A0A3Q0KM87_SCHMA Loading...

RUN and TBC1 domain-containing protein 3

AlphaFold DB , UniProt , Accession A0A3Q0KM87, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 975 aa.

						>A0A3Q0KM87_SCHMA|A0A3Q0KM87
MPSESCDFRESDSKDNLQYSRSDLNGQSEINENQVLRNNSIENLLDMPIHRKELTEILSFSALVPSLIPSCVYRQLDDQVTSESNVPSLVKRYFDEFGFRIDDLEENLPCPFVESSANRRAWLTCLEFSHTHTLGISSLDEYDARYSSVGSTVDEDDDQLWSRVNLRLVQSPRLTELIRGQALDVEALAKSGEQLGIPHSLRPHVWPRLTGALLKAKESKQRIPSVTYTELVQLSSTDTLLAGIQIEKDLFRTMPNNLCFHSSNSTGISRLRRVLRALAWLYVDVGYCQGMGLIVANLLLCLEEETAFWMMCSIIEDLLPPSYFSSLSLLGVQSDQLVLNHLLPFYLPELDAHLKEYEISLPLITLQWFLTLYSSVCPTALTFRIWDLLFYDGSVILFRIALALLSHKSEEILSLNNSSQIFHSLSNAPGSVTDINELIKVAYSLDDEHLEPSNISSLRRHYLAQLMVDEGSVLKPDSRPNLPKQYLAKRQFQRPKSLFTTLFASVASNGQTYRRITGMAVPFQYSIGNNELSPSSSSIHCKPAYVSVSLHEGSVEADDPKLKNVHQTEILVELKQSIQLIVRHFRTNDPEQHGGATAHADYSMESHKLDLDSYVQVVQHRRRRAKALIDFERFEVDELQFHKNDILTIINSDDEHCWIGELNDQQGWFPAKFVELLDERGKNYSPAGDDGVDRLIIGLVRGSLCHSLGAVFSHGLKRPRLLGDTGCHPWHFIEEAAAKEVERDFSSVYSRLVLCKTFRLDEECKVLSPEEVLYRTIHSINMSHDLANAHMDIKFRSLICSGLNEQLLHLWFEILCSSVKVVSKWYHPWSYLRSPGWVQIKCELRVLSQFAFHLSPTYELNSLQNFNHIRQNSFTVPKLFTSSSDSLPRRTNKSGSKVASTLGNALDFHKVKPLQRLVTASSVVDPMNDPPCLSLSSILIPNDENLNEIDSNITTAATETTGDMLVKYHLFSWEL
					

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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	33.3	Very low	30.6	Very low	237 Å²	237	159.9 Å²	159.9	100%	1.167	85%	0.848	S	S	*	*				0	128.2	0	-76.3	-72.5	176.7	0	0	107.1
2	P	32.5	Very low	30.4	Very low	107 Å²	107	158.8 Å²	158.8	70%	0.695	84%	0.843	S	S	*	*				-128.9	161.2	-93.6	38.4	-27.7	0	0	0	116
3	S	30.8	Very low	30.4	Very low	102 Å²	102	155.1 Å²	155.1	71%	0.713	84%	0.838	S	S	*	*			trans	55.5	119	139.1	62.6	0	0	0	0	120.8
4	E	36	Very low	30.2	Very low	204 Å²	204	156.5 Å²	156.5	95%	0.953	83%	0.832	S	S	*	*			trans	-148	116.9	130.7	-111.7	171.4	-161	0	0	110.4
5	S	30.3	Very low	30.3	Very low	106 Å²	106	156.4 Å²	156.4	74%	0.741	83%	0.832	S	S	*	*			trans	-91.1	133.8	-180	46.3	0	0	0	0	110.4
6	C	30	Very low	30	Very low	131 Å²	131	156.3 Å²	156.3	89%	0.885	83%	0.832	S	S	*	*			trans	-108.9	102.8	161.4	-103.7	0	0	0	0	109.7
7	D	28.6	Very low	29.9	Very low	136 Å²	136	156.2 Å²	156.2	73%	0.727	83%	0.831	S	S	*	*			trans	-57.5	129	162.1	-83.6	-38.4	0	0	0	110.9
8	F	29.1	Very low	29.7	Very low	209 Å²	209	157.9 Å²	157.9	92%	0.917	83%	0.833	S	S	*	*			trans	-115.9	106.7	150.2	-103.6	-84.4	0	0	0	108.5
9	R	30.2	Very low	29.5	Very low	221 Å²	221	161.5 Å²	161.5	83%	0.834	84%	0.836	S	S	*	*			trans	-64.9	136.5	179.2	-78.5	175.8	169.2	160.8	-2.7	112
10	E	25	Very low	29.4	Very low	190 Å²	190	158.6 Å²	158.6	89%	0.888	83%	0.83	S	S	*	*			trans	-51.1	141.8	159.2	-72.8	170.3	136.4	0	0	111.8
11	S	30.4	Very low	29.2	Very low	116 Å²	116	163.1 Å²	163.1	81%	0.811	84%	0.836	S	S	*	*			trans	-125	112	153.5	48.9	0	0	0	0	108.6
12	D	28.6	Very low	28.9	Very low	146 Å²	146	156 Å²	156	78%	0.781	81%	0.81	S	S	*	*			trans	-46.1	128.2	168.8	-82.6	-46.7	0	0	0	112
13	S	31	Very low	28.6	Very low	111 Å²	111	158.3 Å²	158.3	78%	0.776	82%	0.816	S	S	*	*			trans	-129.1	102.1	143	54.9	0	0	0	0	108.7	D15	S13-D15 PolarHBondContact O-N 3.15Å
14	K	27.2	Very low	28.5	Very low	175 Å²	175	161.4 Å²	161.4	76%	0.761	82%	0.824	S	S	*	*			trans	-62	111.6	165.9	-70.1	170.7	175.9	171.2	0	108.1
15	D	31.3	Very low	28	Very low	155 Å²	155	160.2 Å²	160.2	83%	0.829	82%	0.824	S	S	*	*			trans	-128.9	108.5	155.5	-93.4	-31.8	0	0	0	110.3	S13 L17	S13-D15 PolarHBondContact O-N 3.15Å; D15-L17 PolarHBondContact O-N 2.71Å
16	N	26.4	Very low	27.9	Very low	155 Å²	155	158.9 Å²	158.9	83%	0.829	83%	0.827	S	S	*	*			trans	-57.9	118.4	171.5	-71	-57.9	0	0	0	110.4
17	L	28.4	Very low	27.7	Very low	155 Å²	155	161.5 Å²	161.5	81%	0.812	83%	0.826	S	S	*	*			trans	-131	94	157	-89.3	160	0	0	0	109	D15 Y19	D15-L17 PolarHBondContact O-N 2.71Å; L17-Y19 PolarHBondContact O-N 2.82Å; L17-Y19 VanDerWaalsContact O-N 3.17Å
18	Q	25.2	Very low	27.6	Very low	187 Å²	187	160.2 Å²	160.2	87%	0.874	83%	0.828	S	S	*	*			trans	-49.9	113.1	163	-78.2	171.7	-42.3	0	0	109.3	S20	Q18-S20 PolarHBondContact O-N 3.03Å
19	Y	26.8	Very low	27.6	Very low	225 Å²	225	158 Å²	158	88%	0.882	82%	0.82	S	S	*	*			trans	-77.9	108.5	161.3	-97.6	-90.5	0	0	0	108.5	L17 R21	L17-Y19 PolarHBondContact O-N 2.82Å; L17-Y19 VanDerWaalsContact O-N 3.17Å; Y19-R21 PolarHBondContact O-N 2.7Å
20	S	27.2	Very low	27.4	Very low	104 Å²	104	155.8 Å²	155.8	73%	0.727	82%	0.823	S	S	*	*			trans	-58.2	114.4	172.2	-58.4	0	0	0	0	110.4	Q18 S22	Q18-S20 PolarHBondContact O-N 3.03Å; S20-S22 PolarHBondContact O-N 3.34Å
21	R	24.7	Very low	27.7	Very low	254 Å²	254	151.4 Å²	151.4	96%	0.958	81%	0.806	S	S	*	*			trans	-65.3	101.7	158.7	-83.3	176.6	166.9	167.9	-4.5	108.9	Y19	Y19-R21 PolarHBondContact O-N 2.7Å
22	S	26.3	Very low	27.8	Very low	88 Å²	88	153.6 Å²	153.6	62%	0.615	80%	0.803	S	S	*	*			trans	-166.6	118.7	159.1	47.4	0	0	0	0	107.8	S20	S20-S22 PolarHBondContact O-N 3.34Å
23	D	27.5	Very low	28.1	Very low	154 Å²	154	150.6 Å²	150.6	82%	0.824	79%	0.787	S	S	*	*	S	Bend	trans	124.1	45.5	169.8	-59.4	-12.1	0	0	0	114.5
24	L	28.2	Very low	28.3	Very low	167 Å²	167	153.1 Å²	153.1	87%	0.874	79%	0.787	S	S	*	*			trans	-138.1	66	157.2	-75.4	173.7	0	0	0	109
25	N	25.6	Very low	28.5	Very low	180 Å²	180	148.9 Å²	148.9	96%	0.963	78%	0.776	S	S	*	*			trans	-101.2	91.6	160.2	-94.6	-5	0	0	0	107.7
26	G	27.7	Very low	28.6	Very low	77 Å²	77	147.9 Å²	147.9	79%	0.794	77%	0.769	S	S	*	*			trans	-169.6	41.4	176.2	0	0	0	0	0	110.2
27	Q	26.4	Very low	29.1	Very low	186 Å²	186	146.8 Å²	146.8	87%	0.869	75%	0.754	S	S	*	*			trans	-96.7	105.7	173.7	-79.2	-178.5	-32.6	0	0	109.2
28	S	26.3	Very low	29.7	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	73%	0.731	S	S	*	*			trans	-178.2	89.3	144.1	59.5	0	0	0	0	109.3
29	E	28.4	Very low	30	Very low	162 Å²	162	138.1 Å²	138.1	76%	0.757	71%	0.714	S	S	*	*			trans	174.2	73.4	148.3	-98	171	-164.5	0	0	107.7	N31	E29-N31 PolarHBondContact O-N 3.38Å; E29-N31 VanDerWaalsContact O-N 3.07Å
30	I	26.9	Very low	30.4	Very low	175 Å²	175	129.8 Å²	129.8	90%	0.897	69%	0.688	S	S	*	*			trans	-74.1	84.1	162	-61.3	168.1	0	0	0	104.6
31	N	31.6	Very low	31	Very low	97 Å²	97	129.2 Å²	129.2	52%	0.519	68%	0.677	S	S	.	*			trans	-100.3	106.7	-176.6	-91.3	-12	0	0	0	110.1	E29 N33	E29-N31 PolarHBondContact O-N 3.38Å; E29-N31 VanDerWaalsContact O-N 3.07Å; N31-N33 PolarHBondContact O-N 2.98Å
32	E	32.8	Very low	31.6	Very low	163 Å²	163	122.8 Å²	122.8	76%	0.762	66%	0.657	S	S	*	*	S	Bend	trans	28.7	-12.2	143.6	-68.6	177.2	152.9	0	0	122.6	V35	E32-V35 WeakPolarHBondContact O-CB 3.31Å; E32-V35 PolarHBondContact O-N 3.39Å
33	N	34.7	Very low	32.1	Very low	83 Å²	83	124.2 Å²	124.2	44%	0.444	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.5	-13.9	-171.4	-72.4	-45.7	0	0	0	115.1	N31 V35	N31-N33 PolarHBondContact O-N 2.98Å; N33-V35 VanDerWaalsContact C-N 3.25Å
34	Q	34.2	Very low	32.5	Very low	164 Å²	164	121.1 Å²	121.1	77%	0.766	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-22.9	168.5	-88	176.5	-29.7	0	0	112	L36 R37	Q34-L36 VanDerWaalsContact C-N 3.31Å; Q34-L36 PolarHBondContact O-N 3.48Å; Q34-R37 PolarHBondContact O-N 2.85Å
35	V	31.1	Very low	32.9	Very low	86 Å²	86	116.9 Å²	116.9	52%	0.521	62%	0.619	S	S	.	*	H	α-helix	trans	-72.5	-23.4	-178.4	-177.9	0	0	0	0	112.2	E32 N33 N39	E32-V35 WeakPolarHBondContact O-CB 3.31Å; E32-V35 PolarHBondContact O-N 3.39Å; N33-V35 VanDerWaalsContact C-N 3.25Å; V35-N39 VanDerWaalsContact CG1-ND2 3.28Å; V35-N39 WeakPolarHBondContact CG1-ND2 3.4Å; V35-N39 PolarHBondContact O-N 3.1Å; V35-N39 PolarHBondContact O-ND2 2.8Å
36	L	33.4	Very low	33.5	Very low	133 Å²	133	114.9 Å²	114.9	70%	0.696	61%	0.608	S	S	*	*	H	α-helix	trans	-83.1	-19.4	179.5	-78.4	162.5	0	0	0	114.3	Q34	Q34-L36 VanDerWaalsContact C-N 3.31Å; Q34-L36 PolarHBondContact O-N 3.48Å
37	R	38.6	Very low	33.7	Very low	133 Å²	133	116.8 Å²	116.8	50%	0.502	60%	0.598	S	S	.	*	H	α-helix	trans	-84.9	-25.1	175.9	-79.6	-175.1	-178.8	-159.5	-6.9	113.4	Q34 L63	Q34-R37 PolarHBondContact O-N 2.85Å; R37-L63 PolarHBondContact NH2-O 3.31Å
38	N	39.8	Very low	34.1	Very low	62 Å²	62	114.3 Å²	114.3	33%	0.332	60%	0.598	S	S	.	*	H	α-helix	trans	-109.1	-16.6	-166.5	-68.9	3.4	0	0	0	113.2
39	N	30.8	Very low	34.5	Very low	97 Å²	97	113.2 Å²	113.2	52%	0.519	58%	0.582	S	S	.	*	S	Bend	trans	-97.5	105	175.5	-74	-55.4	0	0	0	112.9	V35	V35-N39 VanDerWaalsContact CG1-ND2 3.28Å; V35-N39 WeakPolarHBondContact CG1-ND2 3.4Å; V35-N39 PolarHBondContact O-N 3.1Å; V35-N39 PolarHBondContact O-ND2 2.8Å
40	S	36.6	Very low	35	Very low	50 Å²	50	112.7 Å²	112.7	35%	0.35	58%	0.58	S	S	.	*			trans	64.6	49.3	144.5	-59.2	0	0	0	0	119.5	E42 N43 L44	S40-E42 PolarHBondContact O-N 2.97Å; S40-N43 PolarHBondContact OG-ND2 3.15Å; S40-L44 PolarHBondContact O-N 2.76Å
41	I	38.5	Very low	35.4	Very low	93 Å²	93	114.2 Å²	114.2	48%	0.477	57%	0.574	S	S	.	*	H	α-helix	trans	-60.9	-33.5	154.3	-66.6	177.8	0	0	0	109.5	N43 L44 L45 L58	I41-N43 PolarHBondContact O-N 2.93Å; I41-L44 PolarHBondContact O-N 2.89Å; I41-L45 HydrophobicContact CG2-CD1 3.76Å; I41-L45 HydrophobicContact CG2-CG 4.08Å; I41-L45 VanDerWaalsContact O-CG 3.32Å; I41-L45 WeakPolarHBondContact O-CG 3.3Å; I41-L45 PolarHBondContact O-N 2.92Å; I41-L45 VanDerWaalsContact O-N 3.12Å; I41-L58 HydrophobicContact CD1-CD2 4.32Å
42	E	37.6	Very low	35.6	Very low	118 Å²	118	117 Å²	117	55%	0.551	58%	0.582	S	S	*	*	H	α-helix	trans	-65.8	-36	179.1	-74.4	172.8	-146.4	0	0	114.2	S40 L44 S116	S40-E42 PolarHBondContact O-N 2.97Å; E42-L44 VanDerWaalsContact C-N 3.3Å; E42-L44 PolarHBondContact O-N 2.81Å; E42-S116 WeakPolarHBondContact OE1-CB 3.47Å
43	N	37.7	Very low	35.7	Very low	118 Å²	118	114.2 Å²	114.2	63%	0.631	57%	0.569	S	S	*	*	H	α-helix	trans	-79	-13.9	175.2	-61.9	-48.4	0	0	0	113.1	S40 I41	S40-N43 PolarHBondContact OG-ND2 3.15Å; I41-N43 PolarHBondContact O-N 2.93Å
44	L	34.7	Very low	35.7	Very low	89 Å²	89	112.9 Å²	112.9	47%	0.466	56%	0.561	S	S	.	*	H	α-helix	trans	-90.5	-23.3	177.7	-85.5	158.2	0	0	0	112.9	S40 I41 E42	S40-L44 PolarHBondContact O-N 2.76Å; I41-L44 PolarHBondContact O-N 2.89Å; E42-L44 VanDerWaalsContact C-N 3.3Å; E42-L44 PolarHBondContact O-N 2.81Å
45	L	37	Very low	35.8	Very low	79 Å²	79	107.9 Å²	107.9	41%	0.414	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-16.8	180	-72.5	170.4	0	0	0	114.3	I41 L54	I41-L45 HydrophobicContact CG2-CD1 3.76Å; I41-L45 HydrophobicContact CG2-CG 4.08Å; I41-L45 VanDerWaalsContact O-CG 3.32Å; I41-L45 WeakPolarHBondContact O-CG 3.3Å; I41-L45 PolarHBondContact O-N 2.92Å; I41-L45 VanDerWaalsContact O-N 3.12Å; L45-L54 HydrophobicContact CD2-CD2 4.32Å
46	D	39	Very low	36.3	Very low	138 Å²	138	108.6 Å²	108.6	74%	0.738	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	1.5	178.6	-88.3	-9.7	0	0	0	114.1
47	M	31.9	Very low	36.9	Very low	116 Å²	116	107.8 Å²	107.8	57%	0.571	54%	0.535	S	S	*	.	S	Bend	trans	-90.4	133	176.2	-73.7	-74.6	-117.4	0	0	110.9	I49	M47-I49 HydrophobicContact CB-CD1 4.23Å; M47-I49 HydrophobicContact CB-CG1 4.26Å; M47-I49 PolarHBondContact O-N 2.89Å
48	P	34.7	Very low	37.7	Very low	134 Å²	134	103.2 Å²	103.2	87%	0.87	52%	0.52	S	S	*	.			trans	-77.7	42.6	-176.5	33.5	-35.5	0	0	0	112.7
49	I	34.7	Very low	38.5	Very low	87 Å²	87	101.3 Å²	101.3	45%	0.446	51%	0.512	S	S	.	.			trans	-110.4	134.7	-170.7	-56.1	176.6	0	0	0	109.4	M47 R51 E53	M47-I49 HydrophobicContact CB-CD1 4.23Å; M47-I49 HydrophobicContact CB-CG1 4.26Å; M47-I49 PolarHBondContact O-N 2.89Å; I49-R51 PolarHBondContact O-N 2.81Å; I49-E53 WeakPolarHBondContact CG2-OE2 3.33Å
50	H	37.6	Very low	40.4	Very low	152 Å²	152	97.2 Å²	97.2	70%	0.704	49%	0.489	S	S	*	.			trans	-41.5	129.2	-164.7	-75.4	-77.1	0	0	0	115.4	K52 E53	H50-K52 PolarHBondContact O-N 3.1Å; H50-E53 PolarHBondContact O-N 2.97Å
51	R	36.7	Very low	42	Very low	207 Å²	207	97.3 Å²	97.3	78%	0.781	49%	0.49	S	S	*	.	H	α-helix	trans	-42.9	-16.8	169.2	-151.5	-179.9	-166.4	-166.1	3	115.6	I49 T55	I49-R51 PolarHBondContact O-N 2.81Å; R51-T55 PolarHBondContact O-OG1 2.81Å
52	K	35.7	Very low	44	Very low	156 Å²	156	93 Å²	93	68%	0.678	47%	0.468	S	S	*	.	H	α-helix	trans	-73.9	-28.1	174.3	-101.6	-178.6	175.1	175.5	0	114.5	H50 T55	H50-K52 PolarHBondContact O-N 3.1Å; K52-T55 PolarHBondContact O-OG1 3.29Å; K52-T55 VanDerWaalsContact O-OG1 3.06Å
53	E	34.9	Very low	46.2	Very low	103 Å²	103	87.4 Å²	87.4	48%	0.481	44%	0.442	S	S	.	.	H	α-helix	trans	-86.9	-31.7	179.6	-71.1	176.6	-177.5	0	0	111.4	I49 H50 T55 E56	I49-E53 WeakPolarHBondContact CG2-OE2 3.33Å; H50-E53 PolarHBondContact O-N 2.97Å; E53-T55 VanDerWaalsContact C-N 3.27Å; E53-T55 PolarHBondContact O-N 2.78Å; E53-E56 VanDerWaalsContact O-CB 3.24Å; E53-E56 WeakPolarHBondContact O-CB 3.13Å; E53-E56 PolarHBondContact O-N 3.27Å
54	L	33.4	Very low	48.4	Very low	55 Å²	55	82.5 Å²	82.5	29%	0.288	42%	0.416	S	S	.	.	H	α-helix	trans	-64.4	-29.4	175.3	-86.6	153.1	0	0	0	113.5	L45 E56 L58	L45-L54 HydrophobicContact CD2-CD2 4.32Å; L54-E56 PolarHBondContact O-N 3.37Å; L54-L58 WeakPolarHBondContact O-CD1 2.99Å; L54-L58 WeakPolarHBondContact O-CG 2.97Å
55	T	38.3	Very low	50.6	Low	59 Å²	59	81.1 Å²	81.1	36%	0.362	41%	0.413	S	S	.	.	H	α-helix	trans	-70.5	-16.4	172.4	24.2	0	0	0	0	112.6	R51 K52 E53 I57 S59	R51-T55 PolarHBondContact O-OG1 2.81Å; K52-T55 PolarHBondContact O-OG1 3.29Å; K52-T55 VanDerWaalsContact O-OG1 3.06Å; E53-T55 VanDerWaalsContact C-N 3.27Å; E53-T55 PolarHBondContact O-N 2.78Å; T55-I57 VanDerWaalsContact C-N 3.32Å; T55-I57 PolarHBondContact O-N 3.3Å; T55-S59 PolarHBondContact O-OG 3.36Å
56	E	39.7	Very low	52.8	Low	101 Å²	101	79.8 Å²	79.8	47%	0.472	41%	0.41	S	S	.	.	H	α-helix	trans	-77.6	-15.1	-177.4	-59	-175.6	153.7	0	0	113.9	E53 L54	E53-E56 VanDerWaalsContact O-CB 3.24Å; E53-E56 WeakPolarHBondContact O-CB 3.13Å; E53-E56 PolarHBondContact O-N 3.27Å; L54-E56 PolarHBondContact O-N 3.37Å
57	I	46.7	Very low	55	Low	117 Å²	117	73.2 Å²	73.2	60%	0.6	38%	0.375	S	S	*	.	H	α-helix	trans	-107.9	-21.3	-175.4	-60.1	171.1	0	0	0	112.3	T55	T55-I57 VanDerWaalsContact C-N 3.32Å; T55-I57 PolarHBondContact O-N 3.3Å
58	L	54.9	Low	57.1	Low	36 Å²	36	69 Å²	69	19%	0.188	36%	0.355	C	S	.	.	H	α-helix	trans	-99.1	-13.9	-165.1	-68.3	170.2	0	0	0	115.9	I41 L54 F60 S61 P111	I41-L58 HydrophobicContact CD1-CD2 4.32Å; L54-L58 WeakPolarHBondContact O-CD1 2.99Å; L54-L58 WeakPolarHBondContact O-CG 2.97Å; L58-F60 PolarHBondContact O-N 2.91Å; L58-F60 VanDerWaalsContact O-N 3.15Å; L58-S61 WeakPolarHBondContact O-CB 3.32Å; L58-S61 PolarHBondContact O-N 3.13Å; L58-S61 PolarHBondContact O-OG 2.84Å; L58-P111 HydrophobicContact CD1-CB 4.18Å; L58-P111 HydrophobicContact CD1-CG 4.45Å
59	S	56.6	Low	58.8	Low	23 Å²	23	63.7 Å²	63.7	16%	0.161	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	121.8	177.5	-36.1	0	0	0	0	108.6	T55 K91	T55-S59 PolarHBondContact O-OG 3.36Å; S59-K91 PolarHBondContact OG-O 3.49Å
60	F	72.3	Confident	60.5	Low	10 Å²	10	63.3 Å²	63.3	4%	0.044	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	9.2	-175.2	-39.4	-64.4	0	0	0	118	L58 A62 L63 V72 F94 E96 L258	L58-F60 PolarHBondContact O-N 2.91Å; L58-F60 VanDerWaalsContact O-N 3.15Å; F60-A62 PolarHBondContact O-N 2.78Å; F60-A62 VanDerWaalsContact O-N 3.16Å; F60-L63 HydrophobicContact CB-CD1 3.96Å; F60-L63 HydrophobicContact CB-CG 4.29Å; F60-L63 HydrophobicContact CD1-CD1 3.75Å; F60-L63 HydrophobicContact CG-CD1 4.23Å; F60-L63 PolarHBondContact O-N 2.81Å; F60-L63 VanDerWaalsContact O-N 3.09Å; F60-V72 HydrophobicContact CD2-CG1 3.93Å; F60-V72 HydrophobicContact CD2-CG2 4.41Å; F60-V72 HydrophobicContact CE2-CG1 3.99Å; F60-V72 HydrophobicContact CE2-CG2 3.96Å; F60-V72 HydrophobicContact CZ-CG2 4.43Å; F60-F94 HydrophobicContact CE1-CB 3.97Å; F60-F94 HydrophobicContact CE1-CG 4.33Å; F60-F94 HydrophobicContact CZ-CB 3.99Å; F60-F94 HydrophobicContact CZ-CD2 4.37Å; F60-F94 HydrophobicContact CZ-CG 4.27Å; F60-E96 CarbonylContact C-O 3.56Å; F60-E96 VanDerWaalsContact C-O 3.31Å; F60-E96 WeakPolarHBondContact CA-O 3.48Å; F60-L258 HydrophobicContact CE1-CB 4.36Å; F60-L258 HydrophobicContact CE1-CD2 3.55Å; F60-L258 HydrophobicContact CE2-CD2 4.4Å; F60-L258 HydrophobicContact CZ-CD2 3.43Å; F60-L258 VanDerWaalsContact CZ-CD2 3.43Å
61	S	70	Confident	61.7	Low	53 Å²	53	59.1 Å²	59.1	37%	0.371	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-28	-179.3	64.1	0	0	0	0	113.7	L58	L58-S61 WeakPolarHBondContact O-CB 3.32Å; L58-S61 PolarHBondContact O-N 3.13Å; L58-S61 PolarHBondContact O-OG 2.84Å
62	A	80.6	Confident	62.9	Low	2 Å²	2	49.9 Å²	49.9	2%	0.017	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	5.6	-179.2	0	0	0	0	0	113.9	F60 E96 F97 H199	F60-A62 PolarHBondContact O-N 2.78Å; F60-A62 VanDerWaalsContact O-N 3.16Å; A62-E96 HydrophobicContact CB-CB 4.15Å; A62-E96 HydrophobicContact CB-CG 4.19Å; A62-E96 PolarHBondContact N-O 3.43Å; A62-F97 HydrophobicContact CB-CD1 3.61Å; A62-F97 HydrophobicContact CB-CE1 3.44Å; A62-F97 VanDerWaalsContact CB-CE1 3.44Å; A62-F97 HydrophobicContact CB-CG 4.38Å; A62-F97 HydrophobicContact CB-CZ 4.11Å; A62-H199 WeakPolarHBondContact CA-NE2 3.12Å; A62-H199 PolarHBondContact O-CE1 2.84Å; A62-H199 PolarHBondContact O-NE2 3.15Å
63	L	83.2	Confident	64.1	Low	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.259	C	S	.	.	S	Bend	trans	-85.2	143.5	174	-69.1	-173.5	0	0	0	111.5	R37 F60 L67 I68 F97 C259 L300	R37-L63 PolarHBondContact NH2-O 3.31Å; F60-L63 HydrophobicContact CB-CD1 3.96Å; F60-L63 HydrophobicContact CB-CG 4.29Å; F60-L63 HydrophobicContact CD1-CD1 3.75Å; F60-L63 HydrophobicContact CG-CD1 4.23Å; F60-L63 PolarHBondContact O-N 2.81Å; F60-L63 VanDerWaalsContact O-N 3.09Å; L63-L67 HydrophobicContact CD2-CD2 4.39Å; L63-I68 HydrophobicContact CB-CD1 4.46Å; L63-I68 HydrophobicContact CB-CG1 3.88Å; L63-I68 HydrophobicContact CD1-CG1 4.28Å; L63-F97 WeakPolarHBondContact CD2-O 3.01Å; L63-C259 VanDerWaalsContact CD1-SG 3.5Å; L63-L300 CarbonylContact C-O 3.56Å; L63-L300 WeakPolarHBondContact CA-O 3.47Å; L63-L300 HydrophobicContact CD2-CB 4.2Å; L63-L300 HydrophobicContact CD2-CD2 3.51Å; L63-L300 HydrophobicContact CD2-CG 4.44Å
64	V	84.2	Confident	64.8	Low	14 Å²	14	48.8 Å²	48.8	9%	0.085	27%	0.266	C	S	.	.			trans	-59.3	131.4	164.2	68.2	0	0	0	0	108.3	S66 L67 L299 L300 E303	V64-S66 PolarHBondContact O-N 2.86Å; V64-L67 HydrophobicContact CG1-CB 3.65Å; V64-L67 PolarHBondContact O-N 2.93Å; V64-L299 WeakPolarHBondContact CG1-O 3.38Å; V64-L300 PolarHBondContact N-O 3.01Å; V64-E303 HydrophobicContact CG2-CG 4.4Å; V64-E303 VanDerWaalsContact CG2-OE1 3.28Å; V64-E303 WeakPolarHBondContact CG2-OE1 3.41Å
65	P	80.1	Confident	65.4	Low	60 Å²	60	50.1 Å²	50.1	39%	0.39	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-52.8	-36.4	-171.1	-29.3	34.6	0	0	0	113.9	L67 I68	P65-L67 PolarHBondContact O-N 2.94Å; P65-I68 PolarHBondContact O-N 3.04Å
66	S	83.3	Confident	65.8	Low	51 Å²	51	50.7 Å²	50.7	36%	0.357	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-68.2	-10	-180	60.1	0	0	0	0	114.9	V64 R270 E303	V64-S66 PolarHBondContact O-N 2.86Å; S66-R270 PolarHBondContact OG-NH1 2.92Å; S66-E303 WeakPolarHBondContact CB-OE1 3.45Å; S66-E303 PolarHBondContact OG-OE1 3.01Å; S66-E303 PolarHBondContact OG-OE2 3.36Å; S66-E303 VanDerWaalsContact OG-OE2 3.08Å
67	L	84.9	Confident	65.9	Low	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-100.8	-14.2	177.8	-156	75	0	0	0	113.2	L63 V64 P65 P69 C259 F260 L300	L63-L67 HydrophobicContact CD2-CD2 4.39Å; V64-L67 HydrophobicContact CG1-CB 3.65Å; V64-L67 PolarHBondContact O-N 2.93Å; P65-L67 PolarHBondContact O-N 2.94Å; L67-P69 WeakPolarHBondContact O-CD 3.35Å; L67-C259 HydrophobicContact CD1-CB 4.42Å; L67-C259 HydrophobicContact CD2-CB 3.56Å; L67-C259 VanDerWaalsContact CD2-SG 3.59Å; L67-C259 HydrophobicContact CG-CB 3.72Å; L67-C259 PolarHBondContact O-SG 3.15Å; L67-C259 VanDerWaalsContact O-SG 3.4Å; L67-F260 HydrophobicContact CD2-CE2 4.42Å; L67-F260 HydrophobicContact CD2-CZ 4.34Å; L67-L300 HydrophobicContact CD2-CD2 4.06Å
68	I	76.5	Confident	65.8	Low	28 Å²	28	50.6 Å²	50.6	14%	0.144	28%	0.276	C	S	.	.	S	Bend	trans	-65.5	123.6	-179.9	-59.9	176.7	0	0	0	108.6	L63 P65 S70 V72 Y73	L63-I68 HydrophobicContact CB-CD1 4.46Å; L63-I68 HydrophobicContact CB-CG1 3.88Å; L63-I68 HydrophobicContact CD1-CG1 4.28Å; P65-I68 PolarHBondContact O-N 3.04Å; I68-S70 PolarHBondContact O-N 3.02Å; I68-V72 HydrophobicContact CG2-CB 4.13Å; I68-V72 HydrophobicContact CG2-CG1 4.27Å; I68-Y73 HydrophobicContact CB-CE2 3.78Å; I68-Y73 HydrophobicContact CG2-CD2 4.22Å; I68-Y73 HydrophobicContact CG2-CE2 3.61Å
69	P	71.1	Confident	65.1	Low	21 Å²	21	54 Å²	54	14%	0.136	29%	0.291	C	S	.	.			trans	-60.2	137.5	-177.8	-22.6	31.5	0	0	0	112.3	L67 C71 V72 L258	L67-P69 WeakPolarHBondContact O-CD 3.35Å; P69-C71 PolarHBondContact O-N 2.77Å; P69-C71 VanDerWaalsContact O-N 3.08Å; P69-V72 HydrophobicContact CB-CG2 4.2Å; P69-V72 HydrophobicContact CG-CG2 4.34Å; P69-V72 WeakPolarHBondContact O-CB 3.37Å; P69-V72 PolarHBondContact O-N 3.37Å; P69-L258 HydrophobicContact CG-CD2 3.79Å; P69-L258 HydrophobicContact CG-CG 3.84Å
70	S	68.7	Low	64.5	Low	80 Å²	80	58.9 Å²	58.9	56%	0.559	32%	0.319	S	S	*	.	H	α-helix	trans	-59.5	-24.3	-180	56	0	0	0	0	114.2	I68 V72 Y73 R74	I68-S70 PolarHBondContact O-N 3.02Å; S70-V72 VanDerWaalsContact C-N 3.29Å; S70-V72 PolarHBondContact O-N 3.05Å; S70-Y73 PolarHBondContact O-N 3.29Å; S70-R74 PolarHBondContact O-N 3.47Å
71	C	63.6	Low	62.9	Low	63 Å²	63	63.7 Å²	63.7	43%	0.426	35%	0.349	S	S	.	.	H	α-helix	trans	-67.5	-27.8	173.8	58	0	0	0	0	113.2	P69 R74 Q75	P69-C71 PolarHBondContact O-N 2.77Å; P69-C71 VanDerWaalsContact O-N 3.08Å; C71-R74 PolarHBondContact O-N 3.21Å; C71-Q75 WeakPolarHBondContact O-CG 3.45Å; C71-Q75 PolarHBondContact O-N 3.35Å; C71-Q75 VanDerWaalsContact O-N 3.08Å
