Å; L1238-L1248 HydrophobicContact CB-CD1 4.45Å; L1238-L1248 HydrophobicContact CB-CD2 4.13Å; L1238-L1248 HydrophobicContact CB-CG 3.84Å; L1238-L1248 HydrophobicContact CD2-CD2 3.98Å; L1238-L1248 PolarHBondContact N-O 3.21Å; L1238-L1248 VanDerWaalsContact N-O 3.1Å; L1238-L1248 PolarHBondContact O-N 2.71Å; L1238-Y1383 HydrophobicContact CD2-CD2 4.33Å; L1238-Y1383 HydrophobicContact CD2-CG 4.34Å
1239	W	91.9	Very high	88.7	Confident	20 Å²	20	33.4 Å²	33.4	8%	0.076	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143.1	-178.5	-73.9	72.9	0	0	0	111.2	I1206 I1208 G1225 V1226 I1228 E1237 P1241 I1245 R1246	I1206-W1239 HydrophobicContact CD1-CZ3 4.41Å; I1206-W1239 HydrophobicContact CG2-CE3 4.42Å; I1206-W1239 HydrophobicContact CG2-CH2 3.48Å; I1206-W1239 VanDerWaalsContact CG2-CH2 3.48Å; I1206-W1239 HydrophobicContact CG2-CZ2 4.4Å; I1206-W1239 HydrophobicContact CG2-CZ3 3.5Å; I1208-W1239 HydrophobicContact CB-CZ2 4.36Å; I1208-W1239 HydrophobicContact CG2-CH2 4.46Å; I1208-W1239 HydrophobicContact CG2-CZ2 3.78Å; G1225-W1239 CarbonylContact C-O 3.51Å; G1225-W1239 WeakPolarHBondContact CA-O 3.4Å; V1226-W1239 HydrophobicContact CB-CB 4.34Å; V1226-W1239 PolarHBondContact N-O 3.18Å; V1226-W1239 PolarHBondContact O-N 3.13Å; I1228-W1239 VanDerWaalsContact CD1-CD1 3.43Å; I1228-W1239 HydrophobicContact CD1-CD2 4.42Å; I1228-W1239 HydrophobicContact CD1-CG 3.93Å; E1237-W1239 PolarHBondContact OE2-NE1 3.16Å; W1239-P1241 WeakPolarHBondContact O-CD 3.41Å; W1239-I1245 WeakPolarHBondContact CA-O 3.37Å; W1239-I1245 VanDerWaalsContact CE3-C 3.45Å; W1239-R1246 HydrophobicContact CD2-CB 4.05Å; W1239-R1246 HydrophobicContact CE3-CB 4.34Å; W1239-R1246 HydrophobicContact CH2-CB 4.13Å; W1239-R1246 HydrophobicContact CZ2-CB 3.81Å; W1239-R1246 HydrophobicContact CZ2-CG 4.25Å; W1239-R1246 HydrophobicContact CZ3-CB 4.37Å
1240	D	87.8	Confident	88.5	Confident	34 Å²	34	33.5 Å²	33.5	18%	0.182	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	115.9	170.5	-174.3	-27.6	0	0	0	108.9	D1242 R1243 L1244 I1245 I1247	D1240-D1242 VanDerWaalsContact C-N 3.27Å; D1240-D1242 PolarHBondContact O-N 3.31Å; D1240-D1242 PolarHBondContact OD1-N 2.73Å; D1240-R1243 HydrophobicContact CB-CB 4.19Å; D1240-R1243 PolarHBondContact OD1-N 3.03Å; D1240-R1243 WeakPolarHBondContact OD2-CD 3.41Å; D1240-L1244 VanDerWaalsContact O-CA 3.25Å; D1240-L1244 WeakPolarHBondContact O-CA 3.12Å; D1240-L1244 PolarHBondContact O-N 3.1Å; D1240-I1245 HydrophobicContact CB-CG1 4.02Å; D1240-I1245 PolarHBondContact N-O 3.21Å; D1240-I1247 HydrophobicContact CB-CD1 3.95Å; D1240-I1247 HydrophobicContact CB-CG1 4.08Å
1241	P	88.3	Confident	88.5	Confident	14 Å²	14	34.2 Å²	34.2	9%	0.091	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.9	-179.1	26.2	-32.9	0	0	0	113.7	Q1183 W1185 V1226 W1239 L1244	Q1183-P1241 PolarHBondContact OE1-O 3.48Å; W1185-P1241 HydrophobicContact CZ2-CB 4.25Å; V1226-P1241 HydrophobicContact CG2-CB 3.91Å; V1226-P1241 HydrophobicContact CG2-CG 4.44Å; W1239-P1241 WeakPolarHBondContact O-CD 3.41Å; P1241-L1244 WeakPolarHBondContact O-CD2 3.22Å
1242	D	85.4	Confident	88.6	Confident	95 Å²	95	26 Å²	26	51%	0.508	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-40	-176.6	-63.3	-36	0	0	0	110.8	K1181 D1240	K1181-D1242 IonicContact NZ-OD1 2.71Å; K1181-D1242 PolarHBondContact NZ-OD1 3.15Å; K1181-D1242 IonicContact NZ-OD2 3.41Å; K1181-D1242 PolarHBondContact NZ-OD2 3.21Å; D1240-D1242 VanDerWaalsContact C-N 3.27Å; D1240-D1242 PolarHBondContact O-N 3.31Å; D1240-D1242 PolarHBondContact OD1-N 2.73Å
1243	R	83	Confident	88.6	Confident	135 Å²	135	27.1 Å²	27.1	51%	0.509	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-13.8	-179.2	-64.4	-177.5	-179.1	-167.1	2.7	114.1	D1240 I1245 N1378	D1240-R1243 HydrophobicContact CB-CB 4.19Å; D1240-R1243 PolarHBondContact OD1-N 3.03Å; D1240-R1243 WeakPolarHBondContact OD2-CD 3.41Å; R1243-I1245 VanDerWaalsContact C-N 3.25Å; R1243-I1245 HydrophobicContact CB-CD1 4.01Å; R1243-I1245 HydrophobicContact CB-CG1 3.81Å; R1243-I1245 HydrophobicContact CB-CG2 4.49Å; R1243-I1245 PolarHBondContact O-N 3.08Å; R1243-N1378 PolarHBondContact NH1-O 3.49Å
1244	L	86	Confident	88.3	Confident	13 Å²	13	32.1 Å²	32.1	7%	0.068	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	41.3	-175.3	-56.9	-172.9	0	0	0	112.9	W1185 I1194 Y1203 K1204 I1206 D1240 P1241	W1185-L1244 HydrophobicContact CH2-CD2 3.47Å; W1185-L1244 VanDerWaalsContact CH2-CD2 3.47Å; W1185-L1244 HydrophobicContact CZ2-CD2 3.3Å; I1194-L1244 HydrophobicContact CD1-CD1 3.77Å; I1194-L1244 HydrophobicContact CD1-CD2 3.56Å; I1194-L1244 HydrophobicContact CD1-CG 4.32Å; Y1203-L1244 HydrophobicContact CD1-CD1 3.87Å; Y1203-L1244 HydrophobicContact CE1-CD1 3.49Å; Y1203-L1244 VanDerWaalsContact CE1-CD1 3.49Å; Y1203-L1244 HydrophobicContact CE1-CG 4.39Å; K1204-L1244 HydrophobicContact CB-CD1 4.09Å; K1204-L1244 HydrophobicContact CD-CD1 3.8Å; K1204-L1244 HydrophobicContact CG-CD1 4.44Å; I1206-L1244 HydrophobicContact CD1-CB 3.79Å; I1206-L1244 HydrophobicContact CD1-CD1 4.07Å; I1206-L1244 HydrophobicContact CD1-CD2 3.99Å; I1206-L1244 HydrophobicContact CD1-CG 4.17Å; D1240-L1244 VanDerWaalsContact O-CA 3.25Å; D1240-L1244 WeakPolarHBondContact O-CA 3.12Å; D1240-L1244 PolarHBondContact O-N 3.1Å; P1241-L1244 WeakPolarHBondContact O-CD2 3.22Å
1245	I	85.2	Confident	88.2	Confident	58 Å²	58	36.1 Å²	36.1	30%	0.297	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	144.8	177.8	61.2	178.7	0	0	0	110.8	W1239 D1240 R1243 I1247 N1378	W1239-I1245 WeakPolarHBondContact CA-O 3.37Å; W1239-I1245 VanDerWaalsContact CE3-C 3.45Å; D1240-I1245 HydrophobicContact CB-CG1 4.02Å; D1240-I1245 PolarHBondContact N-O 3.21Å; R1243-I1245 VanDerWaalsContact C-N 3.25Å; R1243-I1245 HydrophobicContact CB-CD1 4.01Å; R1243-I1245 HydrophobicContact CB-CG1 3.81Å; R1243-I1245 HydrophobicContact CB-CG2 4.49Å; R1243-I1245 PolarHBondContact O-N 3.08Å; I1245-I1247 PolarHBondContact O-N 2.89Å; I1245-N1378 HydrophobicContact CD1-CB 4.1Å
1246	R	87.2	Confident	88	Confident	65 Å²	65	38.9 Å²	38.9	25%	0.245	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	122.9	173.6	-169.7	-175	67.7	-167.5	2.5	109.9	W1239 S1259	W1239-R1246 HydrophobicContact CD2-CB 4.05Å; W1239-R1246 HydrophobicContact CE3-CB 4.34Å; W1239-R1246 HydrophobicContact CH2-CB 4.13Å; W1239-R1246 HydrophobicContact CZ2-CB 3.81Å; W1239-R1246 HydrophobicContact CZ2-CG 4.25Å; W1239-R1246 HydrophobicContact CZ3-CB 4.37Å; R1246-S1259 PolarHBondContact NH2-O 3.47Å
1247	I	85.9	Confident	87.6	Confident	24 Å²	24	41.9 Å²	41.9	12%	0.123	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-49.3	177.9	-60.3	-178.1	0	0	0	110.6	L1238 D1240 I1245 Y1383	L1238-I1247 HydrophobicContact CB-CB 4.39Å; L1238-I1247 HydrophobicContact CD2-CB 4.38Å; L1238-I1247 HydrophobicContact CD2-CD1 4.25Å; L1238-I1247 HydrophobicContact CD2-CG2 4.26Å; L1238-I1247 HydrophobicContact CG-CB 4.22Å; L1238-I1247 HydrophobicContact CG-CD1 4.13Å; L1238-I1247 WeakPolarHBondContact O-CB 3.45Å; L1238-I1247 PolarHBondContact O-N 3.38Å; D1240-I1247 HydrophobicContact CB-CD1 3.95Å; D1240-I1247 HydrophobicContact CB-CG1 4.08Å; I1245-I1247 PolarHBondContact O-N 2.89Å; I1247-Y1383 HydrophobicContact CD1-CE2 4.14Å; I1247-Y1383 HydrophobicContact CG2-CD2 3.43Å; I1247-Y1383 VanDerWaalsContact CG2-CD2 3.43Å; I1247-Y1383 HydrophobicContact CG2-CE2 3.55Å
1248	L	87.3	Confident	87.1	Confident	16 Å²	16	44.2 Å²	44.2	8%	0.084	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	160.3	179.7	71.7	92.2	0	0	0	112.2	W1227 E1237 L1238 F1250 Y1383 L1385	W1227-L1248 HydrophobicContact CH2-CD1 4.45Å; W1227-L1248 HydrophobicContact CH2-CD2 4.5Å; W1227-L1248 HydrophobicContact CZ3-CD1 4.29Å; E1237-L1248 WeakPolarHBondContact CA-O 3.17Å; L1238-L1248 HydrophobicContact CB-CD1 4.45Å; L1238-L1248 HydrophobicContact CB-CD2 4.13Å; L1238-L1248 HydrophobicContact CB-CG 3.84Å; L1238-L1248 HydrophobicContact CD2-CD2 3.98Å; L1238-L1248 PolarHBondContact N-O 3.21Å; L1238-L1248 VanDerWaalsContact N-O 3.1Å; L1238-L1248 PolarHBondContact O-N 2.71Å; L1248-F1250 HydrophobicContact CD1-CB 3.8Å; L1248-Y1383 HydrophobicContact CD2-CG 4.48Å; L1248-L1385 HydrophobicContact CD1-CD1 4.13Å
1249	L	89.6	Confident	86.1	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.7	174.2	-177.8	72.6	0	0	0	107.5	V1235 E1237 Y1257 L1258	V1235-L1249 HydrophobicContact CG1-CD1 3.29Å; V1235-L1249 HydrophobicContact CG1-CG 3.75Å; E1237-L1249 HydrophobicContact CG-CD1 3.24Å; L1249-Y1257 WeakPolarHBondContact O-CA 3.43Å; L1249-L1258 HydrophobicContact CB-CB 4.37Å; L1249-L1258 HydrophobicContact CD2-CB 3.64Å; L1249-L1258 HydrophobicContact CD2-CD1 4.43Å; L1249-L1258 HydrophobicContact CG-CB 3.91Å; L1249-L1258 PolarHBondContact O-N 3.45Å
1250	F	91.2	Very high	85.3	Confident	3 Å²	3	57.1 Å²	57.1	1%	0.013	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	128.3	-171	-176.5	-99.8	0	0	0	111.8	V1235 I1236 L1248 I1252 E1255 T1256 Y1257 Y1295 L1385	V1235-F1250 WeakPolarHBondContact CA-O 3.3Å; I1236-F1250 HydrophobicContact CD1-CD1 4.17Å; I1236-F1250 HydrophobicContact CG1-CB 4.14Å; I1236-F1250 HydrophobicContact CG1-CD1 4.25Å; I1236-F1250 WeakPolarHBondContact CG1-O 3.33Å; I1236-F1250 PolarHBondContact N-O 3.11Å; I1236-F1250 PolarHBondContact O-N 2.86Å; L1248-F1250 HydrophobicContact CD1-CB 3.8Å; F1250-I1252 HydrophobicContact CD1-CG1 4.16Å; F1250-I1252 HydrophobicContact CE1-CG1 4.35Å; F1250-E1255 HydrophobicContact CZ-CB 4.12Å; F1250-E1255 HydrophobicContact CZ-CG 4.44Å; F1250-T1256 WeakPolarHBondContact CA-O 3.49Å; F1250-Y1257 AromaticContact CD2-CD1 3.81Å; F1250-Y1257 HydrophobicContact CD2-CD1 3.81Å; F1250-Y1257 HydrophobicContact CD2-CD2 4.3Å; F1250-Y1257 AromaticContact CD2-CE1 3.69Å; F1250-Y1257 HydrophobicContact CD2-CE1 3.69Å; F1250-Y1257 HydrophobicContact CD2-CE2 4.19Å; F1250-Y1257 HydrophobicContact CD2-CG 4.11Å; F1250-Y1257 AromaticContact CD2-CZ 3.87Å; F1250-Y1257 HydrophobicContact CE2-CD2 4.45Å; F1250-Y1257 HydrophobicContact CE2-CE1 4.29Å; F1250-Y1257 HydrophobicContact CE2-CE2 4.09Å; F1250-Y1257 AromaticContact CE2-CZ 3.99Å; F1250-Y1295 HydrophobicContact CE1-CD1 4.37Å; F1250-Y1295 AromaticContact CE1-CE1 3.69Å; F1250-Y1295 HydrophobicContact CE1-CE1 3.69Å; F1250-Y1295 AromaticContact CE1-CZ 3.91Å; F1250-Y1295 AromaticContact CZ-CE1 3.89Å; F1250-Y1295 HydrophobicContact CZ-CE1 3.89Å; F1250-L1385 HydrophobicContact CB-CD1 3.88Å; F1250-L1385 HydrophobicContact CD1-CD1 3.7Å; F1250-L1385 HydrophobicContact CD2-CD1 4Å; F1250-L1385 HydrophobicContact CE1-CD1 4.18Å; F1250-L1385 HydrophobicContact CE2-CB 4.4Å; F1250-L1385 HydrophobicContact CE2-CD1 4.45Å; F1250-L1385 HydrophobicContact CG-CD1 3.58Å; F1250-L1385 HydrophobicContact CZ-CB 4.3Å
1251	N	90.4	Very high	84.7	Confident	17 Å²	17	57.5 Å²	57.5	9%	0.091	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	119.8	174.7	-172.4	-24	0	0	0	110.2	S1234 V1235 V1253 E1255 T1256 L1258	S1234-N1251 PolarHBondContact OG-OD1 3.39Å; V1235-N1251 HydrophobicContact CG2-CB 4.17Å; N1251-V1253 PolarHBondContact OD1-N 3.07Å; N1251-E1255 WeakPolarHBondContact O-CA 3.21Å; N1251-E1255 PolarHBondContact O-N 3.01Å; N1251-T1256 PolarHBondContact N-O 2.99Å; N1251-T1256 PolarHBondContact O-N 3.04Å; N1251-T1256 VanDerWaalsContact O-N 3.16Å; N1251-L1258 HydrophobicContact CB-CD1 4.01Å; N1251-L1258 HydrophobicContact CB-CG 4.36Å
1252	I	89.4	Confident	83.8	Confident	9 Å²	9	59.4 Å²	59.4	5%	0.046	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-26.9	-173.7	-64	154	0	0	0	112.3	S1234 I1236 F1250 V1273 I1285 L1293 Y1295	S1234-I1252 WeakPolarHBondContact O-CB 3.4Å; S1234-I1252 WeakPolarHBondContact O-CD1 2.88Å; S1234-I1252 PolarHBondContact O-N 2.8Å; I1236-I1252 HydrophobicContact CB-CD1 4.36Å; I1236-I1252 HydrophobicContact CD1-CD1 4.11Å; I1236-I1252 HydrophobicContact CD1-CG1 4.15Å; I1236-I1252 HydrophobicContact CG1-CD1 3.93Å; I1236-I1252 HydrophobicContact CG1-CG1 4.07Å; I1236-I1252 HydrophobicContact CG2-CD1 3.63Å; F1250-I1252 HydrophobicContact CD1-CG1 4.16Å; F1250-I1252 HydrophobicContact CE1-CG1 4.35Å; I1252-V1273 HydrophobicContact CD1-CG2 3.23Å; I1252-I1285 HydrophobicContact CD1-CD1 3.5Å; I1252-I1285 VanDerWaalsContact CD1-CD1 3.5Å; I1252-I1285 HydrophobicContact CD1-CG2 4.07Å; I1252-I1285 HydrophobicContact CG1-CD1 3.87Å; I1252-L1293 HydrophobicContact CG2-CD1 3.21Å; I1252-Y1295 HydrophobicContact CG2-CE2 4.23Å
1253	V	86.5	Confident	82.7	Confident	52 Å²	52	64.2 Å²	64.2	32%	0.315	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-48	-178.3	171.4	0	0	0	0	110.5	S1234 N1251 Q1271	S1234-V1253 VanDerWaalsContact CB-CG2 3.45Å; N1251-V1253 PolarHBondContact OD1-N 3.07Å; V1253-Q1271 VanDerWaalsContact CG1-OE1 3.25Å; V1253-Q1271 HydrophobicContact CG2-CB 3.7Å
1254	N	82.8	Confident	81.4	Confident	111 Å²	111	61.6 Å²	61.6	59%	0.594	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-5.4	-178.5	-65.7	-14	0	0	0	112.9	T1256	N1254-T1256 VanDerWaalsContact C-N 3.31Å; N1254-T1256 HydrophobicContact CB-CG2 4.25Å; N1254-T1256 PolarHBondContact O-N 3.44Å
1255	E	86.2	Confident	79.5	Confident	87 Å²	87	68.7 Å²	68.7	41%	0.407	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	45.8	-175.1	-65.5	171.2	-123.1	0	0	112.7	F1250 N1251 K1387	F1250-E1255 HydrophobicContact CZ-CB 4.12Å; F1250-E1255 HydrophobicContact CZ-CG 4.44Å; N1251-E1255 WeakPolarHBondContact O-CA 3.21Å; N1251-E1255 PolarHBondContact O-N 3.01Å; E1255-K1387 VanDerWaalsContact CD-NZ 3.31Å; E1255-K1387 VanDerWaalsContact OE1-CE 3.26Å; E1255-K1387 WeakPolarHBondContact OE1-CE 3.38Å; E1255-K1387 IonicContact OE1-NZ 3.52Å; E1255-K1387 PolarHBondContact OE1-NZ 3.22Å; E1255-K1387 WeakPolarHBondContact OE2-CE 3.35Å; E1255-K1387 IonicContact OE2-NZ 3.64Å
1256	T	84.8	Confident	77.9	Confident	58 Å²	58	76.2 Å²	76.2	36%	0.356	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	142.1	-173.8	43.1	0	0	0	0	111.9	F1250 N1251 N1254	F1250-T1256 WeakPolarHBondContact CA-O 3.49Å; N1251-T1256 PolarHBondContact N-O 2.99Å; N1251-T1256 PolarHBondContact O-N 3.04Å; N1251-T1256 VanDerWaalsContact O-N 3.16Å; N1254-T1256 VanDerWaalsContact C-N 3.31Å; N1254-T1256 HydrophobicContact CB-CG2 4.25Å; N1254-T1256 PolarHBondContact O-N 3.44Å
1257	Y	85	Confident	76.4	Confident	65 Å²	65	78.4 Å²	78.4	26%	0.255	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	136.5	168.3	-60.4	-88.3	0	0	0	109.7	L1249 F1250 I1372 E1384 L1385	L1249-Y1257 WeakPolarHBondContact O-CA 3.43Å; F1250-Y1257 AromaticContact CD2-CD1 3.81Å; F1250-Y1257 HydrophobicContact CD2-CD1 3.81Å; F1250-Y1257 HydrophobicContact CD2-CD2 4.3Å; F1250-Y1257 AromaticContact CD2-CE1 3.69Å; F1250-Y1257 HydrophobicContact CD2-CE1 3.69Å; F1250-Y1257 HydrophobicContact CD2-CE2 4.19Å; F1250-Y1257 HydrophobicContact CD2-CG 4.11Å; F1250-Y1257 AromaticContact CD2-CZ 3.87Å; F1250-Y1257 HydrophobicContact CE2-CD2 4.45Å; F1250-Y1257 HydrophobicContact CE2-CE1 4.29Å; F1250-Y1257 HydrophobicContact CE2-CE2 4.09Å; F1250-Y1257 AromaticContact CE2-CZ 3.99Å; Y1257-I1372 HydrophobicContact CD2-CD1 3.64Å; Y1257-I1372 HydrophobicContact CG-CD1 3.82Å; Y1257-E1384 WeakPolarHBondContact OH-CA 3.44Å; Y1257-L1385 PolarHBondContact OH-N 3.47Å