72	V	62.5	Low	61.3	Low	14 Å²	14	64.8 Å²	64.8	9%	0.085	36%	0.357	C	S	.	.	H	α-helix	trans	-68.3	-43	175.9	179.3	0	0	0	0	109.8	F60 I68 P69 S70 Q75 L76 L258	F60-V72 HydrophobicContact CD2-CG1 3.93Å; F60-V72 HydrophobicContact CD2-CG2 4.41Å; F60-V72 HydrophobicContact CE2-CG1 3.99Å; F60-V72 HydrophobicContact CE2-CG2 3.96Å; F60-V72 HydrophobicContact CZ-CG2 4.43Å; I68-V72 HydrophobicContact CG2-CB 4.13Å; I68-V72 HydrophobicContact CG2-CG1 4.27Å; P69-V72 HydrophobicContact CB-CG2 4.2Å; P69-V72 HydrophobicContact CG-CG2 4.34Å; P69-V72 WeakPolarHBondContact O-CB 3.37Å; P69-V72 PolarHBondContact O-N 3.37Å; S70-V72 VanDerWaalsContact C-N 3.29Å; S70-V72 PolarHBondContact O-N 3.05Å; V72-Q75 PolarHBondContact O-N 3.12Å; V72-L76 HydrophobicContact CG1-CD1 4.38Å; V72-L76 WeakPolarHBondContact O-CG 3.2Å; V72-L76 PolarHBondContact O-N 2.69Å; V72-L76 VanDerWaalsContact O-N 3.12Å; V72-L258 HydrophobicContact CG2-CD2 4.24Å
73	Y	59.6	Low	59.1	Low	69 Å²	69	74.5 Å²	74.5	27%	0.271	40%	0.402	S	S	.	.	H	α-helix	trans	-61.4	-44.7	174.6	-69.5	-73.7	0	0	0	112.1	I68 S70 Q75 L76 D77	I68-Y73 HydrophobicContact CB-CE2 3.78Å; I68-Y73 HydrophobicContact CG2-CD2 4.22Å; I68-Y73 HydrophobicContact CG2-CE2 3.61Å; S70-Y73 PolarHBondContact O-N 3.29Å; Y73-Q75 VanDerWaalsContact C-N 3.3Å; Y73-Q75 PolarHBondContact O-N 2.81Å; Y73-L76 WeakPolarHBondContact O-CB 3.48Å; Y73-L76 PolarHBondContact O-N 3.3Å; Y73-D77 PolarHBondContact O-N 2.76Å
74	R	49.7	Very low	56.8	Low	167 Å²	167	78.6 Å²	78.6	63%	0.63	43%	0.431	S	S	*	.	H	α-helix	trans	-61.3	-37.7	176.3	-68.9	-175.4	-161.6	155.9	4.8	113	S70 C71 L76 D77 D78	S70-R74 PolarHBondContact O-N 3.47Å; C71-R74 PolarHBondContact O-N 3.21Å; R74-L76 VanDerWaalsContact C-N 3.27Å; R74-L76 PolarHBondContact O-N 2.76Å; R74-D77 PolarHBondContact O-N 2.8Å; R74-D78 WeakPolarHBondContact O-CB 3.14Å; R74-D78 VanDerWaalsContact O-CG 3.3Å; R74-D78 PolarHBondContact O-N 3.43Å
75	Q	47.1	Very low	54.5	Low	82 Å²	82	86 Å²	86	38%	0.383	47%	0.47	S	S	.	.	H	α-helix	trans	-67.9	-27.4	176.1	-75.1	176.8	-8.7	0	0	112.8	C71 V72 Y73 Q79	C71-Q75 WeakPolarHBondContact O-CG 3.45Å; C71-Q75 PolarHBondContact O-N 3.35Å; C71-Q75 VanDerWaalsContact O-N 3.08Å; V72-Q75 PolarHBondContact O-N 3.12Å; Y73-Q75 VanDerWaalsContact C-N 3.3Å; Y73-Q75 PolarHBondContact O-N 2.81Å; Q75-Q79 VanDerWaalsContact O-CG 3.24Å; Q75-Q79 WeakPolarHBondContact O-CG 3.44Å; Q75-Q79 PolarHBondContact O-N 3.05Å
76	L	46.9	Very low	52.4	Low	72 Å²	72	89.4 Å²	89.4	38%	0.377	49%	0.489	S	S	.	.	H	α-helix	trans	-76.6	-41.2	173.3	-69.5	165.2	0	0	0	111.2	V72 Y73 R74 Q79	V72-L76 HydrophobicContact CG1-CD1 4.38Å; V72-L76 WeakPolarHBondContact O-CG 3.2Å; V72-L76 PolarHBondContact O-N 2.69Å; V72-L76 VanDerWaalsContact O-N 3.12Å; Y73-L76 WeakPolarHBondContact O-CB 3.48Å; Y73-L76 PolarHBondContact O-N 3.3Å; R74-L76 VanDerWaalsContact C-N 3.27Å; R74-L76 PolarHBondContact O-N 2.76Å; L76-Q79 WeakPolarHBondContact O-CB 3.38Å; L76-Q79 PolarHBondContact O-N 2.87Å
77	D	42.2	Very low	50.4	Low	112 Å²	112	91 Å²	91	60%	0.599	50%	0.498	S	S	*	.	H	α-helix	trans	-65.8	-39.3	177.2	-71.6	-21.6	0	0	0	112.4	Y73 R74 Q79 V80 T81	Y73-D77 PolarHBondContact O-N 2.76Å; R74-D77 PolarHBondContact O-N 2.8Å; D77-Q79 VanDerWaalsContact C-N 3.25Å; D77-Q79 PolarHBondContact O-N 2.78Å; D77-V80 PolarHBondContact O-N 3.1Å; D77-T81 PolarHBondContact O-OG1 2.79Å
78	D	44.1	Very low	48.5	Very low	104 Å²	104	93.7 Å²	93.7	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-67.5	-26.2	176.4	-72.3	-20.8	0	0	0	112.1	R74 V80 T81	R74-D78 WeakPolarHBondContact O-CB 3.14Å; R74-D78 VanDerWaalsContact O-CG 3.3Å; R74-D78 PolarHBondContact O-N 3.43Å; D78-V80 VanDerWaalsContact C-N 3.32Å; D78-V80 PolarHBondContact O-N 2.69Å; D78-T81 PolarHBondContact O-N 3.2Å; D78-T81 PolarHBondContact O-OG1 2.99Å
79	Q	40.1	Very low	47	Very low	108 Å²	108	96.6 Å²	96.6	51%	0.505	53%	0.533	S	S	.	.	H	α-helix	trans	-71.6	-23.1	176.5	-81.5	-179.6	1.9	0	0	113.3	Q75 L76 D77 T81	Q75-Q79 VanDerWaalsContact O-CG 3.24Å; Q75-Q79 WeakPolarHBondContact O-CG 3.44Å; Q75-Q79 PolarHBondContact O-N 3.05Å; L76-Q79 WeakPolarHBondContact O-CB 3.38Å; L76-Q79 PolarHBondContact O-N 2.87Å; D77-Q79 VanDerWaalsContact C-N 3.25Å; D77-Q79 PolarHBondContact O-N 2.78Å; Q79-T81 VanDerWaalsContact C-N 3.33Å
80	V	43	Very low	45.9	Very low	125 Å²	125	97.7 Å²	97.7	76%	0.758	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-14	179.1	-179.4	0	0	0	0	111.8	D77 D78	D77-V80 PolarHBondContact O-N 3.1Å; D78-V80 VanDerWaalsContact C-N 3.32Å; D78-V80 PolarHBondContact O-N 2.69Å
81	T	40.3	Very low	45.2	Very low	110 Å²	110	96.3 Å²	96.3	68%	0.675	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	-3.3	-167.1	52.3	0	0	0	0	116.3	D77 D78 Q79	D77-T81 PolarHBondContact O-OG1 2.79Å; D78-T81 PolarHBondContact O-N 3.2Å; D78-T81 PolarHBondContact O-OG1 2.99Å; Q79-T81 VanDerWaalsContact C-N 3.33Å
82	S	35.5	Very low	44.8	Very low	76 Å²	76	99.3 Å²	99.3	53%	0.531	53%	0.525	S	S	.	.			trans	-152.4	115.1	175.7	58.1	0	0	0	0	115.3	S84	S82-S84 VanDerWaalsContact C-N 3.25Å; S82-S84 PolarHBondContact O-N 2.87Å
83	E	34.1	Very low	45.1	Very low	206 Å²	206	102.4 Å²	102.4	96%	0.963	54%	0.536	S	S	*	.			trans	-70.7	74.2	163.3	-70.4	-178.8	160.1	0	0	109.9
84	S	36.3	Very low	45.9	Very low	88 Å²	88	100.7 Å²	100.7	62%	0.615	53%	0.53	S	S	*	.	S	Bend	trans	-174.1	109.9	159.5	32.9	0	0	0	0	114.3	S82	S82-S84 VanDerWaalsContact C-N 3.25Å; S82-S84 PolarHBondContact O-N 2.87Å
85	N	35.1	Very low	47.4	Very low	169 Å²	169	94.3 Å²	94.3	90%	0.904	51%	0.508	S	S	*	.			trans	46.1	70.2	147	-72.5	-22.5	0	0	0	119.1
86	V	36.7	Very low	48.9	Very low	131 Å²	131	91.6 Å²	91.6	79%	0.794	50%	0.496	S	S	*	.			trans	-142.2	137	157.6	-178	0	0	0	0	108.6
87	P	39.5	Very low	50.7	Low	85 Å²	85	88.4 Å²	88.4	55%	0.552	48%	0.479	S	S	*	.			trans	-87.1	145.8	-131.5	20.1	-17.8	0	0	0	117.2	L89	P87-L89 HydrophobicContact CB-CB 4.23Å; P87-L89 HydrophobicContact CB-CD1 3.51Å; P87-L89 HydrophobicContact CB-CG 4.46Å; P87-L89 HydrophobicContact CG-CD1 4.22Å; P87-L89 PolarHBondContact O-N 3.1Å
88	S	46.4	Very low	52.8	Low	57 Å²	57	83 Å²	83	40%	0.399	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	17.4	164.8	67.6	0	0	0	0	115.4
89	L	44.2	Very low	54.8	Low	89 Å²	89	80.1 Å²	80.1	47%	0.466	43%	0.432	S	S	.	.	H	α-helix	trans	-75.9	-55.9	-167.8	-103.1	91.2	0	0	0	111.1	P87 K91 R92 Y93	P87-L89 HydrophobicContact CB-CB 4.23Å; P87-L89 HydrophobicContact CB-CD1 3.51Å; P87-L89 HydrophobicContact CB-CG 4.46Å; P87-L89 HydrophobicContact CG-CD1 4.22Å; P87-L89 PolarHBondContact O-N 3.1Å; L89-K91 VanDerWaalsContact C-N 3.33Å; L89-K91 PolarHBondContact O-N 3.15Å; L89-R92 PolarHBondContact O-N 3.25Å; L89-R92 VanDerWaalsContact O-N 3.12Å; L89-Y93 HydrophobicContact CB-CE2 3.92Å; L89-Y93 HydrophobicContact CD2-CE2 3.82Å; L89-Y93 HydrophobicContact CG-CE2 3.75Å; L89-Y93 WeakPolarHBondContact O-CD2 3.49Å; L89-Y93 VanDerWaalsContact O-CE2 3.22Å; L89-Y93 WeakPolarHBondContact O-CE2 3.33Å
90	V	49.4	Very low	56.8	Low	45 Å²	45	81.5 Å²	81.5	27%	0.273	43%	0.433	S	S	.	.	H	α-helix	trans	-58.9	-41.9	-170.8	-176.2	0	0	0	0	112.5	R92 Y93 F94	V90-R92 VanDerWaalsContact C-N 3.26Å; V90-R92 PolarHBondContact O-N 3.34Å; V90-Y93 PolarHBondContact O-N 3.16Å; V90-F94 HydrophobicContact CG1-CD2 4.06Å; V90-F94 HydrophobicContact CG1-CE2 4.09Å; V90-F94 WeakPolarHBondContact O-CD2 3.42Å
91	K	52	Low	58.5	Low	50 Å²	50	76.8 Å²	76.8	22%	0.217	40%	0.403	C	S	.	.	H	α-helix	trans	-67.4	-21.6	-177.1	-61.8	-178.3	178	-175	0	114.1	S59 L89	S59-K91 PolarHBondContact OG-O 3.49Å; L89-K91 VanDerWaalsContact C-N 3.33Å; L89-K91 PolarHBondContact O-N 3.15Å
92	R	56.4	Low	59.8	Low	127 Å²	127	75.7 Å²	75.7	48%	0.479	39%	0.393	S	S	.	.	H	α-helix	trans	-83.9	-17	176.6	-74.8	-174.8	-177.3	162.9	7	113.5	L89 V90 L104	L89-R92 PolarHBondContact O-N 3.25Å; L89-R92 VanDerWaalsContact O-N 3.12Å; V90-R92 VanDerWaalsContact C-N 3.26Å; V90-R92 PolarHBondContact O-N 3.34Å; R92-L104 VanDerWaalsContact O-CD2 3.28Å; R92-L104 WeakPolarHBondContact O-CD2 3.33Å
93	Y	68.8	Low	60.9	Low	79 Å²	79	78.7 Å²	78.7	31%	0.31	40%	0.403	S	S	.	.	S	Bend	trans	-104.5	2.8	-173.3	-62.6	-73.4	0	0	0	114	L89 V90 R100 I101 L104	L89-Y93 HydrophobicContact CB-CE2 3.92Å; L89-Y93 HydrophobicContact CD2-CE2 3.82Å; L89-Y93 HydrophobicContact CG-CE2 3.75Å; L89-Y93 WeakPolarHBondContact O-CD2 3.49Å; L89-Y93 VanDerWaalsContact O-CE2 3.22Å; L89-Y93 WeakPolarHBondContact O-CE2 3.33Å; V90-Y93 PolarHBondContact O-N 3.16Å; Y93-R100 CarbonylContact O-C 3.54Å; Y93-R100 WeakPolarHBondContact O-CA 3.33Å; Y93-I101 PolarHBondContact O-N 3.48Å; Y93-L104 HydrophobicContact CD1-CD1 3.76Å; Y93-L104 HydrophobicContact CE1-CD1 3.38Å
94	F	76.4	Confident	62	Low	33 Å²	33	71.8 Å²	71.8	15%	0.145	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-133.7	143.6	-178.8	-64.8	-85.2	0	0	0	112.3	F60 V90 G98 F99 R100 L258	F60-F94 HydrophobicContact CE1-CB 3.97Å; F60-F94 HydrophobicContact CE1-CG 4.33Å; F60-F94 HydrophobicContact CZ-CB 3.99Å; F60-F94 HydrophobicContact CZ-CD2 4.37Å; F60-F94 HydrophobicContact CZ-CG 4.27Å; V90-F94 HydrophobicContact CG1-CD2 4.06Å; V90-F94 HydrophobicContact CG1-CE2 4.09Å; V90-F94 WeakPolarHBondContact O-CD2 3.42Å; F94-G98 VanDerWaalsContact CD1-O 3.28Å; F94-G98 WeakPolarHBondContact CD1-O 3.19Å; F94-F99 CarbonylContact C-O 3.57Å; F94-F99 WeakPolarHBondContact CA-O 3.49Å; F94-R100 HydrophobicContact CD1-CB 4.01Å; F94-R100 HydrophobicContact CE1-CB 3.68Å; F94-R100 HydrophobicContact CE1-CG 4.22Å; F94-R100 HydrophobicContact CZ-CB 4.37Å; F94-R100 HydrophobicContact CZ-CG 4.45Å; F94-L258 HydrophobicContact CD1-CB 4.16Å; F94-L258 HydrophobicContact CE1-CB 3.91Å; F94-L258 HydrophobicContact CE1-CD1 4.27Å; F94-L258 HydrophobicContact CE2-CD1 4.35Å; F94-L258 HydrophobicContact CZ-CB 4.38Å; F94-L258 HydrophobicContact CZ-CD1 3.89Å
95	D	80.1	Confident	62.7	Low	33 Å²	33	76.5 Å²	76.5	18%	0.176	39%	0.385	C	S	.	.			trans	-79.5	178.4	172.6	74.5	9.6	0	0	0	112.6	F97 G98 F99 I101	D95-F97 PolarHBondContact O-N 3.37Å; D95-F97 VanDerWaalsContact OD1-C 3.31Å; D95-F97 WeakPolarHBondContact OD1-CA 3.45Å; D95-F97 PolarHBondContact OD1-N 3.48Å; D95-G98 PolarHBondContact O-N 3.11Å; D95-G98 PolarHBondContact OD1-N 3.32Å; D95-F99 PolarHBondContact N-O 3.32Å; D95-F99 PolarHBondContact OD1-N 3.29Å; D95-I101 HydrophobicContact CB-CD1 4.17Å; D95-I101 HydrophobicContact CB-CG1 4.4Å
96	E	78.7	Confident	63.3	Low	25 Å²	25	76.9 Å²	76.9	12%	0.117	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.9	178	58.9	-90.4	-156.3	0	0	114.5	F60 A62 F112	F60-E96 CarbonylContact C-O 3.56Å; F60-E96 VanDerWaalsContact C-O 3.31Å; F60-E96 WeakPolarHBondContact CA-O 3.48Å; A62-E96 HydrophobicContact CB-CB 4.15Å; A62-E96 HydrophobicContact CB-CG 4.19Å; A62-E96 PolarHBondContact N-O 3.43Å; E96-F112 HydrophobicContact CG-CB 3.68Å; E96-F112 WeakPolarHBondContact OE1-CB 3.4Å; E96-F112 PolarHBondContact OE1-N 3.31Å
97	F	86.6	Confident	64	Low	4 Å²	4	78 Å²	78	2%	0.018	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	0	176.6	-59.7	-71.7	0	0	0	112.1	A62 L63 D95 F99 F112 H199 N257 T379 A380 F383	A62-F97 HydrophobicContact CB-CD1 3.61Å; A62-F97 HydrophobicContact CB-CE1 3.44Å; A62-F97 VanDerWaalsContact CB-CE1 3.44Å; A62-F97 HydrophobicContact CB-CG 4.38Å; A62-F97 HydrophobicContact CB-CZ 4.11Å; L63-F97 WeakPolarHBondContact CD2-O 3.01Å; D95-F97 PolarHBondContact O-N 3.37Å; D95-F97 VanDerWaalsContact OD1-C 3.31Å; D95-F97 WeakPolarHBondContact OD1-CA 3.45Å; D95-F97 PolarHBondContact OD1-N 3.48Å; F97-F99 HydrophobicContact CB-CD2 3.78Å; F97-F99 HydrophobicContact CB-CE2 3.87Å; F97-F112 HydrophobicContact CE2-CD2 4.37Å; F97-F112 AromaticContact CZ-CD2 3.9Å; F97-F112 HydrophobicContact CZ-CD2 3.9Å; F97-F112 HydrophobicContact CZ-CE2 4.42Å; F97-F112 HydrophobicContact CZ-CG 4.29Å; F97-H199 AromaticContact CE1-CE1 3.87Å; F97-H199 AromaticContact CE1-ND1 3.94Å; F97-N257 PolarHBondContact O-ND2 3.31Å; F97-T379 HydrophobicContact CB-CG2 4.46Å; F97-T379 HydrophobicContact CD1-CG2 3.74Å; F97-T379 HydrophobicContact CD2-CG2 4.02Å; F97-T379 HydrophobicContact CE1-CG2 3.92Å; F97-T379 HydrophobicContact CE2-CG2 4.19Å; F97-T379 HydrophobicContact CG-CG2 3.8Å; F97-T379 HydrophobicContact CZ-CG2 4.14Å; F97-A380 HydrophobicContact CE2-CB 4.39Å; F97-F383 HydrophobicContact CD1-CE2 4.04Å; F97-F383 AromaticContact CE1-CD2 3.92Å; F97-F383 HydrophobicContact CE1-CD2 3.92Å; F97-F383 AromaticContact CE1-CE2 3.52Å; F97-F383 HydrophobicContact CE1-CE2 3.52Å; F97-F383 HydrophobicContact CZ-CD2 4.32Å; F97-F383 HydrophobicContact CZ-CE2 4.33Å
98	G	85.4	Confident	64.7	Low	0 Å²	0	78.6 Å²	78.6	0%	0	38%	0.381	C	S	.	.			trans	81.1	18.1	178.8	0	0	0	0	0	115.2	F94 D95 N257 L258	F94-G98 VanDerWaalsContact CD1-O 3.28Å; F94-G98 WeakPolarHBondContact CD1-O 3.19Å; D95-G98 PolarHBondContact O-N 3.11Å; D95-G98 PolarHBondContact OD1-N 3.32Å; G98-N257 CarbonylContact O-C 3.38Å; G98-N257 VanDerWaalsContact O-CA 3.31Å; G98-N257 WeakPolarHBondContact O-CA 3.02Å; G98-L258 PolarHBondContact O-N 3.03Å
99	F	86.6	Confident	65.2	Low	42 Å²	42	79.1 Å²	79.1	18%	0.184	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-81.7	139.8	170.4	-66.7	-86	0	0	0	111.6	F94 D95 F97 M254 N257 L300 T379	F94-F99 CarbonylContact C-O 3.57Å; F94-F99 WeakPolarHBondContact CA-O 3.49Å; D95-F99 PolarHBondContact N-O 3.32Å; D95-F99 PolarHBondContact OD1-N 3.29Å; F97-F99 HydrophobicContact CB-CD2 3.78Å; F97-F99 HydrophobicContact CB-CE2 3.87Å; F99-M254 HydrophobicContact CE1-CB 4.06Å; F99-M254 HydrophobicContact CE1-CG 3.98Å; F99-M254 HydrophobicContact CE1-SD 4Å; F99-M254 HydrophobicContact CZ-CE 3.92Å; F99-M254 HydrophobicContact CZ-CG 4.17Å; F99-M254 HydrophobicContact CZ-SD 3.65Å; F99-N257 HydrophobicContact CD1-CB 3.76Å; F99-N257 HydrophobicContact CE1-CB 3.73Å; F99-N257 WeakPolarHBondContact CE2-ND2 3.44Å; F99-N257 HydrophobicContact CG-CB 4.38Å; F99-N257 HydrophobicContact CZ-CB 4.3Å; F99-L300 HydrophobicContact CE2-CD1 4.1Å; F99-L300 HydrophobicContact CZ-CD1 4.33Å; F99-T379 VanDerWaalsContact CE2-OG1 3.26Å; F99-T379 WeakPolarHBondContact CE2-OG1 3.5Å
100	R	81.8	Confident	65.8	Low	137 Å²	137	79.1 Å²	79.1	52%	0.517	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-69.7	131	179.6	-171.7	172.9	158.6	162.8	-3.6	111.4	Y93 F94 D102 N256	Y93-R100 CarbonylContact O-C 3.54Å; Y93-R100 WeakPolarHBondContact O-CA 3.33Å; F94-R100 HydrophobicContact CD1-CB 4.01Å; F94-R100 HydrophobicContact CE1-CB 3.68Å; F94-R100 HydrophobicContact CE1-CG 4.22Å; F94-R100 HydrophobicContact CZ-CB 4.37Å; F94-R100 HydrophobicContact CZ-CG 4.45Å; R100-D102 WeakPolarHBondContact CD-OD1 3.22Å; R100-D102 IonicContact CZ-OD1 3.37Å; R100-D102 IonicContact NE-OD1 2.81Å; R100-D102 PolarHBondContact NE-OD1 3.11Å; R100-D102 IonicContact NH2-OD1 3.84Å; R100-D102 PolarHBondContact NH2-OD1 3.46Å; R100-N256 HydrophobicContact CB-CB 4.43Å; R100-N256 WeakPolarHBondContact CB-O 3.4Å; R100-N256 PolarHBondContact N-O 3.07Å
101	I	77.5	Confident	66.3	Low	26 Å²	26	79.1 Å²	79.1	13%	0.133	39%	0.391	C	S	.	.			trans	-98.1	105.4	172.8	-54.2	170.6	0	0	0	106.7	Y93 D95 P109	Y93-I101 PolarHBondContact O-N 3.48Å; D95-I101 HydrophobicContact CB-CD1 4.17Å; D95-I101 HydrophobicContact CB-CG1 4.4Å; I101-P109 HydrophobicContact CD1-CG 4.11Å; I101-P109 HydrophobicContact CG1-CG 4.49Å
102	D	67.5	Low	67	Low	87 Å²	87	78 Å²	78	47%	0.465	39%	0.386	S	S	.	.			trans	-84	-31.9	-176.9	-74.6	-43.4	0	0	0	113	R100	R100-D102 WeakPolarHBondContact CD-OD1 3.22Å; R100-D102 IonicContact CZ-OD1 3.37Å; R100-D102 IonicContact NE-OD1 2.81Å; R100-D102 PolarHBondContact NE-OD1 3.11Å; R100-D102 IonicContact NH2-OD1 3.84Å; R100-D102 PolarHBondContact NH2-OD1 3.46Å
103	D	60.4	Low	67.6	Low	139 Å²	139	74 Å²	74	74%	0.743	38%	0.376	S	S	*	.			trans	-103	88.5	-176.7	-66.2	-35	0	0	0	111.5	E105	D103-E105 PolarHBondContact O-N 2.91Å
104	L	56.5	Low	67.9	Low	62 Å²	62	73 Å²	73	33%	0.325	37%	0.374	S	S	.	.			trans	-76.1	-4.5	176.4	-78	166.8	0	0	0	114	R92 Y93	R92-L104 VanDerWaalsContact O-CD2 3.28Å; R92-L104 WeakPolarHBondContact O-CD2 3.33Å; Y93-L104 HydrophobicContact CD1-CD1 3.76Å; Y93-L104 HydrophobicContact CE1-CD1 3.38Å
105	E	50.1	Low	68	Low	186 Å²	186	71.6 Å²	71.6	87%	0.869	37%	0.368	S	S	*	.	S	Bend	trans	-93.6	-15.3	-159.9	-72.3	-167.8	155.6	0	0	116.1	D103	D103-E105 PolarHBondContact O-N 2.91Å
106	E	48.5	Very low	68	Low	178 Å²	178	71.8 Å²	71.8	83%	0.832	37%	0.371	S	S	*	.	S	Bend	trans	-134.6	-19.9	-178.7	-75.3	-165.8	159.3	0	0	119.7
107	N	51.8	Low	68.3	Low	153 Å²	153	70.8 Å²	70.8	82%	0.818	37%	0.367	S	S	*	.			trans	-167.8	113	165.5	-84.6	-54.9	0	0	0	109.1
108	L	54.2	Low	68.4	Low	98 Å²	98	70.8 Å²	70.8	51%	0.513	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-60.7	138.7	169.5	-86.3	116.9	0	0	0	109.2	C110	L108-C110 PolarHBondContact O-N 3.23Å
109	P	56.4	Low	68.4	Low	68 Å²	68	73.6 Å²	73.6	44%	0.442	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-50.7	138.8	172.3	-22	30.7	0	0	0	110.1	I101	I101-P109 HydrophobicContact CD1-CG 4.11Å; I101-P109 HydrophobicContact CG1-CG 4.49Å
110	C	56.6	Low	68.3	Low	89 Å²	89	74.8 Å²	74.8	60%	0.601	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-62.4	125.7	169.9	-172.1	0	0	0	0	107.3	L108	L108-C110 PolarHBondContact O-N 3.23Å
111	P	60.2	Low	68.5	Low	46 Å²	46	68.3 Å²	68.3	30%	0.299	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-59.2	147.6	180	24	-32.8	0	0	0	110	L58 V113	L58-P111 HydrophobicContact CD1-CB 4.18Å; L58-P111 HydrophobicContact CD1-CG 4.45Å; P111-V113 HydrophobicContact CG-CG2 4.25Å; P111-V113 WeakPolarHBondContact O-CG2 3.4Å; P111-V113 PolarHBondContact O-N 2.79Å
112	F	66.7	Low	69.1	Low	26 Å²	26	67.1 Å²	67.1	11%	0.114	35%	0.351	C	S	.	.			trans	-56.6	106.2	166.3	-173.6	-86.3	0	0	0	109.9	E96 F97 E114 H199 A380	E96-F112 HydrophobicContact CG-CB 3.68Å; E96-F112 WeakPolarHBondContact OE1-CB 3.4Å; E96-F112 PolarHBondContact OE1-N 3.31Å; F97-F112 HydrophobicContact CE2-CD2 4.37Å; F97-F112 AromaticContact CZ-CD2 3.9Å; F97-F112 HydrophobicContact CZ-CD2 3.9Å; F97-F112 HydrophobicContact CZ-CE2 4.42Å; F97-F112 HydrophobicContact CZ-CG 4.29Å; F112-E114 HydrophobicContact CD1-CG 4.26Å; F112-E114 HydrophobicContact CE1-CG 3.53Å; F112-E114 HydrophobicContact CZ-CG 4.42Å; F112-H199 HydrophobicContact CD1-CB 4.14Å; F112-H199 HydrophobicContact CE1-CB 3.19Å; F112-H199 HydrophobicContact CE2-CB 4.4Å; F112-H199 HydrophobicContact CZ-CB 3.39Å; F112-A380 HydrophobicContact CD2-CB 4.24Å
113	V	67.8	Low	69.9	Low	44 Å²	44	63.3 Å²	63.3	27%	0.267	33%	0.331	S	S	.	.			trans	-108.4	120.7	176.4	-177.7	0	0	0	0	109.4	P111 E193	P111-V113 HydrophobicContact CG-CG2 4.25Å; P111-V113 WeakPolarHBondContact O-CG2 3.4Å; P111-V113 PolarHBondContact O-N 2.79Å; V113-E193 HydrophobicContact CG1-CG 4.41Å
114	E	75.6	Confident	71	Confident	58 Å²	58	57.1 Å²	57.1	27%	0.271	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-78.7	129.5	169.7	-65.2	-176.1	-170.4	0	0	110	F112 S116 P198 H199 S200	F112-E114 HydrophobicContact CD1-CG 4.26Å; F112-E114 HydrophobicContact CE1-CG 3.53Å; F112-E114 HydrophobicContact CZ-CG 4.42Å; E114-S116 PolarHBondContact O-N 3.16Å; E114-P198 HydrophobicContact CG-CB 4.47Å; E114-P198 WeakPolarHBondContact OE2-CB 3.41Å; E114-H199 VanDerWaalsContact OE1-CA 3.26Å; E114-H199 WeakPolarHBondContact OE1-CA 3.37Å; E114-H199 WeakPolarHBondContact OE1-CB 3.32Å; E114-H199 PolarHBondContact OE1-N 3.13Å; E114-S200 PolarHBondContact OE1-N 3.12Å; E114-S200 WeakPolarHBondContact OE2-CB 3.17Å; E114-S200 PolarHBondContact OE2-OG 2.91Å
115	S	79.9	Confident	72.2	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	28%	0.283	C	S	.	.			trans	-69	125.3	170.6	-178.8	0	0	0	0	110.3	A117 N118 R119 E193	S115-A117 VanDerWaalsContact C-N 3.31Å; S115-A117 PolarHBondContact O-N 3.18Å; S115-N118 WeakPolarHBondContact O-CB 3.42Å; S115-N118 PolarHBondContact O-N 3.08Å; S115-R119 PolarHBondContact O-N 3.1Å; S115-E193 WeakPolarHBondContact CB-OE2 3.39Å; S115-E193 PolarHBondContact OG-OE2 3.16Å
116	S	79.8	Confident	73.8	Confident	37 Å²	37	45.4 Å²	45.4	26%	0.259	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-40.7	176.3	60.9	0	0	0	0	112.5	E42 E114 N118 R119 R120	E42-S116 WeakPolarHBondContact OE1-CB 3.47Å; E114-S116 PolarHBondContact O-N 3.16Å; S116-N118 VanDerWaalsContact C-N 3.35Å; S116-R119 PolarHBondContact O-N 3.3Å; S116-R120 WeakPolarHBondContact O-CG 3.17Å; S116-R120 PolarHBondContact O-N 3.35Å
117	A	83.6	Confident	74.9	Confident	4 Å²	4	39.2 Å²	39.2	3%	0.033	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-44.2	174.9	0	0	0	0	0	110.9	S115 R120 A121 L139 L188	S115-A117 VanDerWaalsContact C-N 3.31Å; S115-A117 PolarHBondContact O-N 3.18Å; A117-R120 PolarHBondContact O-N 2.86Å; A117-A121 WeakPolarHBondContact O-CB 3.42Å; A117-A121 PolarHBondContact O-N 3.49Å; A117-L139 HydrophobicContact CB-CD2 4.41Å; A117-L188 HydrophobicContact CB-CB 3.8Å; A117-L188 HydrophobicContact CB-CD1 4.05Å
118	N	88.6	Confident	75.6	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-62.6	-46.3	175.7	-171.5	29.1	0	0	0	111.4	S115 S116 R120 A121 W122 V185 G196	S115-N118 WeakPolarHBondContact O-CB 3.42Å; S115-N118 PolarHBondContact O-N 3.08Å; S116-N118 VanDerWaalsContact C-N 3.35Å; N118-R120 PolarHBondContact O-N 2.96Å; N118-A121 PolarHBondContact O-N 2.65Å; N118-W122 VanDerWaalsContact O-CD1 3.29Å; N118-W122 PolarHBondContact O-N 3.33Å; N118-W122 VanDerWaalsContact OD1-CD1 3.26Å; N118-V185 HydrophobicContact CB-CG1 3.58Å; N118-G196 PolarHBondContact ND2-O 2.95Å; N118-G196 PolarHBondContact OD1-O 2.87Å
119	R	86.9	Confident	75.9	Confident	59 Å²	59	29.4 Å²	29.4	22%	0.223	16%	0.16	C	C	.	.	H	α-helix	trans	-59.8	-45.8	177.8	-171.7	177.4	-177.5	-87.8	-2.3	111.9	S115 S116 W122 L123 P198 S200	S115-R119 PolarHBondContact O-N 3.1Å; S116-R119 PolarHBondContact O-N 3.3Å; R119-W122 WeakPolarHBondContact O-CB 3.24Å; R119-W122 PolarHBondContact O-N 2.97Å; R119-L123 HydrophobicContact CG-CD1 4.48Å; R119-L123 WeakPolarHBondContact O-CG 3.19Å; R119-L123 PolarHBondContact O-N 3.44Å; R119-P198 HydrophobicContact CB-CB 4.46Å; R119-P198 HydrophobicContact CB-CG 4.19Å; R119-S200 PolarHBondContact NE-OG 3.05Å