1258	L	82.7	Confident	75.6	Confident	49 Å²	49	83 Å²	83	26%	0.257	40%	0.401	S	S	.	.			trans	-115	144.5	-176.4	-57.7	-179.1	0	0	0	110	V1235 L1249 N1251 P1262	V1235-L1258 HydrophobicContact CG1-CD1 4.29Å; V1235-L1258 HydrophobicContact CG2-CD1 4.1Å; L1249-L1258 HydrophobicContact CB-CB 4.37Å; L1249-L1258 HydrophobicContact CD2-CB 3.64Å; L1249-L1258 HydrophobicContact CD2-CD1 4.43Å; L1249-L1258 HydrophobicContact CG-CB 3.91Å; L1249-L1258 PolarHBondContact O-N 3.45Å; N1251-L1258 HydrophobicContact CB-CD1 4.01Å; N1251-L1258 HydrophobicContact CB-CG 4.36Å; L1258-P1262 HydrophobicContact CD1-CG 4.19Å
1259	S	72.2	Confident	75.1	Confident	87 Å²	87	83.8 Å²	83.8	61%	0.608	41%	0.406	S	S	*	.	S	Bend	trans	-83.4	-34.7	171.5	55.3	0	0	0	0	111.7	R1246	R1246-S1259 PolarHBondContact NH2-O 3.47Å
1260	R	74.7	Confident	74.4	Confident	205 Å²	205	86.4 Å²	86.4	77%	0.774	42%	0.423	S	S	*	.	S	Bend	trans	-136.5	154.4	178.5	-66.4	-175.7	-179.7	178.7	0.4	110.3
1261	R	74.9	Confident	74.1	Confident	41 Å²	41	89.5 Å²	89.5	16%	0.155	44%	0.437	C	S	.	.			trans	-64.4	134.1	175.6	-162.8	176.8	-137.3	109.5	19.2	108.4	E1237	E1237-R1261 IonicContact OE1-CZ 2.95Å; E1237-R1261 VanDerWaalsContact OE1-CZ 3.24Å; E1237-R1261 IonicContact OE1-NH1 3.26Å; E1237-R1261 PolarHBondContact OE1-NH1 3.18Å; E1237-R1261 IonicContact OE1-NH2 2.79Å; E1237-R1261 PolarHBondContact OE1-NH2 3.18Å; E1237-R1261 VanDerWaalsContact OE1-NH2 3.11Å
1262	P	69.1	Low	74.1	Confident	55 Å²	55	90.9 Å²	90.9	36%	0.357	44%	0.441	S	S	.	.			trans	-70.2	139.7	174.6	26	-24.1	0	0	0	108.8	V1235 L1258 E1264	V1235-P1262 HydrophobicContact CG2-CG 4.28Å; L1258-P1262 HydrophobicContact CD1-CG 4.19Å; P1262-E1264 VanDerWaalsContact C-N 3.26Å; P1262-E1264 HydrophobicContact CG-CG 4.34Å; P1262-E1264 PolarHBondContact O-N 3.25Å
1263	E	63.7	Low	74.3	Confident	196 Å²	196	90.6 Å²	90.6	92%	0.916	44%	0.44	S	S	*	.			trans	-72.1	87.5	167.8	-66.3	-176.1	-177.3	0	0	107	E1265	E1263-E1265 PolarHBondContact O-N 3.36Å
1264	E	54.7	Low	74.5	Confident	79 Å²	79	89.5 Å²	89.5	37%	0.369	43%	0.433	S	S	.	.			trans	-62.9	120.5	-179.4	-69.4	-178.9	-165.2	0	0	109.3	S1233 P1262	S1233-E1264 WeakPolarHBondContact CB-OE1 3.27Å; S1233-E1264 PolarHBondContact OG-OE1 3.41Å; P1262-E1264 VanDerWaalsContact C-N 3.26Å; P1262-E1264 HydrophobicContact CG-CG 4.34Å; P1262-E1264 PolarHBondContact O-N 3.25Å
1265	E	45.5	Very low	75	Confident	162 Å²	162	85.1 Å²	85.1	76%	0.757	41%	0.41	S	S	*	.			trans	-58.8	137.7	169	-70	-179.8	170.3	0	0	108.8	E1263 T1267	E1263-E1265 PolarHBondContact O-N 3.36Å; E1265-T1267 PolarHBondContact O-N 2.89Å; E1265-T1267 PolarHBondContact O-OG1 3.16Å
1266	Y	52.4	Low	75.4	Confident	217 Å²	217	81.2 Å²	81.2	85%	0.851	39%	0.392	S	S	*	.	S	Bend	trans	-53.3	17	-170.8	-58.9	-88	0	0	0	118.1
1267	T	55.4	Low	75.9	Confident	111 Å²	111	79.5 Å²	79.5	68%	0.681	38%	0.381	S	S	*	.	S	Bend	trans	-78.6	138	173.7	64	0	0	0	0	111.6	E1265 N1269	E1265-T1267 PolarHBondContact O-N 2.89Å; E1265-T1267 PolarHBondContact O-OG1 3.16Å; T1267-N1269 PolarHBondContact O-N 3.38Å
1268	F	69.3	Low	76.2	Confident	120 Å²	120	77.1 Å²	77.1	53%	0.526	37%	0.373	S	S	.	.			trans	-65.3	116.2	177.1	175.1	-97.8	0	0	0	110.7	M311 P1270	M311-F1268 HydrophobicContact CE-CB 3.49Å; M311-F1268 VanDerWaalsContact CE-CB 3.49Å; M311-F1268 HydrophobicContact CE-CG 4.13Å; F1268-P1270 WeakPolarHBondContact O-CD 3.32Å
1269	N	76.7	Confident	76.2	Confident	33 Å²	33	76.6 Å²	76.6	18%	0.176	37%	0.368	C	S	.	.			trans	-80.6	110.2	175.3	-172.7	-12.9	0	0	0	110.6	T1267 Q1271 R1272	T1267-N1269 PolarHBondContact O-N 3.38Å; N1269-Q1271 VanDerWaalsContact C-N 3.26Å; N1269-Q1271 PolarHBondContact O-N 2.91Å; N1269-Q1271 WeakPolarHBondContact OD1-CA 3.42Å; N1269-Q1271 PolarHBondContact OD1-N 3.4Å; N1269-R1272 HydrophobicContact CB-CB 4.42Å; N1269-R1272 WeakPolarHBondContact O-CB 3.47Å; N1269-R1272 WeakPolarHBondContact O-CG 3.38Å; N1269-R1272 PolarHBondContact O-N 2.86Å; N1269-R1272 PolarHBondContact OD1-N 2.99Å
1270	P	75.9	Confident	76.6	Confident	58 Å²	58	75.8 Å²	75.8	38%	0.377	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-31.4	178.2	27.2	-33.6	0	0	0	111.8	F1268 R1272 G1288 M1289	F1268-P1270 WeakPolarHBondContact O-CD 3.32Å; P1270-R1272 VanDerWaalsContact C-N 3.26Å; P1270-R1272 PolarHBondContact O-N 3.44Å; P1270-G1288 CarbonylContact O-C 3.55Å; P1270-G1288 VanDerWaalsContact O-CA 3.23Å; P1270-G1288 WeakPolarHBondContact O-CA 3.42Å; P1270-M1289 HydrophobicContact CB-CG 4.01Å; P1270-M1289 HydrophobicContact CB-SD 3.62Å; P1270-M1289 WeakPolarHBondContact O-CG 3.4Å; P1270-M1289 PolarHBondContact O-N 3.37Å
1271	Q	83	Confident	77.1	Confident	67 Å²	67	68.3 Å²	68.3	31%	0.313	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	14.1	-179.2	-65.8	178.7	-30.6	0	0	113.4	V1253 N1269 M1289	V1253-Q1271 VanDerWaalsContact CG1-OE1 3.25Å; V1253-Q1271 HydrophobicContact CG2-CB 3.7Å; N1269-Q1271 VanDerWaalsContact C-N 3.26Å; N1269-Q1271 PolarHBondContact O-N 2.91Å; N1269-Q1271 WeakPolarHBondContact OD1-CA 3.42Å; N1269-Q1271 PolarHBondContact OD1-N 3.4Å; Q1271-M1289 HydrophobicContact CG-CG 4.12Å
1272	R	91.5	Very high	77.8	Confident	47 Å²	47	67 Å²	67	18%	0.177	33%	0.329	C	S	.	.			trans	-54.1	151.5	175	72	-170.3	-178.7	-67.4	-3.5	112.2	G1232 S1233 N1269 P1270 T1274 T1287 G1288	G1232-R1272 VanDerWaalsContact O-CB 3.27Å; G1232-R1272 WeakPolarHBondContact O-CB 3.47Å; S1233-R1272 WeakPolarHBondContact O-CA 3.44Å; N1269-R1272 HydrophobicContact CB-CB 4.42Å; N1269-R1272 WeakPolarHBondContact O-CB 3.47Å; N1269-R1272 WeakPolarHBondContact O-CG 3.38Å; N1269-R1272 PolarHBondContact O-N 2.86Å; N1269-R1272 PolarHBondContact OD1-N 2.99Å; P1270-R1272 VanDerWaalsContact C-N 3.26Å; P1270-R1272 PolarHBondContact O-N 3.44Å; R1272-T1274 HydrophobicContact CG-CG2 4.29Å; R1272-T1287 CarbonylContact O-C 3.59Å; R1272-T1287 VanDerWaalsContact O-CA 3.32Å; R1272-T1287 WeakPolarHBondContact O-CA 3.48Å; R1272-G1288 PolarHBondContact O-N 2.86Å
1273	V	92.9	Very high	78.9	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	134.4	170.2	178.2	0	0	0	0	109.6	L1217 A1229 S1233 I1236 I1252 I1276 I1285	L1217-V1273 VanDerWaalsContact CD2-O 3.3Å; L1217-V1273 WeakPolarHBondContact CD2-O 3.43Å; A1229-V1273 HydrophobicContact CB-CG1 3.89Å; S1233-V1273 PolarHBondContact O-N 3.42Å; I1236-V1273 HydrophobicContact CG2-CG2 4.06Å; I1252-V1273 HydrophobicContact CD1-CG2 3.23Å; V1273-I1276 HydrophobicContact CG1-CG2 3.63Å; V1273-I1285 HydrophobicContact CB-CG2 4.48Å; V1273-I1285 HydrophobicContact CG1-CG2 3.97Å; V1273-I1285 HydrophobicContact CG2-CG2 3.97Å
1274	T	91.9	Very high	80.4	Confident	29 Å²	29	55 Å²	55	18%	0.178	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-26.2	177	50.4	0	0	0	0	112.7	R1272 G1286 T1287 P1397 I1398	R1272-T1274 HydrophobicContact CG-CG2 4.29Å; T1274-G1286 PolarHBondContact N-O 3.44Å; T1274-G1286 PolarHBondContact OG1-O 3.46Å; T1274-T1287 PolarHBondContact OG1-N 2.89Å; T1274-T1287 PolarHBondContact OG1-O 3.46Å; T1274-P1397 HydrophobicContact CG2-CB 4.1Å; T1274-I1398 VanDerWaalsContact CB-O 3.24Å; T1274-I1398 WeakPolarHBondContact CB-O 3.41Å; T1274-I1398 PolarHBondContact OG1-O 3.33Å
1275	V	93.1	Very high	82.3	Confident	19 Å²	19	51.2 Å²	51.2	12%	0.115	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	148	174.4	58.6	0	0	0	0	110.1	I1285 G1286 I1398 L1401	V1275-I1285 WeakPolarHBondContact O-CA 3.46Å; V1275-G1286 PolarHBondContact N-O 2.84Å; V1275-G1286 PolarHBondContact O-N 3.24Å; V1275-I1398 HydrophobicContact CG1-CG2 3.9Å; V1275-L1401 HydrophobicContact CG1-CB 4.31Å; V1275-L1401 HydrophobicContact CG1-CD1 3.78Å; V1275-L1401 HydrophobicContact CG1-CG 3.77Å; V1275-L1401 HydrophobicContact CG2-CB 4.11Å; V1275-L1401 HydrophobicContact CG2-CG 4.48Å
1276	I	94.5	Very high	84.6	Confident	5 Å²	5	43.5 Å²	43.5	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	139.3	175.6	51.2	165.4	0	0	0	110.1	K1218 C1220 W1227 A1229 I1236 V1273 W1284 I1285	K1218-I1276 HydrophobicContact CB-CG1 4.39Å; C1220-I1276 HydrophobicContact CB-CD1 4.33Å; C1220-I1276 PolarHBondContact SG-O 3.37Å; C1220-I1276 VanDerWaalsContact SG-O 3.39Å; W1227-I1276 HydrophobicContact CB-CD1 3.96Å; A1229-I1276 HydrophobicContact CB-CD1 4.04Å; A1229-I1276 HydrophobicContact CB-CG1 4.34Å; A1229-I1276 HydrophobicContact CB-CG2 4.17Å; I1236-I1276 HydrophobicContact CG2-CG2 4.23Å; V1273-I1276 HydrophobicContact CG1-CG2 3.63Å; I1276-W1284 CarbonylContact C-O 3.49Å; I1276-W1284 WeakPolarHBondContact CA-O 3.44Å; I1276-I1285 HydrophobicContact CG2-CG1 4.44Å; I1276-I1285 HydrophobicContact CG2-CG2 4.49Å
1277	L	93.9	Very high	86.5	Confident	23 Å²	23	33.3 Å²	33.3	12%	0.12	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	96.7	178	-178	72.1	0	0	0	109.8	W1284 L1401 M1403 I1413	L1277-W1284 HydrophobicContact CB-CB 4.15Å; L1277-W1284 PolarHBondContact N-O 2.86Å; L1277-W1284 WeakPolarHBondContact O-CB 3.48Å; L1277-W1284 PolarHBondContact O-N 3.48Å; L1277-L1401 HydrophobicContact CB-CB 3.9Å; L1277-L1401 HydrophobicContact CB-CD1 4.4Å; L1277-L1401 HydrophobicContact CD2-CB 3.93Å; L1277-M1403 HydrophobicContact CD1-CG 3.96Å; L1277-M1403 HydrophobicContact CD2-CB 4Å; L1277-M1403 HydrophobicContact CD2-CG 4Å; L1277-M1403 HydrophobicContact CG-CG 4.31Å; L1277-I1413 HydrophobicContact CD2-CG2 4.39Å
1278	P	92	Very high	88.1	Confident	14 Å²	14	28.4 Å²	28.4	9%	0.091	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	136.6	171.6	31.4	-33.6	0	0	0	110.4	C1220 L1221 W1227 L1283	C1220-P1278 HydrophobicContact CB-CG 3.89Å; L1221-P1278 WeakPolarHBondContact O-CG 3.42Å; W1227-P1278 HydrophobicContact CG-CB 4.38Å; P1278-L1283 HydrophobicContact CB-CD1 4.03Å
1279	Y	83.8	Confident	88.9	Confident	39 Å²	39	26.3 Å²	26.3	15%	0.153	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	125.3	176.2	174.3	-98.6	0	0	0	111	N1281 T1282 M1403 I1411	Y1279-N1281 PolarHBondContact O-N 3.14Å; Y1279-T1282 PolarHBondContact N-O 2.86Å; Y1279-T1282 CarbonylContact O-C 3.57Å; Y1279-T1282 WeakPolarHBondContact O-CA 3.49Å; Y1279-T1282 PolarHBondContact O-N 2.94Å; Y1279-T1282 PolarHBondContact O-OG1 3.22Å; Y1279-M1403 HydrophobicContact CD2-CE 4.42Å; Y1279-M1403 HydrophobicContact CD2-SD 3.43Å; Y1279-M1403 WeakPolarHBondContact CD2-SD 3.37Å; Y1279-M1403 HydrophobicContact CE2-SD 4.06Å; Y1279-M1403 HydrophobicContact CG-SD 4.25Å; Y1279-I1411 HydrophobicContact CE1-CD1 3.41Å; Y1279-I1411 VanDerWaalsContact CE1-CD1 3.41Å; Y1279-I1411 HydrophobicContact CE1-CG1 3.9Å; Y1279-I1411 HydrophobicContact CE1-CG2 4.36Å; Y1279-I1411 HydrophobicContact CE2-CG1 4.33Å; Y1279-I1411 HydrophobicContact CE2-CG2 4.45Å; Y1279-I1411 VanDerWaalsContact CZ-CD1 3.46Å; Y1279-I1411 WeakPolarHBondContact OH-CD1 3.44Å; Y1279-I1411 WeakPolarHBondContact OH-CG1 3.46Å
1280	D	80.7	Confident	89.4	Confident	70 Å²	70	24.8 Å²	24.8	37%	0.374	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	-129.9	-175.8	-175.1	-0	0	0	0	109.1	D1223 T1282	D1223-D1280 WeakPolarHBondContact OD2-CA 3.44Å; D1280-T1282 VanDerWaalsContact C-N 3.26Å; D1280-T1282 PolarHBondContact O-N 3.08Å
1281	N	84.6	Confident	90.1	Very high	48 Å²	48	23 Å²	23	26%	0.257	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	30.1	174	-65	-67.2	0	0	0	112.2	Y1279 Q1296 I1297	Y1279-N1281 PolarHBondContact O-N 3.14Å; N1281-Q1296 CarbonylContact O-C 3.57Å; N1281-Q1296 WeakPolarHBondContact O-CA 3.46Å; N1281-Q1296 PolarHBondContact O-NE2 2.96Å; N1281-I1297 PolarHBondContact O-N 3.37Å
1282	T	88.6	Confident	90.5	Very high	12 Å²	12	19.9 Å²	19.9	7%	0.074	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.9	176.2	65.4	0	0	0	0	112.2	Y1279 D1280 W1284 Y1295	Y1279-T1282 PolarHBondContact N-O 2.86Å; Y1279-T1282 CarbonylContact O-C 3.57Å; Y1279-T1282 WeakPolarHBondContact O-CA 3.49Å; Y1279-T1282 PolarHBondContact O-N 2.94Å; Y1279-T1282 PolarHBondContact O-OG1 3.22Å; D1280-T1282 VanDerWaalsContact C-N 3.26Å; D1280-T1282 PolarHBondContact O-N 3.08Å; T1282-W1284 PolarHBondContact OG1-NE1 3.03Å; T1282-Y1295 CarbonylContact C-O 3.43Å; T1282-Y1295 WeakPolarHBondContact CA-O 3.48Å
1283	L	93.3	Very high	90.5	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	116.9	171.8	178.7	66.8	0	0	0	109	W1227 I1236 P1278 I1285 V1294 Y1295 I1297 L1385	W1227-L1283 HydrophobicContact CD2-CD1 4.08Å; W1227-L1283 HydrophobicContact CD2-CD2 4.06Å; W1227-L1283 HydrophobicContact CE3-CD2 3.76Å; W1227-L1283 HydrophobicContact CG-CD1 4.22Å; W1227-L1283 HydrophobicContact CH2-CD2 3.84Å; W1227-L1283 HydrophobicContact CZ2-CD2 4.11Å; W1227-L1283 HydrophobicContact CZ3-CD2 3.65Å; I1236-L1283 HydrophobicContact CD1-CD2 3.4Å; P1278-L1283 HydrophobicContact CB-CD1 4.03Å; L1283-I1285 HydrophobicContact CD2-CD1 4Å; L1283-I1285 HydrophobicContact CD2-CG1 4.32Å; L1283-I1285 HydrophobicContact CG-CD1 4.24Å; L1283-I1285 HydrophobicContact CG-CG1 4.03Å; L1283-V1294 WeakPolarHBondContact O-CA 3.37Å; L1283-Y1295 PolarHBondContact N-O 2.67Å; L1283-Y1295 PolarHBondContact O-N 3.32Å; L1283-I1297 HydrophobicContact CB-CD1 4.23Å; L1283-I1297 HydrophobicContact CB-CG1 4.47Å; L1283-L1385 HydrophobicContact CD2-CD2 4.35Å
1284	W	94.1	Very high	90.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	136.9	176.7	-66.9	67	0	0	0	110.1	I1276 L1277 T1282 V1292 L1293 V1294 L1401 I1413 W1429 W1439	I1276-W1284 CarbonylContact C-O 3.49Å; I1276-W1284 WeakPolarHBondContact CA-O 3.44Å; L1277-W1284 HydrophobicContact CB-CB 4.15Å; L1277-W1284 PolarHBondContact N-O 2.86Å; L1277-W1284 WeakPolarHBondContact O-CB 3.48Å; L1277-W1284 PolarHBondContact O-N 3.48Å; T1282-W1284 PolarHBondContact OG1-NE1 3.03Å; W1284-V1292 HydrophobicContact CE3-CG1 3.68Å; W1284-V1292 HydrophobicContact CZ3-CG1 3.94Å; W1284-L1293 CarbonylContact C-O 3.57Å; W1284-L1293 WeakPolarHBondContact CA-O 3.44Å; W1284-V1294 HydrophobicContact CD2-CB 4.41Å; W1284-V1294 HydrophobicContact CD2-CG1 4.1Å; W1284-V1294 HydrophobicContact CD2-CG2 3.5Å; W1284-V1294 HydrophobicContact CE3-CG2 3.44Å; W1284-V1294 VanDerWaalsContact CE3-CG2 3.44Å; W1284-V1294 HydrophobicContact CG-CG1 4.28Å; W1284-V1294 HydrophobicContact CG-CG2 4.19Å; W1284-V1294 HydrophobicContact CH2-CG2 3.79Å; W1284-V1294 HydrophobicContact CZ2-CG1 4.12Å; W1284-V1294 HydrophobicContact CZ2-CG2 3.84Å; W1284-V1294 HydrophobicContact CZ3-CG2 3.58Å; W1284-L1401 HydrophobicContact CB-CD1 3.99Å; W1284-I1413 HydrophobicContact CD2-CD1 4.07Å; W1284-I1413 VanDerWaalsContact CE2-CD1 3.43Å; W1284-I1413 HydrophobicContact CE3-CG2 4.22Å; W1284-I1413 HydrophobicContact CH2-CD1 4.02Å; W1284-I1413 HydrophobicContact CZ2-CD1 3.41Å; W1284-I1413 VanDerWaalsContact CZ2-CD1 3.41Å; W1284-I1413 HydrophobicContact CZ3-CG2 4.26Å; W1284-W1429 HydrophobicContact CH2-CB 4.22Å; W1284-W1429 HydrophobicContact CH2-CD2 4.14Å; W1284-W1429 HydrophobicContact CH2-CE3 4.04Å; W1284-W1429 HydrophobicContact CH2-CG 4.24Å; W1284-W1429 HydrophobicContact CZ3-CB 4.45Å; W1284-W1429 AromaticContact CZ3-CD2 3.76Å; W1284-W1429 HydrophobicContact CZ3-CD2 3.76Å; W1284-W1429 AromaticContact CZ3-CE3 3.92Å; W1284-W1429 HydrophobicContact CZ3-CE3 3.92Å; W1284-W1429 HydrophobicContact CZ3-CG 4Å; W1284-W1429 HydrophobicContact CZ3-CZ3 4.47Å; W1284-W1439 HydrophobicContact CH2-CB 4.34Å; W1284-W1439 AromaticContact CH2-CD2 3.65Å; W1284-W1439 HydrophobicContact CH2-CD2 3.65Å; W1284-W1439 AromaticContact CH2-CE3 3.73Å; W1284-W1439 HydrophobicContact CH2-CE3 3.73Å; W1284-W1439 AromaticContact CH2-CG 3.93Å; W1284-W1439 HydrophobicContact CH2-CG 3.93Å; W1284-W1439 HydrophobicContact CH2-CZ3 4.25Å; W1284-W1439 AromaticContact CZ2-CD2 3.56Å; W1284-W1439 HydrophobicContact CZ2-CD2 3.56Å; W1284-W1439 AromaticContact CZ2-CE2 3.53Å; W1284-W1439 AromaticContact CZ2-CE3 3.85Å; W1284-W1439 HydrophobicContact CZ2-CE3 3.85Å; W1284-W1439 HydrophobicContact CZ2-CG 4.05Å; W1284-W1439 HydrophobicContact CZ2-CH2 4.03Å; W1284-W1439 AromaticContact CZ2-CZ2 3.78Å; W1284-W1439 HydrophobicContact CZ2-CZ2 3.78Å; W1284-W1439 HydrophobicContact CZ2-CZ3 4.07Å; W1284-W1439 AromaticContact CZ2-NE1 3.94Å
1285	I	94.7	Very high	90.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	125	-174.4	-51.3	-176.1	0	0	0	108.7	I1236 I1252 V1273 V1275 I1276 L1283 V1292 L1293 Y1295	I1236-I1285 HydrophobicContact CD1-CD1 3.83Å; I1252-I1285 HydrophobicContact CD1-CD1 3.5Å; I1252-I1285 VanDerWaalsContact CD1-CD1 3.5Å; I1252-I1285 HydrophobicContact CD1-CG2 4.07Å; I1252-I1285 HydrophobicContact CG1-CD1 3.87Å; V1273-I1285 HydrophobicContact CB-CG2 4.48Å; V1273-I1285 HydrophobicContact CG1-CG2 3.97Å; V1273-I1285 HydrophobicContact CG2-CG2 3.97Å; V1275-I1285 WeakPolarHBondContact O-CA 3.46Å; I1276-I1285 HydrophobicContact CG2-CG1 4.44Å; I1276-I1285 HydrophobicContact CG2-CG2 4.49Å; L1283-I1285 HydrophobicContact CD2-CD1 4Å; L1283-I1285 HydrophobicContact CD2-CG1 4.32Å; L1283-I1285 HydrophobicContact CG-CD1 4.24Å; L1283-I1285 HydrophobicContact CG-CG1 4.03Å; I1285-V1292 WeakPolarHBondContact O-CA 3.39Å; I1285-L1293 HydrophobicContact CB-CB 4.28Å; I1285-L1293 PolarHBondContact N-O 3.37Å; I1285-L1293 PolarHBondContact O-N 3.01Å; I1285-Y1295 HydrophobicContact CD1-CD2 3.93Å; I1285-Y1295 HydrophobicContact CD1-CE2 3.91Å
1286	G	93.7	Very high	90.2	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	140.8	166.6	0	0	0	0	0	110.5	T1274 V1275 E1291	T1274-G1286 PolarHBondContact N-O 3.44Å; T1274-G1286 PolarHBondContact OG1-O 3.46Å; V1275-G1286 PolarHBondContact N-O 2.84Å; V1275-G1286 PolarHBondContact O-N 3.24Å; G1286-E1291 WeakPolarHBondContact CA-O 3.2Å
1287	T	93.6	Very high	90	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.012	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	161	179.3	76.9	0	0	0	0	113.1	R1272 T1274 M1289 G1290 E1291 L1293 I1398	R1272-T1287 CarbonylContact O-C 3.59Å; R1272-T1287 VanDerWaalsContact O-CA 3.32Å; R1272-T1287 WeakPolarHBondContact O-CA 3.48Å; T1274-T1287 PolarHBondContact OG1-N 2.89Å; T1274-T1287 PolarHBondContact OG1-O 3.46Å; T1287-M1289 PolarHBondContact O-N 3.04Å; T1287-M1289 VanDerWaalsContact O-N 3.15Å; T1287-M1289 PolarHBondContact OG1-N 3.48Å; T1287-G1290 PolarHBondContact O-N 3.29Å; T1287-E1291 HydrophobicContact CG2-CB 4.28Å; T1287-E1291 PolarHBondContact N-O 3.1Å; T1287-E1291 WeakPolarHBondContact OG1-CB 3.45Å; T1287-E1291 PolarHBondContact OG1-N 2.99Å; T1287-E1291 VanDerWaalsContact OG1-N 3.17Å; T1287-L1293 HydrophobicContact CG2-CD1 3.86Å; T1287-L1293 HydrophobicContact CG2-CG 4.18Å; T1287-I1398 PolarHBondContact O-N 2.95Å
1288	G	88.5	Confident	89.6	Confident	8 Å²	8	18 Å²	18	8%	0.082	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-18.9	171.8	0	0	0	0	0	114.6	P1270 R1272 P1397	P1270-G1288 CarbonylContact O-C 3.55Å; P1270-G1288 VanDerWaalsContact O-CA 3.23Å; P1270-G1288 WeakPolarHBondContact O-CA 3.42Å; R1272-G1288 PolarHBondContact O-N 2.86Å; G1288-P1397 WeakPolarHBondContact O-CB 3.37Å; G1288-P1397 WeakPolarHBondContact O-CG 3.46Å
1289	M	86.8	Confident	89.1	Confident	77 Å²	77	18.5 Å²	18.5	38%	0.379	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	6.4	175.7	-73	-59.6	-75.3	0	0	113	P1270 Q1271 T1287 E1291 K1392	P1270-M1289 HydrophobicContact CB-CG 4.01Å; P1270-M1289 HydrophobicContact CB-SD 3.62Å; P1270-M1289 WeakPolarHBondContact O-CG 3.4Å; P1270-M1289 PolarHBondContact O-N 3.37Å; Q1271-M1289 HydrophobicContact CG-CG 4.12Å; T1287-M1289 PolarHBondContact O-N 3.04Å; T1287-M1289 VanDerWaalsContact O-N 3.15Å; T1287-M1289 PolarHBondContact OG1-N 3.48Å; M1289-E1291 VanDerWaalsContact C-N 3.33Å; M1289-E1291 HydrophobicContact CB-CG 4.44Å; M1289-K1392 WeakPolarHBondContact O-CD 3.41Å; M1289-K1392 PolarHBondContact O-NZ 3.42Å
1290	G	85.8	Confident	88.7	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	73.5	25	-177.7	0	0	0	0	0	113.6	T1287 V1393 A1394 T1396	T1287-G1290 PolarHBondContact O-N 3.29Å; G1290-V1393 PolarHBondContact O-N 3.27Å; G1290-A1394 WeakPolarHBondContact CA-O 3.39Å; G1290-A1394 PolarHBondContact O-N 3.38Å; G1290-T1396 WeakPolarHBondContact CA-O 3.49Å
1291	E	91.3	Very high	88.2	Confident	22 Å²	22	18.9 Å²	18.9	10%	0.103	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	142.6	171.3	-56.9	179.4	120.5	0	0	110.6	G1286 T1287 M1289 L1293 R1390 S1391 K1392	G1286-E1291 WeakPolarHBondContact CA-O 3.2Å; T1287-E1291 HydrophobicContact CG2-CB 4.28Å; T1287-E1291 PolarHBondContact N-O 3.1Å; T1287-E1291 WeakPolarHBondContact OG1-CB 3.45Å; T1287-E1291 PolarHBondContact OG1-N 2.99Å; T1287-E1291 VanDerWaalsContact OG1-N 3.17Å; M1289-E1291 VanDerWaalsContact C-N 3.33Å; M1289-E1291 HydrophobicContact CB-CG 4.44Å; E1291-L1293 HydrophobicContact CB-CD2 4.42Å; E1291-R1390 IonicContact OE1-CZ 3.83Å; E1291-R1390 VanDerWaalsContact OE1-CZ 3.29Å; E1291-R1390 IonicContact OE1-NE 3.75Å; E1291-R1390 PolarHBondContact OE1-NE 2.95Å; E1291-R1390 IonicContact OE1-NH2 2.69Å; E1291-R1390 PolarHBondContact OE1-NH2 3.25Å; E1291-R1390 IonicContact OE2-CZ 3.33Å; E1291-R1390 IonicContact OE2-NE 2.65Å; E1291-R1390 IonicContact OE2-NH2 2.81Å; E1291-R1390 PolarHBondContact OE2-NH2 3.48Å; E1291-S1391 CarbonylContact C-O 3.5Å; E1291-S1391 VanDerWaalsContact CA-O 3.3Å; E1291-S1391 WeakPolarHBondContact CA-O 3.46Å; E1291-K1392 HydrophobicContact CG-CB 4.23Å; E1291-K1392 HydrophobicContact CG-CD 3.96Å
1292	V	91.5	Very high	87.2	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	120.9	165.1	177.2	0	0	0	0	108.1	W1284 I1285 V1294 S1391 V1393 I1398 W1429	W1284-V1292 HydrophobicContact CE3-CG1 3.68Å; W1284-V1292 HydrophobicContact CZ3-CG1 3.94Å; I1285-V1292 WeakPolarHBondContact O-CA 3.39Å; V1292-V1294 HydrophobicContact CG1-CG2 4.44Å; V1292-S1391 PolarHBondContact N-O 2.86Å; V1292-S1391 PolarHBondContact O-N 2.65Å; V1292-V1393 HydrophobicContact CG2-CG2 3.73Å; V1292-I1398 HydrophobicContact CG2-CD1 4.21Å; V1292-I1398 HydrophobicContact CG2-CG1 3.99Å; V1292-I1398 HydrophobicContact CG2-CG2 4.33Å; V1292-W1429 HydrophobicContact CB-CH2 4.15Å; V1292-W1429 HydrophobicContact CB-CZ2 3.86Å; V1292-W1429 HydrophobicContact CG1-CH2 4.24Å; V1292-W1429 HydrophobicContact CG1-CZ2 3.97Å; V1292-W1429 HydrophobicContact CG2-CZ2 3.92Å
1293	L	91.8	Very high	85.3	Confident	8 Å²	8	21.5 Å²	21.5	4%	0.042	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136.3	176.8	-50.3	175.7	0	0	0	108.9	I1252 W1284 I1285 T1287 E1291 Y1295 V1389 R1390	I1252-L1293 HydrophobicContact CG2-CD1 3.21Å; W1284-L1293 CarbonylContact C-O 3.57Å; W1284-L1293 WeakPolarHBondContact CA-O 3.44Å; I1285-L1293 HydrophobicContact CB-CB 4.28Å; I1285-L1293 PolarHBondContact N-O 3.37Å; I1285-L1293 PolarHBondContact O-N 3.01Å; T1287-L1293 HydrophobicContact CG2-CD1 3.86Å; T1287-L1293 HydrophobicContact CG2-CG 4.18Å; E1291-L1293 HydrophobicContact CB-CD2 4.42Å; L1293-Y1295 HydrophobicContact CB-CD2 4.49Å; L1293-Y1295 HydrophobicContact CB-CE2 3.95Å; L1293-Y1295 HydrophobicContact CD1-CE2 4.4Å; L1293-V1389 WeakPolarHBondContact CA-O 3.39Å; L1293-R1390 HydrophobicContact CD2-CB 3.8Å; L1293-R1390 HydrophobicContact CD2-CG 3.55Å
1294	V	90.9	Very high	82.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.9	175.2	-169.5	0	0	0	0	108.6	L1283 W1284 V1292 I1388 V1389	L1283-V1294 WeakPolarHBondContact O-CA 3.37Å; W1284-V1294 HydrophobicContact CD2-CB 4.41Å; W1284-V1294 HydrophobicContact CD2-CG1 4.1Å; W1284-V1294 HydrophobicContact CD2-CG2 3.5Å; W1284-V1294 HydrophobicContact CE3-CG2 3.44Å; W1284-V1294 VanDerWaalsContact CE3-CG2 3.44Å; W1284-V1294 HydrophobicContact CG-CG1 4.28Å; W1284-V1294 HydrophobicContact CG-CG2 4.19Å; W1284-V1294 HydrophobicContact CH2-CG2 3.79Å; W1284-V1294 HydrophobicContact CZ2-CG1 4.12Å; W1284-V1294 HydrophobicContact CZ2-CG2 3.84Å; W1284-V1294 HydrophobicContact CZ3-CG2 3.58Å; V1292-V1294 HydrophobicContact CG1-CG2 4.44Å; V1294-I1388 HydrophobicContact CB-CD1 4.38Å; V1294-I1388 HydrophobicContact CB-CG1 4Å; V1294-I1388 HydrophobicContact CG1-CD1 3.81Å; V1294-I1388 HydrophobicContact CG1-CG1 3.91Å; V1294-I1388 WeakPolarHBondContact O-CG1 3.31Å; V1294-I1388 PolarHBondContact O-N 3.43Å; V1294-V1389 HydrophobicContact CB-CB 3.82Å; V1294-V1389 HydrophobicContact CB-CG2 4.16Å; V1294-V1389 HydrophobicContact CG2-CB 3.82Å; V1294-V1389 HydrophobicContact CG2-CG1 4.38Å; V1294-V1389 HydrophobicContact CG2-CG2 4.27Å; V1294-V1389 PolarHBondContact N-O 3.46Å; V1294-V1389 PolarHBondContact O-N 3.5Å
1295	Y	91.4	Very high	80.1	Confident	1 Å²	1	40 Å²	40	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.7	175.6	-71.3	-95	0	0	0	109.9	F1250 I1252 T1282 L1283 I1285 L1293 L1385 Q1386 K1387	F1250-Y1295 HydrophobicContact CE1-CD1 4.37Å; F1250-Y1295 AromaticContact CE1-CE1 3.69Å; F1250-Y1295 HydrophobicContact CE1-CE1 3.69Å; F1250-Y1295 AromaticContact CE1-CZ 3.91Å; F1250-Y1295 AromaticContact CZ-CE1 3.89Å; F1250-Y1295 HydrophobicContact CZ-CE1 3.89Å; I1252-Y1295 HydrophobicContact CG2-CE2 4.23Å; T1282-Y1295 CarbonylContact C-O 3.43Å; T1282-Y1295 WeakPolarHBondContact CA-O 3.48Å; L1283-Y1295 PolarHBondContact N-O 2.67Å; L1283-Y1295 PolarHBondContact O-N 3.32Å; I1285-Y1295 HydrophobicContact CD1-CD2 3.93Å; I1285-Y1295 HydrophobicContact CD1-CE2 3.91Å; L1293-Y1295 HydrophobicContact CB-CD2 4.49Å; L1293-Y1295 HydrophobicContact CB-CE2 3.95Å; L1293-Y1295 HydrophobicContact CD1-CE2 4.4Å; Y1295-L1385 HydrophobicContact CD1-CB 3.96Å; Y1295-L1385 HydrophobicContact CG-CD2 4.37Å; Y1295-Q1386 CarbonylContact C-O 3.53Å; Y1295-Q1386 WeakPolarHBondContact CA-O 3.48Å; Y1295-K1387 HydrophobicContact CD1-CB 3.84Å; Y1295-K1387 HydrophobicContact CE1-CB 3.54Å; Y1295-K1387 HydrophobicContact CE1-CD 4.43Å; Y1295-K1387 HydrophobicContact CE1-CG 4.11Å
1296	Q	89.5	Confident	77.2	Confident	54 Å²	54	49.8 Å²	49.8	25%	0.252	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	125.1	165.6	-173.7	69.9	41	0	0	108.9	N1281 H1298 Q1386 I1388	N1281-Q1296 CarbonylContact O-C 3.57Å; N1281-Q1296 WeakPolarHBondContact O-CA 3.46Å; N1281-Q1296 PolarHBondContact O-NE2 2.96Å; Q1296-H1298 VanDerWaalsContact CG-CE1 3.48Å; Q1296-H1298 WeakPolarHBondContact CG-CE1 3.38Å; Q1296-Q1386 PolarHBondContact N-O 2.89Å; Q1296-Q1386 PolarHBondContact O-N 3.04Å; Q1296-I1388 HydrophobicContact CB-CD1 4.42Å; Q1296-I1388 HydrophobicContact CB-CG2 3.79Å
1297	I	89.3	Confident	74.3	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	121.2	177.4	-51.3	164.1	0	0	0	108.2	W1227 N1281 L1283 Y1383 L1385	W1227-I1297 HydrophobicContact CZ2-CD1 3.84Å; W1227-I1297 HydrophobicContact CZ2-CG1 4.45Å; N1281-I1297 PolarHBondContact O-N 3.37Å; L1283-I1297 HydrophobicContact CB-CD1 4.23Å; L1283-I1297 HydrophobicContact CB-CG1 4.47Å; I1297-Y1383 HydrophobicContact CG2-CD1 4.06Å; I1297-L1385 HydrophobicContact CG1-CD2 3.84Å
1298	H	85	Confident	71.3	Confident	18 Å²	18	65 Å²	65	8%	0.083	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124	174.3	-65.2	88	0	0	0	109.5	Q1296 Y1300 R1317 Y1383 E1384 Q1386	Q1296-H1298 VanDerWaalsContact CG-CE1 3.48Å; Q1296-H1298 WeakPolarHBondContact CG-CE1 3.38Å; H1298-Y1300 HydrophobicContact CB-CE2 3.83Å; H1298-R1317 PolarHBondContact CD2-NH2 2.82Å; H1298-R1317 PolarHBondContact NE2-NH2 3.45Å; H1298-Y1383 CarbonylContact O-C 3.59Å; H1298-Y1383 VanDerWaalsContact O-CA 3.31Å; H1298-Y1383 WeakPolarHBondContact O-CA 3.3Å; H1298-E1384 HydrophobicContact CB-CB 4.16Å; H1298-E1384 PolarHBondContact N-O 2.82Å; H1298-E1384 PolarHBondContact O-N 3.33Å; H1298-Q1386 PolarHBondContact CE1-OE1 3.33Å
1299	T	81.5	Confident	69.1	Low	24 Å²	24	73.5 Å²	73.5	15%	0.147	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.2	-179.2	-50	0	0	0	0	110.1	H1318 Y1381 Y1383	T1299-H1318 PolarHBondContact O-N 3.33Å; T1299-Y1381 HydrophobicContact CG2-CD1 3.85Å; T1299-Y1381 HydrophobicContact CG2-CG 4.1Å; T1299-Y1383 HydrophobicContact CG2-CD1 3.92Å; T1299-Y1383 HydrophobicContact CG2-CE1 3.49Å; T1299-Y1383 VanDerWaalsContact CG2-CE1 3.49Å; T1299-Y1383 WeakPolarHBondContact OG1-CD1 3.47Å; T1299-Y1383 WeakPolarHBondContact OG1-CE1 3.46Å
1300	Y	75.8	Confident	66.6	Low	49 Å²	49	78 Å²	78	19%	0.192	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.1	179	-57.4	-85.8	0	0	0	109.9	H1298 M1315 R1317 Y1381 I1382 E1384	H1298-Y1300 HydrophobicContact CB-CE2 3.83Å; Y1300-M1315 HydrophobicContact CD2-CE 4.41Å; Y1300-M1315 HydrophobicContact CG-CE 3.94Å; Y1300-R1317 HydrophobicContact CD1-CB 4.27Å; Y1300-R1317 HydrophobicContact CE1-CB 4.25Å; Y1300-R1317 HydrophobicContact CE1-CG 4.37Å; Y1300-Y1381 CarbonylContact O-C 3.5Å; Y1300-Y1381 WeakPolarHBondContact O-CA 3.43Å; Y1300-I1382 PolarHBondContact N-O 3.48Å; Y1300-I1382 PolarHBondContact O-N 2.98Å; Y1300-E1384 HydrophobicContact CE2-CB 3.89Å; Y1300-E1384 VanDerWaalsContact CE2-OE2 3.26Å; Y1300-E1384 WeakPolarHBondContact CE2-OE2 3.3Å; Y1300-E1384 PolarHBondContact OH-OE2 3.31Å
1301	Q	71.2	Confident	64.1	Low	69 Å²	69	82 Å²	82	32%	0.322	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.3	175.2	-170.6	174.9	-7	0	0	109.7	T1303 T1316 H1318 Y1381	Q1301-T1303 PolarHBondContact O-N 3.06Å; Q1301-T1316 PolarHBondContact N-O 3.27Å; Q1301-H1318 PolarHBondContact OE1-CD2 3Å; Q1301-Y1381 HydrophobicContact CB-CD1 4.04Å; Q1301-Y1381 HydrophobicContact CB-CE1 3.89Å; Q1301-Y1381 HydrophobicContact CG-CD1 4.27Å; Q1301-Y1381 HydrophobicContact CG-CE1 3.87Å
1302	K	63.3	Low	61.2	Low	51 Å²	51	86.7 Å²	86.7	22%	0.222	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	116.6	170.2	-68.9	177.6	-175.8	160.6	0	108.6	A1376 S1379 N1380 I1382	K1302-A1376 PolarHBondContact NZ-O 3.33Å; K1302-S1379 WeakPolarHBondContact CE-O 3.44Å; K1302-S1379 PolarHBondContact NZ-O 2.88Å; K1302-N1380 PolarHBondContact N-O 3.47Å; K1302-I1382 HydrophobicContact CD-CD1 4.4Å; K1302-I1382 HydrophobicContact CG-CD1 3.98Å; K1302-I1382 HydrophobicContact CG-CG1 4.34Å
1303	T	47.9	Very low	58.5	Low	64 Å²	64	92 Å²	92	39%	0.393	47%	0.474	S	S	.	.			trans	-90.1	113.2	170	49.6	0	0	0	0	109.8	Q1301 K1305 Q1314	Q1301-T1303 PolarHBondContact O-N 3.06Å; T1303-K1305 PolarHBondContact O-N 2.98Å; T1303-Q1314 PolarHBondContact OG1-O 2.93Å; T1303-Q1314 VanDerWaalsContact OG1-O 3.06Å
1304	E	41	Very low	55.6	Low	194 Å²	194	98.8 Å²	98.8	91%	0.907	51%	0.505	S	S	*	.			trans	-72.8	108.6	167.1	-68.8	-176.9	170.8	0	0	109
1305	K	37.4	Very low	52.9	Low	195 Å²	195	102.2 Å²	102.2	85%	0.848	52%	0.522	S	S	*	.			trans	-114.5	134.2	162.2	-93.3	-168.9	176.5	-179.9	0	111	T1303 K1307	T1303-K1305 PolarHBondContact O-N 2.98Å; K1305-K1307 PolarHBondContact O-N 3.39Å
1306	K	35	Very low	50.3	Low	204 Å²	204	105.6 Å²	105.6	89%	0.887	54%	0.543	S	S	*	.			trans	-42.1	125.3	-179.5	-71	176.8	173.9	178.6	0	111.6	S1308	K1306-S1308 PolarHBondContact O-N 3.03Å
1307	K	32.5	Very low	47.6	Very low	223 Å²	223	110.6 Å²	110.6	97%	0.97	56%	0.56	S	S	*	*			trans	-16	90.4	170.2	-68.1	179.8	176	-179.8	0	113.7	K1305	K1305-K1307 PolarHBondContact O-N 3.39Å