120	R	83.6	Confident	75.7	Confident	68 Å²	68	29.6 Å²	29.6	26%	0.257	16%	0.155	S	C	.	.	H	α-helix	trans	-59.3	-49.4	175.5	-74.9	-173	-68.4	150.3	-0.7	111.5	S116 A117 N118 W122 L123 T124 Y142 D143	S116-R120 WeakPolarHBondContact O-CG 3.17Å; S116-R120 PolarHBondContact O-N 3.35Å; A117-R120 PolarHBondContact O-N 2.86Å; N118-R120 PolarHBondContact O-N 2.96Å; R120-W122 PolarHBondContact O-N 2.77Å; R120-L123 PolarHBondContact O-N 3.35Å; R120-L123 VanDerWaalsContact O-N 3.1Å; R120-T124 PolarHBondContact O-N 3.5Å; R120-T124 PolarHBondContact O-OG1 3.25Å; R120-Y142 HydrophobicContact CB-CD1 4.35Å; R120-Y142 HydrophobicContact CB-CE1 4.12Å; R120-Y142 HydrophobicContact CG-CD1 4.46Å; R120-Y142 HydrophobicContact CG-CE1 3.86Å; R120-D143 IonicContact CZ-OD1 3.37Å; R120-D143 IonicContact NH1-OD1 2.66Å; R120-D143 PolarHBondContact NH1-OD1 2.59Å; R120-D143 IonicContact NH1-OD2 3.96Å; R120-D143 PolarHBondContact NH1-OD2 3.39Å
121	A	87	Confident	75.5	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-56.1	-39.5	178.6	0	0	0	0	0	112.7	A117 N118 C125 L139 L177 V185	A117-A121 WeakPolarHBondContact O-CB 3.42Å; A117-A121 PolarHBondContact O-N 3.49Å; N118-A121 PolarHBondContact O-N 2.65Å; A121-C125 VanDerWaalsContact O-CB 3.31Å; A121-C125 WeakPolarHBondContact O-CB 3.34Å; A121-C125 PolarHBondContact O-N 2.54Å; A121-L139 HydrophobicContact CB-CD1 3.58Å; A121-L177 HydrophobicContact CB-CD2 3.72Å; A121-V185 HydrophobicContact CB-CG2 3.51Å
122	W	89.2	Confident	75	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66	-46.8	174.9	-92.6	91.5	0	0	0	113.3	N118 R119 R120 T124 C125 L126 L174 L177 I178 G196 I197 P198 L201 V205	N118-W122 VanDerWaalsContact O-CD1 3.29Å; N118-W122 PolarHBondContact O-N 3.33Å; N118-W122 VanDerWaalsContact OD1-CD1 3.26Å; R119-W122 WeakPolarHBondContact O-CB 3.24Å; R119-W122 PolarHBondContact O-N 2.97Å; R120-W122 PolarHBondContact O-N 2.77Å; W122-T124 VanDerWaalsContact C-N 3.33Å; W122-T124 PolarHBondContact O-N 2.94Å; W122-C125 PolarHBondContact O-N 3.5Å; W122-L126 HydrophobicContact CE3-CD1 4.12Å; W122-L126 HydrophobicContact CE3-CG 4.28Å; W122-L126 WeakPolarHBondContact O-CB 3.47Å; W122-L126 VanDerWaalsContact O-CG 3.3Å; W122-L126 WeakPolarHBondContact O-CG 3.5Å; W122-L126 PolarHBondContact O-N 3.38Å; W122-L174 HydrophobicContact CH2-CD1 3.73Å; W122-L174 HydrophobicContact CZ3-CD1 3.72Å; W122-L177 HydrophobicContact CZ2-CB 4.02Å; W122-I178 HydrophobicContact CH2-CD1 3.92Å; W122-I178 HydrophobicContact CH2-CG1 3.28Å; W122-I178 HydrophobicContact CZ2-CB 4.38Å; W122-I178 HydrophobicContact CZ2-CG1 3.45Å; W122-I178 VanDerWaalsContact CZ2-CG1 3.45Å; W122-G196 PolarHBondContact NE1-O 3.46Å; W122-I197 HydrophobicContact CH2-CB 4.47Å; W122-I197 HydrophobicContact CH2-CD1 4.25Å; W122-I197 HydrophobicContact CH2-CG1 3.68Å; W122-I197 HydrophobicContact CH2-CG2 4.47Å; W122-I197 HydrophobicContact CZ2-CB 4.14Å; W122-I197 HydrophobicContact CZ2-CG1 3.52Å; W122-I197 HydrophobicContact CZ2-CG2 4.46Å; W122-P198 HydrophobicContact CB-CG 4.34Å; W122-P198 HydrophobicContact CG-CG 4.11Å; W122-L201 HydrophobicContact CB-CD1 3.47Å; W122-L201 VanDerWaalsContact CB-CD1 3.47Å; W122-L201 HydrophobicContact CG-CD1 4.1Å; W122-V205 HydrophobicContact CE3-CG2 4.41Å; W122-V205 HydrophobicContact CH2-CG1 4.15Å; W122-V205 HydrophobicContact CZ3-CG1 3.92Å; W122-V205 HydrophobicContact CZ3-CG2 4.08Å
123	L	85.3	Confident	73.8	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-45.2	176.8	-68.8	175.8	0	0	0	110.9	R119 R120 C125 L126 E127 V153 L160 L201	R119-L123 HydrophobicContact CG-CD1 4.48Å; R119-L123 WeakPolarHBondContact O-CG 3.19Å; R119-L123 PolarHBondContact O-N 3.44Å; R120-L123 PolarHBondContact O-N 3.35Å; R120-L123 VanDerWaalsContact O-N 3.1Å; L123-C125 PolarHBondContact O-N 3.26Å; L123-L126 PolarHBondContact O-N 2.97Å; L123-E127 PolarHBondContact O-N 3.3Å; L123-V153 HydrophobicContact CD1-CG1 4.11Å; L123-L160 HydrophobicContact CD2-CD2 3.94Å; L123-L201 HydrophobicContact CD2-CD2 4.13Å
124	T	81.7	Confident	73.2	Confident	8 Å²	8	36.1 Å²	36.1	5%	0.049	18%	0.181	C	C	.	.	H	α-helix	trans	-58.8	-46.1	174.8	-44.4	0	0	0	0	111.6	R120 W122 L126 E127 F128 Y142	R120-T124 PolarHBondContact O-N 3.5Å; R120-T124 PolarHBondContact O-OG1 3.25Å; W122-T124 VanDerWaalsContact C-N 3.33Å; W122-T124 PolarHBondContact O-N 2.94Å; T124-L126 VanDerWaalsContact C-N 3.33Å; T124-L126 PolarHBondContact O-N 3.41Å; T124-E127 PolarHBondContact O-N 3.05Å; T124-F128 HydrophobicContact CG2-CE2 4.25Å; T124-F128 VanDerWaalsContact O-CD2 3.27Å; T124-F128 WeakPolarHBondContact O-CD2 3.47Å; T124-Y142 HydrophobicContact CG2-CD2 4.15Å; T124-Y142 WeakPolarHBondContact OG1-CB 3.48Å; T124-Y142 WeakPolarHBondContact OG1-CD2 3.31Å; T124-Y142 VanDerWaalsContact OG1-CG 3.28Å
125	C	83.4	Confident	71.8	Confident	3 Å²	3	34 Å²	34	2%	0.02	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-41.9	179.5	-175.4	0	0	0	0	111.9	A121 W122 L123 L134 R173 L177	A121-C125 VanDerWaalsContact O-CB 3.31Å; A121-C125 WeakPolarHBondContact O-CB 3.34Å; A121-C125 PolarHBondContact O-N 2.54Å; W122-C125 PolarHBondContact O-N 3.5Å; L123-C125 PolarHBondContact O-N 3.26Å; C125-L134 VanDerWaalsContact O-CD2 3.32Å; C125-L134 WeakPolarHBondContact O-CD2 2.87Å; C125-R173 HydrophobicContact CB-CG 4.45Å; C125-L177 HydrophobicContact CB-CD1 3.58Å
126	L	83.1	Confident	70.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-75.3	-31.3	-177.8	-69.2	173.6	0	0	0	113.3	W122 L123 T124 F128 S129 W161 V164 L168 V205	W122-L126 HydrophobicContact CE3-CD1 4.12Å; W122-L126 HydrophobicContact CE3-CG 4.28Å; W122-L126 WeakPolarHBondContact O-CB 3.47Å; W122-L126 VanDerWaalsContact O-CG 3.3Å; W122-L126 WeakPolarHBondContact O-CG 3.5Å; W122-L126 PolarHBondContact O-N 3.38Å; L123-L126 PolarHBondContact O-N 2.97Å; T124-L126 VanDerWaalsContact C-N 3.33Å; T124-L126 PolarHBondContact O-N 3.41Å; L126-F128 PolarHBondContact O-N 3.47Å; L126-S129 WeakPolarHBondContact O-CB 3.41Å; L126-S129 PolarHBondContact O-N 3.25Å; L126-S129 PolarHBondContact O-OG 2.92Å; L126-W161 HydrophobicContact CD1-CH2 3.61Å; L126-W161 HydrophobicContact CD1-CZ3 3.94Å; L126-V164 HydrophobicContact CB-CG2 4.39Å; L126-V164 HydrophobicContact CD2-CG1 4.49Å; L126-L168 HydrophobicContact CD2-CD1 4.14Å; L126-L168 HydrophobicContact CD2-CD2 3.82Å; L126-V205 HydrophobicContact CD1-CG2 4.13Å
127	E	72.4	Confident	68.8	Low	47 Å²	47	41.2 Å²	41.2	22%	0.22	21%	0.21	C	C	.	.	H	α-helix	trans	-54.6	-41.4	178.8	-166.2	-174.8	168.9	0	0	111.3	L123 T124 S129 H130 Y146 L160	L123-E127 PolarHBondContact O-N 3.3Å; T124-E127 PolarHBondContact O-N 3.05Å; E127-S129 PolarHBondContact O-N 3.19Å; E127-H130 PolarHBondContact O-CE1 3.1Å; E127-H130 PolarHBondContact O-ND1 3.27Å; E127-Y146 PolarHBondContact OE2-OH 3.27Å; E127-L160 HydrophobicContact CB-CD1 4.33Å; E127-L160 HydrophobicContact CG-CD1 4.46Å
128	F	65	Low	67.5	Low	37 Å²	37	43.3 Å²	43.3	16%	0.162	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-88.6	6.1	-180	-58.5	-74.6	0	0	0	114.8	T124 L126 H130 T131 T133	T124-F128 HydrophobicContact CG2-CE2 4.25Å; T124-F128 VanDerWaalsContact O-CD2 3.27Å; T124-F128 WeakPolarHBondContact O-CD2 3.47Å; L126-F128 PolarHBondContact O-N 3.47Å; F128-H130 PolarHBondContact O-N 3.24Å; F128-T131 PolarHBondContact O-N 2.91Å; F128-T131 PolarHBondContact O-OG1 3.06Å; F128-T133 WeakPolarHBondContact CB-O 3.19Å; F128-T133 VanDerWaalsContact O-O 3.05Å
129	S	61.9	Low	66	Low	8 Å²	8	43.6 Å²	43.6	6%	0.056	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-60.3	-16.9	-177.6	63.3	0	0	0	0	115.1	L126 E127 N165	L126-S129 WeakPolarHBondContact O-CB 3.41Å; L126-S129 PolarHBondContact O-N 3.25Å; L126-S129 PolarHBondContact O-OG 2.92Å; E127-S129 PolarHBondContact O-N 3.19Å; S129-N165 PolarHBondContact O-ND2 3.06Å; S129-N165 VanDerWaalsContact O-ND2 3.16Å
130	H	52.1	Low	64.5	Low	73 Å²	73	46.7 Å²	46.7	34%	0.338	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-86.7	-13.4	-178	60.3	-79.3	0	0	0	114.4	E127 F128 R163	E127-H130 PolarHBondContact O-CE1 3.1Å; E127-H130 PolarHBondContact O-ND1 3.27Å; F128-H130 PolarHBondContact O-N 3.24Å; H130-R163 PolarHBondContact CE1-NH2 2.81Å; H130-R163 VanDerWaalsContact CE1-NH2 3.32Å; H130-R163 PolarHBondContact NE2-NH2 3.3Å
131	T	52.3	Low	63.4	Low	68 Å²	68	47.9 Å²	47.9	42%	0.417	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-93.3	9.2	-177.8	50.9	0	0	0	0	113.6	F128 T133	F128-T131 PolarHBondContact O-N 2.91Å; F128-T131 PolarHBondContact O-OG1 3.06Å; T131-T133 WeakPolarHBondContact CB-OG1 3.04Å; T131-T133 PolarHBondContact O-N 3.33Å; T131-T133 PolarHBondContact O-OG1 2.86Å; T131-T133 PolarHBondContact OG1-O 2.96Å; T131-T133 PolarHBondContact OG1-OG1 3.1Å
132	H	48.3	Very low	62.1	Low	162 Å²	162	48.6 Å²	48.6	75%	0.75	26%	0.258	S	S	*	.	S	Bend	trans	55.6	0.8	-165.4	-76.1	-83.6	0	0	0	114.8
133	T	41.9	Very low	60.7	Low	92 Å²	92	51.6 Å²	51.6	56%	0.564	27%	0.274	S	S	*	.			trans	-109.5	89.7	169.2	41.6	0	0	0	0	107.3	F128 T131 G135	F128-T133 WeakPolarHBondContact CB-O 3.19Å; F128-T133 VanDerWaalsContact O-O 3.05Å; T131-T133 WeakPolarHBondContact CB-OG1 3.04Å; T131-T133 PolarHBondContact O-N 3.33Å; T131-T133 PolarHBondContact O-OG1 2.86Å; T131-T133 PolarHBondContact OG1-O 2.96Å; T131-T133 PolarHBondContact OG1-OG1 3.1Å; T133-G135 VanDerWaalsContact C-N 3.31Å; T133-G135 PolarHBondContact O-N 3.4Å
134	L	54.9	Low	59.5	Low	20 Å²	20	54.6 Å²	54.6	11%	0.105	30%	0.299	C	S	.	.			trans	-59.9	103.4	162.5	-78.8	159.6	0	0	0	106.2	C125 V169 S171 L174	C125-L134 VanDerWaalsContact O-CD2 3.32Å; C125-L134 WeakPolarHBondContact O-CD2 2.87Å; L134-V169 WeakPolarHBondContact CD1-O 3.33Å; L134-S171 VanDerWaalsContact CB-OG 3.22Å; L134-S171 WeakPolarHBondContact CB-OG 3.5Å; L134-S171 VanDerWaalsContact CD1-OG 3.25Å; L134-S171 WeakPolarHBondContact CD1-OG 3.5Å; L134-L174 HydrophobicContact CD1-CB 4.36Å; L134-L174 HydrophobicContact CD1-CD2 4.16Å
135	G	46.9	Very low	58.3	Low	12 Å²	12	61 Å²	61	12%	0.124	32%	0.323	C	S	.	.			trans	-60.8	140.3	-154.1	0	0	0	0	0	114.3	T133 S137	T133-G135 VanDerWaalsContact C-N 3.31Å; T133-G135 PolarHBondContact O-N 3.4Å; G135-S137 PolarHBondContact O-N 3.19Å
136	I	46.8	Very low	57	Low	173 Å²	173	64.1 Å²	64.1	89%	0.887	34%	0.335	S	S	*	.			trans	-78.3	35.1	172.3	-40.5	173.9	0	0	0	109.9
137	S	50.8	Low	55.5	Low	18 Å²	18	68.5 Å²	68.5	13%	0.126	37%	0.365	C	S	.	.			trans	-84.9	121.6	179.8	-75	0	0	0	0	109.3	G135 E141	G135-S137 PolarHBondContact O-N 3.19Å; S137-E141 WeakPolarHBondContact CA-OE2 3.48Å; S137-E141 WeakPolarHBondContact CB-OE2 3.29Å; S137-E141 PolarHBondContact OG-OE2 3.39Å
138	S	55.3	Low	54.1	Low	48 Å²	48	69.6 Å²	69.6	34%	0.336	38%	0.378	S	S	.	.			trans	-67.4	161.3	170	66	0	0	0	0	110.5	D140 E141	S138-D140 PolarHBondContact O-N 3.18Å; S138-D140 VanDerWaalsContact O-N 3.14Å; S138-D140 WeakPolarHBondContact OG-CB 3.34Å; S138-D140 PolarHBondContact OG-N 3.5Å; S138-E141 PolarHBondContact O-N 3.17Å
139	L	56.9	Low	52.8	Low	11 Å²	11	75.3 Å²	75.3	6%	0.058	42%	0.416	C	S	.	.	H	α-helix	trans	-52.1	-33.4	171.2	-128.2	82.7	0	0	0	112	A117 A121 E141 Y142 D143 L188	A117-L139 HydrophobicContact CB-CD2 4.41Å; A121-L139 HydrophobicContact CB-CD1 3.58Å; L139-E141 VanDerWaalsContact C-N 3.3Å; L139-E141 PolarHBondContact O-N 2.99Å; L139-Y142 PolarHBondContact O-N 3.28Å; L139-D143 PolarHBondContact O-N 3.33Å; L139-L188 HydrophobicContact CD2-CD1 3.54Å
140	D	56.6	Low	52	Low	124 Å²	124	78.5 Å²	78.5	66%	0.663	45%	0.45	S	S	*	.	H	α-helix	trans	-59.7	-36.8	177.7	-52.3	-44.9	0	0	0	112.7	S138 A144	S138-D140 PolarHBondContact O-N 3.18Å; S138-D140 VanDerWaalsContact O-N 3.14Å; S138-D140 WeakPolarHBondContact OG-CB 3.34Å; S138-D140 PolarHBondContact OG-N 3.5Å; D140-A144 VanDerWaalsContact O-CB 3.29Å; D140-A144 WeakPolarHBondContact O-CB 3.4Å; D140-A144 PolarHBondContact O-N 3.07Å
141	E	59.1	Low	51.3	Low	92 Å²	92	77.3 Å²	77.3	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-72	-35.2	178.2	-72.6	-170.3	169.5	0	0	112.4	S137 S138 L139 R145	S137-E141 WeakPolarHBondContact CA-OE2 3.48Å; S137-E141 WeakPolarHBondContact CB-OE2 3.29Å; S137-E141 PolarHBondContact OG-OE2 3.39Å; S138-E141 PolarHBondContact O-N 3.17Å; L139-E141 VanDerWaalsContact C-N 3.3Å; L139-E141 PolarHBondContact O-N 2.99Å; E141-R145 PolarHBondContact O-N 2.66Å
142	Y	59.5	Low	50.7	Low	16 Å²	16	78 Å²	78	6%	0.063	45%	0.454	C	S	.	.	H	α-helix	trans	-65.2	-50.8	172.9	-177.8	-93.1	0	0	0	110.2	R120 T124 L139 A144 R145 Y146	R120-Y142 HydrophobicContact CB-CD1 4.35Å; R120-Y142 HydrophobicContact CB-CE1 4.12Å; R120-Y142 HydrophobicContact CG-CD1 4.46Å; R120-Y142 HydrophobicContact CG-CE1 3.86Å; T124-Y142 HydrophobicContact CG2-CD2 4.15Å; T124-Y142 WeakPolarHBondContact OG1-CB 3.48Å; T124-Y142 WeakPolarHBondContact OG1-CD2 3.31Å; T124-Y142 VanDerWaalsContact OG1-CG 3.28Å; L139-Y142 PolarHBondContact O-N 3.28Å; Y142-A144 VanDerWaalsContact C-N 3.27Å; Y142-A144 PolarHBondContact O-N 3.06Å; Y142-R145 PolarHBondContact O-N 3.15Å; Y142-Y146 HydrophobicContact CD1-CD2 4.07Å; Y142-Y146 AromaticContact CD2-CD2 3.48Å; Y142-Y146 HydrophobicContact CD2-CD2 3.48Å; Y142-Y146 VanDerWaalsContact CD2-CD2 3.48Å; Y142-Y146 AromaticContact CD2-CE2 3.41Å; Y142-Y146 HydrophobicContact CD2-CE2 3.41Å; Y142-Y146 VanDerWaalsContact CD2-CE2 3.41Å; Y142-Y146 AromaticContact CE1-CD2 3.94Å; Y142-Y146 HydrophobicContact CE1-CD2 3.94Å; Y142-Y146 HydrophobicContact CE1-CG 4.4Å; Y142-Y146 AromaticContact CE2-CD2 3.36Å; Y142-Y146 HydrophobicContact CE2-CD2 3.36Å; Y142-Y146 AromaticContact CE2-CE2 3.21Å; Y142-Y146 HydrophobicContact CE2-CE2 3.21Å; Y142-Y146 HydrophobicContact CE2-CG 4.3Å; Y142-Y146 AromaticContact CG-CD2 3.86Å; Y142-Y146 HydrophobicContact CG-CD2 3.86Å; Y142-Y146 HydrophobicContact CG-CE2 4.24Å; Y142-Y146 AromaticContact CZ-CD2 3.6Å; Y142-Y146 AromaticContact CZ-CE2 3.88Å; Y142-Y146 VanDerWaalsContact O-CD2 3.3Å; Y142-Y146 WeakPolarHBondContact O-CD2 3.35Å; Y142-Y146 PolarHBondContact O-N 2.67Å
143	D	61.4	Low	50.6	Low	64 Å²	64	72.4 Å²	72.4	34%	0.342	43%	0.431	S	S	.	.	H	α-helix	trans	-61	-37.5	-180	-73	-8.6	0	0	0	111.6	R120 L139 R145 S147	R120-D143 IonicContact CZ-OD1 3.37Å; R120-D143 IonicContact NH1-OD1 2.66Å; R120-D143 PolarHBondContact NH1-OD1 2.59Å; R120-D143 IonicContact NH1-OD2 3.96Å; R120-D143 PolarHBondContact NH1-OD2 3.39Å; L139-D143 PolarHBondContact O-N 3.33Å; D143-R145 PolarHBondContact O-N 2.7Å; D143-S147 WeakPolarHBondContact O-CB 3.42Å; D143-S147 PolarHBondContact O-N 3.35Å; D143-S147 PolarHBondContact O-OG 2.64Å
144	A	59.9	Low	50.6	Low	70 Å²	70	70.9 Å²	70.9	58%	0.579	42%	0.419	S	S	*	.	H	α-helix	trans	-61.1	-41.9	173.2	0	0	0	0	0	113.1	D140 Y142 S147	D140-A144 VanDerWaalsContact O-CB 3.29Å; D140-A144 WeakPolarHBondContact O-CB 3.4Å; D140-A144 PolarHBondContact O-N 3.07Å; Y142-A144 VanDerWaalsContact C-N 3.27Å; Y142-A144 PolarHBondContact O-N 3.06Å; A144-S147 PolarHBondContact O-OG 2.9Å
145	R	55.2	Low	50.1	Low	143 Å²	143	77.7 Å²	77.7	54%	0.54	45%	0.451	S	S	.	.	H	α-helix	trans	-74.2	-35.9	-178.9	-76.2	-174.8	-169.5	-174.9	7.7	113.7	E141 Y142 D143	E141-R145 PolarHBondContact O-N 2.66Å; Y142-R145 PolarHBondContact O-N 3.15Å; D143-R145 PolarHBondContact O-N 2.7Å
146	Y	57.3	Low	50.4	Low	68 Å²	68	81 Å²	81	27%	0.267	47%	0.465	S	S	.	.	H	α-helix	trans	-99.7	0.2	-173.6	-67.6	-79.9	0	0	0	114	E127 Y142 S148 S151 V153	E127-Y146 PolarHBondContact OE2-OH 3.27Å; Y142-Y146 HydrophobicContact CD1-CD2 4.07Å; Y142-Y146 AromaticContact CD2-CD2 3.48Å; Y142-Y146 HydrophobicContact CD2-CD2 3.48Å; Y142-Y146 VanDerWaalsContact CD2-CD2 3.48Å; Y142-Y146 AromaticContact CD2-CE2 3.41Å; Y142-Y146 HydrophobicContact CD2-CE2 3.41Å; Y142-Y146 VanDerWaalsContact CD2-CE2 3.41Å; Y142-Y146 AromaticContact CE1-CD2 3.94Å; Y142-Y146 HydrophobicContact CE1-CD2 3.94Å; Y142-Y146 HydrophobicContact CE1-CG 4.4Å; Y142-Y146 AromaticContact CE2-CD2 3.36Å; Y142-Y146 HydrophobicContact CE2-CD2 3.36Å; Y142-Y146 AromaticContact CE2-CE2 3.21Å; Y142-Y146 HydrophobicContact CE2-CE2 3.21Å; Y142-Y146 HydrophobicContact CE2-CG 4.3Å; Y142-Y146 AromaticContact CG-CD2 3.86Å; Y142-Y146 HydrophobicContact CG-CD2 3.86Å; Y142-Y146 HydrophobicContact CG-CE2 4.24Å; Y142-Y146 AromaticContact CZ-CD2 3.6Å; Y142-Y146 AromaticContact CZ-CE2 3.88Å; Y142-Y146 VanDerWaalsContact O-CD2 3.3Å; Y142-Y146 WeakPolarHBondContact O-CD2 3.35Å; Y142-Y146 PolarHBondContact O-N 2.67Å; Y146-S148 PolarHBondContact O-N 3.45Å; Y146-S148 VanDerWaalsContact O-N 3.12Å; Y146-S151 VanDerWaalsContact CD1-OG 3.29Å; Y146-S151 WeakPolarHBondContact CD1-OG 3.18Å; Y146-V153 HydrophobicContact CD1-CG2 4.46Å
147	S	52	Low	50.8	Low	92 Å²	92	74.4 Å²	74.4	64%	0.643	43%	0.432	S	S	*	.			trans	-64.7	-7.7	174.9	58.5	0	0	0	0	115.5	D143 A144 V149	D143-S147 WeakPolarHBondContact O-CB 3.42Å; D143-S147 PolarHBondContact O-N 3.35Å; D143-S147 PolarHBondContact O-OG 2.64Å; A144-S147 PolarHBondContact O-OG 2.9Å; S147-V149 PolarHBondContact O-N 3.43Å
148	S	42.1	Very low	51.2	Low	71 Å²	71	80.4 Å²	80.4	50%	0.497	46%	0.463	S	S	.	.	S	Bend	trans	-78.9	119.5	176.1	68	0	0	0	0	112.1	Y146 G150 S151	Y146-S148 PolarHBondContact O-N 3.45Å; Y146-S148 VanDerWaalsContact O-N 3.12Å; S148-G150 PolarHBondContact O-N 3.22Å; S148-S151 PolarHBondContact O-N 3Å
149	V	38.5	Very low	51.8	Low	157 Å²	157	83.4 Å²	83.4	95%	0.952	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	102.5	173.1	-177.1	0	0	0	0	109.7	S147	S147-V149 PolarHBondContact O-N 3.43Å
150	G	43.3	Very low	52.5	Low	75 Å²	75	84.1 Å²	84.1	77%	0.773	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	138.8	-8.6	-179.5	0	0	0	0	0	115.7	S148	S148-G150 PolarHBondContact O-N 3.22Å
151	S	38.1	Very low	53.6	Low	48 Å²	48	79.6 Å²	79.6	34%	0.336	45%	0.449	S	S	.	.			trans	-94.3	95.8	171.8	177.9	0	0	0	0	109.8	Y146 S148	Y146-S151 VanDerWaalsContact CD1-OG 3.29Å; Y146-S151 WeakPolarHBondContact CD1-OG 3.18Å; S148-S151 PolarHBondContact O-N 3Å
152	T	39.9	Very low	54.2	Low	83 Å²	83	79.8 Å²	79.8	51%	0.509	46%	0.46	S	S	.	.			trans	-86.8	113.8	169.1	47.1	0	0	0	0	108.3	D154 E155	T152-D154 PolarHBondContact O-N 3.35Å; T152-E155 PolarHBondContact O-N 3.39Å
153	V	45.4	Very low	54.8	Low	43 Å²	43	85.6 Å²	85.6	26%	0.261	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-53.6	-20.4	177.1	179.6	0	0	0	0	112.2	L123 Y146	L123-V153 HydrophobicContact CD1-CG1 4.11Å; Y146-V153 HydrophobicContact CD1-CG2 4.46Å
154	D	43.7	Very low	55.7	Low	60 Å²	60	82.8 Å²	82.8	32%	0.321	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-78.9	-20	-170.4	-59.8	-43.4	0	0	0	115.9	T152	T152-D154 PolarHBondContact O-N 3.35Å
155	E	43.1	Very low	56.6	Low	163 Å²	163	82.6 Å²	82.6	76%	0.762	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-83.3	-12.8	177.8	-71.1	-167	164.7	0	0	113.2	T152	T152-E155 PolarHBondContact O-N 3.39Å
156	D	53.9	Low	58	Low	81 Å²	81	78.5 Å²	78.5	43%	0.433	45%	0.445	S	S	.	.	S	Bend	trans	-104.5	-3	-173.9	-78	-33.1	0	0	0	114.6	D158 Q159 L160	D156-D158 PolarHBondContact O-N 3.28Å; D156-Q159 CarbonylContact O-C 3.54Å; D156-Q159 WeakPolarHBondContact O-CA 3.16Å; D156-Q159 WeakPolarHBondContact O-CB 3.28Å; D156-Q159 PolarHBondContact O-N 2.89Å; D156-Q159 PolarHBondContact OD1-NE2 3.47Å; D156-Q159 VanDerWaalsContact OD1-NE2 3.15Å; D156-L160 PolarHBondContact O-N 3.42Å
157	D	55.5	Low	59.3	Low	35 Å²	35	82 Å²	82	19%	0.187	46%	0.458	C	S	.	.	H	α-helix	trans	-58.9	-42.8	-175.3	-94.1	-7.7	0	0	0	112.8	Q159 L160 W161	D157-Q159 VanDerWaalsContact C-N 3.29Å; D157-Q159 PolarHBondContact O-N 3.11Å; D157-L160 WeakPolarHBondContact O-CB 3.3Å; D157-L160 PolarHBondContact O-N 3.03Å; D157-W161 PolarHBondContact O-N 3.17Å
158	D	59.4	Low	60.9	Low	144 Å²	144	78.4 Å²	78.4	77%	0.77	43%	0.431	S	S	*	.	H	α-helix	trans	-65.5	-34	176.1	-82.5	-16.8	0	0	0	111.8	D156 S162	D156-D158 PolarHBondContact O-N 3.28Å; D158-S162 PolarHBondContact O-N 3.41Å
159	Q	66.1	Low	62.7	Low	112 Å²	112	79 Å²	79	52%	0.523	43%	0.432	S	S	.	.	H	α-helix	trans	-71.9	-39.2	175.3	-65.9	-175.9	51.3	0	0	111.4	D156 D157 S162 R163	D156-Q159 CarbonylContact O-C 3.54Å; D156-Q159 WeakPolarHBondContact O-CA 3.16Å; D156-Q159 WeakPolarHBondContact O-CB 3.28Å; D156-Q159 PolarHBondContact O-N 2.89Å; D156-Q159 PolarHBondContact OD1-NE2 3.47Å; D156-Q159 VanDerWaalsContact OD1-NE2 3.15Å; D157-Q159 VanDerWaalsContact C-N 3.29Å; D157-Q159 PolarHBondContact O-N 3.11Å; Q159-S162 PolarHBondContact O-N 2.91Å; Q159-S162 PolarHBondContact O-OG 2.94Å; Q159-R163 WeakPolarHBondContact O-CG 3.01Å; Q159-R163 PolarHBondContact O-N 2.82Å
160	L	72.5	Confident	64.9	Low	26 Å²	26	78 Å²	78	14%	0.136	42%	0.417	C	S	.	.	H	α-helix	trans	-56.9	-55.4	177.5	179.9	71.3	0	0	0	110.1	L123 E127 D156 D157 S162 R163 V164	L123-L160 HydrophobicContact CD2-CD2 3.94Å; E127-L160 HydrophobicContact CB-CD1 4.33Å; E127-L160 HydrophobicContact CG-CD1 4.46Å; D156-L160 PolarHBondContact O-N 3.42Å; D157-L160 WeakPolarHBondContact O-CB 3.3Å; D157-L160 PolarHBondContact O-N 3.03Å; L160-S162 PolarHBondContact O-N 2.87Å; L160-R163 WeakPolarHBondContact O-CB 3.42Å; L160-R163 PolarHBondContact O-N 3.45Å; L160-V164 HydrophobicContact CD1-CG2 4.46Å; L160-V164 HydrophobicContact CG-CG2 4.32Å; L160-V164 WeakPolarHBondContact O-CG2 3.48Å; L160-V164 PolarHBondContact O-N 2.67Å; L160-V164 VanDerWaalsContact O-N 3.08Å
161	W	78.9	Confident	66.9	Low	28 Å²	28	75.1 Å²	75.1	11%	0.106	39%	0.385	C	S	.	.	H	α-helix	trans	-66.6	-23.7	-175.9	-65.4	117.8	0	0	0	113.9	L126 D157 R163 V164 L201 H204 V205 R208	L126-W161 HydrophobicContact CD1-CH2 3.61Å; L126-W161 HydrophobicContact CD1-CZ3 3.94Å; D157-W161 PolarHBondContact O-N 3.17Å; W161-R163 VanDerWaalsContact C-N 3.27Å; W161-V164 HydrophobicContact CE3-CB 4.22Å; W161-V164 HydrophobicContact CE3-CG1 4.47Å; W161-V164 HydrophobicContact CE3-CG2 4.14Å; W161-V164 HydrophobicContact CZ3-CG1 4.45Å; W161-V164 HydrophobicContact CZ3-CG2 4.4Å; W161-L201 HydrophobicContact CZ2-CD2 4.05Å; W161-H204 AromaticContact CD1-CE1 3.85Å; W161-H204 AromaticContact CD1-ND1 3.77Å; W161-H204 HydrophobicContact CD2-CB 3.74Å; W161-H204 AromaticContact CD2-CG 3.78Å; W161-H204 AromaticContact CD2-ND1 3.8Å; W161-H204 AromaticContact CE2-CD2 3.72Å; W161-H204 AromaticContact CE2-CG 3.37Å; W161-H204 AromaticContact CE2-ND1 3.7Å; W161-H204 HydrophobicContact CE3-CB 3.69Å; W161-H204 AromaticContact CG-ND1 3.85Å; W161-H204 HydrophobicContact CH2-CB 3.29Å; W161-H204 HydrophobicContact CZ2-CB 3.33Å; W161-H204 AromaticContact CZ2-CD2 3.72Å; W161-H204 AromaticContact CZ2-CG 3.53Å; W161-H204 HydrophobicContact CZ3-CB 3.48Å; W161-H204 VanDerWaalsContact CZ3-CB 3.48Å; W161-H204 AromaticContact NE1-CD2 3.76Å; W161-H204 AromaticContact NE1-CE1 3.73Å; W161-H204 AromaticContact NE1-CG 3.69Å; W161-H204 AromaticContact NE1-ND1 3.67Å; W161-H204 AromaticContact NE1-NE2 3.82Å; W161-V205 HydrophobicContact CH2-CG2 4.16Å; W161-R208 PolarHBondContact O-NH2 3.47Å