1308	S	30.3	Very low	45.1	Very low	98 Å²	98	113.8 Å²	113.8	69%	0.685	57%	0.574	S	S	*	*			trans	-107.8	138.4	154.5	53.4	0	0	0	0	107.7	K1306 E1310	K1306-S1308 PolarHBondContact O-N 3.03Å; S1308-E1310 PolarHBondContact O-N 3.02Å
1309	L	42.5	Very low	42.7	Very low	187 Å²	187	121.6 Å²	121.6	98%	0.979	61%	0.608	S	S	*	*	S	Bend	trans	-69.4	12.8	-155.3	-147.1	79.2	0	0	0	116.6
1310	E	34.3	Very low	40.1	Very low	171 Å²	171	128 Å²	128	80%	0.799	63%	0.63	S	S	*	*	S	Bend	trans	-127.6	100.1	176.9	-71.7	179.8	169.1	0	0	108.3	S1308 T1312	S1308-E1310 PolarHBondContact O-N 3.02Å; E1310-T1312 PolarHBondContact O-N 2.88Å
1311	G	32.2	Very low	37.7	Very low	86 Å²	86	131.6 Å²	131.6	89%	0.887	66%	0.662	S	S	*	*			trans	-72.1	58.6	-167.7	0	0	0	0	0	115
1312	T	30.5	Very low	35.7	Very low	119 Å²	119	133.1 Å²	133.1	73%	0.73	68%	0.676	S	S	*	*			trans	-93.1	110.3	167.9	-46	0	0	0	0	109.3	E1310 Q1314	E1310-T1312 PolarHBondContact O-N 2.88Å; T1312-Q1314 PolarHBondContact O-N 3.02Å; T1312-Q1314 VanDerWaalsContact O-N 3.08Å
1313	I	34.6	Very low	34	Very low	111 Å²	111	135.9 Å²	135.9	57%	0.569	70%	0.701	S	S	*	*			trans	-65.4	107.3	173.1	-59.4	172.1	0	0	0	107.5	M1315	I1313-M1315 HydrophobicContact CG2-CG 4.29Å; I1313-M1315 HydrophobicContact CG2-SD 3.93Å
1314	Q	30.8	Very low	33.1	Very low	151 Å²	151	139.8 Å²	139.8	71%	0.706	72%	0.719	S	S	*	*			trans	-78.5	127.7	169.1	-80.2	-173.2	-12.9	0	0	109.7	T1303 T1312	T1303-Q1314 PolarHBondContact OG1-O 2.93Å; T1303-Q1314 VanDerWaalsContact OG1-O 3.06Å; T1312-Q1314 PolarHBondContact O-N 3.02Å; T1312-Q1314 VanDerWaalsContact O-N 3.08Å
1315	M	34.1	Very low	32.5	Very low	72 Å²	72	137.6 Å²	137.6	36%	0.355	71%	0.707	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.9	124.7	-179.2	-66.1	-70.9	-79.6	0	0	108.3	Y1300 I1313 I1382	Y1300-M1315 HydrophobicContact CD2-CE 4.41Å; Y1300-M1315 HydrophobicContact CG-CE 3.94Å; I1313-M1315 HydrophobicContact CG2-CG 4.29Å; I1313-M1315 HydrophobicContact CG2-SD 3.93Å; M1315-I1382 HydrophobicContact CE-CB 3.73Å; M1315-I1382 HydrophobicContact CE-CD1 3.32Å; M1315-I1382 HydrophobicContact CE-CG1 4Å; M1315-I1382 HydrophobicContact CE-CG2 4.17Å; M1315-I1382 HydrophobicContact SD-CD1 3.9Å
1316	T	37.2	Very low	32.3	Very low	73 Å²	73	136.1 Å²	136.1	45%	0.448	71%	0.708	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.3	126.9	171.6	49.5	0	0	0	0	109.2	Q1301 H1318	Q1301-T1316 PolarHBondContact N-O 3.27Å; T1316-H1318 PolarHBondContact O-N 3.43Å; T1316-H1318 VanDerWaalsContact O-N 3.17Å
1317	R	33.7	Very low	32.2	Very low	158 Å²	158	134.4 Å²	134.4	60%	0.596	70%	0.703	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-64.4	116.2	174.7	-172.8	175.5	-179.1	163.1	4.2	107.8	H1298 Y1300 K1319	H1298-R1317 PolarHBondContact CD2-NH2 2.82Å; H1298-R1317 PolarHBondContact NE2-NH2 3.45Å; Y1300-R1317 HydrophobicContact CD1-CB 4.27Å; Y1300-R1317 HydrophobicContact CE1-CB 4.25Å; Y1300-R1317 HydrophobicContact CE1-CG 4.37Å; R1317-K1319 PolarHBondContact O-N 3.4Å
1318	H	36.2	Very low	31.9	Very low	72 Å²	72	130 Å²	130	33%	0.333	69%	0.689	S	S	.	*			trans	-73.2	102.6	-179.5	-175.4	-76.2	0	0	0	109.2	T1299 Q1301 T1316 R1320	T1299-H1318 PolarHBondContact O-N 3.33Å; Q1301-H1318 PolarHBondContact OE1-CD2 3Å; T1316-H1318 PolarHBondContact O-N 3.43Å; T1316-H1318 VanDerWaalsContact O-N 3.17Å; H1318-R1320 PolarHBondContact O-N 3.42Å
1319	K	34.6	Very low	31.7	Very low	183 Å²	183	134.2 Å²	134.2	80%	0.796	70%	0.698	S	S	*	*			trans	-82.9	108.2	166.5	-73.2	-176.2	178.2	179	0	107.6	R1317 S1321	R1317-K1319 PolarHBondContact O-N 3.4Å; K1319-S1321 PolarHBondContact O-N 2.91Å
1320	R	27.3	Very low	31	Very low	159 Å²	159	132.9 Å²	132.9	60%	0.6	69%	0.692	S	S	*	*			trans	-56.8	137.5	167.1	-89.9	-175.2	176.3	168.2	1.7	108.4	H1318 T1322	H1318-R1320 PolarHBondContact O-N 3.42Å; R1320-T1322 PolarHBondContact O-N 3.46Å
1321	S	25.9	Very low	30.8	Very low	124 Å²	124	131.6 Å²	131.6	87%	0.867	69%	0.689	S	S	*	*			trans	-56.7	101.2	173.4	51.3	0	0	0	0	109.6	K1319 S1323	K1319-S1321 PolarHBondContact O-N 2.91Å; S1321-S1323 PolarHBondContact O-N 3.12Å
1322	T	28	Very low	30.7	Very low	100 Å²	100	130.1 Å²	130.1	61%	0.613	67%	0.673	S	S	*	*			trans	-75.7	119.1	170.3	48.3	0	0	0	0	108.1	R1320 L1324	R1320-T1322 PolarHBondContact O-N 3.46Å; T1322-L1324 PolarHBondContact O-N 3.35Å
1323	S	27.9	Very low	30.8	Very low	109 Å²	109	133.7 Å²	133.7	76%	0.762	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	133.1	167.3	58.1	0	0	0	0	110	S1321	S1321-S1323 PolarHBondContact O-N 3.12Å
1324	L	29.9	Very low	30.7	Very low	146 Å²	146	134.6 Å²	134.6	76%	0.764	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.7	52.5	166.8	-80.5	121.9	0	0	0	117	T1322	T1322-L1324 PolarHBondContact O-N 3.35Å
1325	K	27.9	Very low	30.7	Very low	148 Å²	148	132.2 Å²	132.2	64%	0.643	69%	0.689	S	S	*	*			trans	-116.3	-4.6	161.5	-89.6	-172.7	176.1	180	0	116	E1327 L1328	K1325-E1327 PolarHBondContact O-N 2.9Å; K1325-L1328 PolarHBondContact O-N 3.39Å
1326	D	33.6	Very low	30.4	Very low	164 Å²	164	139.7 Å²	139.7	88%	0.877	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	0.5	174.5	-70.4	-22.3	0	0	0	113.7
1327	E	32.5	Very low	30.2	Very low	169 Å²	169	145.9 Å²	145.9	79%	0.79	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	0.6	172.5	-93	-173.4	163.1	0	0	115.6	K1325	K1325-E1327 PolarHBondContact O-N 2.9Å
1328	L	25.5	Very low	30.1	Very low	129 Å²	129	144 Å²	144	68%	0.675	74%	0.74	S	S	*	*			trans	-111.9	29.6	-178.5	-78.4	165.1	0	0	0	114.3	K1325 L1330 I1331	K1325-L1328 PolarHBondContact O-N 3.39Å; L1328-L1330 PolarHBondContact O-N 3.41Å; L1328-L1330 VanDerWaalsContact O-N 3.14Å; L1328-I1331 HydrophobicContact CD2-CD1 4.35Å
1329	Q	26.4	Very low	29.7	Very low	187 Å²	187	147 Å²	147	87%	0.874	76%	0.757	S	S	*	*			trans	-79.4	30.1	170.5	-116.3	-176.6	28.2	0	0	113.8
1330	L	28	Very low	29.4	Very low	160 Å²	160	146.1 Å²	146.1	84%	0.838	76%	0.761	S	S	*	*			trans	-143.2	58	-177.8	-117	120.5	0	0	0	113.3	L1328	L1328-L1330 PolarHBondContact O-N 3.41Å; L1328-L1330 VanDerWaalsContact O-N 3.14Å
1331	I	29	Very low	29.3	Very low	144 Å²	144	148 Å²	148	74%	0.738	77%	0.773	S	S	*	*	S	Bend	trans	-137	117	153	-75.1	106.2	0	0	0	108.6	L1328	L1328-I1331 HydrophobicContact CD2-CD1 4.35Å
1332	G	30.3	Very low	29.2	Very low	55 Å²	55	147.1 Å²	147.1	57%	0.567	77%	0.767	S	S	*	*			trans	-71.8	166.1	-168.6	0	0	0	0	0	116.7	T1334	G1332-T1334 PolarHBondContact O-N 3.49Å
1333	E	33.3	Very low	29.1	Very low	194 Å²	194	148.7 Å²	148.7	91%	0.907	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-66.4	16.7	-164.5	-70.8	-178.2	128.3	0	0	117.9	T1335	E1333-T1335 PolarHBondContact O-N 2.88Å
1334	T	31.6	Very low	28.9	Very low	129 Å²	129	155.5 Å²	155.5	79%	0.791	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-84.8	-12.5	-170.9	-22.4	0	0	0	0	114.7	G1332	G1332-T1334 PolarHBondContact O-N 3.49Å
1335	T	32.1	Very low	28.6	Very low	102 Å²	102	153.8 Å²	153.8	63%	0.626	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-88.8	-2.9	-175.6	-4	0	0	0	0	115.1	E1333 K1337	E1333-T1335 PolarHBondContact O-N 2.88Å; T1335-K1337 PolarHBondContact O-N 2.86Å
1336	R	28.2	Very low	28.5	Very low	228 Å²	228	153 Å²	153	86%	0.86	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-80.9	-14	-174.3	-142.2	175.1	-171.9	158.3	0.9	114.8
1337	K	33.3	Very low	28.2	Very low	204 Å²	204	150.6 Å²	150.6	89%	0.887	79%	0.791	S	S	*	*	G	3₁₀ helix	trans	-95.8	-7.7	-174.1	-81.9	-173.9	176	178.5	0	116.2	T1335	T1335-K1337 PolarHBondContact O-N 2.86Å
1338	T	31.4	Very low	28	Very low	119 Å²	119	150.1 Å²	150.1	73%	0.73	79%	0.794	S	S	*	*	S	Bend	trans	-107.1	-4.3	-171.4	-22.2	0	0	0	0	115.1
1339	L	27.8	Very low	28.2	Very low	133 Å²	133	148.9 Å²	148.9	70%	0.696	79%	0.793	S	S	*	*	S	Bend	trans	-104.8	9.1	-171	-102.5	139.4	0	0	0	116.2
1340	L	27.5	Very low	28.3	Very low	166 Å²	166	147.2 Å²	147.2	87%	0.869	79%	0.79	S	S	*	*	S	Bend	trans	-97.8	24.7	178.2	-91.2	157.5	0	0	0	114.7
1341	K	25.5	Very low	28.3	Very low	198 Å²	198	146.8 Å²	146.8	86%	0.861	79%	0.794	S	S	*	*			trans	-131.4	78.5	173.8	-75.9	-173.6	177.7	-179.9	0	112.3
1342	S	24.2	Very low	28.2	Very low	106 Å²	106	144.7 Å²	144.7	74%	0.741	79%	0.792	S	S	*	*	S	Bend	trans	-165.7	140.8	142.4	58.2	0	0	0	0	112
1343	T	25.4	Very low	28.1	Very low	132 Å²	132	150.8 Å²	150.8	81%	0.81	81%	0.805	S	S	*	*			trans	69.2	74.7	164.4	57.1	0	0	0	0	118.6
1344	R	24.2	Very low	27.9	Very low	252 Å²	252	149.6 Å²	149.6	95%	0.951	80%	0.803	S	S	*	*			trans	-81.6	121	145.3	-86.5	-177.2	176.7	178.2	-1.2	108.7
1345	C	23	Very low	27.8	Very low	110 Å²	110	149.1 Å²	149.1	74%	0.743	80%	0.803	S	S	*	*			trans	-71	150.2	163.8	-68.1	0	0	0	0	110.2	S1347	C1345-S1347 PolarHBondContact O-N 3.37Å
1346	P	26.2	Very low	27.6	Very low	133 Å²	133	152.2 Å²	152.2	86%	0.864	82%	0.816	S	S	*	*			trans	-75.9	114	-163.3	30	-32.8	0	0	0	111.3
1347	S	26.5	Very low	27.6	Very low	112 Å²	112	150.9 Å²	150.9	78%	0.783	82%	0.816	S	S	*	*			trans	-86.4	134.2	169.2	47	0	0	0	0	110.5	C1345	C1345-S1347 PolarHBondContact O-N 3.37Å
1348	N	27.9	Very low	27.4	Very low	160 Å²	160	148.6 Å²	148.6	86%	0.856	81%	0.813	S	S	*	*			trans	-36.3	140.7	172.4	-116.2	-8.9	0	0	0	113.7
1349	P	30.8	Very low	27.2	Very low	102 Å²	102	148.7 Å²	148.7	66%	0.662	82%	0.816	S	S	*	*	S	Bend	trans	-76.6	160.1	-179.4	34	-32.2	0	0	0	111.2
1350	D	27.9	Very low	27	Very low	152 Å²	152	150.5 Å²	150.5	81%	0.813	82%	0.821	S	S	*	*			trans	80.4	65.9	168.1	-57.4	-19.7	0	0	0	118
1351	V	28.8	Very low	26.9	Very low	151 Å²	151	147.6 Å²	147.6	92%	0.915	81%	0.812	S	S	*	*			trans	-135.1	103	135	-173.8	0	0	0	0	108.3
1352	S	26.1	Very low	26.7	Very low	100 Å²	100	144.8 Å²	144.8	70%	0.699	81%	0.806	S	S	*	*			trans	-81.1	138.2	179.5	43.9	0	0	0	0	112.1
1353	H	28.1	Very low	26.7	Very low	183 Å²	183	148.6 Å²	148.6	85%	0.847	81%	0.809	S	S	*	*			trans	58.4	91.5	152.6	-67.6	-63.8	0	0	0	120.4
1354	I	30	Very low	26.6	Very low	169 Å²	169	151.7 Å²	151.7	87%	0.867	81%	0.807	S	S	*	*			trans	-137.5	131.6	141.3	-56.5	-179.2	0	0	0	108.3
1355	P	28.7	Very low	26.5	Very low	120 Å²	120	145.2 Å²	145.2	78%	0.779	80%	0.798	S	S	*	*			trans	-92.5	159.2	-160.3	36.1	-33.3	0	0	0	115.2	K1357	P1355-K1357 PolarHBondContact O-N 3.09Å
1356	D	28	Very low	26.6	Very low	167 Å²	167	147.1 Å²	147.1	89%	0.893	80%	0.8	S	S	*	*			trans	-44.4	116.5	-179.7	-66.1	-51.6	0	0	0	115.1
1357	K	29	Very low	26.6	Very low	199 Å²	199	151.1 Å²	151.1	87%	0.865	80%	0.798	S	S	*	*			trans	-129.9	125.2	144.8	-85.4	-170.4	175	-177.1	0	107.8	P1355	P1355-K1357 PolarHBondContact O-N 3.09Å
1358	D	28.9	Very low	26.6	Very low	156 Å²	156	155.1 Å²	155.1	83%	0.834	80%	0.804	S	S	*	*			trans	-44.9	129.7	-179.6	-67.3	-57.5	0	0	0	111.7	E1360	D1358-E1360 PolarHBondContact O-N 3.25Å
1359	P	27.3	Very low	26.5	Very low	121 Å²	121	154.6 Å²	154.6	79%	0.786	80%	0.801	S	S	*	*			trans	-77.9	99.5	-179.6	31.3	-29.9	0	0	0	108.4
1360	E	23.6	Very low	26.4	Very low	172 Å²	172	152.5 Å²	152.5	80%	0.804	79%	0.789	S	S	*	*			trans	-54.6	136.3	150.5	-79.5	-173.3	156.4	0	0	108	D1358 L1362	D1358-E1360 PolarHBondContact O-N 3.25Å; E1360-L1362 PolarHBondContact O-N 2.85Å
1361	P	24.4	Very low	26.4	Very low	104 Å²	104	153.3 Å²	153.3	68%	0.675	79%	0.793	S	S	*	*			trans	-62.3	110.2	-172.5	24.7	-31.5	0	0	0	108.7	F1363	P1361-F1363 HydrophobicContact CG-CE2 4.41Å; P1361-F1363 WeakPolarHBondContact O-CD2 3.26Å; P1361-F1363 PolarHBondContact O-N 2.99Å
1362	L	22.5	Very low	26.5	Very low	140 Å²	140	150.2 Å²	150.2	73%	0.733	77%	0.77	S	S	*	*			trans	-59.1	90.7	170.7	-76.9	161.3	0	0	0	108.1	E1360 Y1364	E1360-L1362 PolarHBondContact O-N 2.85Å; L1362-Y1364 HydrophobicContact CB-CD2 4.46Å; L1362-Y1364 HydrophobicContact CB-CE2 4.26Å; L1362-Y1364 PolarHBondContact O-N 2.76Å
1363	F	23.9	Very low	26.7	Very low	186 Å²	186	149.9 Å²	149.9	82%	0.816	76%	0.76	S	S	*	*			trans	-60	92.7	158.5	-81.7	-88.3	0	0	0	106.3	P1361 P1365	P1361-F1363 HydrophobicContact CG-CE2 4.41Å; P1361-F1363 WeakPolarHBondContact O-CD2 3.26Å; P1361-F1363 PolarHBondContact O-N 2.99Å; F1363-P1365 WeakPolarHBondContact O-CD 3.42Å; F1363-P1365 VanDerWaalsContact O-N 3.11Å
1364	Y	22.3	Very low	27	Very low	196 Å²	196	148.9 Å²	148.9	77%	0.769	76%	0.756	S	S	*	*			trans	-59.7	113.5	165.1	-81.9	-84.9	0	0	0	106.7	L1362 L1366	L1362-Y1364 HydrophobicContact CB-CD2 4.46Å; L1362-Y1364 HydrophobicContact CB-CE2 4.26Å; L1362-Y1364 PolarHBondContact O-N 2.76Å; Y1364-L1366 PolarHBondContact O-N 3.21Å
1365	P	23.7	Very low	27.2	Very low	116 Å²	116	147.1 Å²	147.1	75%	0.753	74%	0.744	S	S	*	*			trans	-61.9	125.8	174	-9.8	24.9	0	0	0	106.2	F1363 R1367	F1363-P1365 WeakPolarHBondContact O-CD 3.42Å; F1363-P1365 VanDerWaalsContact O-N 3.11Å; P1365-R1367 PolarHBondContact O-N 3.2Å
1366	L	25.1	Very low	27.6	Very low	151 Å²	151	142.4 Å²	142.4	79%	0.791	72%	0.715	S	S	*	*			trans	-38	116.7	171.8	-79	152.6	0	0	0	108.9	Y1364 Q1368	Y1364-L1366 PolarHBondContact O-N 3.21Å; L1366-Q1368 PolarHBondContact O-N 2.97Å
1367	R	24.9	Very low	28.3	Very low	217 Å²	217	139.6 Å²	139.6	82%	0.819	70%	0.699	S	S	*	*			trans	-51.4	117.8	173.2	-79.7	-175.3	176.1	-175.2	-0.3	107.1	P1365 N1369 S1370	P1365-R1367 PolarHBondContact O-N 3.2Å; R1367-N1369 PolarHBondContact O-N 3.41Å; R1367-S1370 PolarHBondContact O-N 2.84Å; R1367-S1370 PolarHBondContact O-OG 3.47Å; R1367-S1370 VanDerWaalsContact O-OG 3.1Å
1368	Q	26.4	Very low	29.2	Very low	196 Å²	196	135.1 Å²	135.1	92%	0.916	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-6.3	179.4	-83.3	-179.9	-23.7	0	0	114	L1366	L1366-Q1368 PolarHBondContact O-N 2.97Å
1369	N	26.6	Very low	30.4	Very low	148 Å²	148	128.5 Å²	128.5	79%	0.791	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	8	177.6	-66.9	-3.3	0	0	0	114.4	R1367 L1371	R1367-N1369 PolarHBondContact O-N 3.41Å; N1369-L1371 PolarHBondContact O-N 2.94Å
1370	S	28.1	Very low	32.2	Very low	59 Å²	59	127.3 Å²	127.3	41%	0.413	64%	0.637	S	S	.	*			trans	-85.8	88.6	168.7	56.1	0	0	0	0	110	R1367 I1372	R1367-S1370 PolarHBondContact O-N 2.84Å; R1367-S1370 PolarHBondContact O-OG 3.47Å; R1367-S1370 VanDerWaalsContact O-OG 3.1Å; S1370-I1372 PolarHBondContact O-N 3.3Å
1371	L	27.9	Very low	34.3	Very low	168 Å²	168	122.8 Å²	122.8	88%	0.88	61%	0.613	S	S	*	*			trans	-65.1	43.2	174.4	-79.4	152.8	0	0	0	113.2	N1369 L1373	N1369-L1371 PolarHBondContact O-N 2.94Å; L1371-L1373 PolarHBondContact O-N 3.47Å
1372	I	30.8	Very low	36.6	Very low	86 Å²	86	120.4 Å²	120.4	44%	0.441	59%	0.594	S	S	.	*			trans	-88.7	85.3	171.9	-53.8	166.9	0	0	0	106.7	Y1257 S1370	Y1257-I1372 HydrophobicContact CD2-CD1 3.64Å; Y1257-I1372 HydrophobicContact CG-CD1 3.82Å; S1370-I1372 PolarHBondContact O-N 3.3Å
1373	L	31.3	Very low	39.5	Very low	94 Å²	94	115.3 Å²	115.3	49%	0.492	57%	0.566	S	S	.	*			trans	-158.8	-21.9	160.9	-109.6	141.2	0	0	0	117.2	L1371 H1375 A1376 I1377	L1371-L1373 PolarHBondContact O-N 3.47Å; L1373-H1375 PolarHBondContact O-N 3.28Å; L1373-A1376 PolarHBondContact O-N 3.46Å; L1373-I1377 VanDerWaalsContact O-CG1 3.23Å; L1373-I1377 WeakPolarHBondContact O-CG1 3.4Å
1374	E	33.6	Very low	42.3	Very low	162 Å²	162	110.6 Å²	110.6	76%	0.757	55%	0.546	S	S	*	.	S	Bend	trans	-66.4	-32.8	-170.8	-78	-172	162.8	0	0	115.4	I1377	E1374-I1377 VanDerWaalsContact O-CD1 3.27Å; E1374-I1377 WeakPolarHBondContact O-CD1 3.5Å; E1374-I1377 VanDerWaalsContact O-CG1 3.26Å; E1374-I1377 WeakPolarHBondContact O-CG1 3.34Å
1375	H	34	Very low	45.5	Very low	132 Å²	132	101.9 Å²	101.9	61%	0.611	51%	0.513	S	S	*	.	S	Bend	trans	-97.2	-18.5	-179.4	-74.7	65.8	0	0	0	114	L1373 I1377	L1373-H1375 PolarHBondContact O-N 3.28Å; H1375-I1377 PolarHBondContact O-N 2.92Å
1376	A	37.2	Very low	48.5	Very low	21 Å²	21	101.4 Å²	101.4	17%	0.174	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-76.2	-2.4	172	0	0	0	0	0	112.3	K1302 L1373 N1378 S1379	K1302-A1376 PolarHBondContact NZ-O 3.33Å; L1373-A1376 PolarHBondContact O-N 3.46Å; A1376-N1378 PolarHBondContact O-N 2.88Å; A1376-N1378 VanDerWaalsContact O-N 3.12Å; A1376-S1379 PolarHBondContact O-N 3.36Å; A1376-S1379 PolarHBondContact O-OG 2.98Å
1377	I	42.5	Very low	51.6	Low	108 Å²	108	96.9 Å²	96.9	55%	0.554	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-53.6	-35.1	-178.5	-63.9	179.9	0	0	0	111.1	L1373 E1374 H1375	L1373-I1377 VanDerWaalsContact O-CG1 3.23Å; L1373-I1377 WeakPolarHBondContact O-CG1 3.4Å; E1374-I1377 VanDerWaalsContact O-CD1 3.27Å; E1374-I1377 WeakPolarHBondContact O-CD1 3.5Å; E1374-I1377 VanDerWaalsContact O-CG1 3.26Å; E1374-I1377 WeakPolarHBondContact O-CG1 3.34Å; H1375-I1377 PolarHBondContact O-N 2.92Å
1378	N	48.7	Very low	54.4	Low	104 Å²	104	89.8 Å²	89.8	56%	0.556	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-87.5	-10.8	-174.8	-71.1	-12.6	0	0	0	115.2	R1243 I1245 A1376	R1243-N1378 PolarHBondContact NH1-O 3.49Å; I1245-N1378 HydrophobicContact CD1-CB 4.1Å; A1376-N1378 PolarHBondContact O-N 2.88Å; A1376-N1378 VanDerWaalsContact O-N 3.12Å
1379	S	53.3	Low	57.2	Low	17 Å²	17	81.4 Å²	81.4	12%	0.119	41%	0.414	C	S	.	.			trans	-91.5	132	174.7	68.6	0	0	0	0	111.1	K1302 A1376 Y1381	K1302-S1379 WeakPolarHBondContact CE-O 3.44Å; K1302-S1379 PolarHBondContact NZ-O 2.88Å; A1376-S1379 PolarHBondContact O-N 3.36Å; A1376-S1379 PolarHBondContact O-OG 2.98Å; S1379-Y1381 WeakPolarHBondContact CB-O 3.41Å; S1379-Y1381 PolarHBondContact O-N 2.9Å; S1379-Y1381 PolarHBondContact OG-O 3.42Å
1380	N	64.5	Low	60.1	Low	97 Å²	97	80.8 Å²	80.8	52%	0.519	40%	0.401	S	S	.	.	S	Bend	trans	-67.1	-13.1	171.2	-70.6	-5.1	0	0	0	112.2	K1302	K1302-N1380 PolarHBondContact N-O 3.47Å
1381	Y	68.3	Low	62.8	Low	76 Å²	76	79.5 Å²	79.5	30%	0.298	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.9	-174.8	-59.3	-78.4	0	0	0	111.4	T1299 Y1300 Q1301 S1379	T1299-Y1381 HydrophobicContact CG2-CD1 3.85Å; T1299-Y1381 HydrophobicContact CG2-CG 4.1Å; Y1300-Y1381 CarbonylContact O-C 3.5Å; Y1300-Y1381 WeakPolarHBondContact O-CA 3.43Å; Q1301-Y1381 HydrophobicContact CB-CD1 4.04Å; Q1301-Y1381 HydrophobicContact CB-CE1 3.89Å; Q1301-Y1381 HydrophobicContact CG-CD1 4.27Å; Q1301-Y1381 HydrophobicContact CG-CE1 3.87Å; S1379-Y1381 WeakPolarHBondContact CB-O 3.41Å; S1379-Y1381 PolarHBondContact O-N 2.9Å; S1379-Y1381 PolarHBondContact OG-O 3.42Å
1382	I	74	Confident	65.5	Low	54 Å²	54	75.4 Å²	75.4	28%	0.277	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	133.9	171	-67.6	167.5	0	0	0	107.4	Y1300 K1302 M1315	Y1300-I1382 PolarHBondContact N-O 3.48Å; Y1300-I1382 PolarHBondContact O-N 2.98Å; K1302-I1382 HydrophobicContact CD-CD1 4.4Å; K1302-I1382 HydrophobicContact CG-CD1 3.98Å; K1302-I1382 HydrophobicContact CG-CG1 4.34Å; M1315-I1382 HydrophobicContact CE-CB 3.73Å; M1315-I1382 HydrophobicContact CE-CD1 3.32Å; M1315-I1382 HydrophobicContact CE-CG1 4Å; M1315-I1382 HydrophobicContact CE-CG2 4.17Å; M1315-I1382 HydrophobicContact SD-CD1 3.9Å
1383	Y	81.7	Confident	67.9	Low	34 Å²	34	71.9 Å²	71.9	13%	0.133	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.5	-177.9	-60.3	-87.2	0	0	0	110.1	N1224 L1238 I1247 L1248 I1297 H1298 T1299	N1224-Y1383 HydrophobicContact CB-CD1 4.27Å; N1224-Y1383 HydrophobicContact CB-CE1 3.69Å; L1238-Y1383 HydrophobicContact CD2-CD2 4.33Å; L1238-Y1383 HydrophobicContact CD2-CG 4.34Å; I1247-Y1383 HydrophobicContact CD1-CE2 4.14Å; I1247-Y1383 HydrophobicContact CG2-CD2 3.43Å; I1247-Y1383 VanDerWaalsContact CG2-CD2 3.43Å; I1247-Y1383 HydrophobicContact CG2-CE2 3.55Å; L1248-Y1383 HydrophobicContact CD2-CG 4.48Å; I1297-Y1383 HydrophobicContact CG2-CD1 4.06Å; H1298-Y1383 CarbonylContact O-C 3.59Å; H1298-Y1383 VanDerWaalsContact O-CA 3.31Å; H1298-Y1383 WeakPolarHBondContact O-CA 3.3Å; T1299-Y1383 HydrophobicContact CG2-CD1 3.92Å; T1299-Y1383 HydrophobicContact CG2-CE1 3.49Å; T1299-Y1383 VanDerWaalsContact CG2-CE1 3.49Å; T1299-Y1383 WeakPolarHBondContact OG1-CD1 3.47Å; T1299-Y1383 WeakPolarHBondContact OG1-CE1 3.46Å
1384	E	84	Confident	70.4	Confident	86 Å²	86	67.7 Å²	67.7	40%	0.402	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	120.4	176.5	176.5	-175.4	-158.2	0	0	109.9	Y1257 H1298 Y1300	Y1257-E1384 WeakPolarHBondContact OH-CA 3.44Å; H1298-E1384 HydrophobicContact CB-CB 4.16Å; H1298-E1384 PolarHBondContact N-O 2.82Å; H1298-E1384 PolarHBondContact O-N 3.33Å; Y1300-E1384 HydrophobicContact CE2-CB 3.89Å; Y1300-E1384 VanDerWaalsContact CE2-OE2 3.26Å; Y1300-E1384 WeakPolarHBondContact CE2-OE2 3.3Å; Y1300-E1384 PolarHBondContact OH-OE2 3.31Å
1385	L	88.9	Confident	72.6	Confident	14 Å²	14	67.5 Å²	67.5	7%	0.073	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	114.2	173.9	-71.4	161.1	0	0	0	109.7	W1227 I1236 L1248 F1250 Y1257 L1283 Y1295 I1297	W1227-L1385 HydrophobicContact CH2-CD1 4.12Å; W1227-L1385 HydrophobicContact CH2-CD2 4.02Å; W1227-L1385 HydrophobicContact CH2-CG 4.48Å; W1227-L1385 HydrophobicContact CZ3-CD1 4.47Å; I1236-L1385 HydrophobicContact CD1-CD1 4.49Å; L1248-L1385 HydrophobicContact CD1-CD1 4.13Å; F1250-L1385 HydrophobicContact CB-CD1 3.88Å; F1250-L1385 HydrophobicContact CD1-CD1 3.7Å; F1250-L1385 HydrophobicContact CD2-CD1 4Å; F1250-L1385 HydrophobicContact CE1-CD1 4.18Å; F1250-L1385 HydrophobicContact CE2-CB 4.4Å; F1250-L1385 HydrophobicContact CE2-CD1 4.45Å; F1250-L1385 HydrophobicContact CG-CD1 3.58Å; F1250-L1385 HydrophobicContact CZ-CB 4.3Å; Y1257-L1385 PolarHBondContact OH-N 3.47Å; L1283-L1385 HydrophobicContact CD2-CD2 4.35Å; Y1295-L1385 HydrophobicContact CD1-CB 3.96Å; Y1295-L1385 HydrophobicContact CG-CD2 4.37Å; I1297-L1385 HydrophobicContact CG1-CD2 3.84Å
1386	Q	87.1	Confident	75.1	Confident	105 Å²	105	62.3 Å²	62.3	49%	0.491	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	117.2	172.4	-177.9	-176.8	2.2	0	0	109.4	Y1295 Q1296 H1298 I1388	Y1295-Q1386 CarbonylContact C-O 3.53Å; Y1295-Q1386 WeakPolarHBondContact CA-O 3.48Å; Q1296-Q1386 PolarHBondContact N-O 2.89Å; Q1296-Q1386 PolarHBondContact O-N 3.04Å; H1298-Q1386 PolarHBondContact CE1-OE1 3.33Å; Q1386-I1388 PolarHBondContact O-N 3Å
1387	K	88.9	Confident	77.5	Confident	57 Å²	57	62.9 Å²	62.9	25%	0.248	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	124	175.5	-170.2	173.1	53.9	-179.7	0	110.4	E1255 Y1295 R1390	E1255-K1387 VanDerWaalsContact CD-NZ 3.31Å; E1255-K1387 VanDerWaalsContact OE1-CE 3.26Å; E1255-K1387 WeakPolarHBondContact OE1-CE 3.38Å; E1255-K1387 IonicContact OE1-NZ 3.52Å; E1255-K1387 PolarHBondContact OE1-NZ 3.22Å; E1255-K1387 WeakPolarHBondContact OE2-CE 3.35Å; E1255-K1387 IonicContact OE2-NZ 3.64Å; Y1295-K1387 HydrophobicContact CD1-CB 3.84Å; Y1295-K1387 HydrophobicContact CE1-CB 3.54Å; Y1295-K1387 HydrophobicContact CE1-CD 4.43Å; Y1295-K1387 HydrophobicContact CE1-CG 4.11Å; K1387-R1390 HydrophobicContact CD-CB 4.39Å
1388	I	85.4	Confident	79.9	Confident	67 Å²	67	57.8 Å²	57.8	34%	0.344	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-29.9	179.4	54.3	165.6	0	0	0	112.7	V1294 Q1296 Q1386	V1294-I1388 HydrophobicContact CB-CD1 4.38Å; V1294-I1388 HydrophobicContact CB-CG1 4Å; V1294-I1388 HydrophobicContact CG1-CD1 3.81Å; V1294-I1388 HydrophobicContact CG1-CG1 3.91Å; V1294-I1388 WeakPolarHBondContact O-CG1 3.31Å; V1294-I1388 PolarHBondContact O-N 3.43Å; Q1296-I1388 HydrophobicContact CB-CD1 4.42Å; Q1296-I1388 HydrophobicContact CB-CG2 3.79Å; Q1386-I1388 PolarHBondContact O-N 3Å
1389	V	83.5	Confident	81.8	Confident	21 Å²	21	57.1 Å²	57.1	13%	0.127	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.3	178.6	-178.1	0	0	0	0	109.4	L1293 V1294 W1439	L1293-V1389 WeakPolarHBondContact CA-O 3.39Å; V1294-V1389 HydrophobicContact CB-CB 3.82Å; V1294-V1389 HydrophobicContact CB-CG2 4.16Å; V1294-V1389 HydrophobicContact CG2-CB 3.82Å; V1294-V1389 HydrophobicContact CG2-CG1 4.38Å; V1294-V1389 HydrophobicContact CG2-CG2 4.27Å; V1294-V1389 PolarHBondContact N-O 3.46Å; V1294-V1389 PolarHBondContact O-N 3.5Å; V1389-W1439 HydrophobicContact CG2-CB 4.31Å
1390	R	88.2	Confident	83.7	Confident	134 Å²	134	58.3 Å²	58.3	51%	0.506	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	112.2	162.7	172.7	172.3	-171.8	168.9	12.9	107.1	E1291 L1293 K1387	E1291-R1390 IonicContact OE1-CZ 3.83Å; E1291-R1390 VanDerWaalsContact OE1-CZ 3.29Å; E1291-R1390 IonicContact OE1-NE 3.75Å; E1291-R1390 PolarHBondContact OE1-NE 2.95Å; E1291-R1390 IonicContact OE1-NH2 2.69Å; E1291-R1390 PolarHBondContact OE1-NH2 3.25Å; E1291-R1390 IonicContact OE2-CZ 3.33Å; E1291-R1390 IonicContact OE2-NE 2.65Å; E1291-R1390 IonicContact OE2-NH2 2.81Å; E1291-R1390 PolarHBondContact OE2-NH2 3.48Å; L1293-R1390 HydrophobicContact CD2-CB 3.8Å; L1293-R1390 HydrophobicContact CD2-CG 3.55Å; K1387-R1390 HydrophobicContact CD-CB 4.39Å
1391	S	84.4	Confident	85	Confident	32 Å²	32	54.2 Å²	54.2	22%	0.224	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119.8	-178.9	-169.4	0	0	0	0	109.1	E1291 V1292 V1393	E1291-S1391 CarbonylContact C-O 3.5Å; E1291-S1391 VanDerWaalsContact CA-O 3.3Å; E1291-S1391 WeakPolarHBondContact CA-O 3.46Å; V1292-S1391 PolarHBondContact N-O 2.86Å; V1292-S1391 PolarHBondContact O-N 2.65Å; S1391-V1393 PolarHBondContact O-N 3.46Å; S1391-V1393 VanDerWaalsContact OG-CG1 3.24Å; S1391-V1393 WeakPolarHBondContact OG-CG1 3.47Å
1392	K	85.7	Confident	86	Confident	83 Å²	83	51.7 Å²	51.7	36%	0.361	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	105.9	168.8	173.1	69.2	174.1	177.5	0	106.5	M1289 E1291 A1394 E1395	M1289-K1392 WeakPolarHBondContact O-CD 3.41Å; M1289-K1392 PolarHBondContact O-NZ 3.42Å; E1291-K1392 HydrophobicContact CG-CB 4.23Å; E1291-K1392 HydrophobicContact CG-CD 3.96Å; K1392-A1394 WeakPolarHBondContact CD-O 3.48Å; K1392-A1394 WeakPolarHBondContact CE-O 3.33Å; K1392-A1394 PolarHBondContact NZ-O 2.9Å; K1392-E1395 WeakPolarHBondContact CE-OE1 3.28Å; K1392-E1395 WeakPolarHBondContact CE-OE2 3.32Å; K1392-E1395 IonicContact NZ-OE1 3.65Å; K1392-E1395 IonicContact NZ-OE2 4Å; K1392-E1395 PolarHBondContact NZ-OE2 3.07Å
1393	V	81.7	Confident	86.6	Confident	12 Å²	12	51.9 Å²	51.9	7%	0.073	25%	0.245	C	C	.	.			trans	-112.4	-15.9	-172.3	-61	0	0	0	0	113.4	G1290 V1292 S1391 I1398 D1424 L1427 W1429	G1290-V1393 PolarHBondContact O-N 3.27Å; V1292-V1393 HydrophobicContact CG2-CG2 3.73Å; S1391-V1393 PolarHBondContact O-N 3.46Å; S1391-V1393 VanDerWaalsContact OG-CG1 3.24Å; S1391-V1393 WeakPolarHBondContact OG-CG1 3.47Å; V1393-I1398 HydrophobicContact CG2-CD1 3.56Å; V1393-D1424 WeakPolarHBondContact O-CB 3.36Å; V1393-L1427 HydrophobicContact CB-CD1 3.59Å; V1393-L1427 HydrophobicContact CG1-CD1 4.08Å; V1393-L1427 HydrophobicContact CG2-CD1 4.09Å; V1393-W1429 HydrophobicContact CG1-CH2 3.78Å; V1393-W1429 HydrophobicContact CG1-CZ2 3.74Å
1394	A	83.5	Confident	86.7	Confident	6 Å²	6	52.6 Å²	52.6	5%	0.05	25%	0.248	C	C	.	.			trans	-144.3	156.8	174.9	0	0	0	0	0	110.6	G1290 K1392 T1396 I1398	G1290-A1394 WeakPolarHBondContact CA-O 3.39Å; G1290-A1394 PolarHBondContact O-N 3.38Å; K1392-A1394 WeakPolarHBondContact CD-O 3.48Å; K1392-A1394 WeakPolarHBondContact CE-O 3.33Å; K1392-A1394 PolarHBondContact NZ-O 2.9Å; A1394-T1396 VanDerWaalsContact C-N 3.27Å; A1394-T1396 WeakPolarHBondContact CB-O 3.41Å; A1394-I1398 HydrophobicContact CB-CD1 4.08Å
1395	E	80.1	Confident	86.5	Confident	158 Å²	158	53 Å²	53	74%	0.738	25%	0.249	S	C	*	.	S	Bend	trans	-81.2	-13.8	167	-66.9	-55.6	154.8	0	0	112.9	K1392	K1392-E1395 WeakPolarHBondContact CE-OE1 3.28Å; K1392-E1395 WeakPolarHBondContact CE-OE2 3.32Å; K1392-E1395 IonicContact NZ-OE1 3.65Å; K1392-E1395 IonicContact NZ-OE2 4Å; K1392-E1395 PolarHBondContact NZ-OE2 3.07Å
1396	T	85.2	Confident	85.8	Confident	23 Å²	23	55 Å²	55	14%	0.141	26%	0.259	C	S	.	.	S	Bend	trans	-111.8	160	-177.9	63.9	0	0	0	0	111.7	G1290 A1394 I1398 S1417 T1418 Y1419 D1422	G1290-T1396 WeakPolarHBondContact CA-O 3.49Å; A1394-T1396 VanDerWaalsContact C-N 3.27Å; A1394-T1396 WeakPolarHBondContact CB-O 3.41Å; T1396-I1398 PolarHBondContact O-N 3.5Å; T1396-S1417 WeakPolarHBondContact OG1-CB 3.41Å; T1396-S1417 PolarHBondContact OG1-OG 3.24Å; T1396-T1418 PolarHBondContact OG1-N 3.48Å; T1396-Y1419 HydrophobicContact CG2-CD2 3.81Å; T1396-Y1419 HydrophobicContact CG2-CE2 3.73Å; T1396-D1422 PolarHBondContact OG1-OD2 3.45Å; T1396-D1422 VanDerWaalsContact OG1-OD2 3.09Å
1397	P	89.2	Confident	84.9	Confident	33 Å²	33	53.2 Å²	53.2	21%	0.214	26%	0.255	C	S	.	.			trans	-13	110.1	160.8	42.9	-33.4	0	0	0	119.1	T1274 G1288 R1399 S1417 T1418	T1274-P1397 HydrophobicContact CG2-CB 4.1Å; G1288-P1397 WeakPolarHBondContact O-CB 3.37Å; G1288-P1397 WeakPolarHBondContact O-CG 3.46Å; P1397-R1399 PolarHBondContact O-N 2.87Å; P1397-S1417 CarbonylContact O-C 3.59Å; P1397-S1417 VanDerWaalsContact O-C 3.24Å; P1397-S1417 WeakPolarHBondContact O-CA 3.37Å; P1397-T1418 WeakPolarHBondContact CA-OG1 3.45Å; P1397-T1418 PolarHBondContact O-N 2.9Å; P1397-T1418 PolarHBondContact O-OG1 3.06Å
1398	I	91.5	Very high	83.9	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.28	C	S	.	.			trans	-70.8	106.4	158.9	-54.7	-51.4	0	0	0	107.2	T1274 V1275 T1287 V1292 V1393 A1394 T1396 L1401 C1416	T1274-I1398 VanDerWaalsContact CB-O 3.24Å; T1274-I1398 WeakPolarHBondContact CB-O 3.41Å; T1274-I1398 PolarHBondContact OG1-O 3.33Å; V1275-I1398 HydrophobicContact CG1-CG2 3.9Å; T1287-I1398 PolarHBondContact O-N 2.95Å; V1292-I1398 HydrophobicContact CG2-CD1 4.21Å; V1292-I1398 HydrophobicContact CG2-CG1 3.99Å; V1292-I1398 HydrophobicContact CG2-CG2 4.33Å; V1393-I1398 HydrophobicContact CG2-CD1 3.56Å; A1394-I1398 HydrophobicContact CB-CD1 4.08Å; T1396-I1398 PolarHBondContact O-N 3.5Å; I1398-L1401 HydrophobicContact CG2-CD2 4.45Å; I1398-L1401 HydrophobicContact CG2-CG 4.29Å; I1398-C1416 CarbonylContact C-O 3.55Å
1399	R	89.7	Confident	82.9	Confident	89 Å²	89	59.2 Å²	59.2	34%	0.336	30%	0.299	S	S	.	.			trans	-87.6	-37.2	-175.5	-70.1	-168.1	67.1	115.8	3.5	112.7	I1040 P1397 C1416	I1040-R1399 PolarHBondContact O-NE 3.41Å; P1397-R1399 PolarHBondContact O-N 2.87Å; R1399-C1416 PolarHBondContact N-O 2.73Å
1400	F	91.7	Very high	82.3	Confident	42 Å²	42	61.8 Å²	61.8	18%	0.184	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	142.7	-174	-51.6	-80	0	0	0	111.8	I1040 Q1041 I1043 S1415 C1416	I1040-F1400 HydrophobicContact CB-CE2 4.21Å; I1040-F1400 HydrophobicContact CG2-CD2 3.82Å; I1040-F1400 HydrophobicContact CG2-CE2 3.62Å; I1040-F1400 WeakPolarHBondContact O-CE2 3.2Å; Q1041-F1400 VanDerWaalsContact C-CZ 3.49Å; Q1041-F1400 WeakPolarHBondContact O-CZ 3.41Å; I1043-F1400 HydrophobicContact CG2-CB 3.37Å; I1043-F1400 HydrophobicContact CG2-CD1 3.66Å; I1043-F1400 HydrophobicContact CG2-CD2 3.99Å; I1043-F1400 HydrophobicContact CG2-CE1 4.48Å; I1043-F1400 HydrophobicContact CG2-CG 3.38Å; F1400-S1415 WeakPolarHBondContact O-CA 3.47Å; F1400-C1416 HydrophobicContact CB-CB 4.16Å; F1400-C1416 HydrophobicContact CD2-CB 4.08Å; F1400-C1416 PolarHBondContact N-O 2.95Å; F1400-C1416 PolarHBondContact O-N 2.92Å