162	S	73.2	Confident	69.2	Low	96 Å²	96	77.7 Å²	77.7	67%	0.671	40%	0.401	S	S	*	.	H	α-helix	trans	-68.7	-25.4	172.4	81.4	0	0	0	0	113	D158 Q159 L160	D158-S162 PolarHBondContact O-N 3.41Å; Q159-S162 PolarHBondContact O-N 2.91Å; Q159-S162 PolarHBondContact O-OG 2.94Å; L160-S162 PolarHBondContact O-N 2.87Å
163	R	72.3	Confident	71.6	Confident	138 Å²	138	75.3 Å²	75.3	52%	0.521	38%	0.383	S	S	.	.	H	α-helix	trans	-94.4	-27.3	-179.8	-64.3	171.1	66.6	165.5	-0.9	113.1	H130 Q159 L160 W161 N165	H130-R163 PolarHBondContact CE1-NH2 2.81Å; H130-R163 VanDerWaalsContact CE1-NH2 3.32Å; H130-R163 PolarHBondContact NE2-NH2 3.3Å; Q159-R163 WeakPolarHBondContact O-CG 3.01Å; Q159-R163 PolarHBondContact O-N 2.82Å; L160-R163 WeakPolarHBondContact O-CB 3.42Å; L160-R163 PolarHBondContact O-N 3.45Å; W161-R163 VanDerWaalsContact C-N 3.27Å; R163-N165 PolarHBondContact O-N 3.3Å
164	V	78.6	Confident	73.7	Confident	6 Å²	6	73.3 Å²	73.3	4%	0.036	37%	0.37	C	S	.	.	S	Bend	trans	-70.8	125.5	178.6	178.5	0	0	0	0	110.5	L126 L160 W161 L168	L126-V164 HydrophobicContact CB-CG2 4.39Å; L126-V164 HydrophobicContact CD2-CG1 4.49Å; L160-V164 HydrophobicContact CD1-CG2 4.46Å; L160-V164 HydrophobicContact CG-CG2 4.32Å; L160-V164 WeakPolarHBondContact O-CG2 3.48Å; L160-V164 PolarHBondContact O-N 2.67Å; L160-V164 VanDerWaalsContact O-N 3.08Å; W161-V164 HydrophobicContact CE3-CB 4.22Å; W161-V164 HydrophobicContact CE3-CG1 4.47Å; W161-V164 HydrophobicContact CE3-CG2 4.14Å; W161-V164 HydrophobicContact CZ3-CG1 4.45Å; W161-V164 HydrophobicContact CZ3-CG2 4.4Å; V164-L168 HydrophobicContact CG1-CD2 3.83Å
165	N	79.8	Confident	76	Confident	65 Å²	65	71.9 Å²	71.9	35%	0.348	36%	0.364	S	S	.	.			trans	-49.1	141.6	178.2	-80.4	-45.3	0	0	0	112.9	S129 R163 R167 R208	S129-N165 PolarHBondContact O-ND2 3.06Å; S129-N165 VanDerWaalsContact O-ND2 3.16Å; R163-N165 PolarHBondContact O-N 3.3Å; N165-R167 WeakPolarHBondContact CB-O 3.4Å; N165-R167 PolarHBondContact O-N 3.43Å; N165-R167 VanDerWaalsContact O-N 3.14Å; N165-R208 VanDerWaalsContact O-CD 3.25Å; N165-R208 WeakPolarHBondContact O-CD 3.24Å; N165-R208 PolarHBondContact O-NE 3.43Å
166	L	84.2	Confident	78.3	Confident	58 Å²	58	68 Å²	68	30%	0.304	35%	0.345	S	S	.	.	S	Bend	trans	-65.4	-15.3	178.9	-68.5	177.3	0	0	0	113.5	R208 L213 L214 K217	L166-R208 WeakPolarHBondContact O-CA 3.35Å; L166-L213 HydrophobicContact CD2-CB 4.14Å; L166-L213 HydrophobicContact CD2-CD1 4.01Å; L166-L214 HydrophobicContact CB-CD2 3.59Å; L166-L214 HydrophobicContact CB-CG 3.98Å; L166-L214 HydrophobicContact CD1-CD2 3.87Å; L166-L214 HydrophobicContact CG-CD2 4.4Å; L166-K217 HydrophobicContact CD1-CD 3.75Å
167	R	84.9	Confident	80.2	Confident	141 Å²	141	64.1 Å²	64.1	53%	0.532	33%	0.325	S	S	.	.	S	Bend	trans	-133.2	122.1	168.4	-173.7	168.6	-168.7	148.7	5.7	108.7	N165 R208 L214	N165-R167 WeakPolarHBondContact CB-O 3.4Å; N165-R167 PolarHBondContact O-N 3.43Å; N165-R167 VanDerWaalsContact O-N 3.14Å; R167-R208 WeakPolarHBondContact CA-O 3.07Å; R167-L214 HydrophobicContact CB-CD1 3.57Å; R167-L214 HydrophobicContact CB-CG 4.38Å; R167-L214 HydrophobicContact CG-CD1 4.36Å
168	L	86.3	Confident	82	Confident	16 Å²	16	62.5 Å²	62.5	8%	0.084	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-73.1	138.8	177.6	-70.2	170.1	0	0	0	109.3	L126 V164 L174 V205 R208 L209	L126-L168 HydrophobicContact CD2-CD1 4.14Å; L126-L168 HydrophobicContact CD2-CD2 3.82Å; V164-L168 HydrophobicContact CG1-CD2 3.83Å; L168-L174 HydrophobicContact CB-CD2 4.25Å; L168-V205 HydrophobicContact CD1-CG1 4.03Å; L168-R208 HydrophobicContact CD1-CB 4.15Å; L168-R208 HydrophobicContact CG-CB 3.92Å; L168-R208 PolarHBondContact N-O 3.41Å; L168-L209 HydrophobicContact CB-CD2 4.16Å; L168-L209 HydrophobicContact CD1-CD2 3.89Å; L168-L209 HydrophobicContact CD1-CG 4.4Å
169	V	79.8	Confident	83.7	Confident	85 Å²	85	58.8 Å²	58.8	52%	0.515	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-92	142.2	175.4	-178.9	0	0	0	0	108.1	L134 L174	L134-V169 WeakPolarHBondContact CD1-O 3.33Å; V169-L174 WeakPolarHBondContact O-CD2 3.18Å
170	Q	84.4	Confident	84.9	Confident	134 Å²	134	53.9 Å²	53.9	63%	0.626	27%	0.271	S	S	*	.	P	Polyproline II helix	trans	-63.9	140.5	176.1	-68	-175.9	-14.8	0	0	110.7	Y391	Q170-Y391 HydrophobicContact CG-CE2 3.84Å
171	S	84.3	Confident	85.8	Confident	16 Å²	16	56 Å²	56	11%	0.112	28%	0.28	C	S	.	.			trans	-147.6	157.7	170.8	66.8	0	0	0	0	109.7	L134 R173 L174 T175	L134-S171 VanDerWaalsContact CB-OG 3.22Å; L134-S171 WeakPolarHBondContact CB-OG 3.5Å; L134-S171 VanDerWaalsContact CD1-OG 3.25Å; L134-S171 WeakPolarHBondContact CD1-OG 3.5Å; S171-R173 VanDerWaalsContact C-N 3.3Å; S171-R173 PolarHBondContact O-N 3.4Å; S171-L174 PolarHBondContact O-N 3.24Å; S171-L174 VanDerWaalsContact OG-CB 3.24Å; S171-L174 WeakPolarHBondContact OG-CB 3.49Å; S171-L174 PolarHBondContact OG-N 3.39Å; S171-L174 VanDerWaalsContact OG-N 3.17Å; S171-T175 PolarHBondContact O-N 3.34Å; S171-T175 PolarHBondContact O-OG1 3.35Å; S171-T175 VanDerWaalsContact O-OG1 3.04Å
172	P	87.7	Confident	86.3	Confident	102 Å²	102	54.8 Å²	54.8	66%	0.662	28%	0.276	S	S	*	.	H	α-helix	trans	-52.4	-47.3	177.1	-27.6	35.6	0	0	0	112.7	L174 T175 E176	P172-L174 PolarHBondContact O-N 3Å; P172-T175 WeakPolarHBondContact O-CB 3.35Å; P172-T175 PolarHBondContact O-N 2.84Å; P172-E176 WeakPolarHBondContact O-CG 3.29Å; P172-E176 PolarHBondContact O-N 3.49Å
173	R	88.8	Confident	87	Confident	33 Å²	33	56.7 Å²	56.7	13%	0.125	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-43.3	179.8	-177	55.4	173.9	-179.9	-2.9	112.9	C125 S171 T175 E176 L177 D184	C125-R173 HydrophobicContact CB-CG 4.45Å; S171-R173 VanDerWaalsContact C-N 3.3Å; S171-R173 PolarHBondContact O-N 3.4Å; R173-T175 VanDerWaalsContact C-N 3.32Å; R173-T175 PolarHBondContact O-N 3.48Å; R173-E176 IonicContact NH1-OE2 3.66Å; R173-E176 PolarHBondContact O-N 2.94Å; R173-L177 HydrophobicContact CG-CD1 4.14Å; R173-L177 WeakPolarHBondContact O-CB 3.38Å; R173-L177 WeakPolarHBondContact O-CG 3.3Å; R173-L177 PolarHBondContact O-N 3.33Å; R173-D184 IonicContact CZ-OD1 2.92Å; R173-D184 IonicContact CZ-OD2 2.81Å; R173-D184 IonicContact NH1-OD1 2.64Å; R173-D184 PolarHBondContact NH1-OD1 3.41Å; R173-D184 IonicContact NH1-OD2 2.58Å; R173-D184 PolarHBondContact NH1-OD2 3.2Å; R173-D184 IonicContact NH2-OD1 3.09Å; R173-D184 PolarHBondContact NH2-OD1 2.8Å; R173-D184 IonicContact NH2-OD2 3.07Å; R173-D184 PolarHBondContact NH2-OD2 3.13Å
174	L	90.2	Very high	87.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-40.2	176.3	-176.4	63.4	0	0	0	111.1	W122 L134 L168 V169 S171 P172 L177 I178 Y391	W122-L174 HydrophobicContact CH2-CD1 3.73Å; W122-L174 HydrophobicContact CZ3-CD1 3.72Å; L134-L174 HydrophobicContact CD1-CB 4.36Å; L134-L174 HydrophobicContact CD1-CD2 4.16Å; L168-L174 HydrophobicContact CB-CD2 4.25Å; V169-L174 WeakPolarHBondContact O-CD2 3.18Å; S171-L174 PolarHBondContact O-N 3.24Å; S171-L174 VanDerWaalsContact OG-CB 3.24Å; S171-L174 WeakPolarHBondContact OG-CB 3.49Å; S171-L174 PolarHBondContact OG-N 3.39Å; S171-L174 VanDerWaalsContact OG-N 3.17Å; P172-L174 PolarHBondContact O-N 3Å; L174-L177 PolarHBondContact O-N 3.21Å; L174-I178 HydrophobicContact CD1-CD1 3.72Å; L174-I178 HydrophobicContact CD1-CG1 4.13Å; L174-I178 HydrophobicContact CD2-CD1 4.38Å; L174-I178 HydrophobicContact CG-CD1 3.7Å; L174-I178 HydrophobicContact CG-CG1 4.41Å; L174-I178 WeakPolarHBondContact O-CB 3.45Å; L174-I178 VanDerWaalsContact O-CG1 3.28Å; L174-I178 WeakPolarHBondContact O-CG1 3.3Å; L174-I178 PolarHBondContact O-N 2.82Å; L174-Y391 HydrophobicContact CD2-CE2 3.89Å; L174-Y391 HydrophobicContact CG-CE2 4.04Å
175	T	92.1	Very high	88	Confident	30 Å²	30	52.2 Å²	52.2	18%	0.184	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-51.1	174.9	-60.2	0	0	0	0	111.2	S171 P172 R173 L177 I178 R179 Y391	S171-T175 PolarHBondContact O-N 3.34Å; S171-T175 PolarHBondContact O-OG1 3.35Å; S171-T175 VanDerWaalsContact O-OG1 3.04Å; P172-T175 WeakPolarHBondContact O-CB 3.35Å; P172-T175 PolarHBondContact O-N 2.84Å; R173-T175 VanDerWaalsContact C-N 3.32Å; R173-T175 PolarHBondContact O-N 3.48Å; T175-L177 PolarHBondContact O-N 2.83Å; T175-I178 PolarHBondContact O-N 2.77Å; T175-R179 HydrophobicContact CG2-CG 4.32Å; T175-R179 VanDerWaalsContact O-CB 3.31Å; T175-R179 WeakPolarHBondContact O-CB 3.36Å; T175-R179 VanDerWaalsContact O-CG 3.28Å; T175-R179 WeakPolarHBondContact O-CG 3.43Å; T175-R179 PolarHBondContact O-N 2.92Å; T175-Y391 HydrophobicContact CG2-CE1 4.11Å; T175-Y391 PolarHBondContact N-OH 3.07Å; T175-Y391 PolarHBondContact OG1-OH 3.38Å
176	E	92.3	Very high	88.3	Confident	81 Å²	81	52.1 Å²	52.1	38%	0.379	26%	0.262	S	S	.	.	H	α-helix	trans	-58.1	-46.7	179.4	-72.8	170.1	-175.5	0	0	111.7	P172 R173 G180 Q181 A182	P172-E176 WeakPolarHBondContact O-CG 3.29Å; P172-E176 PolarHBondContact O-N 3.49Å; R173-E176 IonicContact NH1-OE2 3.66Å; R173-E176 PolarHBondContact O-N 2.94Å; E176-G180 PolarHBondContact O-N 3.46Å; E176-Q181 PolarHBondContact O-N 3.16Å; E176-A182 HydrophobicContact CB-CB 4.12Å; E176-A182 PolarHBondContact O-N 3.4Å
177	L	92.8	Very high	88.4	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-44.6	179.7	-72.8	173.4	0	0	0	112.5	A121 W122 C125 R173 L174 T175 G180 A182 V185 G196	A121-L177 HydrophobicContact CB-CD2 3.72Å; W122-L177 HydrophobicContact CZ2-CB 4.02Å; C125-L177 HydrophobicContact CB-CD1 3.58Å; R173-L177 HydrophobicContact CG-CD1 4.14Å; R173-L177 WeakPolarHBondContact O-CB 3.38Å; R173-L177 WeakPolarHBondContact O-CG 3.3Å; R173-L177 PolarHBondContact O-N 3.33Å; L174-L177 PolarHBondContact O-N 3.21Å; T175-L177 PolarHBondContact O-N 2.83Å; L177-G180 PolarHBondContact O-N 3.1Å; L177-A182 HydrophobicContact CD2-CB 3.76Å; L177-A182 HydrophobicContact CG-CB 4.36Å; L177-V185 HydrophobicContact CD2-CG2 3.87Å; L177-G196 VanDerWaalsContact O-CA 3.25Å; L177-G196 WeakPolarHBondContact O-CA 3.4Å
178	I	94.3	Very high	88.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.2	-42.5	179.1	-73.5	173.9	0	0	0	111.6	W122 L174 T175 G180 I197 L209 R384 L388 Y391	W122-I178 HydrophobicContact CH2-CD1 3.92Å; W122-I178 HydrophobicContact CH2-CG1 3.28Å; W122-I178 HydrophobicContact CZ2-CB 4.38Å; W122-I178 HydrophobicContact CZ2-CG1 3.45Å; W122-I178 VanDerWaalsContact CZ2-CG1 3.45Å; L174-I178 HydrophobicContact CD1-CD1 3.72Å; L174-I178 HydrophobicContact CD1-CG1 4.13Å; L174-I178 HydrophobicContact CD2-CD1 4.38Å; L174-I178 HydrophobicContact CG-CD1 3.7Å; L174-I178 HydrophobicContact CG-CG1 4.41Å; L174-I178 WeakPolarHBondContact O-CB 3.45Å; L174-I178 VanDerWaalsContact O-CG1 3.28Å; L174-I178 WeakPolarHBondContact O-CG1 3.3Å; L174-I178 PolarHBondContact O-N 2.82Å; T175-I178 PolarHBondContact O-N 2.77Å; I178-G180 PolarHBondContact O-N 3.25Å; I178-I197 HydrophobicContact CG1-CG1 4.33Å; I178-L209 HydrophobicContact CD1-CD1 4.12Å; I178-L209 HydrophobicContact CD1-CD2 4.09Å; I178-R384 PolarHBondContact O-NH1 3.48Å; I178-R384 PolarHBondContact O-NH2 3.45Å; I178-L388 HydrophobicContact CG2-CD2 3.87Å; I178-L388 WeakPolarHBondContact O-CD2 3.31Å; I178-Y391 HydrophobicContact CB-CD1 4.5Å; I178-Y391 HydrophobicContact CB-CG 4.47Å; I178-Y391 HydrophobicContact CD1-CD1 4.25Å; I178-Y391 HydrophobicContact CD1-CD2 3.24Å; I178-Y391 HydrophobicContact CD1-CE2 3.64Å; I178-Y391 HydrophobicContact CD1-CG 3.58Å; I178-Y391 HydrophobicContact CG2-CD1 4.09Å; I178-Y391 HydrophobicContact CG2-CG 3.95Å
179	R	94.1	Very high	88.3	Confident	66 Å²	66	52 Å²	52	25%	0.249	29%	0.287	C	S	.	.	H	α-helix	trans	-73.9	-14.9	178.8	-66	-173.8	178.8	171.6	1.3	113	T175 Q181 L388 D392 Y443	T175-R179 HydrophobicContact CG2-CG 4.32Å; T175-R179 VanDerWaalsContact O-CB 3.31Å; T175-R179 WeakPolarHBondContact O-CB 3.36Å; T175-R179 VanDerWaalsContact O-CG 3.28Å; T175-R179 WeakPolarHBondContact O-CG 3.43Å; T175-R179 PolarHBondContact O-N 2.92Å; R179-Q181 HydrophobicContact CB-CB 4.47Å; R179-Q181 HydrophobicContact CB-CG 4Å; R179-L388 HydrophobicContact CG-CD2 4.22Å; R179-D392 IonicContact CZ-OD1 2.87Å; R179-D392 IonicContact CZ-OD2 2.91Å; R179-D392 IonicContact NE-OD1 3.42Å; R179-D392 IonicContact NE-OD2 3.56Å; R179-D392 PolarHBondContact NE-OD2 2.89Å; R179-D392 VanDerWaalsContact NE-OD2 3.07Å; R179-D392 VanDerWaalsContact NH2-CG 3.32Å; R179-D392 IonicContact NH2-OD1 2.82Å; R179-D392 PolarHBondContact NH2-OD1 2.72Å; R179-D392 IonicContact NH2-OD2 3.33Å; R179-D392 PolarHBondContact NH2-OD2 2.92Å; R179-D392 VanDerWaalsContact NH2-OD2 3.1Å; R179-Y443 HydrophobicContact CB-CE2 4.06Å; R179-Y443 VanDerWaalsContact CD-CZ 3.45Å; R179-Y443 HydrophobicContact CG-CE1 4.26Å; R179-Y443 HydrophobicContact CG-CE2 3.78Å; R179-Y443 VanDerWaalsContact NE-CE1 3.28Å; R179-Y443 PolarHBondContact NE-OH 3.01Å
180	G	91.8	Very high	88.4	Confident	9 Å²	9	54 Å²	54	9%	0.093	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	34.8	-175.6	0	0	0	0	0	112.3	E176 L177 I178 L195	E176-G180 PolarHBondContact O-N 3.46Å; L177-G180 PolarHBondContact O-N 3.1Å; I178-G180 PolarHBondContact O-N 3.25Å; G180-L195 WeakPolarHBondContact O-CD1 3.3Å
181	Q	90.5	Very high	87.9	Confident	71 Å²	71	54.1 Å²	54.1	33%	0.332	31%	0.305	S	S	.	.			trans	-115.8	9.1	-177.7	-64.8	178.1	-42	0	0	112.2	E176 R179 L183	E176-Q181 PolarHBondContact O-N 3.16Å; R179-Q181 HydrophobicContact CB-CB 4.47Å; R179-Q181 HydrophobicContact CB-CG 4Å; Q181-L183 PolarHBondContact O-N 3.15Å; Q181-L183 VanDerWaalsContact O-N 3.15Å
182	A	89.2	Confident	87.3	Confident	3 Å²	3	56.4 Å²	56.4	3%	0.025	33%	0.331	C	S	.	.			trans	-70.2	105.3	175.2	0	0	0	0	0	109.9	E176 L177 D184 V185 E186	E176-A182 HydrophobicContact CB-CB 4.12Å; E176-A182 PolarHBondContact O-N 3.4Å; L177-A182 HydrophobicContact CD2-CB 3.76Å; L177-A182 HydrophobicContact CG-CB 4.36Å; A182-D184 VanDerWaalsContact C-N 3.28Å; A182-D184 PolarHBondContact O-N 3.47Å; A182-V185 HydrophobicContact CB-CB 4.09Å; A182-V185 HydrophobicContact CB-CG2 3.93Å; A182-V185 PolarHBondContact O-N 2.61Å; A182-E186 PolarHBondContact O-N 2.93Å
183	L	88.1	Confident	87	Confident	135 Å²	135	52.6 Å²	52.6	71%	0.707	30%	0.304	S	S	*	.	H	α-helix	trans	-58.5	-36.7	-172.5	-65.5	174.7	0	0	0	113.6	Q181 V185 E186 A187	Q181-L183 PolarHBondContact O-N 3.15Å; Q181-L183 VanDerWaalsContact O-N 3.15Å; L183-V185 VanDerWaalsContact C-N 3.32Å; L183-E186 PolarHBondContact O-N 3.38Å; L183-A187 VanDerWaalsContact O-CB 3.29Å; L183-A187 WeakPolarHBondContact O-CB 3.38Å; L183-A187 PolarHBondContact O-N 3.37Å
184	D	85.5	Confident	86.5	Confident	47 Å²	47	52.1 Å²	52.1	25%	0.251	30%	0.303	S	S	.	.	H	α-helix	trans	-66.6	-34.8	177.3	62.3	-40.3	0	0	0	112.3	R173 A182 L188	R173-D184 IonicContact CZ-OD1 2.92Å; R173-D184 IonicContact CZ-OD2 2.81Å; R173-D184 IonicContact NH1-OD1 2.64Å; R173-D184 PolarHBondContact NH1-OD1 3.41Å; R173-D184 IonicContact NH1-OD2 2.58Å; R173-D184 PolarHBondContact NH1-OD2 3.2Å; R173-D184 IonicContact NH2-OD1 3.09Å; R173-D184 PolarHBondContact NH2-OD1 2.8Å; R173-D184 IonicContact NH2-OD2 3.07Å; R173-D184 PolarHBondContact NH2-OD2 3.13Å; A182-D184 VanDerWaalsContact C-N 3.28Å; A182-D184 PolarHBondContact O-N 3.47Å; D184-L188 WeakPolarHBondContact O-CG 3.41Å
185	V	87.7	Confident	86.5	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-76.7	-45	174.8	-178.5	0	0	0	0	110.6	N118 A121 L177 A182 L183 A187 L188 A189 L195	N118-V185 HydrophobicContact CB-CG1 3.58Å; A121-V185 HydrophobicContact CB-CG2 3.51Å; L177-V185 HydrophobicContact CD2-CG2 3.87Å; A182-V185 HydrophobicContact CB-CB 4.09Å; A182-V185 HydrophobicContact CB-CG2 3.93Å; A182-V185 PolarHBondContact O-N 2.61Å; L183-V185 VanDerWaalsContact C-N 3.32Å; V185-A187 VanDerWaalsContact C-N 3.29Å; V185-A187 PolarHBondContact O-N 3.41Å; V185-L188 PolarHBondContact O-N 3.26Å; V185-L188 VanDerWaalsContact O-N 3.09Å; V185-A189 WeakPolarHBondContact O-CB 3.42Å; V185-A189 PolarHBondContact O-N 2.87Å; V185-L195 HydrophobicContact CG1-CD2 3.9Å
186	E	85.9	Confident	86.6	Confident	64 Å²	64	51 Å²	51	30%	0.299	30%	0.296	S	S	.	.	H	α-helix	trans	-60.7	-38.6	-179.9	-173.6	175.9	-171.8	0	0	111.8	A182 L183 L188 A189 L195 K440	A182-E186 PolarHBondContact O-N 2.93Å; L183-E186 PolarHBondContact O-N 3.38Å; E186-L188 PolarHBondContact O-N 3.29Å; E186-A189 PolarHBondContact O-N 3.16Å; E186-L195 HydrophobicContact CB-CD1 4.39Å; E186-L195 HydrophobicContact CG-CD1 4.32Å; E186-K440 VanDerWaalsContact OE1-CE 3.3Å; E186-K440 WeakPolarHBondContact OE1-CE 3.44Å; E186-K440 IonicContact OE1-NZ 3.87Å; E186-K440 PolarHBondContact OE1-NZ 3.14Å
187	A	86.7	Confident	86.6	Confident	86 Å²	86	47.3 Å²	47.3	71%	0.711	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-24.1	176.8	0	0	0	0	0	113.9	L183 V185	L183-A187 VanDerWaalsContact O-CB 3.29Å; L183-A187 WeakPolarHBondContact O-CB 3.38Å; L183-A187 PolarHBondContact O-N 3.37Å; V185-A187 VanDerWaalsContact C-N 3.29Å; V185-A187 PolarHBondContact O-N 3.41Å
188	L	86	Confident	86.6	Confident	99 Å²	99	47.5 Å²	47.5	52%	0.518	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-17.5	-178.9	-65.4	173.9	0	0	0	113.3	A117 L139 D184 V185 E186	A117-L188 HydrophobicContact CB-CB 3.8Å; A117-L188 HydrophobicContact CB-CD1 4.05Å; L139-L188 HydrophobicContact CD2-CD1 3.54Å; D184-L188 WeakPolarHBondContact O-CG 3.41Å; V185-L188 PolarHBondContact O-N 3.26Å; V185-L188 VanDerWaalsContact O-N 3.09Å; E186-L188 PolarHBondContact O-N 3.29Å
189	A	82.4	Confident	86.3	Confident	26 Å²	26	48.1 Å²	48.1	22%	0.215	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-70.4	133.2	-178.4	0	0	0	0	0	111.3	V185 E186 E193 L195	V185-A189 WeakPolarHBondContact O-CB 3.42Å; V185-A189 PolarHBondContact O-N 2.87Å; E186-A189 PolarHBondContact O-N 3.16Å; A189-E193 WeakPolarHBondContact CA-OE2 3.49Å; A189-L195 HydrophobicContact CB-CD2 3.77Å
190	K	82.1	Confident	85.9	Confident	129 Å²	129	47.1 Å²	47.1	56%	0.561	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-76.1	154.8	174.5	-61.3	175.8	-177.2	172.7	0	110.1	G192 E193	K190-G192 PolarHBondContact O-N 3.08Å; K190-E193 HydrophobicContact CB-CG 4.01Å; K190-E193 PolarHBondContact N-OE2 2.95Å; K190-E193 WeakPolarHBondContact O-CB 3.21Å; K190-E193 PolarHBondContact O-N 3.32Å
191	S	73.6	Confident	85.8	Confident	136 Å²	136	46.9 Å²	46.9	95%	0.951	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	127.7	175	-175.8	0	0	0	0	110.7
192	G	72.1	Confident	85.9	Confident	64 Å²	64	43.5 Å²	43.5	66%	0.66	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	-9	-175.6	0	0	0	0	0	115.1	K190	K190-G192 PolarHBondContact O-N 3.08Å
193	E	80.6	Confident	86.1	Confident	21 Å²	21	45.5 Å²	45.5	10%	0.098	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-71.9	135.3	171.5	-70.8	-179	175.5	0	0	110.8	V113 S115 A189 K190 L195 N436	V113-E193 HydrophobicContact CG1-CG 4.41Å; S115-E193 WeakPolarHBondContact CB-OE2 3.39Å; S115-E193 PolarHBondContact OG-OE2 3.16Å; A189-E193 WeakPolarHBondContact CA-OE2 3.49Å; K190-E193 HydrophobicContact CB-CG 4.01Å; K190-E193 PolarHBondContact N-OE2 2.95Å; K190-E193 WeakPolarHBondContact O-CB 3.21Å; K190-E193 PolarHBondContact O-N 3.32Å; E193-L195 PolarHBondContact O-N 2.91Å; E193-N436 PolarHBondContact O-ND2 3.02Å
194	Q	79.5	Confident	86.2	Confident	23 Å²	23	42.4 Å²	42.4	11%	0.107	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-82	121.6	-177.6	-176.4	170.6	-33.6	0	0	110.7	R384	Q194-R384 HydrophobicContact CG-CG 4.08Å
195	L	90.1	Very high	86.6	Confident	8 Å²	8	40.1 Å²	40.1	4%	0.042	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-82.7	166.8	169.6	-57.2	178.5	0	0	0	110.2	G180 V185 E186 A189 E193 R384 N436	G180-L195 WeakPolarHBondContact O-CD1 3.3Å; V185-L195 HydrophobicContact CG1-CD2 3.9Å; E186-L195 HydrophobicContact CB-CD1 4.39Å; E186-L195 HydrophobicContact CG-CD1 4.32Å; A189-L195 HydrophobicContact CB-CD2 3.77Å; E193-L195 PolarHBondContact O-N 2.91Å; L195-R384 VanDerWaalsContact O-CD 3.22Å; L195-R384 WeakPolarHBondContact O-CD 3.26Å; L195-R384 PolarHBondContact O-NE 3.24Å; L195-N436 PolarHBondContact N-OD1 3.31Å
196	G	92.8	Very high	87	Confident	0 Å²	0	40 Å²	40	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	103.5	-153.6	-174.5	0	0	0	0	0	113	N118 W122 L177 P198	N118-G196 PolarHBondContact ND2-O 2.95Å; N118-G196 PolarHBondContact OD1-O 2.87Å; W122-G196 PolarHBondContact NE1-O 3.46Å; L177-G196 VanDerWaalsContact O-CA 3.25Å; L177-G196 WeakPolarHBondContact O-CA 3.4Å; G196-P198 VanDerWaalsContact O-CD 3.3Å; G196-P198 WeakPolarHBondContact O-CD 3.46Å
197	I	93.6	Very high	87.4	Confident	3 Å²	3	37 Å²	37	2%	0.015	23%	0.234	C	C	.	.	S	Bend	trans	-72.7	120	178.9	-48.5	179.6	0	0	0	108.8	W122 I178 H199 L201 R202 V205 L209 D387	W122-I197 HydrophobicContact CH2-CB 4.47Å; W122-I197 HydrophobicContact CH2-CD1 4.25Å; W122-I197 HydrophobicContact CH2-CG1 3.68Å; W122-I197 HydrophobicContact CH2-CG2 4.47Å; W122-I197 HydrophobicContact CZ2-CB 4.14Å; W122-I197 HydrophobicContact CZ2-CG1 3.52Å; W122-I197 HydrophobicContact CZ2-CG2 4.46Å; I178-I197 HydrophobicContact CG1-CG1 4.33Å; I197-H199 PolarHBondContact O-N 3.01Å; I197-L201 HydrophobicContact CG2-CB 4.26Å; I197-R202 HydrophobicContact CB-CG 4.15Å; I197-R202 HydrophobicContact CG2-CG 3.77Å; I197-R202 PolarHBondContact O-NH2 2.95Å; I197-V205 HydrophobicContact CD1-CG1 3.78Å; I197-V205 HydrophobicContact CG2-CB 4.16Å; I197-V205 HydrophobicContact CG2-CG1 4.29Å; I197-V205 HydrophobicContact CG2-CG2 4.34Å; I197-L209 HydrophobicContact CD1-CD1 3.85Å; I197-D387 HydrophobicContact CD1-CB 3.74Å; I197-D387 WeakPolarHBondContact CD1-OD1 3.47Å; I197-D387 HydrophobicContact CG1-CB 3.92Å