1401	L	91.7	Very high	81.7	Confident	11 Å²	11	56.5 Å²	56.5	6%	0.058	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	116.5	166.4	-73.5	171.4	0	0	0	106.1	V1275 L1277 W1284 I1398 I1414	V1275-L1401 HydrophobicContact CG1-CB 4.31Å; V1275-L1401 HydrophobicContact CG1-CD1 3.78Å; V1275-L1401 HydrophobicContact CG1-CG 3.77Å; V1275-L1401 HydrophobicContact CG2-CB 4.11Å; V1275-L1401 HydrophobicContact CG2-CG 4.48Å; L1277-L1401 HydrophobicContact CB-CB 3.9Å; L1277-L1401 HydrophobicContact CB-CD1 4.4Å; L1277-L1401 HydrophobicContact CD2-CB 3.93Å; W1284-L1401 HydrophobicContact CB-CD1 3.99Å; I1398-L1401 HydrophobicContact CG2-CD2 4.45Å; I1398-L1401 HydrophobicContact CG2-CG 4.29Å; L1401-I1414 WeakPolarHBondContact CA-O 3.24Å
1402	V	89.7	Confident	81.5	Confident	24 Å²	24	55 Å²	55	15%	0.145	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	147.9	178	-68.2	0	0	0	0	109.7	I1043 F1045 L1051 I1413 I1414	I1043-V1402 HydrophobicContact CD1-CG2 3.79Å; I1043-V1402 HydrophobicContact CG1-CG1 4.38Å; I1043-V1402 HydrophobicContact CG1-CG2 4.04Å; I1043-V1402 HydrophobicContact CG2-CG1 3.8Å; F1045-V1402 HydrophobicContact CD2-CB 4.19Å; F1045-V1402 HydrophobicContact CD2-CG2 4.16Å; F1045-V1402 HydrophobicContact CE2-CB 3.95Å; F1045-V1402 HydrophobicContact CE2-CG2 3.61Å; F1045-V1402 HydrophobicContact CZ-CG2 4.38Å; L1051-V1402 HydrophobicContact CD1-CG2 3.91Å; V1402-I1413 WeakPolarHBondContact O-CA 3.32Å; V1402-I1414 HydrophobicContact CG2-CB 3.94Å; V1402-I1414 PolarHBondContact N-O 3.32Å; V1402-I1414 PolarHBondContact O-N 3.25Å
1403	M	88	Confident	81.6	Confident	58 Å²	58	51 Å²	51	29%	0.286	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	149.6	177.9	58.2	124.6	-62.5	0	0	112	L1277 Y1279 K1405 L1412 I1413	L1277-M1403 HydrophobicContact CD1-CG 3.96Å; L1277-M1403 HydrophobicContact CD2-CB 4Å; L1277-M1403 HydrophobicContact CD2-CG 4Å; L1277-M1403 HydrophobicContact CG-CG 4.31Å; Y1279-M1403 HydrophobicContact CD2-CE 4.42Å; Y1279-M1403 HydrophobicContact CD2-SD 3.43Å; Y1279-M1403 WeakPolarHBondContact CD2-SD 3.37Å; Y1279-M1403 HydrophobicContact CE2-SD 4.06Å; Y1279-M1403 HydrophobicContact CG-SD 4.25Å; M1403-K1405 HydrophobicContact CE-CB 4.34Å; M1403-L1412 CarbonylContact C-O 3.56Å; M1403-L1412 VanDerWaalsContact CA-O 3.24Å; M1403-L1412 WeakPolarHBondContact CA-O 3.43Å; M1403-I1413 HydrophobicContact CB-CG1 4.08Å
1404	K	83.3	Confident	82	Confident	48 Å²	48	50.5 Å²	50.5	21%	0.209	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	129.6	167.7	-165.4	73.9	175.3	-152.7	0	109.3	F1045 D1047 N1048 L1412	F1045-K1404 HydrophobicContact CB-CD 3.92Å; F1045-K1404 HydrophobicContact CD1-CB 4Å; F1045-K1404 HydrophobicContact CD1-CG 4.38Å; F1045-K1404 HydrophobicContact CD2-CB 3.85Å; F1045-K1404 HydrophobicContact CE1-CB 4.12Å; F1045-K1404 HydrophobicContact CE2-CB 3.95Å; F1045-K1404 HydrophobicContact CG-CB 3.87Å; F1045-K1404 HydrophobicContact CG-CD 4.18Å; F1045-K1404 HydrophobicContact CG-CG 4.3Å; F1045-K1404 HydrophobicContact CZ-CB 4.09Å; D1047-K1404 WeakPolarHBondContact O-CE 3.28Å; D1047-K1404 PolarHBondContact O-NZ 3.49Å; D1047-K1404 VanDerWaalsContact O-NZ 3.17Å; N1048-K1404 WeakPolarHBondContact OD1-CE 3.37Å; K1404-L1412 PolarHBondContact N-O 3.44Å; K1404-L1412 PolarHBondContact O-N 2.88Å
1405	K	78.7	Confident	82.3	Confident	94 Å²	94	50.3 Å²	50.3	41%	0.409	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	111.4	173.6	-172.8	179	176.1	-170.3	0	107.8	M1403 T1407 D1408	M1403-K1405 HydrophobicContact CE-CB 4.34Å; K1405-T1407 WeakPolarHBondContact CE-O 3.39Å; K1405-T1407 WeakPolarHBondContact CG-O 3.47Å; K1405-D1408 VanDerWaalsContact CE-OD1 3.23Å; K1405-D1408 WeakPolarHBondContact CE-OD1 3.47Å; K1405-D1408 IonicContact NZ-OD1 2.66Å; K1405-D1408 PolarHBondContact NZ-OD1 3.34Å
1406	I	74.6	Confident	82.7	Confident	58 Å²	58	42.8 Å²	42.8	30%	0.297	22%	0.223	S	C	.	.			trans	-87.5	-46.5	-178.5	-60	173.4	0	0	0	109.4	H1410 L1412	I1406-H1410 PolarHBondContact N-O 3Å; I1406-L1412 HydrophobicContact CD1-CB 3.9Å; I1406-L1412 HydrophobicContact CG1-CB 4.41Å
1407	T	69.2	Low	82.8	Confident	67 Å²	67	41.8 Å²	41.8	41%	0.411	22%	0.217	S	C	.	.	S	Bend	trans	-136.4	173.8	172.4	61.7	0	0	0	0	109.8	K1405 S1409 H1410	K1405-T1407 WeakPolarHBondContact CE-O 3.39Å; K1405-T1407 WeakPolarHBondContact CG-O 3.47Å; T1407-S1409 PolarHBondContact O-N 3.32Å; T1407-S1409 PolarHBondContact OG1-OG 2.86Å; T1407-H1410 PolarHBondContact N-O 3.33Å; T1407-H1410 VanDerWaalsContact N-O 3.1Å; T1407-H1410 PolarHBondContact O-N 3.05Å; T1407-H1410 WeakPolarHBondContact OG1-CB 3.36Å; T1407-H1410 PolarHBondContact OG1-N 3.21Å
1408	D	67.1	Low	82.5	Confident	144 Å²	144	41 Å²	41	77%	0.77	21%	0.212	S	C	*	.	S	Bend	trans	-60.2	-23.4	174.4	-73	-34.9	0	0	0	113.7	K1405	K1405-D1408 VanDerWaalsContact CE-OD1 3.23Å; K1405-D1408 WeakPolarHBondContact CE-OD1 3.47Å; K1405-D1408 IonicContact NZ-OD1 2.66Å; K1405-D1408 PolarHBondContact NZ-OD1 3.34Å
1409	S	65.3	Low	82.1	Confident	105 Å²	105	45.2 Å²	45.2	73%	0.734	23%	0.228	S	C	*	.	S	Bend	trans	-106.4	-23.6	179.2	59.4	0	0	0	0	114.2	T1407	T1407-S1409 PolarHBondContact O-N 3.32Å; T1407-S1409 PolarHBondContact OG1-OG 2.86Å
1410	H	69.4	Low	81.4	Confident	75 Å²	75	41.7 Å²	41.7	35%	0.347	22%	0.215	S	C	.	.			trans	-111.9	114.9	-175.1	-159.8	61	0	0	0	111.5	I1406 T1407	I1406-H1410 PolarHBondContact N-O 3Å; T1407-H1410 PolarHBondContact N-O 3.33Å; T1407-H1410 VanDerWaalsContact N-O 3.1Å; T1407-H1410 PolarHBondContact O-N 3.05Å; T1407-H1410 WeakPolarHBondContact OG1-CB 3.36Å; T1407-H1410 PolarHBondContact OG1-N 3.21Å
1411	I	76.2	Confident	80.3	Confident	23 Å²	23	43.1 Å²	43.1	12%	0.118	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.3	176.6	-55.6	121.1	0	0	0	108.2	Y1279 I1413	Y1279-I1411 HydrophobicContact CE1-CD1 3.41Å; Y1279-I1411 VanDerWaalsContact CE1-CD1 3.41Å; Y1279-I1411 HydrophobicContact CE1-CG1 3.9Å; Y1279-I1411 HydrophobicContact CE1-CG2 4.36Å; Y1279-I1411 HydrophobicContact CE2-CG1 4.33Å; Y1279-I1411 HydrophobicContact CE2-CG2 4.45Å; Y1279-I1411 VanDerWaalsContact CZ-CD1 3.46Å; Y1279-I1411 WeakPolarHBondContact OH-CD1 3.44Å; Y1279-I1411 WeakPolarHBondContact OH-CG1 3.46Å; I1411-I1413 HydrophobicContact CG2-CG1 4.08Å
1412	L	80.6	Confident	79.2	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127	173.7	-177.8	78.8	0	0	0	108.9	F1045 V1068 M1403 K1404 I1406 I1414 K1428	F1045-L1412 HydrophobicContact CE1-CD2 3.4Å; F1045-L1412 VanDerWaalsContact CE1-CD2 3.4Å; F1045-L1412 HydrophobicContact CZ-CD2 3.37Å; F1045-L1412 HydrophobicContact CZ-CG 4.23Å; V1068-L1412 HydrophobicContact CB-CD2 4.05Å; V1068-L1412 HydrophobicContact CG1-CD1 3.32Å; V1068-L1412 HydrophobicContact CG1-CD2 3.4Å; V1068-L1412 VanDerWaalsContact CG1-CD2 3.4Å; V1068-L1412 HydrophobicContact CG1-CG 3.95Å; V1068-L1412 HydrophobicContact CG2-CD2 3.64Å; M1403-L1412 CarbonylContact C-O 3.56Å; M1403-L1412 VanDerWaalsContact CA-O 3.24Å; M1403-L1412 WeakPolarHBondContact CA-O 3.43Å; K1404-L1412 PolarHBondContact N-O 3.44Å; K1404-L1412 PolarHBondContact O-N 2.88Å; I1406-L1412 HydrophobicContact CD1-CB 3.9Å; I1406-L1412 HydrophobicContact CG1-CB 4.41Å; L1412-I1414 HydrophobicContact CD2-CD1 4.29Å; L1412-I1414 HydrophobicContact CG-CG1 4.41Å; L1412-K1428 HydrophobicContact CD1-CD 3.92Å; L1412-K1428 HydrophobicContact CD1-CG 3.68Å
1413	I	87.4	Confident	77.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134	172.6	-60.6	174.1	0	0	0	107.5	L1277 W1284 V1402 M1403 I1411 W1429 W1439	L1277-I1413 HydrophobicContact CD2-CG2 4.39Å; W1284-I1413 HydrophobicContact CD2-CD1 4.07Å; W1284-I1413 VanDerWaalsContact CE2-CD1 3.43Å; W1284-I1413 HydrophobicContact CE3-CG2 4.22Å; W1284-I1413 HydrophobicContact CH2-CD1 4.02Å; W1284-I1413 HydrophobicContact CZ2-CD1 3.41Å; W1284-I1413 VanDerWaalsContact CZ2-CD1 3.41Å; W1284-I1413 HydrophobicContact CZ3-CG2 4.26Å; V1402-I1413 WeakPolarHBondContact O-CA 3.32Å; M1403-I1413 HydrophobicContact CB-CG1 4.08Å; I1411-I1413 HydrophobicContact CG2-CG1 4.08Å; I1413-W1429 HydrophobicContact CB-CB 4.07Å; I1413-W1429 HydrophobicContact CG2-CB 4.47Å; I1413-W1429 PolarHBondContact O-N 2.89Å; I1413-W1439 HydrophobicContact CD1-CH2 3.88Å; I1413-W1439 HydrophobicContact CD1-CZ3 4.11Å
1414	I	89.5	Confident	76.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.9	175.8	-62	-179.2	0	0	0	108.6	I1043 F1045 L1051 V1068 L1401 V1402 L1412 V1426 L1427 I1444	I1043-I1414 HydrophobicContact CD1-CG2 4.31Å; F1045-I1414 HydrophobicContact CE1-CD1 4.12Å; F1045-I1414 HydrophobicContact CZ-CD1 3.62Å; F1045-I1414 HydrophobicContact CZ-CG1 4.05Å; L1051-I1414 HydrophobicContact CD1-CD1 4.49Å; L1051-I1414 HydrophobicContact CD2-CD1 3.48Å; L1051-I1414 VanDerWaalsContact CD2-CD1 3.48Å; L1051-I1414 HydrophobicContact CD2-CG2 4.22Å; L1051-I1414 HydrophobicContact CG-CD1 4.39Å; V1068-I1414 HydrophobicContact CG2-CD1 4.12Å; L1401-I1414 WeakPolarHBondContact CA-O 3.24Å; V1402-I1414 HydrophobicContact CG2-CB 3.94Å; V1402-I1414 PolarHBondContact N-O 3.32Å; V1402-I1414 PolarHBondContact O-N 3.25Å; L1412-I1414 HydrophobicContact CD2-CD1 4.29Å; L1412-I1414 HydrophobicContact CG-CG1 4.41Å; I1414-V1426 HydrophobicContact CG2-CG1 3.58Å; I1414-L1427 VanDerWaalsContact CA-O 3.31Å; I1414-L1427 WeakPolarHBondContact CA-O 3.4Å; I1414-I1444 HydrophobicContact CD1-CD1 4.33Å
1415	S	90.3	Very high	76.4	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.014	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.5	171.2	64.7	0	0	0	0	110.5	F1400 V1426 L1427 W1429	F1400-S1415 WeakPolarHBondContact O-CA 3.47Å; S1415-V1426 WeakPolarHBondContact O-CA 3.48Å; S1415-L1427 PolarHBondContact N-O 2.92Å; S1415-L1427 PolarHBondContact O-N 3.21Å; S1415-W1429 PolarHBondContact OG-NE1 3.43Å
1416	C	89	Confident	76.6	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.5	175.3	-62.6	0	0	0	0	112.7	I1040 I1043 I1398 R1399 F1400 A1425	I1040-C1416 HydrophobicContact CD1-CB 3.91Å; I1040-C1416 HydrophobicContact CG2-CB 4.47Å; I1043-C1416 WeakPolarHBondContact CD1-SG 3.22Å; I1398-C1416 CarbonylContact C-O 3.55Å; R1399-C1416 PolarHBondContact N-O 2.73Å; F1400-C1416 HydrophobicContact CB-CB 4.16Å; F1400-C1416 HydrophobicContact CD2-CB 4.08Å; F1400-C1416 PolarHBondContact N-O 2.95Å; F1400-C1416 PolarHBondContact O-N 2.92Å; C1416-A1425 CarbonylContact C-O 3.53Å; C1416-A1425 WeakPolarHBondContact CA-O 3.34Å
1417	S	87.1	Confident	77.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.007	21%	0.205	C	C	.	.			trans	-84.9	-162.6	173.5	84.9	0	0	0	0	111.2	T1396 P1397 A1425	T1396-S1417 WeakPolarHBondContact OG1-CB 3.41Å; T1396-S1417 PolarHBondContact OG1-OG 3.24Å; P1397-S1417 CarbonylContact O-C 3.59Å; P1397-S1417 VanDerWaalsContact O-C 3.24Å; P1397-S1417 WeakPolarHBondContact O-CA 3.37Å; S1417-A1425 PolarHBondContact N-O 3.38Å; S1417-A1425 WeakPolarHBondContact OG-CA 3.43Å
1418	T	83.3	Confident	78	Confident	17 Å²	17	35.2 Å²	35.2	10%	0.104	19%	0.188	C	C	.	.	S	Bend	trans	-81.7	-47.1	-173.8	-61.6	0	0	0	0	113.8	V1039 I1040 T1396 P1397	V1039-T1418 CarbonylContact C-O 3.54Å; V1039-T1418 WeakPolarHBondContact CA-O 3.29Å; V1039-T1418 HydrophobicContact CG1-CG2 4.35Å; I1040-T1418 PolarHBondContact N-O 3.43Å; T1396-T1418 PolarHBondContact OG1-N 3.48Å; P1397-T1418 WeakPolarHBondContact CA-OG1 3.45Å; P1397-T1418 PolarHBondContact O-N 2.9Å; P1397-T1418 PolarHBondContact O-OG1 3.06Å
1419	Y	81.6	Confident	78.8	Confident	89 Å²	89	28.4 Å²	28.4	35%	0.349	15%	0.152	S	C	.	.	B	Isolated β-bridge	trans	-102.9	133.6	-173.6	-54.7	-70.2	0	0	0	110	A1038 V1039 T1396 N1421 D1422 A1425	A1038-Y1419 CarbonylContact O-C 3.59Å; A1038-Y1419 WeakPolarHBondContact O-CA 3.44Å; V1039-Y1419 HydrophobicContact CG2-CD1 3.86Å; V1039-Y1419 HydrophobicContact CG2-CE1 3.86Å; T1396-Y1419 HydrophobicContact CG2-CD2 3.81Å; T1396-Y1419 HydrophobicContact CG2-CE2 3.73Å; Y1419-N1421 PolarHBondContact O-N 3.25Å; Y1419-D1422 WeakPolarHBondContact CD2-OD2 3.38Å; Y1419-D1422 WeakPolarHBondContact O-CB 3.3Å; Y1419-D1422 PolarHBondContact O-N 3.43Å; Y1419-D1422 VanDerWaalsContact O-N 3.17Å; Y1419-A1425 WeakPolarHBondContact O-CB 3.19Å
1420	F	76.1	Confident	79.4	Confident	15 Å²	15	26 Å²	26	7%	0.066	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-31.4	-178.1	-179.6	-100.8	0	0	0	112.5	A1038 I1040 I1053 Y1055 M1073 A1425	A1038-F1420 HydrophobicContact CB-CB 4.27Å; A1038-F1420 WeakPolarHBondContact O-CB 3.48Å; A1038-F1420 PolarHBondContact O-N 3.34Å; I1040-F1420 HydrophobicContact CG1-CB 3.93Å; I1040-F1420 HydrophobicContact CG1-CD2 4.22Å; I1053-F1420 HydrophobicContact CG2-CD2 4.13Å; I1053-F1420 HydrophobicContact CG2-CE2 4.11Å; Y1055-F1420 HydrophobicContact CD1-CD1 4.39Å; Y1055-F1420 AromaticContact CD1-CD2 3.59Å; Y1055-F1420 HydrophobicContact CD1-CD2 3.59Å; Y1055-F1420 HydrophobicContact CD1-CE1 4.25Å; Y1055-F1420 AromaticContact CD1-CE2 3.39Å; Y1055-F1420 HydrophobicContact CD1-CE2 3.39Å; Y1055-F1420 HydrophobicContact CD1-CG 4.09Å; Y1055-F1420 AromaticContact CD1-CZ 3.75Å; Y1055-F1420 HydrophobicContact CD1-CZ 3.75Å; Y1055-F1420 HydrophobicContact CD2-CB 4.01Å; Y1055-F1420 AromaticContact CD2-CD1 3.47Å; Y1055-F1420 HydrophobicContact CD2-CD1 3.47Å; Y1055-F1420 VanDerWaalsContact CD2-CD1 3.47Å; Y1055-F1420 AromaticContact CD2-CD2 3.93Å; Y1055-F1420 HydrophobicContact CD2-CD2 3.93Å; Y1055-F1420 AromaticContact CD2-CE1 3.83Å; Y1055-F1420 HydrophobicContact CD2-CE1 3.83Å; Y1055-F1420 HydrophobicContact CD2-CE2 4.23Å; Y1055-F1420 AromaticContact CD2-CG 3.53Å; Y1055-F1420 HydrophobicContact CD2-CG 3.53Å; Y1055-F1420 HydrophobicContact CD2-CZ 4.18Å; Y1055-F1420 HydrophobicContact CE1-CD2 4.26Å; Y1055-F1420 HydrophobicContact CE1-CE1 4.02Å; Y1055-F1420 AromaticContact CE1-CE2 3.67Å; Y1055-F1420 HydrophobicContact CE1-CE2 3.67Å; Y1055-F1420 AromaticContact CE1-CZ 3.53Å; Y1055-F1420 HydrophobicContact CE1-CZ 3.53Å; Y1055-F1420 AromaticContact CE2-CD1 3.64Å; Y1055-F1420 HydrophobicContact CE2-CD1 3.64Å; Y1055-F1420 AromaticContact CE2-CE1 3.55Å; Y1055-F1420 HydrophobicContact CE2-CE1 3.55Å; Y1055-F1420 HydrophobicContact CE2-CE2 4.44Å; Y1055-F1420 HydrophobicContact CE2-CG 4.15Å; Y1055-F1420 AromaticContact CE2-CZ 3.96Å; Y1055-F1420 HydrophobicContact CE2-CZ 3.96Å; Y1055-F1420 HydrophobicContact CG-CB 4.02Å; Y1055-F1420 AromaticContact CG-CD1 3.88Å; Y1055-F1420 HydrophobicContact CG-CD1 3.88Å; Y1055-F1420 AromaticContact CG-CD2 3.42Å; Y1055-F1420 HydrophobicContact CG-CD2 3.42Å; Y1055-F1420 VanDerWaalsContact CG-CD2 3.42Å; Y1055-F1420 HydrophobicContact CG-CE1 4.18Å; Y1055-F1420 AromaticContact CG-CE2 3.71Å; Y1055-F1420 HydrophobicContact CG-CE2 3.71Å; Y1055-F1420 AromaticContact CG-CG 3.5Å; Y1055-F1420 HydrophobicContact CG-CG 3.5Å; Y1055-F1420 VanDerWaalsContact CG-CG 3.5Å; Y1055-F1420 HydrophobicContact CG-CZ 4.08Å; Y1055-F1420 AromaticContact CZ-CE1 3.65Å; Y1055-F1420 AromaticContact CZ-CZ 3.63Å; M1073-F1420 HydrophobicContact CE-CD2 4.34Å; M1073-F1420 HydrophobicContact CE-CE1 3.98Å; M1073-F1420 HydrophobicContact CE-CE2 3.43Å; M1073-F1420 VanDerWaalsContact CE-CE2 3.43Å; M1073-F1420 HydrophobicContact CE-CZ 3.21Å; M1073-F1420 HydrophobicContact SD-CD2 4.48Å; M1073-F1420 HydrophobicContact SD-CE2 3.37Å; M1073-F1420 WeakPolarHBondContact SD-CE2 3.17Å; M1073-F1420 HydrophobicContact SD-CZ 3.55Å; M1073-F1420 VanDerWaalsContact SD-CZ 3.55Å; F1420-A1425 VanDerWaalsContact O-CB 3.3Å; F1420-A1425 WeakPolarHBondContact O-CB 3.33Å