198	P	91.4	Very high	87.8	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.026	20%	0.203	C	C	.	.			trans	-55.5	139.6	171.1	-20.9	30.1	0	0	0	110	E114 R119 W122 G196 S200 L201 R202	E114-P198 HydrophobicContact CG-CB 4.47Å; E114-P198 WeakPolarHBondContact OE2-CB 3.41Å; R119-P198 HydrophobicContact CB-CB 4.46Å; R119-P198 HydrophobicContact CB-CG 4.19Å; W122-P198 HydrophobicContact CB-CG 4.34Å; W122-P198 HydrophobicContact CG-CG 4.11Å; G196-P198 VanDerWaalsContact O-CD 3.3Å; G196-P198 WeakPolarHBondContact O-CD 3.46Å; P198-S200 VanDerWaalsContact C-N 3.26Å; P198-S200 PolarHBondContact O-N 3.27Å; P198-L201 HydrophobicContact CB-CD1 4.31Å; P198-L201 HydrophobicContact CB-CG 4.18Å; P198-L201 HydrophobicContact CG-CD1 3.89Å; P198-L201 HydrophobicContact CG-CG 4.31Å; P198-L201 PolarHBondContact O-N 3.19Å; P198-R202 PolarHBondContact O-N 3.1Å
199	H	88.2	Confident	88.2	Confident	13 Å²	13	29.7 Å²	29.7	6%	0.06	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-59.3	-39.5	-174.5	178	95.1	0	0	0	112.1	A62 F97 F112 E114 I197 L201 R202 P203 F383	A62-H199 WeakPolarHBondContact CA-NE2 3.12Å; A62-H199 PolarHBondContact O-CE1 2.84Å; A62-H199 PolarHBondContact O-NE2 3.15Å; F97-H199 AromaticContact CE1-CE1 3.87Å; F97-H199 AromaticContact CE1-ND1 3.94Å; F112-H199 HydrophobicContact CD1-CB 4.14Å; F112-H199 HydrophobicContact CE1-CB 3.19Å; F112-H199 HydrophobicContact CE2-CB 4.4Å; F112-H199 HydrophobicContact CZ-CB 3.39Å; E114-H199 VanDerWaalsContact OE1-CA 3.26Å; E114-H199 WeakPolarHBondContact OE1-CA 3.37Å; E114-H199 WeakPolarHBondContact OE1-CB 3.32Å; E114-H199 PolarHBondContact OE1-N 3.13Å; I197-H199 PolarHBondContact O-N 3.01Å; H199-L201 PolarHBondContact O-N 3.42Å; H199-L201 VanDerWaalsContact O-N 3.12Å; H199-R202 VanDerWaalsContact CB-NH1 3.26Å; H199-R202 PolarHBondContact ND1-NH1 3.14Å; H199-R202 WeakPolarHBondContact O-CB 3.25Å; H199-R202 PolarHBondContact O-N 3.25Å; H199-R202 VanDerWaalsContact O-N 3.14Å; H199-P203 WeakPolarHBondContact O-CD 3.31Å; H199-F383 AromaticContact CE1-CE2 3.91Å; H199-F383 AromaticContact ND1-CD2 3.96Å
200	S	85.1	Confident	88.7	Confident	45 Å²	45	28.7 Å²	28.7	32%	0.315	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-54.3	-27.6	173.8	58.2	0	0	0	0	113.8	E114 R119 P198	E114-S200 PolarHBondContact OE1-N 3.12Å; E114-S200 WeakPolarHBondContact OE2-CB 3.17Å; E114-S200 PolarHBondContact OE2-OG 2.91Å; R119-S200 PolarHBondContact NE-OG 3.05Å; P198-S200 VanDerWaalsContact C-N 3.26Å; P198-S200 PolarHBondContact O-N 3.27Å
201	L	90.1	Very high	89.2	Confident	5 Å²	5	22.6 Å²	22.6	3%	0.026	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-96.5	-18.7	-178.7	-56.7	-174.8	0	0	0	113.6	W122 L123 W161 I197 P198 H199 P203 H204 V205	W122-L201 HydrophobicContact CB-CD1 3.47Å; W122-L201 VanDerWaalsContact CB-CD1 3.47Å; W122-L201 HydrophobicContact CG-CD1 4.1Å; L123-L201 HydrophobicContact CD2-CD2 4.13Å; W161-L201 HydrophobicContact CZ2-CD2 4.05Å; I197-L201 HydrophobicContact CG2-CB 4.26Å; P198-L201 HydrophobicContact CB-CD1 4.31Å; P198-L201 HydrophobicContact CB-CG 4.18Å; P198-L201 HydrophobicContact CG-CD1 3.89Å; P198-L201 HydrophobicContact CG-CG 4.31Å; P198-L201 PolarHBondContact O-N 3.19Å; H199-L201 PolarHBondContact O-N 3.42Å; H199-L201 VanDerWaalsContact O-N 3.12Å; L201-P203 VanDerWaalsContact C-N 3.34Å; L201-H204 PolarHBondContact O-N 2.8Å; L201-V205 HydrophobicContact CB-CG2 4.13Å; L201-V205 WeakPolarHBondContact O-CB 3.33Å; L201-V205 WeakPolarHBondContact O-CG2 3.46Å; L201-V205 PolarHBondContact O-N 2.74Å
202	R	93.5	Very high	90.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-51.9	-41.7	178.9	-70.9	178.8	172.9	118.9	6.6	114.2	I197 P198 H199 H204 V205 W206 D387	I197-R202 HydrophobicContact CB-CG 4.15Å; I197-R202 HydrophobicContact CG2-CG 3.77Å; I197-R202 PolarHBondContact O-NH2 2.95Å; P198-R202 PolarHBondContact O-N 3.1Å; H199-R202 VanDerWaalsContact CB-NH1 3.26Å; H199-R202 PolarHBondContact ND1-NH1 3.14Å; H199-R202 WeakPolarHBondContact O-CB 3.25Å; H199-R202 PolarHBondContact O-N 3.25Å; H199-R202 VanDerWaalsContact O-N 3.14Å; R202-H204 PolarHBondContact O-N 2.64Å; R202-H204 VanDerWaalsContact O-N 3.11Å; R202-V205 PolarHBondContact O-N 3.31Å; R202-W206 HydrophobicContact CB-CD2 4Å; R202-W206 HydrophobicContact CB-CG 4.32Å; R202-W206 HydrophobicContact CB-CZ2 4.31Å; R202-W206 HydrophobicContact CG-CD2 4.37Å; R202-W206 HydrophobicContact CG-CZ2 4.01Å; R202-W206 WeakPolarHBondContact O-CB 3.39Å; R202-W206 PolarHBondContact O-N 3.06Å; R202-D387 IonicContact CZ-OD1 2.63Å; R202-D387 IonicContact CZ-OD2 2.88Å; R202-D387 IonicContact NE-OD1 2.63Å; R202-D387 PolarHBondContact NE-OD1 2.94Å; R202-D387 IonicContact NE-OD2 3.51Å; R202-D387 IonicContact NH2-OD1 3.55Å; R202-D387 IonicContact NH2-OD2 3.09Å; R202-D387 PolarHBondContact NH2-OD2 2.99Å
203	P	92.2	Very high	91	Very high	44 Å²	44	15.4 Å²	15.4	29%	0.286	8%	0.083	S	C	.	.	H	α-helix	trans	-59.7	-26	179.7	-22.8	33.3	0	0	0	114.2	H199 L201 P207 C301 L302	H199-P203 WeakPolarHBondContact O-CD 3.31Å; L201-P203 VanDerWaalsContact C-N 3.34Å; P203-P207 WeakPolarHBondContact O-CD 3.39Å; P203-P207 WeakPolarHBondContact O-CG 3.47Å; P203-C301 WeakPolarHBondContact CG-O 3.49Å; P203-L302 VanDerWaalsContact CA-CD2 3.5Å; P203-L302 HydrophobicContact CB-CD2 4.1Å
204	H	91.1	Very high	91.5	Very high	70 Å²	70	16.7 Å²	16.7	32%	0.324	9%	0.09	S	C	.	.	H	α-helix	trans	-100.1	-33.8	-179.2	-58	-82.2	0	0	0	112.6	W161 L201 R202 R208	W161-H204 AromaticContact CD1-CE1 3.85Å; W161-H204 AromaticContact CD1-ND1 3.77Å; W161-H204 HydrophobicContact CD2-CB 3.74Å; W161-H204 AromaticContact CD2-CG 3.78Å; W161-H204 AromaticContact CD2-ND1 3.8Å; W161-H204 AromaticContact CE2-CD2 3.72Å; W161-H204 AromaticContact CE2-CG 3.37Å; W161-H204 AromaticContact CE2-ND1 3.7Å; W161-H204 HydrophobicContact CE3-CB 3.69Å; W161-H204 AromaticContact CG-ND1 3.85Å; W161-H204 HydrophobicContact CH2-CB 3.29Å; W161-H204 HydrophobicContact CZ2-CB 3.33Å; W161-H204 AromaticContact CZ2-CD2 3.72Å; W161-H204 AromaticContact CZ2-CG 3.53Å; W161-H204 HydrophobicContact CZ3-CB 3.48Å; W161-H204 VanDerWaalsContact CZ3-CB 3.48Å; W161-H204 AromaticContact NE1-CD2 3.76Å; W161-H204 AromaticContact NE1-CE1 3.73Å; W161-H204 AromaticContact NE1-CG 3.69Å; W161-H204 AromaticContact NE1-ND1 3.67Å; W161-H204 AromaticContact NE1-NE2 3.82Å; L201-H204 PolarHBondContact O-N 2.8Å; R202-H204 PolarHBondContact O-N 2.64Å; R202-H204 VanDerWaalsContact O-N 3.11Å; H204-R208 WeakPolarHBondContact O-CD 3.05Å; H204-R208 WeakPolarHBondContact O-CG 3.21Å; H204-R208 PolarHBondContact O-NH1 3.03Å
205	V	93.5	Very high	92	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-82	-48.7	-175.9	176.7	0	0	0	0	111.6	W122 L126 W161 L168 I197 L201 R202 R208 L209	W122-V205 HydrophobicContact CE3-CG2 4.41Å; W122-V205 HydrophobicContact CH2-CG1 4.15Å; W122-V205 HydrophobicContact CZ3-CG1 3.92Å; W122-V205 HydrophobicContact CZ3-CG2 4.08Å; L126-V205 HydrophobicContact CD1-CG2 4.13Å; W161-V205 HydrophobicContact CH2-CG2 4.16Å; L168-V205 HydrophobicContact CD1-CG1 4.03Å; I197-V205 HydrophobicContact CD1-CG1 3.78Å; I197-V205 HydrophobicContact CG2-CB 4.16Å; I197-V205 HydrophobicContact CG2-CG1 4.29Å; I197-V205 HydrophobicContact CG2-CG2 4.34Å; L201-V205 HydrophobicContact CB-CG2 4.13Å; L201-V205 WeakPolarHBondContact O-CB 3.33Å; L201-V205 WeakPolarHBondContact O-CG2 3.46Å; L201-V205 PolarHBondContact O-N 2.74Å; R202-V205 PolarHBondContact O-N 3.31Å; V205-R208 WeakPolarHBondContact O-CB 2.98Å; V205-R208 PolarHBondContact O-N 2.84Å; V205-L209 HydrophobicContact CG1-CD1 3.81Å; V205-L209 HydrophobicContact CG1-CD2 4.48Å; V205-L209 HydrophobicContact CG1-CG 3.86Å; V205-L209 WeakPolarHBondContact O-CG 3.42Å; V205-L209 PolarHBondContact O-N 3.05Å
206	W	96.6	Very high	92	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-55.4	-46.1	-177.4	-70.7	-6.3	0	0	0	113.7	R202 R208 L209 T210 L298 C301 L302 M310 F383 W386 D387 F390	R202-W206 HydrophobicContact CB-CD2 4Å; R202-W206 HydrophobicContact CB-CG 4.32Å; R202-W206 HydrophobicContact CB-CZ2 4.31Å; R202-W206 HydrophobicContact CG-CD2 4.37Å; R202-W206 HydrophobicContact CG-CZ2 4.01Å; R202-W206 WeakPolarHBondContact O-CB 3.39Å; R202-W206 PolarHBondContact O-N 3.06Å; W206-R208 PolarHBondContact O-N 3.46Å; W206-L209 PolarHBondContact O-N 3.03Å; W206-T210 PolarHBondContact O-N 3.08Å; W206-T210 VanDerWaalsContact O-N 3.1Å; W206-T210 PolarHBondContact O-OG1 3.29Å; W206-T210 VanDerWaalsContact O-OG1 3.1Å; W206-L298 HydrophobicContact CE3-CD2 4.28Å; W206-L298 HydrophobicContact CZ3-CD2 4.1Å; W206-C301 WeakPolarHBondContact CZ3-SG 3.33Å; W206-L302 HydrophobicContact CE3-CD1 4.3Å; W206-L302 HydrophobicContact CE3-CD2 4.38Å; W206-L302 HydrophobicContact CE3-CG 4.49Å; W206-M310 HydrophobicContact CB-CE 3.8Å; W206-M310 HydrophobicContact CB-SD 4.26Å; W206-F383 HydrophobicContact CH2-CB 4.28Å; W206-F383 AromaticContact CH2-CD1 3.67Å; W206-F383 HydrophobicContact CH2-CD1 3.67Å; W206-F383 HydrophobicContact CH2-CD2 4.37Å; W206-F383 HydrophobicContact CH2-CE1 4.01Å; W206-F383 AromaticContact CH2-CG 3.86Å; W206-F383 HydrophobicContact CH2-CG 3.86Å; W206-F383 HydrophobicContact CH2-CZ 4.49Å; W206-F383 HydrophobicContact CZ2-CB 4.13Å; W206-F383 HydrophobicContact CZ2-CD1 4.35Å; W206-F383 HydrophobicContact CZ2-CG 4.21Å; W206-W386 HydrophobicContact CH2-CB 4.49Å; W206-W386 AromaticContact CH2-CE3 3.86Å; W206-W386 HydrophobicContact CH2-CE3 3.86Å; W206-W386 HydrophobicContact CZ2-CB 4.17Å; W206-W386 HydrophobicContact CZ3-CE3 4.02Å; W206-W386 HydrophobicContact CZ3-CZ3 4.48Å; W206-D387 PolarHBondContact NE1-OD1 3.16Å; W206-F390 HydrophobicContact CB-CD2 3.94Å; W206-F390 HydrophobicContact CB-CE2 4.17Å; W206-F390 AromaticContact CD1-CD2 3.69Å; W206-F390 AromaticContact CD2-CD2 3.87Å; W206-F390 HydrophobicContact CD2-CD2 3.87Å; W206-F390 AromaticContact CD2-CE2 3.56Å; W206-F390 HydrophobicContact CD2-CE2 3.56Å; W206-F390 AromaticContact CE2-CE2 3.86Å; W206-F390 AromaticContact CE3-CE2 3.81Å; W206-F390 HydrophobicContact CE3-CE2 3.81Å; W206-F390 AromaticContact CG-CD2 3.59Å; W206-F390 HydrophobicContact CG-CD2 3.59Å; W206-F390 AromaticContact CG-CE2 3.76Å; W206-F390 HydrophobicContact CG-CE2 3.76Å; W206-F390 HydrophobicContact CZ2-CE2 4.36Å; W206-F390 HydrophobicContact CZ3-CE2 4.31Å; W206-F390 AromaticContact NE1-CD2 3.97Å
207	P	95.2	Very high	91.8	Very high	1 Å²	1	22 Å²	22	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-66.5	-22.1	179.1	-24.1	39	0	0	0	114	P203 G211 A212 L213 T306 M310	P203-P207 WeakPolarHBondContact O-CD 3.39Å; P203-P207 WeakPolarHBondContact O-CG 3.47Å; P207-G211 CarbonylContact O-C 3.59Å; P207-G211 PolarHBondContact O-N 2.82Å; P207-A212 HydrophobicContact CB-CB 4.23Å; P207-A212 PolarHBondContact O-N 3.46Å; P207-L213 HydrophobicContact CB-CD1 4.18Å; P207-L213 HydrophobicContact CB-CD2 3.87Å; P207-L213 HydrophobicContact CB-CG 3.6Å; P207-L213 PolarHBondContact O-N 3.34Å; P207-T306 HydrophobicContact CB-CG2 3.97Å; P207-T306 HydrophobicContact CG-CG2 3.35Å; P207-M310 HydrophobicContact CB-SD 4.29Å; P207-M310 HydrophobicContact CG-SD 4.22Å
208	R	93.5	Very high	91.5	Very high	16 Å²	16	26.3 Å²	26.3	6%	0.06	14%	0.135	C	C	.	.	H	α-helix	trans	-85.2	-34.8	175.2	-68.1	177	166.1	77.3	-3.8	112.3	W161 N165 L166 R167 L168 H204 V205 W206 L213	W161-R208 PolarHBondContact O-NH2 3.47Å; N165-R208 VanDerWaalsContact O-CD 3.25Å; N165-R208 WeakPolarHBondContact O-CD 3.24Å; N165-R208 PolarHBondContact O-NE 3.43Å; L166-R208 WeakPolarHBondContact O-CA 3.35Å; R167-R208 WeakPolarHBondContact CA-O 3.07Å; L168-R208 HydrophobicContact CD1-CB 4.15Å; L168-R208 HydrophobicContact CG-CB 3.92Å; L168-R208 PolarHBondContact N-O 3.41Å; H204-R208 WeakPolarHBondContact O-CD 3.05Å; H204-R208 WeakPolarHBondContact O-CG 3.21Å; H204-R208 PolarHBondContact O-NH1 3.03Å; V205-R208 WeakPolarHBondContact O-CB 2.98Å; V205-R208 PolarHBondContact O-N 2.84Å; W206-R208 PolarHBondContact O-N 3.46Å; R208-L213 HydrophobicContact CG-CD1 3.79Å
209	L	94.4	Very high	91.3	Very high	16 Å²	16	26.4 Å²	26.4	8%	0.084	14%	0.136	C	C	.	.	H	α-helix	trans	-63.7	-47	174.4	-70.2	-176.2	0	0	0	111.2	L168 I178 I197 V205 W206 F390 Y391	L168-L209 HydrophobicContact CB-CD2 4.16Å; L168-L209 HydrophobicContact CD1-CD2 3.89Å; L168-L209 HydrophobicContact CD1-CG 4.4Å; I178-L209 HydrophobicContact CD1-CD1 4.12Å; I178-L209 HydrophobicContact CD1-CD2 4.09Å; I197-L209 HydrophobicContact CD1-CD1 3.85Å; V205-L209 HydrophobicContact CG1-CD1 3.81Å; V205-L209 HydrophobicContact CG1-CD2 4.48Å; V205-L209 HydrophobicContact CG1-CG 3.86Å; V205-L209 WeakPolarHBondContact O-CG 3.42Å; V205-L209 PolarHBondContact O-N 3.05Å; W206-L209 PolarHBondContact O-N 3.03Å; L209-F390 HydrophobicContact CB-CB 4.05Å; L209-F390 HydrophobicContact CD1-CB 4.23Å; L209-Y391 HydrophobicContact CD2-CD2 3.92Å
210	T	94	Very high	91.1	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.031	15%	0.153	C	C	.	.	S	Bend	trans	-79	-19.7	-178.4	60.2	0	0	0	0	114	W206 A212 M310 L318 F390	W206-T210 PolarHBondContact O-N 3.08Å; W206-T210 VanDerWaalsContact O-N 3.1Å; W206-T210 PolarHBondContact O-OG1 3.29Å; W206-T210 VanDerWaalsContact O-OG1 3.1Å; T210-A212 VanDerWaalsContact C-N 3.34Å; T210-A212 WeakPolarHBondContact OG1-CB 3.4Å; T210-A212 PolarHBondContact OG1-N 2.89Å; T210-M310 HydrophobicContact CG2-CE 3.65Å; T210-M310 HydrophobicContact CG2-SD 3.94Å; T210-M310 PolarHBondContact OG1-SD 3.28Å; T210-L318 HydrophobicContact CG2-CD1 4.18Å; T210-F390 HydrophobicContact CG2-CB 3.76Å; T210-F390 HydrophobicContact CG2-CD1 3.5Å; T210-F390 HydrophobicContact CG2-CD2 4.35Å; T210-F390 HydrophobicContact CG2-CE1 4.19Å; T210-F390 HydrophobicContact CG2-CG 3.6Å
211	G	91.4	Very high	91	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.01	17%	0.168	C	C	.	.			trans	79.8	13	-171.5	0	0	0	0	0	114.2	P207 L213 L214 K215	P207-G211 CarbonylContact O-C 3.59Å; P207-G211 PolarHBondContact O-N 2.82Å; G211-L213 VanDerWaalsContact C-N 3.27Å; G211-L213 PolarHBondContact O-N 3.02Å; G211-L214 WeakPolarHBondContact O-CB 3.44Å; G211-L214 PolarHBondContact O-N 2.91Å; G211-L214 VanDerWaalsContact O-N 3.07Å; G211-K215 PolarHBondContact O-N 2.86Å
212	A	94.1	Very high	90.4	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-55.2	-39.1	176.7	0	0	0	0	0	113	P207 T210 L214 K215 A216 W309 M310	P207-A212 HydrophobicContact CB-CB 4.23Å; P207-A212 PolarHBondContact O-N 3.46Å; T210-A212 VanDerWaalsContact C-N 3.34Å; T210-A212 WeakPolarHBondContact OG1-CB 3.4Å; T210-A212 PolarHBondContact OG1-N 2.89Å; A212-L214 PolarHBondContact O-N 3.06Å; A212-K215 PolarHBondContact O-N 2.71Å; A212-A216 WeakPolarHBondContact O-CB 3.37Å; A212-A216 PolarHBondContact O-N 3.45Å; A212-W309 HydrophobicContact CB-CB 3.96Å; A212-M310 HydrophobicContact CB-CG 4.18Å; A212-M310 HydrophobicContact CB-SD 3.88Å
213	L	90.8	Very high	89.2	Confident	47 Å²	47	48.7 Å²	48.7	25%	0.246	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-38.8	176.4	-63.4	-179.3	0	0	0	112.4	L166 P207 R208 G211 A216 K217	L166-L213 HydrophobicContact CD2-CB 4.14Å; L166-L213 HydrophobicContact CD2-CD1 4.01Å; P207-L213 HydrophobicContact CB-CD1 4.18Å; P207-L213 HydrophobicContact CB-CD2 3.87Å; P207-L213 HydrophobicContact CB-CG 3.6Å; P207-L213 PolarHBondContact O-N 3.34Å; R208-L213 HydrophobicContact CG-CD1 3.79Å; G211-L213 VanDerWaalsContact C-N 3.27Å; G211-L213 PolarHBondContact O-N 3.02Å; L213-A216 PolarHBondContact O-N 3.24Å; L213-K217 WeakPolarHBondContact O-CB 3.49Å; L213-K217 PolarHBondContact O-N 2.64Å
214	L	89.7	Confident	88.2	Confident	48 Å²	48	48.2 Å²	48.2	25%	0.251	23%	0.228	S	C	.	.	H	α-helix	trans	-65.4	-46	174.7	-72	179.9	0	0	0	110.8	L166 R167 G211 A212 A216 K217 E218	L166-L214 HydrophobicContact CB-CD2 3.59Å; L166-L214 HydrophobicContact CB-CG 3.98Å; L166-L214 HydrophobicContact CD1-CD2 3.87Å; L166-L214 HydrophobicContact CG-CD2 4.4Å; R167-L214 HydrophobicContact CB-CD1 3.57Å; R167-L214 HydrophobicContact CB-CG 4.38Å; R167-L214 HydrophobicContact CG-CD1 4.36Å; G211-L214 WeakPolarHBondContact O-CB 3.44Å; G211-L214 PolarHBondContact O-N 2.91Å; G211-L214 VanDerWaalsContact O-N 3.07Å; A212-L214 PolarHBondContact O-N 3.06Å; L214-A216 VanDerWaalsContact C-N 3.3Å; L214-A216 PolarHBondContact O-N 2.95Å; L214-K217 PolarHBondContact O-N 3.12Å; L214-K217 VanDerWaalsContact O-N 3.15Å; L214-E218 WeakPolarHBondContact O-CB 3.13Å; L214-E218 WeakPolarHBondContact O-CG 3.31Å; L214-E218 PolarHBondContact O-N 2.94Å
215	K	90.7	Very high	87.7	Confident	29 Å²	29	46.4 Å²	46.4	13%	0.126	22%	0.223	C	C	.	.	H	α-helix	trans	-57.7	-42.7	176	-72.5	-171.4	-167.8	-90.1	0	112.1	G211 A212 S219 W309 S313 E316 D317	G211-K215 PolarHBondContact O-N 2.86Å; A212-K215 PolarHBondContact O-N 2.71Å; K215-S219 VanDerWaalsContact O-CB 3.26Å; K215-S219 WeakPolarHBondContact O-CB 3.23Å; K215-S219 PolarHBondContact O-N 3.46Å; K215-W309 HydrophobicContact CB-CE3 4.05Å; K215-W309 HydrophobicContact CB-CZ3 4.42Å; K215-S313 WeakPolarHBondContact CE-OG 3.42Å; K215-E316 IonicContact NZ-OE2 3.54Å; K215-E316 PolarHBondContact NZ-OE2 3.47Å; K215-D317 WeakPolarHBondContact CE-OD2 3.37Å; K215-D317 IonicContact NZ-OD1 2.77Å; K215-D317 PolarHBondContact NZ-OD1 3.46Å; K215-D317 IonicContact NZ-OD2 3.83Å; K215-D317 PolarHBondContact NZ-OD2 3.34Å
216	A	90.6	Very high	87.1	Confident	10 Å²	10	47.1 Å²	47.1	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-46.2	176.2	0	0	0	0	0	111.8	A212 L213 L214 S219 K220 W309	A212-A216 WeakPolarHBondContact O-CB 3.37Å; A212-A216 PolarHBondContact O-N 3.45Å; L213-A216 PolarHBondContact O-N 3.24Å; L214-A216 VanDerWaalsContact C-N 3.3Å; L214-A216 PolarHBondContact O-N 2.95Å; A216-S219 PolarHBondContact O-N 3.19Å; A216-K220 WeakPolarHBondContact O-CG 3.46Å; A216-K220 PolarHBondContact O-N 3.35Å; A216-W309 VanDerWaalsContact CB-CD1 3.47Å; A216-W309 HydrophobicContact CB-CD2 3.86Å; A216-W309 HydrophobicContact CB-CG 3.76Å; A216-W309 HydrophobicContact CB-CZ2 4.44Å
217	K	88.4	Confident	86.7	Confident	104 Å²	104	48.8 Å²	48.8	45%	0.452	24%	0.238	S	C	.	.	H	α-helix	trans	-63.5	-48.1	177.8	-175.2	178.9	178.7	-178.5	0	111.8	L166 L213 L214 S219 K220 Q221	L166-K217 HydrophobicContact CD1-CD 3.75Å; L213-K217 WeakPolarHBondContact O-CB 3.49Å; L213-K217 PolarHBondContact O-N 2.64Å; L214-K217 PolarHBondContact O-N 3.12Å; L214-K217 VanDerWaalsContact O-N 3.15Å; K217-S219 PolarHBondContact O-N 3Å; K217-K220 WeakPolarHBondContact O-CB 3.44Å; K217-K220 PolarHBondContact O-N 2.94Å; K217-Q221 WeakPolarHBondContact O-CG 3.1Å; K217-Q221 PolarHBondContact O-N 3.23Å
218	E	87.3	Confident	86.5	Confident	93 Å²	93	49.3 Å²	49.3	44%	0.435	24%	0.24	S	C	.	.	H	α-helix	trans	-62.8	-41	178.2	-72.6	175	-174.8	0	0	111.8	L214 K220 Q221 R222	L214-E218 WeakPolarHBondContact O-CB 3.13Å; L214-E218 WeakPolarHBondContact O-CG 3.31Å; L214-E218 PolarHBondContact O-N 2.94Å; E218-K220 VanDerWaalsContact C-N 3.28Å; E218-K220 PolarHBondContact O-N 2.9Å; E218-Q221 PolarHBondContact O-N 3.48Å; E218-R222 WeakPolarHBondContact O-CG 3.28Å; E218-R222 PolarHBondContact O-N 3.24Å; E218-R222 IonicContact OE2-NH2 2.55Å
219	S	86.1	Confident	86.5	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-35.5	177.9	-167.2	0	0	0	0	112.5	K215 A216 K217 Q221 V226 W309	K215-S219 VanDerWaalsContact O-CB 3.26Å; K215-S219 WeakPolarHBondContact O-CB 3.23Å; K215-S219 PolarHBondContact O-N 3.46Å; A216-S219 PolarHBondContact O-N 3.19Å; K217-S219 PolarHBondContact O-N 3Å; S219-Q221 VanDerWaalsContact C-N 3.3Å; S219-V226 WeakPolarHBondContact CB-O 3.34Å; S219-V226 PolarHBondContact O-N 3.21Å; S219-V226 PolarHBondContact OG-O 2.65Å; S219-W309 WeakPolarHBondContact OG-CH2 2.89Å
220	K	85.1	Confident	86.2	Confident	99 Å²	99	54.1 Å²	54.1	43%	0.43	27%	0.269	S	S	.	.	H	α-helix	trans	-67.3	-29.8	172.7	-72.2	173.8	-177	173.4	0	112.3	A216 K217 E218 S225 T227 E305	A216-K220 WeakPolarHBondContact O-CG 3.46Å; A216-K220 PolarHBondContact O-N 3.35Å; K217-K220 WeakPolarHBondContact O-CB 3.44Å; K217-K220 PolarHBondContact O-N 2.94Å; E218-K220 VanDerWaalsContact C-N 3.28Å; E218-K220 PolarHBondContact O-N 2.9Å; K220-S225 VanDerWaalsContact O-CB 3.25Å; K220-S225 WeakPolarHBondContact O-CB 3.43Å; K220-T227 HydrophobicContact CG-CG2 4.23Å; K220-E305 WeakPolarHBondContact CE-OE1 3.26Å; K220-E305 IonicContact NZ-OE1 3.63Å; K220-E305 PolarHBondContact NZ-OE1 3.39Å
221	Q	82.3	Confident	86.1	Confident	133 Å²	133	54 Å²	54	62%	0.621	27%	0.267	S	S	*	.	H	α-helix	trans	-89.5	-14.3	-177.8	-69.1	176.5	-11.2	0	0	114.6	K217 E218 S219	K217-Q221 WeakPolarHBondContact O-CG 3.1Å; K217-Q221 PolarHBondContact O-N 3.23Å; E218-Q221 PolarHBondContact O-N 3.48Å; S219-Q221 VanDerWaalsContact C-N 3.3Å
222	R	78.7	Confident	86.1	Confident	126 Å²	126	55.2 Å²	55.2	48%	0.475	28%	0.275	S	S	.	.	S	Bend	trans	-65.5	161.7	176	-75.9	176.5	-164	153.7	8.2	111.9	E218 P224 S225	E218-R222 WeakPolarHBondContact O-CG 3.28Å; E218-R222 PolarHBondContact O-N 3.24Å; E218-R222 IonicContact OE2-NH2 2.55Å; R222-P224 CarbonylContact C-O 3.56Å; R222-P224 CarbonylContact O-C 3.1Å; R222-S225 WeakPolarHBondContact O-CA 3.3Å; R222-S225 PolarHBondContact O-N 2.94Å
223	I	67.6	Low	85.9	Confident	174 Å²	174	61.1 Å²	61.1	89%	0.892	30%	0.302	S	S	*	.	S	Bend	trans	-118	115.1	173	-59	174.8	0	0	0	109
224	P	72	Confident	85.7	Confident	33 Å²	33	62.4 Å²	62.4	21%	0.214	31%	0.309	C	S	.	.	S	Bend	cis	-70	151.4	-6.8	32.7	-35.7	0	0	0	111.6	R222 F492 R494	R222-P224 CarbonylContact C-O 3.56Å; R222-P224 CarbonylContact O-C 3.1Å; P224-F492 WeakPolarHBondContact CD-O 3.49Å; P224-F492 HydrophobicContact CG-CB 3.31Å; P224-F492 HydrophobicContact CG-CG 4.44Å; P224-F492 WeakPolarHBondContact CG-O 3.37Å; P224-R494 HydrophobicContact CB-CG 4.17Å
225	S	79.1	Confident	85.7	Confident	32 Å²	32	60.3 Å²	60.3	22%	0.224	30%	0.298	C	S	.	.			trans	-65.1	140.7	173.5	59.4	0	0	0	0	108.9	K220 R222	K220-S225 VanDerWaalsContact O-CB 3.25Å; K220-S225 WeakPolarHBondContact O-CB 3.43Å; R222-S225 WeakPolarHBondContact O-CA 3.3Å; R222-S225 PolarHBondContact O-N 2.94Å
226	V	80.8	Confident	85.3	Confident	16 Å²	16	62.1 Å²	62.1	10%	0.097	32%	0.315	C	S	.	.			trans	-126.2	110.6	175.7	-179.3	0	0	0	0	108.5	S219 L231 F492	S219-V226 WeakPolarHBondContact CB-O 3.34Å; S219-V226 PolarHBondContact O-N 3.21Å; S219-V226 PolarHBondContact OG-O 2.65Å; V226-L231 HydrophobicContact CG1-CD1 3.85Å; V226-L231 HydrophobicContact CG1-CD2 3.99Å; V226-L231 HydrophobicContact CG1-CG 3.7Å; V226-F492 HydrophobicContact CB-CD2 4.43Å; V226-F492 HydrophobicContact CB-CE1 4.47Å; V226-F492 HydrophobicContact CB-CE2 4.09Å; V226-F492 HydrophobicContact CB-CZ 4.12Å; V226-F492 HydrophobicContact CG1-CD2 4.29Å; V226-F492 HydrophobicContact CG1-CE1 3.93Å; V226-F492 HydrophobicContact CG1-CE2 3.49Å; V226-F492 VanDerWaalsContact CG1-CE2 3.49Å; V226-F492 HydrophobicContact CG1-CZ 3.28Å; V226-F492 HydrophobicContact CG2-CB 4.21Å; V226-F492 HydrophobicContact CG2-CD1 3.8Å; V226-F492 HydrophobicContact CG2-CD2 3.29Å; V226-F492 HydrophobicContact CG2-CE1 3.86Å; V226-F492 HydrophobicContact CG2-CE2 3.41Å; V226-F492 VanDerWaalsContact CG2-CE2 3.41Å; V226-F492 HydrophobicContact CG2-CG 3.51Å; V226-F492 HydrophobicContact CG2-CZ 3.7Å
227	T	88.2	Confident	84.3	Confident	34 Å²	34	67.2 Å²	67.2	21%	0.209	35%	0.345	C	S	.	.			trans	-96.7	158.1	175.6	62.4	0	0	0	0	111.2	K220 T229 E230 L231	K220-T227 HydrophobicContact CG-CG2 4.23Å; T227-T229 VanDerWaalsContact C-N 3.28Å; T227-T229 PolarHBondContact O-N 3.42Å; T227-E230 PolarHBondContact N-OE2 2.84Å; T227-E230 PolarHBondContact O-N 3Å; T227-E230 WeakPolarHBondContact OG1-CB 3.38Å; T227-E230 VanDerWaalsContact OG1-CD 3.3Å; T227-E230 WeakPolarHBondContact OG1-CG 3.19Å; T227-E230 PolarHBondContact OG1-N 3.36Å; T227-E230 PolarHBondContact OG1-OE2 2.86Å; T227-L231 PolarHBondContact O-N 3.43Å; T227-L231 VanDerWaalsContact O-N 3.09Å
228	Y	92.5	Very high	83.1	Confident	13 Å²	13	64.1 Å²	64.1	5%	0.051	33%	0.333	C	S	.	.	H	α-helix	trans	-57.7	-42.7	172.3	174.6	-112.8	0	0	0	111.6	E230 L231 V232 R273 V274 A277 E304 E305 F308	Y228-E230 VanDerWaalsContact C-N 3.35Å; Y228-E230 PolarHBondContact O-N 2.94Å; Y228-L231 WeakPolarHBondContact O-CB 3.32Å; Y228-L231 PolarHBondContact O-N 3.29Å; Y228-L231 VanDerWaalsContact O-N 3.1Å; Y228-V232 HydrophobicContact CD1-CG2 4.23Å; Y228-V232 HydrophobicContact CD2-CG2 4.14Å; Y228-V232 HydrophobicContact CE1-CG2 3.69Å; Y228-V232 HydrophobicContact CE2-CG2 3.59Å; Y228-V232 HydrophobicContact CG-CG2 4.42Å; Y228-V232 WeakPolarHBondContact O-CG2 3.48Å; Y228-V232 PolarHBondContact O-N 3.41Å; Y228-V232 WeakPolarHBondContact OH-CG2 3.1Å; Y228-R273 WeakPolarHBondContact OH-CB 3.35Å; Y228-V274 WeakPolarHBondContact OH-CG2 3.34Å; Y228-A277 HydrophobicContact CE2-CB 4.17Å; Y228-E304 HydrophobicContact CE1-CG 3.95Å; Y228-E304 WeakPolarHBondContact CE1-OE1 3.3Å; Y228-E304 WeakPolarHBondContact OH-CG 3.44Å; Y228-E304 PolarHBondContact OH-OE1 2.82Å; Y228-E305 HydrophobicContact CD1-CB 3.84Å; Y228-E305 HydrophobicContact CD1-CG 4.23Å; Y228-E305 HydrophobicContact CG-CB 4.18Å; Y228-E305 HydrophobicContact CG-CG 4.12Å; Y228-F308 HydrophobicContact CD2-CB 3.77Å; Y228-F308 AromaticContact CD2-CD1 3.61Å; Y228-F308 HydrophobicContact CD2-CD1 3.61Å; Y228-F308 AromaticContact CD2-CD2 3.91Å; Y228-F308 HydrophobicContact CD2-CD2 3.91Å; Y228-F308 HydrophobicContact CD2-CE1 4.19Å; Y228-F308 HydrophobicContact CD2-CE2 4.45Å; Y228-F308 AromaticContact CD2-CG 3.46Å; Y228-F308 HydrophobicContact CD2-CG 3.46Å; Y228-F308 VanDerWaalsContact CD2-CG 3.46Å; Y228-F308 HydrophobicContact CE2-CB 3.69Å; Y228-F308 HydrophobicContact CE2-CD1 4.28Å; Y228-F308 AromaticContact CE2-CD2 3.81Å; Y228-F308 HydrophobicContact CE2-CD2 3.81Å; Y228-F308 AromaticContact CE2-CG 3.65Å; Y228-F308 HydrophobicContact CE2-CG 3.65Å; Y228-F308 HydrophobicContact CG-CD1 4.43Å
229	T	92	Very high	81.8	Confident	83 Å²	83	66 Å²	66	51%	0.509	35%	0.351	S	S	.	.	H	α-helix	trans	-58.1	-43.7	177.4	-49.2	0	0	0	0	112.5	T227 V232 Q233	T227-T229 VanDerWaalsContact C-N 3.28Å; T227-T229 PolarHBondContact O-N 3.42Å; T229-V232 PolarHBondContact O-N 3.27Å; T229-Q233 WeakPolarHBondContact O-CG 3.22Å; T229-Q233 PolarHBondContact O-N 3.29Å
230	E	88.8	Confident	80.9	Confident	50 Å²	50	69.3 Å²	69.3	23%	0.234	37%	0.368	C	S	.	.	H	α-helix	trans	-64	-41.2	175	-74.2	164.1	146	0	0	111.5	T227 Y228 Q233 L234 R494	T227-E230 PolarHBondContact N-OE2 2.84Å; T227-E230 PolarHBondContact O-N 3Å; T227-E230 WeakPolarHBondContact OG1-CB 3.38Å; T227-E230 VanDerWaalsContact OG1-CD 3.3Å; T227-E230 WeakPolarHBondContact OG1-CG 3.19Å; T227-E230 PolarHBondContact OG1-N 3.36Å; T227-E230 PolarHBondContact OG1-OE2 2.86Å; Y228-E230 VanDerWaalsContact C-N 3.35Å; Y228-E230 PolarHBondContact O-N 2.94Å; E230-Q233 PolarHBondContact O-N 2.97Å; E230-L234 WeakPolarHBondContact O-CB 3.36Å; E230-L234 WeakPolarHBondContact O-CG 3.49Å; E230-L234 PolarHBondContact O-N 3.48Å; E230-R494 IonicContact OE1-NH2 3.78Å
231	L	91.2	Very high	80.3	Confident	1 Å²	1	71 Å²	71	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-63.1	-41.6	176.5	-74.1	165.7	0	0	0	112.6	V226 T227 Y228 L234 S235 A277 W280 L281 F308 F492	V226-L231 HydrophobicContact CG1-CD1 3.85Å; V226-L231 HydrophobicContact CG1-CD2 3.99Å; V226-L231 HydrophobicContact CG1-CG 3.7Å; T227-L231 PolarHBondContact O-N 3.43Å; T227-L231 VanDerWaalsContact O-N 3.09Å; Y228-L231 WeakPolarHBondContact O-CB 3.32Å; Y228-L231 PolarHBondContact O-N 3.29Å; Y228-L231 VanDerWaalsContact O-N 3.1Å; L231-L234 PolarHBondContact O-N 2.73Å; L231-S235 VanDerWaalsContact O-CB 3.29Å; L231-S235 WeakPolarHBondContact O-CB 3.41Å; L231-S235 PolarHBondContact O-N 3.31Å; L231-S235 PolarHBondContact O-OG 2.94Å; L231-A277 HydrophobicContact CB-CB 4.27Å; L231-W280 HydrophobicContact CD2-CE3 3.75Å; L231-W280 HydrophobicContact CD2-CZ3 3.69Å; L231-L281 HydrophobicContact CD2-CB 4.5Å; L231-L281 HydrophobicContact CD2-CD1 4.28Å; L231-F308 HydrophobicContact CD1-CE1 3.85Å; L231-F308 HydrophobicContact CD1-CE2 4.48Å; L231-F308 HydrophobicContact CD1-CZ 3.55Å; L231-F492 HydrophobicContact CD2-CE2 4.17Å; L231-F492 HydrophobicContact CD2-CZ 3.64Å; L231-F492 HydrophobicContact CG-CZ 4.34Å
232	V	92.6	Very high	80.2	Confident	27 Å²	27	65.3 Å²	65.3	16%	0.164	36%	0.357	C	S	.	.	H	α-helix	trans	-61.5	-44.9	174.5	169.7	0	0	0	0	110.6	Y228 T229 S235 S236 R273	Y228-V232 HydrophobicContact CD1-CG2 4.23Å; Y228-V232 HydrophobicContact CD2-CG2 4.14Å; Y228-V232 HydrophobicContact CE1-CG2 3.69Å; Y228-V232 HydrophobicContact CE2-CG2 3.59Å; Y228-V232 HydrophobicContact CG-CG2 4.42Å; Y228-V232 WeakPolarHBondContact O-CG2 3.48Å; Y228-V232 PolarHBondContact O-N 3.41Å; Y228-V232 WeakPolarHBondContact OH-CG2 3.1Å; T229-V232 PolarHBondContact O-N 3.27Å; V232-S235 PolarHBondContact O-N 2.89Å; V232-S235 PolarHBondContact O-OG 3.14Å; V232-S236 WeakPolarHBondContact O-CB 3.5Å; V232-S236 PolarHBondContact O-N 3.29Å; V232-R273 HydrophobicContact CG1-CB 4.35Å; V232-R273 HydrophobicContact CG1-CG 4.02Å; V232-R273 HydrophobicContact CG2-CB 4.19Å
233	Q	90.1	Very high	80.5	Confident	125 Å²	125	59.9 Å²	59.9	58%	0.584	34%	0.34	S	S	*	.	H	α-helix	trans	-62.1	-46.5	177.3	-72.2	174	0.5	0	0	111.6	T229 E230 S235 S236	T229-Q233 WeakPolarHBondContact O-CG 3.22Å; T229-Q233 PolarHBondContact O-N 3.29Å; E230-Q233 PolarHBondContact O-N 2.97Å; Q233-S235 VanDerWaalsContact C-N 3.34Å; Q233-S235 PolarHBondContact O-N 3.38Å; Q233-S236 PolarHBondContact O-N 3.42Å; Q233-S236 PolarHBondContact O-OG 3Å
234	L	86.7	Confident	81.3	Confident	75 Å²	75	56.2 Å²	56.2	39%	0.393	32%	0.321	S	S	.	.	H	α-helix	trans	-68.4	-30.2	-178.8	-70.2	169.5	0	0	0	113.7	E230 L231 W280 F492	E230-L234 WeakPolarHBondContact O-CB 3.36Å; E230-L234 WeakPolarHBondContact O-CG 3.49Å; E230-L234 PolarHBondContact O-N 3.48Å; L231-L234 PolarHBondContact O-N 2.73Å; L234-W280 HydrophobicContact CB-CH2 4.2Å; L234-W280 HydrophobicContact CB-CZ2 3.75Å; L234-W280 HydrophobicContact CD1-CH2 3.85Å; L234-W280 HydrophobicContact CD1-CZ2 4.12Å; L234-W280 HydrophobicContact CD1-CZ3 4.48Å; L234-W280 HydrophobicContact CG-CZ2 4.41Å; L234-W280 PolarHBondContact O-NE1 2.83Å; L234-W280 VanDerWaalsContact O-NE1 3.16Å; L234-F492 HydrophobicContact CD1-CD1 4.26Å; L234-F492 HydrophobicContact CD1-CE1 3.33Å; L234-F492 HydrophobicContact CD1-CZ 3.91Å
235	S	89.2	Confident	81.9	Confident	4 Å²	4	59.1 Å²	59.1	3%	0.028	33%	0.332	C	S	.	.	H	α-helix	trans	-87.3	-16	177.6	61.3	0	0	0	0	113.6	L231 V232 Q233 T237 D238	L231-S235 VanDerWaalsContact O-CB 3.29Å; L231-S235 WeakPolarHBondContact O-CB 3.41Å; L231-S235 PolarHBondContact O-N 3.31Å; L231-S235 PolarHBondContact O-OG 2.94Å; V232-S235 PolarHBondContact O-N 2.89Å; V232-S235 PolarHBondContact O-OG 3.14Å; Q233-S235 VanDerWaalsContact C-N 3.34Å; Q233-S235 PolarHBondContact O-N 3.38Å; S235-T237 VanDerWaalsContact C-N 3.33Å; S235-T237 PolarHBondContact O-N 3.41Å; S235-D238 PolarHBondContact O-N 3.18Å
236	S	82.8	Confident	82.5	Confident	67 Å²	67	57.7 Å²	57.7	47%	0.469	32%	0.322	S	S	.	.	H	α-helix	trans	-62.3	-36.8	-176.9	68.9	0	0	0	0	113.8	V232 Q233 R276	V232-S236 WeakPolarHBondContact O-CB 3.5Å; V232-S236 PolarHBondContact O-N 3.29Å; Q233-S236 PolarHBondContact O-N 3.42Å; Q233-S236 PolarHBondContact O-OG 3Å; S236-R276 PolarHBondContact O-NH1 3.09Å
237	T	68.3	Low	83	Confident	116 Å²	116	59.2 Å²	59.2	71%	0.712	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-3.2	179.8	53.6	0	0	0	0	113.1	S235 T239	S235-T237 VanDerWaalsContact C-N 3.33Å; S235-T237 PolarHBondContact O-N 3.41Å; T237-T239 PolarHBondContact O-N 2.68Å
238	D	64.4	Low	82.9	Confident	39 Å²	39	64.5 Å²	64.5	21%	0.209	35%	0.348	C	S	.	.			trans	-76.1	118.5	-175.9	-148.3	-1.3	0	0	0	110.2	S235 L240 R490	S235-D238 PolarHBondContact O-N 3.18Å; D238-L240 VanDerWaalsContact C-N 3.33Å; D238-L240 VanDerWaalsContact OD1-CG 3.29Å; D238-L240 WeakPolarHBondContact OD1-CG 3.3Å; D238-L240 WeakPolarHBondContact OD2-CD1 3.39Å; D238-R490 IonicContact OD2-CZ 3.07Å; D238-R490 IonicContact OD2-NH1 3.75Å; D238-R490 IonicContact OD2-NH2 3.8Å; D238-R490 PolarHBondContact OD2-NH2 3.35Å
239	T	59.9	Low	82.8	Confident	132 Å²	132	64.4 Å²	64.4	81%	0.81	35%	0.348	S	S	*	.			trans	-99.8	22.9	-177.3	47	0	0	0	0	111.9	T237	T237-T239 PolarHBondContact O-N 2.68Å
240	L	65.9	Low	82.8	Confident	77 Å²	77	60.5 Å²	60.5	40%	0.403	32%	0.324	S	S	.	.			trans	-56.5	156.7	177.6	-69.2	173.1	0	0	0	112.5	D238 A242 G243	D238-L240 VanDerWaalsContact C-N 3.33Å; D238-L240 VanDerWaalsContact OD1-CG 3.29Å; D238-L240 WeakPolarHBondContact OD1-CG 3.3Å; D238-L240 WeakPolarHBondContact OD2-CD1 3.39Å; L240-A242 PolarHBondContact O-N 3.03Å; L240-A242 VanDerWaalsContact O-N 3.13Å; L240-G243 WeakPolarHBondContact O-CA 3.47Å; L240-G243 PolarHBondContact O-N 2.93Å
241	L	73.7	Confident	82.7	Confident	133 Å²	133	63.2 Å²	63.2	70%	0.696	34%	0.336	S	S	*	.	H	α-helix	trans	-50.2	-37.3	172.9	-68.7	174.4	0	0	0	112.5	G243 I244 Q245	L241-G243 VanDerWaalsContact C-N 3.29Å; L241-G243 PolarHBondContact O-N 3.26Å; L241-I244 PolarHBondContact O-N 3.22Å; L241-I244 VanDerWaalsContact O-N 3.15Å; L241-Q245 PolarHBondContact O-N 3.31Å; L241-Q245 VanDerWaalsContact O-N 3.09Å
242	A	79.7	Confident	82.5	Confident	14 Å²	14	69.2 Å²	69.2	12%	0.116	36%	0.358	C	S	.	.	H	α-helix	trans	-57.2	-40.2	174.9	0	0	0	0	0	112.2	L240 I244 Q245 I246 A279	L240-A242 PolarHBondContact O-N 3.03Å; L240-A242 VanDerWaalsContact O-N 3.13Å; A242-I244 VanDerWaalsContact C-N 3.33Å; A242-I244 PolarHBondContact O-N 3.39Å; A242-Q245 PolarHBondContact O-N 2.81Å; A242-I246 WeakPolarHBondContact O-CB 3.26Å; A242-I246 WeakPolarHBondContact O-CD1 3.27Å; A242-I246 WeakPolarHBondContact O-CG1 3.47Å; A242-I246 PolarHBondContact O-N 2.79Å; A242-A279 HydrophobicContact CB-CB 3.96Å
243	G	84.4	Confident	82.3	Confident	12 Å²	12	68.5 Å²	68.5	12%	0.124	35%	0.354	C	S	.	.	H	α-helix	trans	-61.9	-39.5	177.1	0	0	0	0	0	112.7	L240 L241 I246 E247	L240-G243 WeakPolarHBondContact O-CA 3.47Å; L240-G243 PolarHBondContact O-N 2.93Å; L241-G243 VanDerWaalsContact C-N 3.29Å; L241-G243 PolarHBondContact O-N 3.26Å; G243-I246 PolarHBondContact O-N 3.34Å; G243-E247 WeakPolarHBondContact O-CG 3.38Å; G243-E247 PolarHBondContact O-N 3.3Å
244	I	84.1	Confident	82.3	Confident	97 Å²	97	63.1 Å²	63.1	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-67.4	-42.6	177.2	-59.9	173.8	0	0	0	110.9	L241 A242 K248	L241-I244 PolarHBondContact O-N 3.22Å; L241-I244 VanDerWaalsContact O-N 3.15Å; A242-I244 VanDerWaalsContact C-N 3.33Å; A242-I244 PolarHBondContact O-N 3.39Å; I244-K248 WeakPolarHBondContact O-CG 3.29Å; I244-K248 PolarHBondContact O-N 3.29Å
245	Q	86	Confident	82.3	Confident	95 Å²	95	62.9 Å²	62.9	44%	0.444	33%	0.332	S	S	.	.	H	α-helix	trans	-64.9	-43.7	176.6	-70.8	173.7	-28.7	0	0	111.3	L241 A242 E247 K248 D249 Y287	L241-Q245 PolarHBondContact O-N 3.31Å; L241-Q245 VanDerWaalsContact O-N 3.09Å; A242-Q245 PolarHBondContact O-N 2.81Å; Q245-E247 PolarHBondContact O-N 2.99Å; Q245-K248 PolarHBondContact O-N 3.18Å; Q245-D249 PolarHBondContact O-N 3.44Å; Q245-Y287 HydrophobicContact CB-CD1 3.81Å; Q245-Y287 HydrophobicContact CB-CE1 4.3Å
246	I	91.5	Very high	82.1	Confident	1 Å²	1	67 Å²	67	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-55.8	-52.4	175.4	-71	162.4	0	0	0	110.1	A242 G243 K248 D249 L250 L275 R276 A279 Y287	A242-I246 WeakPolarHBondContact O-CB 3.26Å; A242-I246 WeakPolarHBondContact O-CD1 3.27Å; A242-I246 WeakPolarHBondContact O-CG1 3.47Å; A242-I246 PolarHBondContact O-N 2.79Å; G243-I246 PolarHBondContact O-N 3.34Å; I246-K248 PolarHBondContact O-N 2.95Å; I246-D249 PolarHBondContact O-N 3.42Å; I246-L250 HydrophobicContact CG2-CD1 4.24Å; I246-L250 HydrophobicContact CG2-CD2 4.29Å; I246-L250 HydrophobicContact CG2-CG 4.09Å; I246-L250 VanDerWaalsContact O-CG 3.29Å; I246-L250 WeakPolarHBondContact O-CG 3.36Å; I246-L250 PolarHBondContact O-N 3.22Å; I246-L275 HydrophobicContact CD1-CB 3.93Å; I246-L275 HydrophobicContact CG1-CB 4.1Å; I246-L275 HydrophobicContact CG2-CB 4.04Å; I246-L275 HydrophobicContact CG2-CD1 4.08Å; I246-R276 HydrophobicContact CD1-CG 4.07Å; I246-A279 HydrophobicContact CD1-CB 4.16Å; I246-Y287 HydrophobicContact CD1-CD2 4.11Å; I246-Y287 HydrophobicContact CD1-CG 4.16Å; I246-Y287 HydrophobicContact CG1-CD1 3.89Å; I246-Y287 HydrophobicContact CG1-CD2 3.48Å; I246-Y287 VanDerWaalsContact CG1-CD2 3.48Å; I246-Y287 HydrophobicContact CG1-CE1 4.24Å; I246-Y287 HydrophobicContact CG1-CE2 3.88Å; I246-Y287 HydrophobicContact CG1-CG 3.47Å; I246-Y287 VanDerWaalsContact CG1-CG 3.47Å
247	E	90.6	Very high	82.4	Confident	48 Å²	48	63.9 Å²	63.9	22%	0.224	33%	0.332	C	S	.	.	H	α-helix	trans	-58.1	-35.1	-178.7	-68.5	-54.9	145.6	0	0	113.4	G243 Q245 D249 F251 R272 R276	G243-E247 WeakPolarHBondContact O-CG 3.38Å; G243-E247 PolarHBondContact O-N 3.3Å; Q245-E247 PolarHBondContact O-N 2.99Å; E247-D249 VanDerWaalsContact C-N 3.34Å; E247-F251 VanDerWaalsContact O-CD2 3.25Å; E247-F251 WeakPolarHBondContact O-CD2 3.44Å; E247-F251 WeakPolarHBondContact O-CE2 3.49Å; E247-R272 VanDerWaalsContact CD-NE 3.3Å; E247-R272 VanDerWaalsContact OE1-CD 3.23Å; E247-R272 WeakPolarHBondContact OE1-CD 3.47Å; E247-R272 IonicContact OE1-CZ 3.3Å; E247-R272 IonicContact OE1-NE 3.68Å; E247-R272 PolarHBondContact OE1-NE 3.07Å; E247-R272 IonicContact OE2-CZ 3.79Å; E247-R272 IonicContact OE2-NE 2.75Å; E247-R272 PolarHBondContact OE2-NE 3.13Å; E247-R272 IonicContact OE2-NH2 3.48Å; E247-R272 PolarHBondContact OE2-NH2 3.44Å; E247-R276 IonicContact OE1-CZ 2.85Å; E247-R276 IonicContact OE1-NE 3.68Å; E247-R276 IonicContact OE1-NH2 2.86Å; E247-R276 PolarHBondContact OE1-NH2 3.36Å
248	K	87	Confident	83.3	Confident	146 Å²	146	59.4 Å²	59.4	64%	0.635	30%	0.303	S	S	*	.	H	α-helix	trans	-67.8	-37.4	174.8	-69.4	177.1	179.6	-177.9	0	111.8	I244 Q245 I246	I244-K248 WeakPolarHBondContact O-CG 3.29Å; I244-K248 PolarHBondContact O-N 3.29Å; Q245-K248 PolarHBondContact O-N 3.18Å; I246-K248 PolarHBondContact O-N 2.95Å
249	D	89.9	Confident	84.4	Confident	11 Å²	11	57.6 Å²	57.6	6%	0.059	29%	0.294	C	S	.	.	H	α-helix	trans	-79.7	-29.2	-174.9	-75.9	22.3	0	0	0	113.1	Q245 I246 E247 F251 R252 T253 Y287	Q245-D249 PolarHBondContact O-N 3.44Å; I246-D249 PolarHBondContact O-N 3.42Å; E247-D249 VanDerWaalsContact C-N 3.34Å; D249-F251 VanDerWaalsContact C-N 3.3Å; D249-F251 PolarHBondContact O-N 2.92Å; D249-R252 VanDerWaalsContact CG-NE 3.31Å; D249-R252 CarbonylContact O-C 3.58Å; D249-R252 VanDerWaalsContact O-CG 3.26Å; D249-R252 WeakPolarHBondContact O-CG 3.5Å; D249-R252 PolarHBondContact O-N 3.04Å; D249-R252 VanDerWaalsContact O-N 3.14Å; D249-R252 IonicContact OD1-CZ 3.42Å; D249-R252 IonicContact OD1-NE 3.48Å; D249-R252 PolarHBondContact OD1-NE 2.98Å; D249-R252 IonicContact OD1-NH2 3.91Å; D249-R252 PolarHBondContact OD1-NH2 2.66Å; D249-R252 IonicContact OD2-CZ 2.66Å; D249-R252 IonicContact OD2-NE 3.02Å; D249-R252 IonicContact OD2-NH2 3.06Å; D249-R252 PolarHBondContact OD2-NH2 3.38Å; D249-T253 WeakPolarHBondContact O-CB 3.2Å; D249-T253 PolarHBondContact O-N 3.18Å; D249-T253 PolarHBondContact O-OG1 3.33Å; D249-Y287 HydrophobicContact CB-CE1 4.01Å; D249-Y287 WeakPolarHBondContact CB-OH 3.47Å; D249-Y287 WeakPolarHBondContact OD2-CE1 3.47Å; D249-Y287 PolarHBondContact OD2-OH 3.47Å; D249-Y287 VanDerWaalsContact OD2-OH 3.05Å
250	L	92.3	Very high	85.8	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-52	-47.8	178.7	-72.6	177	0	0	0	112.1	I246 R252 T253 I268 L271 R272 L275	I246-L250 HydrophobicContact CG2-CD1 4.24Å; I246-L250 HydrophobicContact CG2-CD2 4.29Å; I246-L250 HydrophobicContact CG2-CG 4.09Å; I246-L250 VanDerWaalsContact O-CG 3.29Å; I246-L250 WeakPolarHBondContact O-CG 3.36Å; I246-L250 PolarHBondContact O-N 3.22Å; L250-R252 VanDerWaalsContact C-N 3.31Å; L250-R252 PolarHBondContact O-N 3.09Å; L250-T253 PolarHBondContact O-N 2.75Å; L250-I268 HydrophobicContact CB-CD1 4.27Å; L250-I268 HydrophobicContact CB-CG2 4.45Å; L250-I268 HydrophobicContact CD1-CG2 4.37Å; L250-I268 WeakPolarHBondContact O-CD1 3.45Å; L250-L271 HydrophobicContact CD2-CB 3.91Å; L250-L271 HydrophobicContact CD2-CD2 3.57Å; L250-L271 HydrophobicContact CD2-CG 3.47Å; L250-L271 VanDerWaalsContact CD2-CG 3.47Å; L250-R272 HydrophobicContact CD1-CB 3.71Å; L250-R272 HydrophobicContact CD1-CG 4Å; L250-R272 VanDerWaalsContact CD1-CZ 3.43Å; L250-R272 VanDerWaalsContact CD1-NH2 3.28Å; L250-R272 HydrophobicContact CD2-CB 4.28Å; L250-L275 HydrophobicContact CD2-CD1 4.26Å
251	F	85.6	Confident	86.7	Confident	107 Å²	107	52.6 Å²	52.6	47%	0.469	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-14.5	-175.4	-57.3	-65.5	0	0	0	114.6	E247 D249	E247-F251 VanDerWaalsContact O-CD2 3.25Å; E247-F251 WeakPolarHBondContact O-CD2 3.44Å; E247-F251 WeakPolarHBondContact O-CE2 3.49Å; D249-F251 VanDerWaalsContact C-N 3.3Å; D249-F251 PolarHBondContact O-N 2.92Å
252	R	87.4	Confident	87.2	Confident	126 Å²	126	48 Å²	48	48%	0.475	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-2	174.1	61.3	175.7	-176.6	153.4	-0.2	113.1	D249 L250 Q289	D249-R252 VanDerWaalsContact CG-NE 3.31Å; D249-R252 CarbonylContact O-C 3.58Å; D249-R252 VanDerWaalsContact O-CG 3.26Å; D249-R252 WeakPolarHBondContact O-CG 3.5Å; D249-R252 PolarHBondContact O-N 3.04Å; D249-R252 VanDerWaalsContact O-N 3.14Å; D249-R252 IonicContact OD1-CZ 3.42Å; D249-R252 IonicContact OD1-NE 3.48Å; D249-R252 PolarHBondContact OD1-NE 2.98Å; D249-R252 IonicContact OD1-NH2 3.91Å; D249-R252 PolarHBondContact OD1-NH2 2.66Å; D249-R252 IonicContact OD2-CZ 2.66Å; D249-R252 IonicContact OD2-NE 3.02Å; D249-R252 IonicContact OD2-NH2 3.06Å; D249-R252 PolarHBondContact OD2-NH2 3.38Å; L250-R252 VanDerWaalsContact C-N 3.31Å; L250-R252 PolarHBondContact O-N 3.09Å; R252-Q289 VanDerWaalsContact NH1-NE2 3.1Å
253	T	89	Confident	87.4	Confident	12 Å²	12	50.2 Å²	50.2	7%	0.074	25%	0.253	C	S	.	.	S	Bend	trans	-87.9	111.8	177.4	-58.8	0	0	0	0	109.2	D249 L250 L271 G292 L293 A296	D249-T253 WeakPolarHBondContact O-CB 3.2Å; D249-T253 PolarHBondContact O-N 3.18Å; D249-T253 PolarHBondContact O-OG1 3.33Å; L250-T253 PolarHBondContact O-N 2.75Å; T253-L271 HydrophobicContact CG2-CD2 3.93Å; T253-G292 WeakPolarHBondContact CG2-O 3.41Å; T253-L293 HydrophobicContact CG2-CD1 4.13Å; T253-A296 HydrophobicContact CG2-CB 3.6Å
254	M	89.1	Confident	87.3	Confident	13 Å²	13	56.4 Å²	56.4	6%	0.064	28%	0.283	C	S	.	.	S	Bend	trans	50.9	54.9	-176.3	-57.8	-176.2	173.3	0	0	114.2	F99 N256 N257 F260 L293 A296 N297 L300	F99-M254 HydrophobicContact CE1-CB 4.06Å; F99-M254 HydrophobicContact CE1-CG 3.98Å; F99-M254 HydrophobicContact CE1-SD 4Å; F99-M254 HydrophobicContact CZ-CE 3.92Å; F99-M254 HydrophobicContact CZ-CG 4.17Å; F99-M254 HydrophobicContact CZ-SD 3.65Å; M254-N256 PolarHBondContact O-N 2.83Å; M254-N256 VanDerWaalsContact O-N 3.13Å; M254-N257 HydrophobicContact CB-CB 3.76Å; M254-N257 WeakPolarHBondContact O-CB 3.47Å; M254-N257 PolarHBondContact O-N 3.34Å; M254-N257 HydrophobicContact SD-CB 4.46Å; M254-F260 HydrophobicContact CB-CB 4.28Å; M254-F260 HydrophobicContact CB-CD2 4.14Å; M254-F260 HydrophobicContact CB-CG 4.46Å; M254-F260 HydrophobicContact SD-CD2 3.85Å; M254-F260 HydrophobicContact SD-CE2 3.87Å; M254-L293 HydrophobicContact CE-CD1 3.96Å; M254-L293 HydrophobicContact CG-CD1 3.67Å; M254-A296 HydrophobicContact CE-CB 3.92Å; M254-A296 HydrophobicContact CG-CB 4.32Å; M254-A296 HydrophobicContact SD-CB 3.81Å; M254-N297 HydrophobicContact CE-CB 4Å; M254-N297 WeakPolarHBondContact CE-ND2 3.4Å; M254-N297 WeakPolarHBondContact CE-OD1 3.38Å; M254-L300 HydrophobicContact CE-CD1 4.08Å; M254-L300 HydrophobicContact SD-CD1 4.29Å
255	P	86.9	Confident	87.4	Confident	70 Å²	70	52.5 Å²	52.5	46%	0.455	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-27	-175.1	27	-35.4	0	0	0	113.2	N257 H261	P255-N257 VanDerWaalsContact C-N 3.3Å; P255-H261 WeakPolarHBondContact O-CB 3.49Å