1421	N	68.6	Low	79.5	Confident	73 Å²	73	28.4 Å²	28.4	39%	0.39	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	5.1	180	-61.9	-33.9	0	0	0	113	E1035 Y1419	E1035-N1421 PolarHBondContact O-ND2 2.88Å; Y1419-N1421 PolarHBondContact O-N 3.25Å
1422	D	68.7	Low	79	Confident	53 Å²	53	29.5 Å²	29.5	28%	0.283	14%	0.14	S	C	.	.	S	Bend	trans	-66.1	144.5	168.6	-79.5	-10.6	0	0	0	109.4	T1396 Y1419 D1424 A1425	T1396-D1422 PolarHBondContact OG1-OD2 3.45Å; T1396-D1422 VanDerWaalsContact OG1-OD2 3.09Å; Y1419-D1422 WeakPolarHBondContact CD2-OD2 3.38Å; Y1419-D1422 WeakPolarHBondContact O-CB 3.3Å; Y1419-D1422 PolarHBondContact O-N 3.43Å; Y1419-D1422 VanDerWaalsContact O-N 3.17Å; D1422-D1424 PolarHBondContact O-N 3.39Å; D1422-A1425 HydrophobicContact CB-CB 4.18Å; D1422-A1425 WeakPolarHBondContact O-CB 3.38Å; D1422-A1425 PolarHBondContact O-N 3.39Å
1423	D	61.3	Low	78.1	Confident	60 Å²	60	35.8 Å²	35.8	32%	0.321	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-34.6	-180	-85.6	-11.5	0	0	0	114.2	P1457 A1458 Y1459	D1423-P1457 HydrophobicContact CB-CB 4.48Å; D1423-A1458 VanDerWaalsContact CG-N 3.32Å; D1423-A1458 WeakPolarHBondContact OD1-CA 3.44Å; D1423-A1458 WeakPolarHBondContact OD1-CB 3.34Å; D1423-A1458 PolarHBondContact OD1-N 3.46Å; D1423-A1458 WeakPolarHBondContact OD2-CB 3.48Å; D1423-A1458 PolarHBondContact OD2-N 3.13Å; D1423-Y1459 HydrophobicContact CB-CD1 3.69Å; D1423-Y1459 HydrophobicContact CB-CE1 4.38Å; D1423-Y1459 PolarHBondContact OD2-N 3.41Å
1424	D	66	Low	76.6	Confident	51 Å²	51	42.7 Å²	42.7	27%	0.273	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	27.9	177.7	-57.7	-53.4	0	0	0	111.2	V1393 D1422 V1426 L1427	V1393-D1424 WeakPolarHBondContact O-CB 3.36Å; D1422-D1424 PolarHBondContact O-N 3.39Å; D1424-V1426 VanDerWaalsContact C-N 3.29Å; D1424-V1426 PolarHBondContact O-N 3.49Å; D1424-L1427 HydrophobicContact CB-CD1 4.35Å; D1424-L1427 HydrophobicContact CB-CD2 4.44Å
1425	A	74.7	Confident	74.8	Confident	4 Å²	4	47.3 Å²	47.3	3%	0.033	24%	0.235	C	C	.	.	S	Bend	trans	-59.4	-39.1	-176.8	0	0	0	0	0	113	I1040 C1416 S1417 Y1419 F1420 D1422	I1040-A1425 HydrophobicContact CD1-CB 4.26Å; C1416-A1425 CarbonylContact C-O 3.53Å; C1416-A1425 WeakPolarHBondContact CA-O 3.34Å; S1417-A1425 PolarHBondContact N-O 3.38Å; S1417-A1425 WeakPolarHBondContact OG-CA 3.43Å; Y1419-A1425 WeakPolarHBondContact O-CB 3.19Å; F1420-A1425 VanDerWaalsContact O-CB 3.3Å; F1420-A1425 WeakPolarHBondContact O-CB 3.33Å; D1422-A1425 HydrophobicContact CB-CB 4.18Å; D1422-A1425 WeakPolarHBondContact O-CB 3.38Å; D1422-A1425 PolarHBondContact O-N 3.39Å
1426	V	83.5	Confident	72.9	Confident	10 Å²	10	49 Å²	49	6%	0.061	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	112.7	-175.9	-169.1	0	0	0	0	109.3	I1040 I1053 I1414 S1415 D1424 I1444	I1040-V1426 HydrophobicContact CD1-CG2 4.2Å; I1053-V1426 HydrophobicContact CD1-CG1 4.06Å; I1053-V1426 HydrophobicContact CD1-CG2 3.67Å; I1414-V1426 HydrophobicContact CG2-CG1 3.58Å; S1415-V1426 WeakPolarHBondContact O-CA 3.48Å; D1424-V1426 VanDerWaalsContact C-N 3.29Å; D1424-V1426 PolarHBondContact O-N 3.49Å; V1426-I1444 HydrophobicContact CG1-CD1 3.63Å; V1426-I1444 HydrophobicContact CG1-CG1 4.24Å; V1426-I1444 PolarHBondContact O-N 2.91Å
1427	L	85.6	Confident	71.4	Confident	2 Å²	2	53 Å²	53	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.6	-178.3	-60.2	176	0	0	0	110.8	V1393 I1414 S1415 D1424 N1441 P1443	V1393-L1427 HydrophobicContact CB-CD1 3.59Å; V1393-L1427 HydrophobicContact CG1-CD1 4.08Å; V1393-L1427 HydrophobicContact CG2-CD1 4.09Å; I1414-L1427 VanDerWaalsContact CA-O 3.31Å; I1414-L1427 WeakPolarHBondContact CA-O 3.4Å; S1415-L1427 PolarHBondContact N-O 2.92Å; S1415-L1427 PolarHBondContact O-N 3.21Å; D1424-L1427 HydrophobicContact CB-CD1 4.35Å; D1424-L1427 HydrophobicContact CB-CD2 4.44Å; L1427-N1441 HydrophobicContact CB-CB 4.3Å; L1427-P1443 HydrophobicContact CD2-CB 4.25Å
1428	K	85.6	Confident	70.3	Confident	13 Å²	13	57.3 Å²	57.3	6%	0.057	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	121.8	173.7	178.2	179	-179.8	-179.4	0	109.6	V1068 N1071 L1412 N1441 E1442 I1444	V1068-K1428 HydrophobicContact CG1-CD 4.02Å; V1068-K1428 PolarHBondContact O-NZ 3.43Å; N1071-K1428 WeakPolarHBondContact OD1-CD 3.37Å; N1071-K1428 PolarHBondContact OD1-NZ 3.17Å; L1412-K1428 HydrophobicContact CD1-CD 3.92Å; L1412-K1428 HydrophobicContact CD1-CG 3.68Å; K1428-N1441 CarbonylContact O-C 3.51Å; K1428-N1441 VanDerWaalsContact O-CA 3.29Å; K1428-N1441 WeakPolarHBondContact O-CA 3.28Å; K1428-E1442 PolarHBondContact N-O 2.99Å; K1428-E1442 PolarHBondContact O-N 3.16Å; K1428-I1444 HydrophobicContact CB-CD1 4.36Å; K1428-I1444 HydrophobicContact CB-CG1 4.31Å
1429	W	85.9	Confident	69.9	Low	1 Å²	1	57.6 Å²	57.6	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.2	177.8	-63.4	79.6	0	0	0	110.5	W1284 V1292 V1393 I1413 S1415 W1439 T1440 N1441	W1284-W1429 HydrophobicContact CH2-CB 4.22Å; W1284-W1429 HydrophobicContact CH2-CD2 4.14Å; W1284-W1429 HydrophobicContact CH2-CE3 4.04Å; W1284-W1429 HydrophobicContact CH2-CG 4.24Å; W1284-W1429 HydrophobicContact CZ3-CB 4.45Å; W1284-W1429 AromaticContact CZ3-CD2 3.76Å; W1284-W1429 HydrophobicContact CZ3-CD2 3.76Å; W1284-W1429 AromaticContact CZ3-CE3 3.92Å; W1284-W1429 HydrophobicContact CZ3-CE3 3.92Å; W1284-W1429 HydrophobicContact CZ3-CG 4Å; W1284-W1429 HydrophobicContact CZ3-CZ3 4.47Å; V1292-W1429 HydrophobicContact CB-CH2 4.15Å; V1292-W1429 HydrophobicContact CB-CZ2 3.86Å; V1292-W1429 HydrophobicContact CG1-CH2 4.24Å; V1292-W1429 HydrophobicContact CG1-CZ2 3.97Å; V1292-W1429 HydrophobicContact CG2-CZ2 3.92Å; V1393-W1429 HydrophobicContact CG1-CH2 3.78Å; V1393-W1429 HydrophobicContact CG1-CZ2 3.74Å; I1413-W1429 HydrophobicContact CB-CB 4.07Å; I1413-W1429 HydrophobicContact CG2-CB 4.47Å; I1413-W1429 PolarHBondContact O-N 2.89Å; S1415-W1429 PolarHBondContact OG-NE1 3.43Å; W1429-W1439 HydrophobicContact CB-CE3 4.22Å; W1429-W1439 HydrophobicContact CE3-CB 4.23Å; W1429-T1440 WeakPolarHBondContact CA-O 3.3Å; W1429-N1441 HydrophobicContact CD2-CB 4Å; W1429-N1441 HydrophobicContact CE3-CB 4.06Å; W1429-N1441 HydrophobicContact CH2-CB 4.39Å; W1429-N1441 HydrophobicContact CZ2-CB 4.32Å; W1429-N1441 HydrophobicContact CZ3-CB 4.26Å
1430	K	76	Confident	69.4	Low	54 Å²	54	56.4 Å²	56.4	24%	0.235	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	148.8	174.1	-67.9	-179.3	-174	165.5	0	109.6	W1439 T1440 E1442	K1430-W1439 WeakPolarHBondContact O-CA 3.43Å; K1430-T1440 PolarHBondContact N-O 3.2Å; K1430-T1440 PolarHBondContact O-N 3.43Å; K1430-E1442 WeakPolarHBondContact CD-OE1 3.39Å; K1430-E1442 VanDerWaalsContact CE-OE2 3.3Å; K1430-E1442 WeakPolarHBondContact CE-OE2 3.34Å; K1430-E1442 IonicContact NZ-OE1 2.72Å; K1430-E1442 PolarHBondContact NZ-OE1 3.34Å; K1430-E1442 IonicContact NZ-OE2 2.7Å; K1430-E1442 PolarHBondContact NZ-OE2 2.8Å
1431	R	72.6	Confident	69.6	Low	126 Å²	126	58.5 Å²	58.5	48%	0.475	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	123.8	172.1	-168.8	174.7	178.8	171.1	1.8	108.5	N1433 G1436 W1439	R1431-N1433 PolarHBondContact O-N 3.49Å; R1431-G1436 PolarHBondContact NH2-O 3.37Å; R1431-W1439 HydrophobicContact CB-CD2 4.28Å; R1431-W1439 HydrophobicContact CB-CE3 4.1Å; R1431-W1439 HydrophobicContact CB-CH2 4.14Å; R1431-W1439 HydrophobicContact CB-CZ2 4.29Å; R1431-W1439 HydrophobicContact CB-CZ3 4.04Å
1432	D	66	Low	70	Confident	46 Å²	46	58 Å²	58	25%	0.246	31%	0.311	C	S	.	.			trans	-71.2	111.2	174.9	-179.6	9	0	0	0	109.6	N1434 N1435 G1436 I1438	D1432-N1434 PolarHBondContact O-N 2.85Å; D1432-N1434 WeakPolarHBondContact OD1-CB 3.49Å; D1432-N1434 PolarHBondContact OD1-N 3.24Å; D1432-N1435 PolarHBondContact OD2-ND2 2.84Å; D1432-G1436 PolarHBondContact O-N 3.46Å; D1432-I1438 PolarHBondContact N-O 3.49Å
1433	N	62.2	Low	70.3	Confident	134 Å²	134	56 Å²	56	72%	0.717	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.7	-179.9	-73	-17.9	0	0	0	112.4	R1431	R1431-N1433 PolarHBondContact O-N 3.49Å
1434	N	55.7	Low	70.9	Confident	145 Å²	145	53.7 Å²	53.7	78%	0.775	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-31.1	-174.1	-66.7	-22.1	0	0	0	112.8	D1432	D1432-N1434 PolarHBondContact O-N 2.85Å; D1432-N1434 WeakPolarHBondContact OD1-CB 3.49Å; D1432-N1434 PolarHBondContact OD1-N 3.24Å
1435	N	52	Low	71.1	Confident	96 Å²	96	54.4 Å²	54.4	51%	0.513	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	5.6	179.8	-68.7	-43.6	0	0	0	113.8	D1432 S1437 I1438	D1432-N1435 PolarHBondContact OD2-ND2 2.84Å; N1435-S1437 PolarHBondContact O-N 3.4Å; N1435-I1438 HydrophobicContact CB-CD1 4.08Å
1436	G	50.4	Low	70.8	Confident	37 Å²	37	57 Å²	57	38%	0.381	30%	0.304	S	S	.	.	S	Bend	trans	66.9	-18.8	165.7	0	0	0	0	0	117.9	R1431 D1432	R1431-G1436 PolarHBondContact NH2-O 3.37Å; D1432-G1436 PolarHBondContact O-N 3.46Å
1437	S	56.3	Low	69.9	Low	85 Å²	85	59.4 Å²	59.4	59%	0.594	31%	0.314	S	S	*	.	S	Bend	trans	-148.8	1	-175	-71.5	0	0	0	0	115.9	N1435	N1435-S1437 PolarHBondContact O-N 3.4Å
1438	I	64.4	Low	68.9	Low	92 Å²	92	60.7 Å²	60.7	47%	0.472	32%	0.32	S	S	.	.			trans	-95.1	121.6	-178.6	-60.1	167.9	0	0	0	109.2	D1432 N1435 T1440	D1432-I1438 PolarHBondContact N-O 3.49Å; N1435-I1438 HydrophobicContact CB-CD1 4.08Å; I1438-T1440 HydrophobicContact CG2-CG2 4.21Å
1439	W	74	Confident	67.5	Low	24 Å²	24	66.2 Å²	66.2	9%	0.091	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.5	167.3	-72.2	94	0	0	0	109	W1284 V1389 I1413 W1429 K1430 R1431	W1284-W1439 HydrophobicContact CH2-CB 4.34Å; W1284-W1439 AromaticContact CH2-CD2 3.65Å; W1284-W1439 HydrophobicContact CH2-CD2 3.65Å; W1284-W1439 AromaticContact CH2-CE3 3.73Å; W1284-W1439 HydrophobicContact CH2-CE3 3.73Å; W1284-W1439 AromaticContact CH2-CG 3.93Å; W1284-W1439 HydrophobicContact CH2-CG 3.93Å; W1284-W1439 HydrophobicContact CH2-CZ3 4.25Å; W1284-W1439 AromaticContact CZ2-CD2 3.56Å; W1284-W1439 HydrophobicContact CZ2-CD2 3.56Å; W1284-W1439 AromaticContact CZ2-CE2 3.53Å; W1284-W1439 AromaticContact CZ2-CE3 3.85Å; W1284-W1439 HydrophobicContact CZ2-CE3 3.85Å; W1284-W1439 HydrophobicContact CZ2-CG 4.05Å; W1284-W1439 HydrophobicContact CZ2-CH2 4.03Å; W1284-W1439 AromaticContact CZ2-CZ2 3.78Å; W1284-W1439 HydrophobicContact CZ2-CZ2 3.78Å; W1284-W1439 HydrophobicContact CZ2-CZ3 4.07Å; W1284-W1439 AromaticContact CZ2-NE1 3.94Å; V1389-W1439 HydrophobicContact CG2-CB 4.31Å; I1413-W1439 HydrophobicContact CD1-CH2 3.88Å; I1413-W1439 HydrophobicContact CD1-CZ3 4.11Å; W1429-W1439 HydrophobicContact CB-CE3 4.22Å; W1429-W1439 HydrophobicContact CE3-CB 4.23Å; K1430-W1439 WeakPolarHBondContact O-CA 3.43Å; R1431-W1439 HydrophobicContact CB-CD2 4.28Å; R1431-W1439 HydrophobicContact CB-CE3 4.1Å; R1431-W1439 HydrophobicContact CB-CH2 4.14Å; R1431-W1439 HydrophobicContact CB-CZ2 4.29Å; R1431-W1439 HydrophobicContact CB-CZ3 4.04Å
1440	T	72.5	Confident	66.2	Low	64 Å²	64	75 Å²	75	39%	0.393	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	156.4	172.8	57.2	0	0	0	0	109.3	W1429 K1430 I1438	W1429-T1440 WeakPolarHBondContact CA-O 3.3Å; K1430-T1440 PolarHBondContact N-O 3.2Å; K1430-T1440 PolarHBondContact O-N 3.43Å; I1438-T1440 HydrophobicContact CG2-CG2 4.21Å
1441	N	79.4	Confident	65.4	Low	59 Å²	59	75.2 Å²	75.2	32%	0.316	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	147.8	174.2	59.2	61.7	0	0	0	110.9	L1427 K1428 W1429	L1427-N1441 HydrophobicContact CB-CB 4.3Å; K1428-N1441 CarbonylContact O-C 3.51Å; K1428-N1441 VanDerWaalsContact O-CA 3.29Å; K1428-N1441 WeakPolarHBondContact O-CA 3.28Å; W1429-N1441 HydrophobicContact CD2-CB 4Å; W1429-N1441 HydrophobicContact CE3-CB 4.06Å; W1429-N1441 HydrophobicContact CH2-CB 4.39Å; W1429-N1441 HydrophobicContact CZ2-CB 4.32Å; W1429-N1441 HydrophobicContact CZ3-CB 4.26Å
1442	E	76.7	Confident	64.7	Low	61 Å²	61	76.5 Å²	76.5	29%	0.285	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135	172.5	-67.9	174.9	-170.3	0	0	108.1	N1071 K1428 K1430	N1071-E1442 PolarHBondContact ND2-OE2 2.69Å; K1428-E1442 PolarHBondContact N-O 2.99Å; K1428-E1442 PolarHBondContact O-N 3.16Å; K1430-E1442 WeakPolarHBondContact CD-OE1 3.39Å; K1430-E1442 VanDerWaalsContact CE-OE2 3.3Å; K1430-E1442 WeakPolarHBondContact CE-OE2 3.34Å; K1430-E1442 IonicContact NZ-OE1 2.72Å; K1430-E1442 PolarHBondContact NZ-OE1 3.34Å; K1430-E1442 IonicContact NZ-OE2 2.7Å; K1430-E1442 PolarHBondContact NZ-OE2 2.8Å
1443	P	75.5	Confident	64.4	Low	11 Å²	11	76.7 Å²	76.7	7%	0.071	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	154.3	173	33	-37.7	0	0	0	111.2	L1427 P1457 Y1459 M1460	L1427-P1443 HydrophobicContact CD2-CB 4.25Å; P1443-P1457 HydrophobicContact CB-CG 4.11Å; P1443-Y1459 WeakPolarHBondContact CG-OH 3.5Å; P1443-M1460 HydrophobicContact CG-CE 3.52Å; P1443-M1460 HydrophobicContact CG-SD 4.19Å
1444	I	74.7	Confident	64.3	Low	13 Å²	13	75.2 Å²	75.2	7%	0.067	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-99.1	129.3	173.1	-57.3	-168.8	0	0	0	108.9	V1066 M1073 I1414 V1426 K1428	V1066-I1444 HydrophobicContact CG1-CD1 3.52Å; V1066-I1444 HydrophobicContact CG1-CG2 3.93Å; M1073-I1444 HydrophobicContact CB-CG2 4.1Å; I1414-I1444 HydrophobicContact CD1-CD1 4.33Å; V1426-I1444 HydrophobicContact CG1-CD1 3.63Å; V1426-I1444 HydrophobicContact CG1-CG1 4.24Å; V1426-I1444 PolarHBondContact O-N 2.91Å; K1428-I1444 HydrophobicContact CB-CD1 4.36Å; K1428-I1444 HydrophobicContact CB-CG1 4.31Å
1445	Y	69.9	Low	64.6	Low	65 Å²	65	74.3 Å²	74.3	26%	0.255	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	139.6	-176.3	-60.3	-72.1	0	0	0	111.7	N1071 C1072 M1073 L1456 M1460	N1071-Y1445 HydrophobicContact CB-CD2 4.48Å; N1071-Y1445 PolarHBondContact O-N 3.49Å; C1072-Y1445 CarbonylContact C-O 3.2Å; C1072-Y1445 VanDerWaalsContact CA-O 3.29Å; C1072-Y1445 WeakPolarHBondContact CA-O 3.37Å; M1073-Y1445 PolarHBondContact N-O 3.16Å; Y1445-L1456 HydrophobicContact CD1-CD2 3.99Å; Y1445-L1456 HydrophobicContact CE1-CD2 3.47Å; Y1445-L1456 VanDerWaalsContact CE1-CD2 3.47Å; Y1445-M1460 HydrophobicContact CE1-SD 4.22Å
1446	V	67.5	Low	64.8	Low	60 Å²	60	72.7 Å²	72.7	36%	0.364	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	120.8	173.3	-172.1	0	0	0	0	109.3	M1073 R1455	M1073-V1446 HydrophobicContact CE-CG2 3.6Å; V1446-R1455 PolarHBondContact O-N 3.39Å
1447	F	65.8	Low	65	Low	60 Å²	60	71.7 Å²	71.7	26%	0.263	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	111.3	173.5	-177	-98.9	0	0	0	109.6	M1073 R1449 L1454	M1073-F1447 PolarHBondContact O-N 2.69Å; F1447-R1449 HydrophobicContact CE1-CG 4.4Å; F1447-L1454 HydrophobicContact CD2-CD2 4.37Å; F1447-L1454 HydrophobicContact CD2-CG 4.39Å
1448	D	63.3	Low	64.8	Low	28 Å²	28	69.1 Å²	69.1	15%	0.15	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115	177.1	179.4	3.7	0	0	0	109.6	E1450 S1451 H1452 S1453 R1455	D1448-E1450 VanDerWaalsContact C-N 3.32Å; D1448-E1450 PolarHBondContact O-N 3.48Å; D1448-E1450 PolarHBondContact OD1-N 2.86Å; D1448-E1450 VanDerWaalsContact OD1-N 3.16Å; D1448-S1451 WeakPolarHBondContact CB-OG 3.46Å; D1448-S1451 PolarHBondContact OD2-OG 3.34Å; D1448-H1452 WeakPolarHBondContact O-CA 3.46Å; D1448-H1452 PolarHBondContact O-N 3.35Å; D1448-H1452 VanDerWaalsContact O-N 3.08Å; D1448-S1453 PolarHBondContact N-O 3.02Å; D1448-S1453 VanDerWaalsContact N-O 3.1Å; D1448-S1453 PolarHBondContact O-N 2.87Å; D1448-R1455 IonicContact OD2-CZ 2.98Å; D1448-R1455 IonicContact OD2-NE 2.52Å; D1448-R1455 PolarHBondContact OD2-NE 2.98Å; D1448-R1455 IonicContact OD2-NH2 3.61Å; D1448-R1455 PolarHBondContact OD2-NH2 2.96Å