256	N	86.6	Confident	87.6	Confident	91 Å²	91	51.3 Å²	51.3	49%	0.487	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-0.3	178.2	-64.5	-7.4	0	0	0	113.2	R100 M254	R100-N256 HydrophobicContact CB-CB 4.43Å; R100-N256 WeakPolarHBondContact CB-O 3.4Å; R100-N256 PolarHBondContact N-O 3.07Å; M254-N256 PolarHBondContact O-N 2.83Å; M254-N256 VanDerWaalsContact O-N 3.13Å
257	N	89	Confident	87.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-94.7	131.6	178.9	-171.5	-75	0	0	0	111.3	F97 G98 F99 M254 P255 C259 F260 H261	F97-N257 PolarHBondContact O-ND2 3.31Å; G98-N257 CarbonylContact O-C 3.38Å; G98-N257 VanDerWaalsContact O-CA 3.31Å; G98-N257 WeakPolarHBondContact O-CA 3.02Å; F99-N257 HydrophobicContact CD1-CB 3.76Å; F99-N257 HydrophobicContact CE1-CB 3.73Å; F99-N257 WeakPolarHBondContact CE2-ND2 3.44Å; F99-N257 HydrophobicContact CG-CB 4.38Å; F99-N257 HydrophobicContact CZ-CB 4.3Å; M254-N257 HydrophobicContact CB-CB 3.76Å; M254-N257 WeakPolarHBondContact O-CB 3.47Å; M254-N257 PolarHBondContact O-N 3.34Å; M254-N257 HydrophobicContact SD-CB 4.46Å; P255-N257 VanDerWaalsContact C-N 3.3Å; N257-C259 PolarHBondContact O-N 2.95Å; N257-C259 VanDerWaalsContact O-N 3.12Å; N257-C259 VanDerWaalsContact OD1-CB 3.28Å; N257-C259 WeakPolarHBondContact OD1-CB 3.48Å; N257-C259 PolarHBondContact OD1-N 3.18Å; N257-F260 HydrophobicContact CB-CD2 4.1Å; N257-F260 CarbonylContact O-C 3.53Å; N257-F260 PolarHBondContact O-N 3.49Å; N257-H261 WeakPolarHBondContact O-CB 2.97Å; N257-H261 PolarHBondContact O-N 3.04Å
258	L	86.4	Confident	87.8	Confident	22 Å²	22	49 Å²	49	12%	0.115	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.6	-176.8	-169.5	67.1	0	0	0	113.6	F60 P69 V72 F94 G98 H261	F60-L258 HydrophobicContact CE1-CB 4.36Å; F60-L258 HydrophobicContact CE1-CD2 3.55Å; F60-L258 HydrophobicContact CE2-CD2 4.4Å; F60-L258 HydrophobicContact CZ-CD2 3.43Å; F60-L258 VanDerWaalsContact CZ-CD2 3.43Å; P69-L258 HydrophobicContact CG-CD2 3.79Å; P69-L258 HydrophobicContact CG-CG 3.84Å; V72-L258 HydrophobicContact CG2-CD2 4.24Å; F94-L258 HydrophobicContact CD1-CB 4.16Å; F94-L258 HydrophobicContact CE1-CB 3.91Å; F94-L258 HydrophobicContact CE1-CD1 4.27Å; F94-L258 HydrophobicContact CE2-CD1 4.35Å; F94-L258 HydrophobicContact CZ-CB 4.38Å; F94-L258 HydrophobicContact CZ-CD1 3.89Å; G98-L258 PolarHBondContact O-N 3.03Å; L258-H261 PolarHBondContact O-CD2 3.44Å; L258-H261 PolarHBondContact O-NE2 3.38Å
259	C	87.3	Confident	88.1	Confident	2 Å²	2	44 Å²	44	1%	0.014	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-16.9	176.6	-60.2	0	0	0	0	112.9	L63 L67 N257 S265 G267	L63-C259 VanDerWaalsContact CD1-SG 3.5Å; L67-C259 HydrophobicContact CD1-CB 4.42Å; L67-C259 HydrophobicContact CD2-CB 3.56Å; L67-C259 VanDerWaalsContact CD2-SG 3.59Å; L67-C259 HydrophobicContact CG-CB 3.72Å; L67-C259 PolarHBondContact O-SG 3.15Å; L67-C259 VanDerWaalsContact O-SG 3.4Å; N257-C259 PolarHBondContact O-N 2.95Å; N257-C259 VanDerWaalsContact O-N 3.12Å; N257-C259 VanDerWaalsContact OD1-CB 3.28Å; N257-C259 WeakPolarHBondContact OD1-CB 3.48Å; N257-C259 PolarHBondContact OD1-N 3.18Å; C259-S265 WeakPolarHBondContact O-CB 3.25Å; C259-G267 WeakPolarHBondContact O-CA 3.42Å; C259-G267 PolarHBondContact O-N 2.66Å; C259-G267 VanDerWaalsContact O-N 3.13Å
260	F	89.8	Confident	88.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-5.1	-171.9	-56.5	-78.8	0	0	0	114.8	L67 M254 N257 S262 G267 I268 L271 A296 L299 L300	L67-F260 HydrophobicContact CD2-CE2 4.42Å; L67-F260 HydrophobicContact CD2-CZ 4.34Å; M254-F260 HydrophobicContact CB-CB 4.28Å; M254-F260 HydrophobicContact CB-CD2 4.14Å; M254-F260 HydrophobicContact CB-CG 4.46Å; M254-F260 HydrophobicContact SD-CD2 3.85Å; M254-F260 HydrophobicContact SD-CE2 3.87Å; N257-F260 HydrophobicContact CB-CD2 4.1Å; N257-F260 CarbonylContact O-C 3.53Å; N257-F260 PolarHBondContact O-N 3.49Å; F260-S262 VanDerWaalsContact C-N 3.32Å; F260-S262 PolarHBondContact O-N 3.17Å; F260-G267 VanDerWaalsContact CE1-C 3.46Å; F260-G267 WeakPolarHBondContact CE1-O 3.34Å; F260-I268 HydrophobicContact CB-CD1 4.07Å; F260-I268 HydrophobicContact CD1-CD1 4.21Å; F260-I268 VanDerWaalsContact O-CD1 3.27Å; F260-I268 WeakPolarHBondContact O-CD1 3.21Å; F260-I268 WeakPolarHBondContact O-CG1 3.3Å; F260-L271 HydrophobicContact CD1-CD2 4.22Å; F260-L271 HydrophobicContact CE1-CB 4.24Å; F260-L271 HydrophobicContact CE1-CD2 4.34Å; F260-A296 HydrophobicContact CE1-CB 4.06Å; F260-A296 HydrophobicContact CE2-CB 4.17Å; F260-A296 HydrophobicContact CZ-CB 3.87Å; F260-L299 HydrophobicContact CE1-CD1 4.44Å; F260-L299 HydrophobicContact CZ-CB 4.21Å; F260-L300 HydrophobicContact CE2-CD2 3.8Å; F260-L300 HydrophobicContact CE2-CG 4.37Å
261	H	84.9	Confident	88.5	Confident	104 Å²	104	43.8 Å²	43.8	48%	0.481	23%	0.234	S	C	.	.	S	Bend	trans	-67.4	-20.1	-174.5	75.9	95.1	0	0	0	116	P255 N257 L258 S265	P255-H261 WeakPolarHBondContact O-CB 3.49Å; N257-H261 WeakPolarHBondContact O-CB 2.97Å; N257-H261 PolarHBondContact O-N 3.04Å; L258-H261 PolarHBondContact O-CD2 3.44Å; L258-H261 PolarHBondContact O-NE2 3.38Å; H261-S265 PolarHBondContact NE2-OG 2.91Å
262	S	83	Confident	89	Confident	35 Å²	35	41.1 Å²	41.1	25%	0.245	22%	0.221	C	C	.	.	S	Bend	trans	-132.6	153.5	-175.8	84.5	0	0	0	0	113.3	F260 N264 S265 I268	F260-S262 VanDerWaalsContact C-N 3.32Å; F260-S262 PolarHBondContact O-N 3.17Å; S262-N264 PolarHBondContact O-N 3.06Å; S262-N264 VanDerWaalsContact O-N 3.08Å; S262-N264 PolarHBondContact OG-N 2.95Å; S262-S265 PolarHBondContact N-OG 3.08Å; S262-S265 WeakPolarHBondContact O-CB 3.18Å; S262-S265 PolarHBondContact O-N 3.36Å; S262-S265 PolarHBondContact O-OG 2.99Å; S262-S265 PolarHBondContact OG-N 3.22Å; S262-S265 PolarHBondContact OG-OG 3.24Å; S262-I268 VanDerWaalsContact O-CG1 3.24Å; S262-I268 WeakPolarHBondContact O-CG1 3.39Å
263	S	83.6	Confident	89.4	Confident	62 Å²	62	39.6 Å²	39.6	43%	0.434	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.1	176.1	60.5	0	0	0	0	114.2
264	N	83.7	Confident	89.8	Confident	142 Å²	142	39 Å²	39	76%	0.759	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-4.5	-176.6	-60.7	-8.8	0	0	0	112.1	S262	S262-N264 PolarHBondContact O-N 3.06Å; S262-N264 VanDerWaalsContact O-N 3.08Å; S262-N264 PolarHBondContact OG-N 2.95Å
265	S	86.7	Confident	90	Very high	14 Å²	14	38.4 Å²	38.4	10%	0.098	21%	0.209	C	C	.	.	S	Bend	trans	-67.4	139.9	178.2	-56.6	0	0	0	0	110.2	C259 H261 S262 G267 I268 S269	C259-S265 WeakPolarHBondContact O-CB 3.25Å; H261-S265 PolarHBondContact NE2-OG 2.91Å; S262-S265 PolarHBondContact N-OG 3.08Å; S262-S265 WeakPolarHBondContact O-CB 3.18Å; S262-S265 PolarHBondContact O-N 3.36Å; S262-S265 PolarHBondContact O-OG 2.99Å; S262-S265 PolarHBondContact OG-N 3.22Å; S262-S265 PolarHBondContact OG-OG 3.24Å; S265-G267 PolarHBondContact O-N 3.14Å; S265-I268 PolarHBondContact O-N 2.75Å; S265-S269 PolarHBondContact O-N 2.93Å
266	T	89.3	Confident	90.4	Very high	70 Å²	70	37.8 Å²	37.8	43%	0.429	20%	0.197	S	C	.	.	H	α-helix	trans	-54.4	-41.5	179.3	-54.5	0	0	0	0	111.1	I268 S269 R270	T266-I268 PolarHBondContact O-N 2.9Å; T266-S269 WeakPolarHBondContact O-CB 3.48Å; T266-S269 PolarHBondContact O-N 3.3Å; T266-S269 VanDerWaalsContact O-N 3.16Å; T266-R270 HydrophobicContact CG2-CG 4.26Å; T266-R270 WeakPolarHBondContact O-CG 3.4Å; T266-R270 PolarHBondContact O-N 3.35Å
267	G	92	Very high	90.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-43	179.6	0	0	0	0	0	113.8	C259 F260 S265 S269 R270 L271	C259-G267 WeakPolarHBondContact O-CA 3.42Å; C259-G267 PolarHBondContact O-N 2.66Å; C259-G267 VanDerWaalsContact O-N 3.13Å; F260-G267 VanDerWaalsContact CE1-C 3.46Å; F260-G267 WeakPolarHBondContact CE1-O 3.34Å; S265-G267 PolarHBondContact O-N 3.14Å; G267-S269 VanDerWaalsContact C-N 3.3Å; G267-S269 PolarHBondContact O-N 2.8Å; G267-R270 PolarHBondContact O-N 3.44Å; G267-L271 WeakPolarHBondContact O-CB 3.22Å; G267-L271 PolarHBondContact O-N 3.27Å
268	I	93.9	Very high	90.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.5	-41	175.5	-69.3	-57.3	0	0	0	111.6	L250 F260 S262 S265 T266 R272	L250-I268 HydrophobicContact CB-CD1 4.27Å; L250-I268 HydrophobicContact CB-CG2 4.45Å; L250-I268 HydrophobicContact CD1-CG2 4.37Å; L250-I268 WeakPolarHBondContact O-CD1 3.45Å; F260-I268 HydrophobicContact CB-CD1 4.07Å; F260-I268 HydrophobicContact CD1-CD1 4.21Å; F260-I268 VanDerWaalsContact O-CD1 3.27Å; F260-I268 WeakPolarHBondContact O-CD1 3.21Å; F260-I268 WeakPolarHBondContact O-CG1 3.3Å; S262-I268 VanDerWaalsContact O-CG1 3.24Å; S262-I268 WeakPolarHBondContact O-CG1 3.39Å; S265-I268 PolarHBondContact O-N 2.75Å; T266-I268 PolarHBondContact O-N 2.9Å; I268-R272 WeakPolarHBondContact O-CB 3.06Å; I268-R272 PolarHBondContact O-N 2.8Å
269	S	93.6	Very high	91.1	Very high	41 Å²	41	32.9 Å²	32.9	29%	0.287	17%	0.172	S	C	.	.	H	α-helix	trans	-65.8	-42.1	178.4	-67.8	0	0	0	0	112.6	S265 T266 G267 R273	S265-S269 PolarHBondContact O-N 2.93Å; T266-S269 WeakPolarHBondContact O-CB 3.48Å; T266-S269 PolarHBondContact O-N 3.3Å; T266-S269 VanDerWaalsContact O-N 3.16Å; G267-S269 VanDerWaalsContact C-N 3.3Å; G267-S269 PolarHBondContact O-N 2.8Å; S269-R273 PolarHBondContact O-N 3.27Å
270	R	95.4	Very high	91.1	Very high	9 Å²	9	34 Å²	34	3%	0.034	18%	0.176	C	C	.	.	H	α-helix	trans	-68	-47.2	177	-60.5	178.9	73.3	167.8	4	111.2	S66 T266 G267 R272 R273 V274 L299 E303 E304	S66-R270 PolarHBondContact OG-NH1 2.92Å; T266-R270 HydrophobicContact CG2-CG 4.26Å; T266-R270 WeakPolarHBondContact O-CG 3.4Å; T266-R270 PolarHBondContact O-N 3.35Å; G267-R270 PolarHBondContact O-N 3.44Å; R270-R272 VanDerWaalsContact C-N 3.31Å; R270-R272 PolarHBondContact O-N 3.37Å; R270-R273 PolarHBondContact O-N 3Å; R270-R273 VanDerWaalsContact O-N 3.12Å; R270-V274 WeakPolarHBondContact O-CG2 3.38Å; R270-V274 PolarHBondContact O-N 3.49Å; R270-L299 HydrophobicContact CB-CD1 3.97Å; R270-L299 HydrophobicContact CB-CD2 4.12Å; R270-E303 IonicContact CZ-OE2 3.76Å; R270-E303 IonicContact NH1-OE2 3.47Å; R270-E303 VanDerWaalsContact NH2-CA 3.33Å; R270-E303 IonicContact NH2-OE2 3.1Å; R270-E303 PolarHBondContact NH2-OE2 3.48Å; R270-E304 HydrophobicContact CB-CG 4.23Å; R270-E304 VanDerWaalsContact CG-OE2 3.23Å; R270-E304 WeakPolarHBondContact CG-OE2 3.37Å; R270-E304 IonicContact NE-OE2 3.61Å
271	L	96.1	Very high	91.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56	-45	178	-178.3	60	0	0	0	111.5	L250 T253 F260 G267 R273 V274 L275 G292 V295 A296 L299	L250-L271 HydrophobicContact CD2-CB 3.91Å; L250-L271 HydrophobicContact CD2-CD2 3.57Å; L250-L271 HydrophobicContact CD2-CG 3.47Å; L250-L271 VanDerWaalsContact CD2-CG 3.47Å; T253-L271 HydrophobicContact CG2-CD2 3.93Å; F260-L271 HydrophobicContact CD1-CD2 4.22Å; F260-L271 HydrophobicContact CE1-CB 4.24Å; F260-L271 HydrophobicContact CE1-CD2 4.34Å; G267-L271 WeakPolarHBondContact O-CB 3.22Å; G267-L271 PolarHBondContact O-N 3.27Å; L271-R273 PolarHBondContact O-N 3.37Å; L271-V274 PolarHBondContact O-N 2.99Å; L271-L275 HydrophobicContact CD1-CD1 3.74Å; L271-L275 HydrophobicContact CD1-CG 3.98Å; L271-L275 HydrophobicContact CG-CD1 3.85Å; L271-L275 HydrophobicContact CG-CG 4.43Å; L271-L275 WeakPolarHBondContact O-CB 3.28Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.39Å; L271-L275 PolarHBondContact O-N 3.19Å; L271-G292 WeakPolarHBondContact CD1-O 3.34Å; L271-V295 HydrophobicContact CD1-CB 3.66Å; L271-V295 HydrophobicContact CD1-CG1 3.47Å; L271-V295 VanDerWaalsContact CD1-CG1 3.47Å; L271-A296 HydrophobicContact CD1-CB 4.32Å; L271-A296 HydrophobicContact CD2-CB 4.32Å; L271-L299 HydrophobicContact CB-CD1 4.02Å; L271-L299 HydrophobicContact CD1-CD1 4.37Å
272	R	95.2	Very high	91.1	Very high	50 Å²	50	29.9 Å²	29.9	19%	0.189	16%	0.157	C	C	.	.	H	α-helix	trans	-56.5	-49.1	175.1	-178.1	-178.5	-69.7	100	-0.1	112.4	E247 L250 I268 R270 R276	E247-R272 VanDerWaalsContact CD-NE 3.3Å; E247-R272 VanDerWaalsContact OE1-CD 3.23Å; E247-R272 WeakPolarHBondContact OE1-CD 3.47Å; E247-R272 IonicContact OE1-CZ 3.3Å; E247-R272 IonicContact OE1-NE 3.68Å; E247-R272 PolarHBondContact OE1-NE 3.07Å; E247-R272 IonicContact OE2-CZ 3.79Å; E247-R272 IonicContact OE2-NE 2.75Å; E247-R272 PolarHBondContact OE2-NE 3.13Å; E247-R272 IonicContact OE2-NH2 3.48Å; E247-R272 PolarHBondContact OE2-NH2 3.44Å; L250-R272 HydrophobicContact CD1-CB 3.71Å; L250-R272 HydrophobicContact CD1-CG 4Å; L250-R272 VanDerWaalsContact CD1-CZ 3.43Å; L250-R272 VanDerWaalsContact CD1-NH2 3.28Å; L250-R272 HydrophobicContact CD2-CB 4.28Å; I268-R272 WeakPolarHBondContact O-CB 3.06Å; I268-R272 PolarHBondContact O-N 2.8Å; R270-R272 VanDerWaalsContact C-N 3.31Å; R270-R272 PolarHBondContact O-N 3.37Å; R272-R276 HydrophobicContact CG-CG 4.44Å; R272-R276 VanDerWaalsContact O-CB 3.3Å; R272-R276 WeakPolarHBondContact O-CB 3.42Å; R272-R276 VanDerWaalsContact O-CG 3.26Å; R272-R276 WeakPolarHBondContact O-CG 3.32Å; R272-R276 PolarHBondContact O-N 3.18Å
273	R	95.9	Very high	90.8	Very high	94 Å²	94	31.9 Å²	31.9	36%	0.355	17%	0.168	S	C	.	.	H	α-helix	trans	-64	-46.4	-177.3	-73.2	-170.3	-65.6	-96.9	7.8	111.6	Y228 V232 S269 R270 L271 A277 E304	Y228-R273 WeakPolarHBondContact OH-CB 3.35Å; V232-R273 HydrophobicContact CG1-CB 4.35Å; V232-R273 HydrophobicContact CG1-CG 4.02Å; V232-R273 HydrophobicContact CG2-CB 4.19Å; S269-R273 PolarHBondContact O-N 3.27Å; R270-R273 PolarHBondContact O-N 3Å; R270-R273 VanDerWaalsContact O-N 3.12Å; L271-R273 PolarHBondContact O-N 3.37Å; R273-A277 VanDerWaalsContact O-CB 3.26Å; R273-A277 WeakPolarHBondContact O-CB 3.31Å; R273-A277 PolarHBondContact O-N 3.18Å; R273-E304 WeakPolarHBondContact CB-OE1 3.34Å; R273-E304 IonicContact CZ-OE1 3.62Å; R273-E304 IonicContact CZ-OE2 2.66Å; R273-E304 IonicContact NE-OE1 2.98Å; R273-E304 PolarHBondContact NE-OE1 2.75Å; R273-E304 IonicContact NE-OE2 3.61Å; R273-E304 PolarHBondContact NE-OE2 2.78Å; R273-E304 IonicContact NH2-OE1 2.75Å; R273-E304 IonicContact NH2-OE2 3.36Å; R273-E304 PolarHBondContact NH2-OE2 3.31Å
274	V	96.5	Very high	90	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.9	-49.8	179.4	176.6	0	0	0	0	110.9	Y228 R270 L271 R276 A277 L278 V295 E304 F308	Y228-V274 WeakPolarHBondContact OH-CG2 3.34Å; R270-V274 WeakPolarHBondContact O-CG2 3.38Å; R270-V274 PolarHBondContact O-N 3.49Å; L271-V274 PolarHBondContact O-N 2.99Å; V274-R276 PolarHBondContact O-N 2.89Å; V274-A277 PolarHBondContact O-N 3Å; V274-L278 HydrophobicContact CG1-CD1 3.82Å; V274-L278 HydrophobicContact CG1-CG 4.41Å; V274-L278 VanDerWaalsContact O-CG 3.29Å; V274-L278 WeakPolarHBondContact O-CG 3.28Å; V274-L278 PolarHBondContact O-N 2.88Å; V274-V295 HydrophobicContact CB-CG1 3.82Å; V274-V295 HydrophobicContact CG1-CG1 3.5Å; V274-V295 HydrophobicContact CG1-CG2 4.16Å; V274-V295 HydrophobicContact CG2-CG1 4.46Å; V274-E304 HydrophobicContact CG2-CG 3.6Å; V274-F308 HydrophobicContact CG1-CB 4.13Å; V274-F308 HydrophobicContact CG1-CD2 4.33Å; V274-F308 HydrophobicContact CG2-CB 4.45Å
275	L	95	Very high	89.9	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-63.8	-41.3	-179.3	-69.1	176.1	0	0	0	112.7	I246 L250 L271 L278 A279 Y287 M291 V295	I246-L275 HydrophobicContact CD1-CB 3.93Å; I246-L275 HydrophobicContact CG1-CB 4.1Å; I246-L275 HydrophobicContact CG2-CB 4.04Å; I246-L275 HydrophobicContact CG2-CD1 4.08Å; L250-L275 HydrophobicContact CD2-CD1 4.26Å; L271-L275 HydrophobicContact CD1-CD1 3.74Å; L271-L275 HydrophobicContact CD1-CG 3.98Å; L271-L275 HydrophobicContact CG-CD1 3.85Å; L271-L275 HydrophobicContact CG-CG 4.43Å; L271-L275 WeakPolarHBondContact O-CB 3.28Å; L271-L275 VanDerWaalsContact O-CG 3.29Å; L271-L275 WeakPolarHBondContact O-CG 3.39Å; L271-L275 PolarHBondContact O-N 3.19Å; L275-L278 PolarHBondContact O-N 3.3Å; L275-A279 WeakPolarHBondContact O-CB 3.26Å; L275-A279 PolarHBondContact O-N 3.29Å; L275-Y287 HydrophobicContact CD1-CE2 3.81Å; L275-Y287 HydrophobicContact CD2-CD2 4.24Å; L275-Y287 HydrophobicContact CD2-CE2 3.84Å; L275-Y287 HydrophobicContact CG-CE2 4.28Å; L275-M291 HydrophobicContact CD2-CB 4.29Å; L275-V295 HydrophobicContact CD2-CB 4.19Å; L275-V295 HydrophobicContact CD2-CG2 3.78Å
276	R	93.7	Very high	89.7	Confident	57 Å²	57	26.4 Å²	26.4	22%	0.215	14%	0.136	C	C	.	.	H	α-helix	trans	-65.2	-42.1	175.7	-74.8	-176.9	177.9	-145.5	5.2	111.6	S236 I246 E247 R272 V274 L278 A279 W280	S236-R276 PolarHBondContact O-NH1 3.09Å; I246-R276 HydrophobicContact CD1-CG 4.07Å; E247-R276 IonicContact OE1-CZ 2.85Å; E247-R276 IonicContact OE1-NE 3.68Å; E247-R276 IonicContact OE1-NH2 2.86Å; E247-R276 PolarHBondContact OE1-NH2 3.36Å; R272-R276 HydrophobicContact CG-CG 4.44Å; R272-R276 VanDerWaalsContact O-CB 3.3Å; R272-R276 WeakPolarHBondContact O-CB 3.42Å; R272-R276 VanDerWaalsContact O-CG 3.26Å; R272-R276 WeakPolarHBondContact O-CG 3.32Å; R272-R276 PolarHBondContact O-N 3.18Å; V274-R276 PolarHBondContact O-N 2.89Å; R276-L278 PolarHBondContact O-N 2.63Å; R276-A279 PolarHBondContact O-N 2.9Å; R276-W280 WeakPolarHBondContact O-CB 3.46Å; R276-W280 PolarHBondContact O-N 3.34Å
277	A	94	Very high	89.6	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.4	-41.9	176.4	0	0	0	0	0	111.7	Y228 L231 R273 V274 L281 F308	Y228-A277 HydrophobicContact CE2-CB 4.17Å; L231-A277 HydrophobicContact CB-CB 4.27Å; R273-A277 VanDerWaalsContact O-CB 3.26Å; R273-A277 WeakPolarHBondContact O-CB 3.31Å; R273-A277 PolarHBondContact O-N 3.18Å; V274-A277 PolarHBondContact O-N 3Å; A277-L281 VanDerWaalsContact O-CB 3.23Å; A277-L281 WeakPolarHBondContact O-CB 3.48Å; A277-L281 PolarHBondContact O-N 3.1Å; A277-F308 HydrophobicContact CB-CD2 4.05Å; A277-F308 HydrophobicContact CB-CE2 3.75Å
278	L	92.5	Very high	89.3	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-49.8	176.4	-71.7	165.4	0	0	0	112.1	V274 L275 R276 W280 L281 Y282 M291 V295 F308 M311 I315	V274-L278 HydrophobicContact CG1-CD1 3.82Å; V274-L278 HydrophobicContact CG1-CG 4.41Å; V274-L278 VanDerWaalsContact O-CG 3.29Å; V274-L278 WeakPolarHBondContact O-CG 3.28Å; V274-L278 PolarHBondContact O-N 2.88Å; L275-L278 PolarHBondContact O-N 3.3Å; R276-L278 PolarHBondContact O-N 2.63Å; L278-W280 VanDerWaalsContact C-N 3.25Å; L278-W280 PolarHBondContact O-N 3.04Å; L278-L281 PolarHBondContact O-N 3.47Å; L278-L281 VanDerWaalsContact O-N 3.17Å; L278-Y282 HydrophobicContact CD2-CD2 4.29Å; L278-Y282 HydrophobicContact CD2-CE2 3.88Å; L278-Y282 WeakPolarHBondContact O-CD2 3.11Å; L278-Y282 PolarHBondContact O-N 3.09Å; L278-M291 HydrophobicContact CD1-CE 4.4Å; L278-V295 HydrophobicContact CD1-CG2 4.11Å; L278-F308 HydrophobicContact CD2-CD2 3.92Å; L278-F308 HydrophobicContact CD2-CE2 3.72Å; L278-F308 HydrophobicContact CG-CD2 3.91Å; L278-F308 HydrophobicContact CG-CE2 3.89Å; L278-M311 HydrophobicContact CD1-CB 3.89Å; L278-M311 HydrophobicContact CD1-CG 3.43Å; L278-M311 VanDerWaalsContact CD1-CG 3.43Å; L278-M311 HydrophobicContact CD2-CB 4.12Å; L278-M311 HydrophobicContact CD2-CG 4.01Å; L278-M311 HydrophobicContact CG-CG 4.38Å; L278-I315 HydrophobicContact CD2-CD1 4.2Å
279	A	89.9	Confident	88.7	Confident	7 Å²	7	29 Å²	29	6%	0.058	14%	0.144	C	C	.	.	H	α-helix	trans	-63.9	-32.6	179.7	0	0	0	0	0	112.6	A242 I246 L275 R276 G286	A242-A279 HydrophobicContact CB-CB 3.96Å; I246-A279 HydrophobicContact CD1-CB 4.16Å; L275-A279 WeakPolarHBondContact O-CB 3.26Å; L275-A279 PolarHBondContact O-N 3.29Å; R276-A279 PolarHBondContact O-N 2.9Å; A279-G286 VanDerWaalsContact CA-O 3.24Å; A279-G286 WeakPolarHBondContact CA-O 3.3Å; A279-G286 VanDerWaalsContact CB-O 3.32Å; A279-G286 WeakPolarHBondContact CB-O 3.49Å
280	W	88.8	Confident	88.3	Confident	26 Å²	26	27.7 Å²	27.7	10%	0.098	14%	0.136	C	C	.	.	H	α-helix	trans	-71	-42.9	173.5	-171.8	101.8	0	0	0	111.8	L231 L234 R276 L278 R490 F492	L231-W280 HydrophobicContact CD2-CE3 3.75Å; L231-W280 HydrophobicContact CD2-CZ3 3.69Å; L234-W280 HydrophobicContact CB-CH2 4.2Å; L234-W280 HydrophobicContact CB-CZ2 3.75Å; L234-W280 HydrophobicContact CD1-CH2 3.85Å; L234-W280 HydrophobicContact CD1-CZ2 4.12Å; L234-W280 HydrophobicContact CD1-CZ3 4.48Å; L234-W280 HydrophobicContact CG-CZ2 4.41Å; L234-W280 PolarHBondContact O-NE1 2.83Å; L234-W280 VanDerWaalsContact O-NE1 3.16Å; R276-W280 WeakPolarHBondContact O-CB 3.46Å; R276-W280 PolarHBondContact O-N 3.34Å; L278-W280 VanDerWaalsContact C-N 3.25Å; L278-W280 PolarHBondContact O-N 3.04Å; W280-R490 HydrophobicContact CH2-CB 4.13Å; W280-R490 HydrophobicContact CZ3-CB 3.95Å; W280-R490 HydrophobicContact CZ3-CG 4.38Å; W280-R490 VanDerWaalsContact O-CD 3.23Å; W280-R490 WeakPolarHBondContact O-CD 3.44Å; W280-R490 WeakPolarHBondContact O-CG 3.1Å; W280-R490 PolarHBondContact O-NE 2.87Å; W280-F492 HydrophobicContact CH2-CE1 4.4Å; W280-F492 HydrophobicContact CH2-CE2 4.35Å; W280-F492 AromaticContact CH2-CZ 3.96Å; W280-F492 HydrophobicContact CH2-CZ 3.96Å; W280-F492 AromaticContact CZ3-CE2 3.98Å; W280-F492 HydrophobicContact CZ3-CE2 3.98Å; W280-F492 AromaticContact CZ3-CZ 3.74Å; W280-F492 HydrophobicContact CZ3-CZ 3.74Å
281	L	88.4	Confident	88.2	Confident	15 Å²	15	27.3 Å²	27.3	8%	0.079	14%	0.135	C	C	.	.	H	α-helix	trans	-68.1	-49	-177.8	178.8	60.4	0	0	0	112	L231 A277 L278 F308 K489 R490	L231-L281 HydrophobicContact CD2-CB 4.5Å; L231-L281 HydrophobicContact CD2-CD1 4.28Å; A277-L281 VanDerWaalsContact O-CB 3.23Å; A277-L281 WeakPolarHBondContact O-CB 3.48Å; A277-L281 PolarHBondContact O-N 3.1Å; L278-L281 PolarHBondContact O-N 3.47Å; L278-L281 VanDerWaalsContact O-N 3.17Å; L281-F308 HydrophobicContact CD2-CZ 3.83Å; L281-K489 HydrophobicContact CD1-CB 4.37Å; L281-K489 HydrophobicContact CD1-CG 4.44Å; L281-K489 WeakPolarHBondContact O-CA 3.29Å; L281-R490 PolarHBondContact O-N 3.17Å