1449	R	57.6	Low	64.1	Low	130 Å²	130	68.5 Å²	68.5	49%	0.491	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-35.8	-177.9	-82.2	-172.8	176.9	168.8	5.9	112.1	Q1074 F1447	Q1074-R1449 VanDerWaalsContact CD-NH2 3.3Å; Q1074-R1449 HydrophobicContact CG-CG 4.25Å; F1447-R1449 HydrophobicContact CE1-CG 4.4Å
1450	E	56.8	Low	63.2	Low	184 Å²	184	69.7 Å²	69.7	86%	0.86	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-40.4	-173.4	-66.7	-173.8	167.4	0	0	111.9	D1448	D1448-E1450 VanDerWaalsContact C-N 3.32Å; D1448-E1450 PolarHBondContact O-N 3.48Å; D1448-E1450 PolarHBondContact OD1-N 2.86Å; D1448-E1450 VanDerWaalsContact OD1-N 3.16Å
1451	S	61.1	Low	62.3	Low	59 Å²	59	72.8 Å²	72.8	41%	0.413	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-5.9	179.1	61.3	0	0	0	0	113.7	D1448 S1453	D1448-S1451 WeakPolarHBondContact CB-OG 3.46Å; D1448-S1451 PolarHBondContact OD2-OG 3.34Å; S1451-S1453 PolarHBondContact O-N 3.23Å; S1451-S1453 VanDerWaalsContact O-N 3.08Å; S1451-S1453 PolarHBondContact OG-OG 2.93Å
1452	H	57.9	Low	60.9	Low	153 Å²	153	75 Å²	75	71%	0.708	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	33.8	-168.8	-75.3	-67.2	0	0	0	112.8	D1448	D1448-H1452 WeakPolarHBondContact O-CA 3.46Å; D1448-H1452 PolarHBondContact O-N 3.35Å; D1448-H1452 VanDerWaalsContact O-N 3.08Å
1453	S	59	Low	59.7	Low	50 Å²	50	75.1 Å²	75.1	35%	0.35	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145.2	-173.5	78.4	0	0	0	0	112	D1448 S1451	D1448-S1453 PolarHBondContact N-O 3.02Å; D1448-S1453 VanDerWaalsContact N-O 3.1Å; D1448-S1453 PolarHBondContact O-N 2.87Å; S1451-S1453 PolarHBondContact O-N 3.23Å; S1451-S1453 VanDerWaalsContact O-N 3.08Å; S1451-S1453 PolarHBondContact OG-OG 2.93Å
1454	L	60.5	Low	58.6	Low	104 Å²	104	78.3 Å²	78.3	55%	0.545	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	115.1	170.9	-77.1	155.3	0	0	0	108.3	F1447 L1456	F1447-L1454 HydrophobicContact CD2-CD2 4.37Å; F1447-L1454 HydrophobicContact CD2-CG 4.39Å; L1454-L1456 PolarHBondContact O-N 2.96Å
1455	R	61.2	Low	57.5	Low	126 Å²	126	81.3 Å²	81.3	48%	0.475	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	116.2	172.1	-70.3	-171.5	-170.6	-175.3	5.1	109.1	V1446 D1448	V1446-R1455 PolarHBondContact O-N 3.39Å; D1448-R1455 IonicContact OD2-CZ 2.98Å; D1448-R1455 IonicContact OD2-NE 2.52Å; D1448-R1455 PolarHBondContact OD2-NE 2.98Å; D1448-R1455 IonicContact OD2-NH2 3.61Å; D1448-R1455 PolarHBondContact OD2-NH2 2.96Å
1456	L	57	Low	56.7	Low	62 Å²	62	83.5 Å²	83.5	33%	0.325	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-66.8	142	169.2	-70	172.3	0	0	0	110.1	Y1445 L1454 M1460 R1461 L1464	Y1445-L1456 HydrophobicContact CD1-CD2 3.99Å; Y1445-L1456 HydrophobicContact CE1-CD2 3.47Å; Y1445-L1456 VanDerWaalsContact CE1-CD2 3.47Å; L1454-L1456 PolarHBondContact O-N 2.96Å; L1456-M1460 HydrophobicContact CD2-SD 4.48Å; L1456-R1461 HydrophobicContact CB-CG 3.99Å; L1456-R1461 PolarHBondContact O-NE 3.43Å; L1456-R1461 PolarHBondContact O-NH2 3.45Å; L1456-L1464 HydrophobicContact CD1-CD1 4.26Å
1457	P	55	Low	56	Low	15 Å²	15	86.2 Å²	86.2	10%	0.097	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-51.5	144.3	166.6	-26.2	34.7	0	0	0	111.5	D1423 P1443 Y1459 M1460 R1461	D1423-P1457 HydrophobicContact CB-CB 4.48Å; P1443-P1457 HydrophobicContact CB-CG 4.11Å; P1457-Y1459 VanDerWaalsContact C-N 3.33Å; P1457-Y1459 HydrophobicContact CB-CD1 3.41Å; P1457-Y1459 VanDerWaalsContact CB-CD1 3.41Å; P1457-Y1459 HydrophobicContact CB-CE1 3.28Å; P1457-Y1459 HydrophobicContact CG-CD1 4.49Å; P1457-Y1459 HydrophobicContact CG-CE1 3.91Å; P1457-Y1459 PolarHBondContact O-N 3.38Å; P1457-M1460 WeakPolarHBondContact O-CB 3.3Å; P1457-M1460 PolarHBondContact O-N 3.44Å; P1457-M1460 VanDerWaalsContact O-N 3.12Å; P1457-R1461 PolarHBondContact O-N 3.45Å
1458	A	51	Low	55.2	Low	32 Å²	32	88.8 Å²	88.8	26%	0.264	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-33	-173.4	0	0	0	0	0	112.9	D1423 M1460 R1461 N1462	D1423-A1458 VanDerWaalsContact CG-N 3.32Å; D1423-A1458 WeakPolarHBondContact OD1-CA 3.44Å; D1423-A1458 WeakPolarHBondContact OD1-CB 3.34Å; D1423-A1458 PolarHBondContact OD1-N 3.46Å; D1423-A1458 WeakPolarHBondContact OD2-CB 3.48Å; D1423-A1458 PolarHBondContact OD2-N 3.13Å; A1458-M1460 VanDerWaalsContact C-N 3.32Å; A1458-M1460 PolarHBondContact O-N 2.89Å; A1458-R1461 WeakPolarHBondContact O-CB 3.13Å; A1458-R1461 PolarHBondContact O-N 2.81Å; A1458-R1461 VanDerWaalsContact O-N 3.13Å; A1458-N1462 PolarHBondContact O-N 3.3Å
1459	Y	50.9	Low	54.6	Low	78 Å²	78	94 Å²	94	31%	0.306	47%	0.467	S	S	.	.	H	α-helix	trans	-61.6	-38.7	172.6	81.8	-78.9	0	0	0	112.5	D1423 P1443 P1457 N1462 S1463	D1423-Y1459 HydrophobicContact CB-CD1 3.69Å; D1423-Y1459 HydrophobicContact CB-CE1 4.38Å; D1423-Y1459 PolarHBondContact OD2-N 3.41Å; P1443-Y1459 WeakPolarHBondContact CG-OH 3.5Å; P1457-Y1459 VanDerWaalsContact C-N 3.33Å; P1457-Y1459 HydrophobicContact CB-CD1 3.41Å; P1457-Y1459 VanDerWaalsContact CB-CD1 3.41Å; P1457-Y1459 HydrophobicContact CB-CE1 3.28Å; P1457-Y1459 HydrophobicContact CG-CD1 4.49Å; P1457-Y1459 HydrophobicContact CG-CE1 3.91Å; P1457-Y1459 PolarHBondContact O-N 3.38Å; Y1459-N1462 PolarHBondContact O-N 3.4Å; Y1459-S1463 PolarHBondContact O-N 3.04Å
1460	M	54.7	Low	54.2	Low	50 Å²	50	92.2 Å²	92.2	25%	0.246	47%	0.468	C	S	.	.	H	α-helix	trans	-68	-40.2	172.7	-77.6	-168.3	168.6	0	0	110.9	P1443 Y1445 L1456 P1457 A1458 N1462 S1463 L1464	P1443-M1460 HydrophobicContact CG-CE 3.52Å; P1443-M1460 HydrophobicContact CG-SD 4.19Å; Y1445-M1460 HydrophobicContact CE1-SD 4.22Å; L1456-M1460 HydrophobicContact CD2-SD 4.48Å; P1457-M1460 WeakPolarHBondContact O-CB 3.3Å; P1457-M1460 PolarHBondContact O-N 3.44Å; P1457-M1460 VanDerWaalsContact O-N 3.12Å; A1458-M1460 VanDerWaalsContact C-N 3.32Å; A1458-M1460 PolarHBondContact O-N 2.89Å; M1460-N1462 VanDerWaalsContact C-N 3.34Å; M1460-N1462 PolarHBondContact O-N 3.22Å; M1460-S1463 PolarHBondContact O-N 3.32Å; M1460-L1464 WeakPolarHBondContact O-CB 3.36Å; M1460-L1464 PolarHBondContact O-N 2.89Å
1461	R	54.1	Low	53.9	Low	129 Å²	129	90.2 Å²	90.2	49%	0.487	46%	0.456	S	S	.	.	H	α-helix	trans	-60.1	-42.3	174.2	-75.7	-174.9	-105.2	159.1	-3	112	L1456 P1457 A1458 L1464 C1465	L1456-R1461 HydrophobicContact CB-CG 3.99Å; L1456-R1461 PolarHBondContact O-NE 3.43Å; L1456-R1461 PolarHBondContact O-NH2 3.45Å; P1457-R1461 PolarHBondContact O-N 3.45Å; A1458-R1461 WeakPolarHBondContact O-CB 3.13Å; A1458-R1461 PolarHBondContact O-N 2.81Å; A1458-R1461 VanDerWaalsContact O-N 3.13Å; R1461-L1464 PolarHBondContact O-N 2.87Å; R1461-C1465 VanDerWaalsContact O-CB 3.26Å; R1461-C1465 WeakPolarHBondContact O-CB 3.37Å; R1461-C1465 PolarHBondContact O-N 2.93Å
1462	N	49.5	Very low	53.2	Low	105 Å²	105	94.3 Å²	94.3	56%	0.561	47%	0.467	S	S	*	.	H	α-helix	trans	-66.6	-42.7	177.5	-75.6	-21.2	0	0	0	111.9	A1458 Y1459 M1460 C1465 L1466	A1458-N1462 PolarHBondContact O-N 3.3Å; Y1459-N1462 PolarHBondContact O-N 3.4Å; M1460-N1462 VanDerWaalsContact C-N 3.34Å; M1460-N1462 PolarHBondContact O-N 3.22Å; N1462-C1465 PolarHBondContact O-N 2.89Å; N1462-L1466 WeakPolarHBondContact O-CB 3.29Å; N1462-L1466 WeakPolarHBondContact O-CG 3.42Å; N1462-L1466 PolarHBondContact O-N 3.04Å
1463	S	51.5	Low	52.6	Low	63 Å²	63	89.6 Å²	89.6	44%	0.441	45%	0.451	S	S	.	.	H	α-helix	trans	-64.9	-41.2	175.3	-168.2	0	0	0	0	112	Y1459 M1460 L1466 Q1467	Y1459-S1463 PolarHBondContact O-N 3.04Å; M1460-S1463 PolarHBondContact O-N 3.32Å; S1463-L1466 PolarHBondContact O-N 3.46Å; S1463-Q1467 WeakPolarHBondContact O-CB 3.3Å; S1463-Q1467 WeakPolarHBondContact O-CG 3.47Å; S1463-Q1467 PolarHBondContact O-N 3.4Å
1464	L	51.8	Low	52	Low	79 Å²	79	91.9 Å²	91.9	41%	0.414	46%	0.458	S	S	.	.	H	α-helix	trans	-66.6	-40.9	174	-115.9	126.7	0	0	0	112	L1456 M1460 R1461 Q1467 M1468	L1456-L1464 HydrophobicContact CD1-CD1 4.26Å; M1460-L1464 WeakPolarHBondContact O-CB 3.36Å; M1460-L1464 PolarHBondContact O-N 2.89Å; R1461-L1464 PolarHBondContact O-N 2.87Å; L1464-Q1467 PolarHBondContact O-N 3.38Å; L1464-M1468 HydrophobicContact CD2-CE 4.11Å; L1464-M1468 WeakPolarHBondContact O-CB 3.28Å; L1464-M1468 WeakPolarHBondContact O-CG 3.43Å; L1464-M1468 PolarHBondContact O-N 3.43Å
1465	C	51.5	Low	51.4	Low	75 Å²	75	92.7 Å²	92.7	51%	0.507	46%	0.462	S	S	.	.	H	α-helix	trans	-63.5	-42.1	174.1	-96	0	0	0	0	111.4	R1461 N1462 M1468 H1469	R1461-C1465 VanDerWaalsContact O-CB 3.26Å; R1461-C1465 WeakPolarHBondContact O-CB 3.37Å; R1461-C1465 PolarHBondContact O-N 2.93Å; N1462-C1465 PolarHBondContact O-N 2.89Å; C1465-M1468 PolarHBondContact O-N 3.23Å; C1465-H1469 VanDerWaalsContact O-CB 3.31Å; C1465-H1469 WeakPolarHBondContact O-CB 3.4Å; C1465-H1469 PolarHBondContact O-N 3.34Å
1466	L	53.2	Low	50.5	Low	111 Å²	111	94.5 Å²	94.5	58%	0.581	48%	0.478	S	S	*	.	H	α-helix	trans	-64.6	-42.3	174.1	-84	158.2	0	0	0	111.7	N1462 S1463 H1469 N1470	N1462-L1466 WeakPolarHBondContact O-CB 3.29Å; N1462-L1466 WeakPolarHBondContact O-CG 3.42Å; N1462-L1466 PolarHBondContact O-N 3.04Å; S1463-L1466 PolarHBondContact O-N 3.46Å; L1466-H1469 PolarHBondContact O-N 3.31Å; L1466-N1470 VanDerWaalsContact O-CB 3.29Å; L1466-N1470 WeakPolarHBondContact O-CB 3.44Å; L1466-N1470 PolarHBondContact O-N 2.87Å
1467	Q	51.8	Low	49.8	Very low	118 Å²	118	98.4 Å²	98.4	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-66.6	-37.6	174.1	-77	-172.9	-2	0	0	112.4	S1463 L1464 K1471	S1463-Q1467 WeakPolarHBondContact O-CB 3.3Å; S1463-Q1467 WeakPolarHBondContact O-CG 3.47Å; S1463-Q1467 PolarHBondContact O-N 3.4Å; L1464-Q1467 PolarHBondContact O-N 3.38Å; Q1467-K1471 VanDerWaalsContact O-CB 3.32Å; Q1467-K1471 WeakPolarHBondContact O-CB 3.5Å; Q1467-K1471 WeakPolarHBondContact O-CG 3.4Å; Q1467-K1471 PolarHBondContact O-N 2.79Å
1468	M	50.8	Low	48.8	Very low	114 Å²	114	106.4 Å²	106.4	56%	0.562	54%	0.54	S	S	*	.	H	α-helix	trans	-68.6	-39.5	174.5	-74.8	-105.1	-171	0	0	111.3	L1464 C1465 K1471 K1472	L1464-M1468 HydrophobicContact CD2-CE 4.11Å; L1464-M1468 WeakPolarHBondContact O-CB 3.28Å; L1464-M1468 WeakPolarHBondContact O-CG 3.43Å; L1464-M1468 PolarHBondContact O-N 3.43Å; C1465-M1468 PolarHBondContact O-N 3.23Å; M1468-K1471 PolarHBondContact O-N 2.85Å; M1468-K1472 WeakPolarHBondContact O-CB 3.4Å; M1468-K1472 WeakPolarHBondContact O-CG 3.25Å; M1468-K1472 PolarHBondContact O-N 3.08Å
1469	H	50.7	Low	48.7	Very low	136 Å²	136	110.1 Å²	110.1	63%	0.63	55%	0.554	S	S	*	*	H	α-helix	trans	-68	-41	174	-105.2	-72.6	0	0	0	111.7	C1465 L1466 K1472 S1473	C1465-H1469 VanDerWaalsContact O-CB 3.31Å; C1465-H1469 WeakPolarHBondContact O-CB 3.4Å; C1465-H1469 PolarHBondContact O-N 3.34Å; L1466-H1469 PolarHBondContact O-N 3.31Å; H1469-K1472 CarbonylContact O-C 3.46Å; H1469-K1472 PolarHBondContact O-N 3.33Å; H1469-S1473 WeakPolarHBondContact O-CB 3.29Å; H1469-S1473 PolarHBondContact O-N 2.97Å
1470	N	48.6	Very low	48.6	Very low	93 Å²	93	111.8 Å²	111.8	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-66.8	-39.5	173.5	-78.1	-17.5	0	0	0	111.3	L1466 S1473 I1474	L1466-N1470 VanDerWaalsContact O-CB 3.29Å; L1466-N1470 WeakPolarHBondContact O-CB 3.44Å; L1466-N1470 PolarHBondContact O-N 2.87Å; N1470-S1473 PolarHBondContact O-N 3.19Å; N1470-S1473 PolarHBondContact O-OG 2.9Å; N1470-S1473 VanDerWaalsContact O-OG 3.11Å; N1470-I1474 WeakPolarHBondContact O-CB 3.33Å; N1470-I1474 WeakPolarHBondContact O-CD1 3.28Å; N1470-I1474 WeakPolarHBondContact O-CG1 3.48Å; N1470-I1474 PolarHBondContact O-N 3.04Å
1471	K	49.9	Very low	48.2	Very low	143 Å²	143	115.2 Å²	115.2	62%	0.622	59%	0.585	S	S	*	*	H	α-helix	trans	-64.3	-40.6	171.8	-82.8	-176.3	176.1	179.9	0	111.7	Q1467 M1468 I1474 I1475	Q1467-K1471 VanDerWaalsContact O-CB 3.32Å; Q1467-K1471 WeakPolarHBondContact O-CB 3.5Å; Q1467-K1471 WeakPolarHBondContact O-CG 3.4Å; Q1467-K1471 PolarHBondContact O-N 2.79Å; M1468-K1471 PolarHBondContact O-N 2.85Å; K1471-I1474 PolarHBondContact O-N 3.14Å; K1471-I1475 WeakPolarHBondContact O-CB 3.38Å; K1471-I1475 WeakPolarHBondContact O-CD1 3.45Å; K1471-I1475 WeakPolarHBondContact O-CG1 3.39Å; K1471-I1475 PolarHBondContact O-N 3.41Å
1472	K	47.7	Very low	47.9	Very low	145 Å²	145	114.4 Å²	114.4	63%	0.63	59%	0.591	S	S	*	*	H	α-helix	trans	-67.1	-35.7	174.5	-83.3	-174.2	175.9	-178.9	0	112.6	M1468 H1469 I1475 M1476	M1468-K1472 WeakPolarHBondContact O-CB 3.4Å; M1468-K1472 WeakPolarHBondContact O-CG 3.25Å; M1468-K1472 PolarHBondContact O-N 3.08Å; H1469-K1472 CarbonylContact O-C 3.46Å; H1469-K1472 PolarHBondContact O-N 3.33Å; K1472-I1475 PolarHBondContact O-N 2.89Å; K1472-M1476 WeakPolarHBondContact O-CB 3.45Å; K1472-M1476 WeakPolarHBondContact O-CG 3.43Å; K1472-M1476 PolarHBondContact O-N 3.22Å
1473	S	44.4	Very low	47.8	Very low	53 Å²	53	115 Å²	115	37%	0.371	59%	0.593	S	S	.	*	H	α-helix	trans	-71.7	-35.9	175	81	0	0	0	0	111.5	H1469 N1470 I1475 M1476 N1477	H1469-S1473 WeakPolarHBondContact O-CB 3.29Å; H1469-S1473 PolarHBondContact O-N 2.97Å; N1470-S1473 PolarHBondContact O-N 3.19Å; N1470-S1473 PolarHBondContact O-OG 2.9Å; N1470-S1473 VanDerWaalsContact O-OG 3.11Å; S1473-I1475 VanDerWaalsContact C-N 3.33Å; S1473-M1476 PolarHBondContact O-N 2.85Å; S1473-N1477 VanDerWaalsContact O-CB 3.29Å; S1473-N1477 WeakPolarHBondContact O-CB 3.45Å; S1473-N1477 PolarHBondContact O-N 3.04Å
1474	I	46	Very low	47.5	Very low	98 Å²	98	118.5 Å²	118.5	50%	0.503	60%	0.603	S	S	.	*	H	α-helix	trans	-66.8	-34.6	172.3	-66.9	163	0	0	0	111.2	N1470 K1471 N1478	N1470-I1474 WeakPolarHBondContact O-CB 3.33Å; N1470-I1474 WeakPolarHBondContact O-CD1 3.28Å; N1470-I1474 WeakPolarHBondContact O-CG1 3.48Å; N1470-I1474 PolarHBondContact O-N 3.04Å; K1471-I1474 PolarHBondContact O-N 3.14Å; I1474-N1478 WeakPolarHBondContact O-CB 3.25Å; I1474-N1478 PolarHBondContact O-N 2.91Å; I1474-N1478 PolarHBondContact O-ND2 3.07Å
1475	I	47.5	Very low	47.2	Very low	122 Å²	122	121.3 Å²	121.3	63%	0.626	62%	0.616	S	S	*	*	H	α-helix	trans	-78.4	-24.7	175.5	-66.2	163.8	0	0	0	112.3	K1471 K1472 S1473	K1471-I1475 WeakPolarHBondContact O-CB 3.38Å; K1471-I1475 WeakPolarHBondContact O-CD1 3.45Å; K1471-I1475 WeakPolarHBondContact O-CG1 3.39Å; K1471-I1475 PolarHBondContact O-N 3.41Å; K1472-I1475 PolarHBondContact O-N 2.89Å; S1473-I1475 VanDerWaalsContact C-N 3.33Å
1476	M	43.2	Very low	46.9	Very low	164 Å²	164	124.8 Å²	124.8	81%	0.808	63%	0.625	S	S	*	*	H	α-helix	trans	-87.1	-21.3	174.1	-79	-103.1	-84	0	0	113.3	K1472 S1473	K1472-M1476 WeakPolarHBondContact O-CB 3.45Å; K1472-M1476 WeakPolarHBondContact O-CG 3.43Å; K1472-M1476 PolarHBondContact O-N 3.22Å; S1473-M1476 PolarHBondContact O-N 2.85Å
1477	N	42.8	Very low	46.4	Very low	144 Å²	144	126 Å²	126	77%	0.77	63%	0.629	S	S	*	*	H	α-helix	trans	-92.2	-9.5	174.2	-80.1	-11.6	0	0	0	113.7	S1473	S1473-N1477 VanDerWaalsContact O-CB 3.29Å; S1473-N1477 WeakPolarHBondContact O-CB 3.45Å; S1473-N1477 PolarHBondContact O-N 3.04Å
1478	N	33	Very low	45.9	Very low	182 Å²	182	126.7 Å²	126.7	97%	0.973	64%	0.636	S	S	*	*			trans	-100	0	166.6	-75.3	-24.3	0	0	0	109.3	I1474	I1474-N1478 WeakPolarHBondContact O-CB 3.25Å; I1474-N1478 PolarHBondContact O-N 2.91Å; I1474-N1478 PolarHBondContact O-ND2 3.07Å

Retrieved 1,478 of 1,478 residues in 592.4 ms (Link to these results)

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