282	Y	85.1	Confident	88.1	Confident	3 Å²	3	27.4 Å²	27.4	1%	0.012	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-102.9	84.9	-176.9	-57.7	-72.7	0	0	0	110.9	L278 D284 V285 G286 C312 I315 E316 L487 K489	L278-Y282 HydrophobicContact CD2-CD2 4.29Å; L278-Y282 HydrophobicContact CD2-CE2 3.88Å; L278-Y282 WeakPolarHBondContact O-CD2 3.11Å; L278-Y282 PolarHBondContact O-N 3.09Å; Y282-D284 VanDerWaalsContact C-N 3.28Å; Y282-D284 PolarHBondContact O-N 3.08Å; Y282-V285 PolarHBondContact O-N 2.74Å; Y282-V285 VanDerWaalsContact O-N 3.1Å; Y282-G286 PolarHBondContact O-N 3.45Å; Y282-C312 WeakPolarHBondContact OH-CA 3.37Å; Y282-C312 VanDerWaalsContact OH-CB 3.27Å; Y282-C312 WeakPolarHBondContact OH-CB 3.47Å; Y282-C312 PolarHBondContact OH-SG 2.73Å; Y282-C312 VanDerWaalsContact OH-SG 3.35Å; Y282-I315 HydrophobicContact CD2-CD1 4.07Å; Y282-I315 HydrophobicContact CE2-CD1 3.96Å; Y282-E316 HydrophobicContact CE1-CG 4.18Å; Y282-E316 VanDerWaalsContact CE1-OE1 3.3Å; Y282-E316 WeakPolarHBondContact CE1-OE1 3.47Å; Y282-E316 VanDerWaalsContact CZ-OE1 3.27Å; Y282-E316 PolarHBondContact OH-OE1 2.9Å; Y282-L487 HydrophobicContact CD1-CB 3.9Å; Y282-L487 HydrophobicContact CD1-CD1 4.05Å; Y282-L487 HydrophobicContact CD1-CD2 4.44Å; Y282-L487 HydrophobicContact CD1-CG 4.37Å; Y282-L487 HydrophobicContact CE1-CB 4.31Å; Y282-L487 HydrophobicContact CE1-CD1 3.94Å; Y282-K489 HydrophobicContact CD1-CG 4.17Å; Y282-K489 HydrophobicContact CE1-CD 4.43Å; Y282-K489 HydrophobicContact CE1-CG 4.06Å
283	V	77.4	Confident	88.1	Confident	77 Å²	77	26.5 Å²	26.5	47%	0.467	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-37.8	-173.6	-178.1	0	0	0	0	112.3	V285 A488 R490	V283-V285 VanDerWaalsContact C-N 3.3Å; V283-V285 PolarHBondContact O-N 2.97Å; V283-A488 PolarHBondContact N-O 3.43Å; V283-R490 HydrophobicContact CG2-CG 3.58Å
284	D	67.8	Low	88.1	Confident	82 Å²	82	22 Å²	22	44%	0.439	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-24.3	-179.3	-57.4	-30.3	0	0	0	113.2	Y282 A488	Y282-D284 VanDerWaalsContact C-N 3.28Å; Y282-D284 PolarHBondContact O-N 3.08Å; D284-A488 WeakPolarHBondContact OD2-CB 3.41Å; D284-A488 PolarHBondContact OD2-N 3.35Å
285	V	80.9	Confident	88.2	Confident	8 Å²	8	22 Å²	22	5%	0.048	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-48.5	175.5	174.2	0	0	0	0	109	Y282 V283 Y287 M291 I315 F324 L487	Y282-V285 PolarHBondContact O-N 2.74Å; Y282-V285 VanDerWaalsContact O-N 3.1Å; V283-V285 VanDerWaalsContact C-N 3.3Å; V283-V285 PolarHBondContact O-N 2.97Å; V285-Y287 PolarHBondContact O-N 3.19Å; V285-M291 HydrophobicContact CG1-CE 4.29Å; V285-M291 HydrophobicContact CG1-SD 4.05Å; V285-I315 HydrophobicContact CG2-CG2 4.46Å; V285-F324 HydrophobicContact CG1-CB 3.71Å; V285-L487 HydrophobicContact CG2-CD2 3.53Å
286	G	82	Confident	88.2	Confident	12 Å²	12	22 Å²	22	12%	0.124	12%	0.117	C	C	.	.			trans	60.9	-125.2	-171.4	0	0	0	0	0	110.3	A279 Y282	A279-G286 VanDerWaalsContact CA-O 3.24Å; A279-G286 WeakPolarHBondContact CA-O 3.3Å; A279-G286 VanDerWaalsContact CB-O 3.32Å; A279-G286 WeakPolarHBondContact CB-O 3.49Å; Y282-G286 PolarHBondContact O-N 3.45Å
287	Y	87.6	Confident	88.3	Confident	7 Å²	7	19.3 Å²	19.3	3%	0.027	11%	0.107	C	C	.	.			trans	-123.8	124.2	172.9	176.9	-105.4	0	0	0	110	Q245 I246 D249 L275 V285 M291	Q245-Y287 HydrophobicContact CB-CD1 3.81Å; Q245-Y287 HydrophobicContact CB-CE1 4.3Å; I246-Y287 HydrophobicContact CD1-CD2 4.11Å; I246-Y287 HydrophobicContact CD1-CG 4.16Å; I246-Y287 HydrophobicContact CG1-CD1 3.89Å; I246-Y287 HydrophobicContact CG1-CD2 3.48Å; I246-Y287 VanDerWaalsContact CG1-CD2 3.48Å; I246-Y287 HydrophobicContact CG1-CE1 4.24Å; I246-Y287 HydrophobicContact CG1-CE2 3.88Å; I246-Y287 HydrophobicContact CG1-CG 3.47Å; I246-Y287 VanDerWaalsContact CG1-CG 3.47Å; D249-Y287 HydrophobicContact CB-CE1 4.01Å; D249-Y287 WeakPolarHBondContact CB-OH 3.47Å; D249-Y287 WeakPolarHBondContact OD2-CE1 3.47Å; D249-Y287 PolarHBondContact OD2-OH 3.47Å; D249-Y287 VanDerWaalsContact OD2-OH 3.05Å; L275-Y287 HydrophobicContact CD1-CE2 3.81Å; L275-Y287 HydrophobicContact CD2-CD2 4.24Å; L275-Y287 HydrophobicContact CD2-CE2 3.84Å; L275-Y287 HydrophobicContact CG-CE2 4.28Å; V285-Y287 PolarHBondContact O-N 3.19Å; Y287-M291 HydrophobicContact CE2-CB 4.22Å
288	C	85.7	Confident	88.5	Confident	8 Å²	8	19.3 Å²	19.3	5%	0.054	11%	0.107	C	C	.	.			trans	-106	131.9	174.1	176.7	0	0	0	0	110.3	G290 M291 F324 L329	C288-G290 PolarHBondContact O-N 2.88Å; C288-G290 VanDerWaalsContact O-N 3.11Å; C288-M291 HydrophobicContact CB-CG 4.04Å; C288-M291 HydrophobicContact CB-SD 3.89Å; C288-M291 PolarHBondContact N-SD 3.23Å; C288-M291 WeakPolarHBondContact O-CB 3.2Å; C288-M291 WeakPolarHBondContact O-CG 3.44Å; C288-M291 PolarHBondContact O-N 3.17Å; C288-F324 HydrophobicContact CB-CB 3.91Å; C288-F324 HydrophobicContact CB-CD1 4.23Å; C288-F324 WeakPolarHBondContact CB-O 3.31Å; C288-L329 VanDerWaalsContact SG-CD2 3.52Å
289	Q	81.8	Confident	88.7	Confident	111 Å²	111	19.2 Å²	19.2	52%	0.519	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	114.9	174.3	178.7	177.7	-28	0	0	109.3	R252 L370	R252-Q289 VanDerWaalsContact NH1-NE2 3.1Å; Q289-L370 WeakPolarHBondContact O-CD2 3.39Å
290	G	85	Confident	88.8	Confident	12 Å²	12	18.9 Å²	18.9	12%	0.124	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	127.1	-34.5	-171.6	0	0	0	0	0	112.4	C288 G292 L293	C288-G290 PolarHBondContact O-N 2.88Å; C288-G290 VanDerWaalsContact O-N 3.11Å; G290-G292 PolarHBondContact O-N 3.49Å; G290-L293 PolarHBondContact O-N 3.17Å; G290-L293 VanDerWaalsContact O-N 3.14Å
291	M	93.3	Very high	88.9	Confident	2 Å²	2	17.7 Å²	17.7	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-59.8	-35.7	176.9	-69.2	177.6	72.9	0	0	112.4	L275 L278 V285 Y287 C288 L293 I294 V295 M311 I315 F324	L275-M291 HydrophobicContact CD2-CB 4.29Å; L278-M291 HydrophobicContact CD1-CE 4.4Å; V285-M291 HydrophobicContact CG1-CE 4.29Å; V285-M291 HydrophobicContact CG1-SD 4.05Å; Y287-M291 HydrophobicContact CE2-CB 4.22Å; C288-M291 HydrophobicContact CB-CG 4.04Å; C288-M291 HydrophobicContact CB-SD 3.89Å; C288-M291 PolarHBondContact N-SD 3.23Å; C288-M291 WeakPolarHBondContact O-CB 3.2Å; C288-M291 WeakPolarHBondContact O-CG 3.44Å; C288-M291 PolarHBondContact O-N 3.17Å; M291-L293 PolarHBondContact O-N 3.07Å; M291-I294 PolarHBondContact O-N 3.44Å; M291-V295 WeakPolarHBondContact O-CG2 3.39Å; M291-V295 PolarHBondContact O-N 3.45Å; M291-M311 HydrophobicContact CB-CE 4.25Å; M291-M311 HydrophobicContact CE-CE 3.59Å; M291-M311 HydrophobicContact CG-CE 3.96Å; M291-I315 HydrophobicContact CE-CD1 3.93Å; M291-F324 HydrophobicContact CG-CB 4.37Å; M291-F324 HydrophobicContact CG-CD1 3.6Å; M291-F324 HydrophobicContact CG-CE1 3.95Å; M291-F324 HydrophobicContact CG-CG 3.95Å; M291-F324 HydrophobicContact SD-CB 4.05Å; M291-F324 HydrophobicContact SD-CD1 4.38Å; M291-F324 HydrophobicContact SD-CG 4.19Å
292	G	94.6	Very high	89.2	Confident	1 Å²	1	17 Å²	17	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-56.3	-38.9	178.4	0	0	0	0	0	112.7	T253 L271 G290 V295 A296	T253-G292 WeakPolarHBondContact CG2-O 3.41Å; L271-G292 WeakPolarHBondContact CD1-O 3.34Å; G290-G292 PolarHBondContact O-N 3.49Å; G292-V295 PolarHBondContact O-N 3Å; G292-A296 VanDerWaalsContact O-CB 3.31Å; G292-A296 WeakPolarHBondContact O-CB 3.45Å; G292-A296 PolarHBondContact O-N 3.3Å
293	L	94.2	Very high	89.6	Confident	31 Å²	31	21.1 Å²	21.1	16%	0.162	12%	0.115	C	C	.	.	H	α-helix	trans	-73.3	-36.6	-178	-166.7	63.5	0	0	0	112.8	T253 M254 G290 M291 A296 N297 S374 S375	T253-L293 HydrophobicContact CG2-CD1 4.13Å; M254-L293 HydrophobicContact CE-CD1 3.96Å; M254-L293 HydrophobicContact CG-CD1 3.67Å; G290-L293 PolarHBondContact O-N 3.17Å; G290-L293 VanDerWaalsContact O-N 3.14Å; M291-L293 PolarHBondContact O-N 3.07Å; L293-A296 PolarHBondContact O-N 3.43Å; L293-N297 WeakPolarHBondContact O-CB 3.38Å; L293-N297 PolarHBondContact O-N 3.39Å; L293-N297 PolarHBondContact O-ND2 3.07Å; L293-S374 VanDerWaalsContact CD2-C 3.48Å; L293-S374 WeakPolarHBondContact CD2-O 3.49Å; L293-S375 VanDerWaalsContact CD2-CB 3.4Å
294	I	96.8	Very high	90.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.3	-49.2	173	-59.5	170.7	0	0	0	109.3	M291 A296 N297 L298 M311 I314 F324 L372 W386	M291-I294 PolarHBondContact O-N 3.44Å; I294-A296 PolarHBondContact O-N 3.04Å; I294-N297 PolarHBondContact O-N 3Å; I294-L298 HydrophobicContact CG2-CD1 4.26Å; I294-L298 WeakPolarHBondContact O-CG 3.44Å; I294-L298 PolarHBondContact O-N 3.01Å; I294-M311 HydrophobicContact CD1-CE 4.46Å; I294-M311 HydrophobicContact CG2-SD 3.93Å; I294-I314 HydrophobicContact CG2-CD1 4.12Å; I294-F324 HydrophobicContact CD1-CE1 3.9Å; I294-F324 HydrophobicContact CD1-CZ 3.6Å; I294-L372 HydrophobicContact CD1-CD1 3.95Å; I294-L372 HydrophobicContact CD1-CG 3.98Å; I294-L372 HydrophobicContact CG2-CD1 4.46Å; I294-W386 HydrophobicContact CB-CH2 4.41Å; I294-W386 HydrophobicContact CB-CZ2 4.47Å; I294-W386 HydrophobicContact CG2-CH2 3.82Å; I294-W386 HydrophobicContact CG2-CZ2 3.98Å; I294-W386 WeakPolarHBondContact O-CH2 3.13Å
295	V	97.5	Very high	91.8	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.7	-40	179.9	176.4	0	0	0	0	111.7	L271 V274 L275 L278 M291 G292 L298 L299 M311	L271-V295 HydrophobicContact CD1-CB 3.66Å; L271-V295 HydrophobicContact CD1-CG1 3.47Å; L271-V295 VanDerWaalsContact CD1-CG1 3.47Å; V274-V295 HydrophobicContact CB-CG1 3.82Å; V274-V295 HydrophobicContact CG1-CG1 3.5Å; V274-V295 HydrophobicContact CG1-CG2 4.16Å; V274-V295 HydrophobicContact CG2-CG1 4.46Å; L275-V295 HydrophobicContact CD2-CB 4.19Å; L275-V295 HydrophobicContact CD2-CG2 3.78Å; L278-V295 HydrophobicContact CD1-CG2 4.11Å; M291-V295 WeakPolarHBondContact O-CG2 3.39Å; M291-V295 PolarHBondContact O-N 3.45Å; G292-V295 PolarHBondContact O-N 3Å; V295-L298 PolarHBondContact O-N 3Å; V295-L299 HydrophobicContact CG1-CD1 3.97Å; V295-L299 HydrophobicContact CG1-CG 4.31Å; V295-L299 WeakPolarHBondContact O-CB 3.29Å; V295-L299 VanDerWaalsContact O-CG 3.28Å; V295-L299 WeakPolarHBondContact O-CG 3.45Å; V295-L299 PolarHBondContact O-N 3.43Å; V295-M311 HydrophobicContact CG2-CG 4.17Å; V295-M311 HydrophobicContact CG2-SD 4.46Å
296	A	96.2	Very high	92.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-61.4	-44.9	176.7	0	0	0	0	0	111.8	T253 M254 F260 L271 G292 L293 I294 L299 L300	T253-A296 HydrophobicContact CG2-CB 3.6Å; M254-A296 HydrophobicContact CE-CB 3.92Å; M254-A296 HydrophobicContact CG-CB 4.32Å; M254-A296 HydrophobicContact SD-CB 3.81Å; F260-A296 HydrophobicContact CE1-CB 4.06Å; F260-A296 HydrophobicContact CE2-CB 4.17Å; F260-A296 HydrophobicContact CZ-CB 3.87Å; L271-A296 HydrophobicContact CD1-CB 4.32Å; L271-A296 HydrophobicContact CD2-CB 4.32Å; G292-A296 VanDerWaalsContact O-CB 3.31Å; G292-A296 WeakPolarHBondContact O-CB 3.45Å; G292-A296 PolarHBondContact O-N 3.3Å; L293-A296 PolarHBondContact O-N 3.43Å; I294-A296 PolarHBondContact O-N 3.04Å; A296-L299 WeakPolarHBondContact O-CB 3.5Å; A296-L299 PolarHBondContact O-N 3.29Å; A296-L300 PolarHBondContact O-N 3.46Å; A296-L300 VanDerWaalsContact O-N 3.15Å
297	N	95.8	Very high	93.2	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-62.2	-43.4	174.6	-87.2	-76	0	0	0	112.5	M254 L293 I294 L299 L300 S374 F383 W386	M254-N297 HydrophobicContact CE-CB 4Å; M254-N297 WeakPolarHBondContact CE-ND2 3.4Å; M254-N297 WeakPolarHBondContact CE-OD1 3.38Å; L293-N297 WeakPolarHBondContact O-CB 3.38Å; L293-N297 PolarHBondContact O-N 3.39Å; L293-N297 PolarHBondContact O-ND2 3.07Å; I294-N297 PolarHBondContact O-N 3Å; N297-L299 VanDerWaalsContact C-N 3.29Å; N297-L299 PolarHBondContact O-N 2.92Å; N297-L300 WeakPolarHBondContact O-CB 3.17Å; N297-L300 PolarHBondContact O-N 3.29Å; N297-S374 WeakPolarHBondContact ND2-CB 3.45Å; N297-F383 HydrophobicContact CB-CE1 4.18Å; N297-W386 HydrophobicContact CB-CH2 3.47Å; N297-W386 VanDerWaalsContact CB-CH2 3.47Å; N297-W386 HydrophobicContact CB-CZ2 4.35Å; N297-W386 HydrophobicContact CB-CZ3 3.84Å
298	L	97	Very high	93.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.6	-41.8	174.2	-72.7	171.2	0	0	0	111.4	W206 I294 V295 L300 C301 L302 A307 M310 I314 W386 F390	W206-L298 HydrophobicContact CE3-CD2 4.28Å; W206-L298 HydrophobicContact CZ3-CD2 4.1Å; I294-L298 HydrophobicContact CG2-CD1 4.26Å; I294-L298 WeakPolarHBondContact O-CG 3.44Å; I294-L298 PolarHBondContact O-N 3.01Å; V295-L298 PolarHBondContact O-N 3Å; L298-L300 PolarHBondContact O-N 3.12Å; L298-C301 PolarHBondContact O-N 3.34Å; L298-C301 PolarHBondContact O-SG 2.91Å; L298-C301 VanDerWaalsContact O-SG 3.33Å; L298-L302 HydrophobicContact CB-CD1 4.3Å; L298-L302 HydrophobicContact CD2-CD1 3.83Å; L298-L302 VanDerWaalsContact O-CB 3.23Å; L298-L302 WeakPolarHBondContact O-CB 3.15Å; L298-L302 WeakPolarHBondContact O-CG 3.25Å; L298-L302 PolarHBondContact O-N 3.43Å; L298-A307 HydrophobicContact CB-CB 4.01Å; L298-M310 HydrophobicContact CD1-CB 4.05Å; L298-M310 HydrophobicContact CD2-CB 4.27Å; L298-M310 HydrophobicContact CD2-CE 4.28Å; L298-I314 HydrophobicContact CD1-CD1 4.18Å; L298-W386 HydrophobicContact CD2-CE3 4.09Å; L298-W386 HydrophobicContact CD2-CH2 4.49Å; L298-W386 HydrophobicContact CD2-CZ3 3.6Å; L298-W386 HydrophobicContact CG-CH2 4.17Å; L298-W386 HydrophobicContact CG-CZ3 3.7Å; L298-F390 HydrophobicContact CD2-CZ 4.46Å
299	L	96.1	Very high	94.2	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.2	-23.2	178.9	-75	171.2	0	0	0	113.4	V64 F260 R270 L271 V295 A296 N297 C301 E304 A307	V64-L299 WeakPolarHBondContact CG1-O 3.38Å; F260-L299 HydrophobicContact CE1-CD1 4.44Å; F260-L299 HydrophobicContact CZ-CB 4.21Å; R270-L299 HydrophobicContact CB-CD1 3.97Å; R270-L299 HydrophobicContact CB-CD2 4.12Å; L271-L299 HydrophobicContact CB-CD1 4.02Å; L271-L299 HydrophobicContact CD1-CD1 4.37Å; V295-L299 HydrophobicContact CG1-CD1 3.97Å; V295-L299 HydrophobicContact CG1-CG 4.31Å; V295-L299 WeakPolarHBondContact O-CB 3.29Å; V295-L299 VanDerWaalsContact O-CG 3.28Å; V295-L299 WeakPolarHBondContact O-CG 3.45Å; V295-L299 PolarHBondContact O-N 3.43Å; A296-L299 WeakPolarHBondContact O-CB 3.5Å; A296-L299 PolarHBondContact O-N 3.29Å; N297-L299 VanDerWaalsContact C-N 3.29Å; N297-L299 PolarHBondContact O-N 2.92Å; L299-C301 PolarHBondContact O-N 3.09Å; L299-E304 HydrophobicContact CD2-CB 4.38Å; L299-E304 HydrophobicContact CD2-CG 4.4Å; L299-A307 HydrophobicContact CD2-CB 3.89Å; L299-A307 HydrophobicContact CG-CB 4.24Å
300	L	92.8	Very high	94.9	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.8	-35.4	174	-66.6	174.3	0	0	0	111.4	L63 V64 L67 F99 M254 F260 A296 N297 L298 T379 F383	L63-L300 CarbonylContact C-O 3.56Å; L63-L300 WeakPolarHBondContact CA-O 3.47Å; L63-L300 HydrophobicContact CD2-CB 4.2Å; L63-L300 HydrophobicContact CD2-CD2 3.51Å; L63-L300 HydrophobicContact CD2-CG 4.44Å; V64-L300 PolarHBondContact N-O 3.01Å; L67-L300 HydrophobicContact CD2-CD2 4.06Å; F99-L300 HydrophobicContact CE2-CD1 4.1Å; F99-L300 HydrophobicContact CZ-CD1 4.33Å; M254-L300 HydrophobicContact CE-CD1 4.08Å; M254-L300 HydrophobicContact SD-CD1 4.29Å; F260-L300 HydrophobicContact CE2-CD2 3.8Å; F260-L300 HydrophobicContact CE2-CG 4.37Å; A296-L300 PolarHBondContact O-N 3.46Å; A296-L300 VanDerWaalsContact O-N 3.15Å; N297-L300 WeakPolarHBondContact O-CB 3.17Å; N297-L300 PolarHBondContact O-N 3.29Å; L298-L300 PolarHBondContact O-N 3.12Å; L300-T379 HydrophobicContact CD1-CG2 4.25Å; L300-F383 HydrophobicContact CB-CZ 4.42Å
301	C	90.5	Very high	95.4	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.014	6%	0.062	C	C	.	.	H	α-helix	trans	-114.4	-15.4	-176.1	51.7	0	0	0	0	114.8	P203 W206 L298 L299	P203-C301 WeakPolarHBondContact CG-O 3.49Å; W206-C301 WeakPolarHBondContact CZ3-SG 3.33Å; L298-C301 PolarHBondContact O-N 3.34Å; L298-C301 PolarHBondContact O-SG 2.91Å; L298-C301 VanDerWaalsContact O-SG 3.33Å; L299-C301 PolarHBondContact O-N 3.09Å
302	L	94.2	Very high	95.5	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	6%	0.061	C	C	.	.	S	Bend	trans	-118.4	151.1	-172.6	-54.6	-178.3	0	0	0	113.3	P203 W206 L298 T306 A307 M310	P203-L302 VanDerWaalsContact CA-CD2 3.5Å; P203-L302 HydrophobicContact CB-CD2 4.1Å; W206-L302 HydrophobicContact CE3-CD1 4.3Å; W206-L302 HydrophobicContact CE3-CD2 4.38Å; W206-L302 HydrophobicContact CE3-CG 4.49Å; L298-L302 HydrophobicContact CB-CD1 4.3Å; L298-L302 HydrophobicContact CD2-CD1 3.83Å; L298-L302 VanDerWaalsContact O-CB 3.23Å; L298-L302 WeakPolarHBondContact O-CB 3.15Å; L298-L302 WeakPolarHBondContact O-CG 3.25Å; L298-L302 PolarHBondContact O-N 3.43Å; L302-T306 HydrophobicContact CD1-CG2 4.29Å; L302-A307 HydrophobicContact CB-CB 4.28Å; L302-M310 HydrophobicContact CD1-CB 4.34Å; L302-M310 HydrophobicContact CD1-CG 3.62Å
303	E	93.9	Very high	95.5	Very high	89 Å²	89	12.4 Å²	12.4	42%	0.416	6%	0.061	S	C	.	.			trans	-65.1	154.6	164.2	-72.1	-57.2	153.1	0	0	112.3	V64 S66 R270 E305 T306 A307	V64-E303 HydrophobicContact CG2-CG 4.4Å; V64-E303 VanDerWaalsContact CG2-OE1 3.28Å; V64-E303 WeakPolarHBondContact CG2-OE1 3.41Å; S66-E303 WeakPolarHBondContact CB-OE1 3.45Å; S66-E303 PolarHBondContact OG-OE1 3.01Å; S66-E303 PolarHBondContact OG-OE2 3.36Å; S66-E303 VanDerWaalsContact OG-OE2 3.08Å; R270-E303 IonicContact CZ-OE2 3.76Å; R270-E303 IonicContact NH1-OE2 3.47Å; R270-E303 VanDerWaalsContact NH2-CA 3.33Å; R270-E303 IonicContact NH2-OE2 3.1Å; R270-E303 PolarHBondContact NH2-OE2 3.48Å; E303-E305 PolarHBondContact O-N 3.34Å; E303-T306 CarbonylContact O-C 3.51Å; E303-T306 WeakPolarHBondContact O-CA 3.27Å; E303-T306 WeakPolarHBondContact O-CB 3.44Å; E303-T306 PolarHBondContact O-N 3.45Å; E303-A307 PolarHBondContact O-N 2.98Å
304	E	95.4	Very high	95.5	Very high	23 Å²	23	11 Å²	11	11%	0.107	5%	0.053	C	C	.	.	H	α-helix	trans	-63.7	-47.1	-163.4	-173.1	-178.8	135.9	0	0	112.3	Y228 R270 R273 V274 L299 T306 A307 F308	Y228-E304 HydrophobicContact CE1-CG 3.95Å; Y228-E304 WeakPolarHBondContact CE1-OE1 3.3Å; Y228-E304 WeakPolarHBondContact OH-CG 3.44Å; Y228-E304 PolarHBondContact OH-OE1 2.82Å; R270-E304 HydrophobicContact CB-CG 4.23Å; R270-E304 VanDerWaalsContact CG-OE2 3.23Å; R270-E304 WeakPolarHBondContact CG-OE2 3.37Å; R270-E304 IonicContact NE-OE2 3.61Å; R273-E304 WeakPolarHBondContact CB-OE1 3.34Å; R273-E304 IonicContact CZ-OE1 3.62Å; R273-E304 IonicContact CZ-OE2 2.66Å; R273-E304 IonicContact NE-OE1 2.98Å; R273-E304 PolarHBondContact NE-OE1 2.75Å; R273-E304 IonicContact NE-OE2 3.61Å; R273-E304 PolarHBondContact NE-OE2 2.78Å; R273-E304 IonicContact NH2-OE1 2.75Å; R273-E304 IonicContact NH2-OE2 3.36Å; R273-E304 PolarHBondContact NH2-OE2 3.31Å; V274-E304 HydrophobicContact CG2-CG 3.6Å; L299-E304 HydrophobicContact CD2-CB 4.38Å; L299-E304 HydrophobicContact CD2-CG 4.4Å; E304-T306 VanDerWaalsContact C-N 3.27Å; E304-T306 PolarHBondContact O-N 3.05Å; E304-A307 PolarHBondContact O-N 3Å; E304-F308 PolarHBondContact O-N 2.95Å
305	E	95.8	Very high	95.3	Very high	60 Å²	60	11.7 Å²	11.7	28%	0.28	6%	0.057	S	C	.	.	H	α-helix	trans	-61.7	-40.2	176.2	177.4	172.6	-178.3	0	0	110.3	K220 Y228 E303 F308 W309	K220-E305 WeakPolarHBondContact CE-OE1 3.26Å; K220-E305 IonicContact NZ-OE1 3.63Å; K220-E305 PolarHBondContact NZ-OE1 3.39Å; Y228-E305 HydrophobicContact CD1-CB 3.84Å; Y228-E305 HydrophobicContact CD1-CG 4.23Å; Y228-E305 HydrophobicContact CG-CB 4.18Å; Y228-E305 HydrophobicContact CG-CG 4.12Å; E303-E305 PolarHBondContact O-N 3.34Å; E305-F308 WeakPolarHBondContact O-CB 3.22Å; E305-F308 PolarHBondContact O-N 3.19Å; E305-W309 PolarHBondContact O-N 3.42Å
306	T	95.4	Very high	94.9	Very high	35 Å²	35	14.2 Å²	14.2	22%	0.215	7%	0.069	C	C	.	.	H	α-helix	trans	-65.3	-43.9	177.6	-51.9	0	0	0	0	111.3	P207 L302 E303 E304 F308 W309 M310	P207-T306 HydrophobicContact CB-CG2 3.97Å; P207-T306 HydrophobicContact CG-CG2 3.35Å; L302-T306 HydrophobicContact CD1-CG2 4.29Å; E303-T306 CarbonylContact O-C 3.51Å; E303-T306 WeakPolarHBondContact O-CA 3.27Å; E303-T306 WeakPolarHBondContact O-CB 3.44Å; E303-T306 PolarHBondContact O-N 3.45Å; E304-T306 VanDerWaalsContact C-N 3.27Å; E304-T306 PolarHBondContact O-N 3.05Å; T306-F308 VanDerWaalsContact C-N 3.3Å; T306-F308 PolarHBondContact O-N 2.87Å; T306-W309 PolarHBondContact O-N 3.24Å; T306-M310 HydrophobicContact CG2-CG 4.47Å; T306-M310 WeakPolarHBondContact O-CB 3.21Å; T306-M310 VanDerWaalsContact O-CG 3.27Å; T306-M310 WeakPolarHBondContact O-CG 3.36Å; T306-M310 PolarHBondContact O-N 3.48Å
307	A	97.3	Very high	94.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60	-39.3	175.3	0	0	0	0	0	111.9	L298 L299 L302 E303 E304 M311	L298-A307 HydrophobicContact CB-CB 4.01Å; L299-A307 HydrophobicContact CD2-CB 3.89Å; L299-A307 HydrophobicContact CG-CB 4.24Å; L302-A307 HydrophobicContact CB-CB 4.28Å; E303-A307 PolarHBondContact O-N 2.98Å; E304-A307 PolarHBondContact O-N 3Å; A307-M311 PolarHBondContact O-N 2.97Å
308	F	97.4	Very high	94.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.5	-50.9	173.2	171.1	-95.4	0	0	0	112	Y228 L231 V274 A277 L278 L281 E304 E305 T306 M310 M311 C312	Y228-F308 HydrophobicContact CD2-CB 3.77Å; Y228-F308 AromaticContact CD2-CD1 3.61Å; Y228-F308 HydrophobicContact CD2-CD1 3.61Å; Y228-F308 AromaticContact CD2-CD2 3.91Å; Y228-F308 HydrophobicContact CD2-CD2 3.91Å; Y228-F308 HydrophobicContact CD2-CE1 4.19Å; Y228-F308 HydrophobicContact CD2-CE2 4.45Å; Y228-F308 AromaticContact CD2-CG 3.46Å; Y228-F308 HydrophobicContact CD2-CG 3.46Å; Y228-F308 VanDerWaalsContact CD2-CG 3.46Å; Y228-F308 HydrophobicContact CE2-CB 3.69Å; Y228-F308 HydrophobicContact CE2-CD1 4.28Å; Y228-F308 AromaticContact CE2-CD2 3.81Å; Y228-F308 HydrophobicContact CE2-CD2 3.81Å; Y228-F308 AromaticContact CE2-CG 3.65Å; Y228-F308 HydrophobicContact CE2-CG 3.65Å; Y228-F308 HydrophobicContact CG-CD1 4.43Å; L231-F308 HydrophobicContact CD1-CE1 3.85Å; L231-F308 HydrophobicContact CD1-CE2 4.48Å; L231-F308 HydrophobicContact CD1-CZ 3.55Å; V274-F308 HydrophobicContact CG1-CB 4.13Å; V274-F308 HydrophobicContact CG1-CD2 4.33Å; V274-F308 HydrophobicContact CG2-CB 4.45Å; A277-F308 HydrophobicContact CB-CD2 4.05Å; A277-F308 HydrophobicContact CB-CE2 3.75Å; L278-F308 HydrophobicContact CD2-CD2 3.92Å; L278-F308 HydrophobicContact CD2-CE2 3.72Å; L278-F308 HydrophobicContact CG-CD2 3.91Å; L278-F308 HydrophobicContact CG-CE2 3.89Å; L281-F308 HydrophobicContact CD2-CZ 3.83Å; E304-F308 PolarHBondContact O-N 2.95Å; E305-F308 WeakPolarHBondContact O-CB 3.22Å; E305-F308 PolarHBondContact O-N 3.19Å; T306-F308 VanDerWaalsContact C-N 3.3Å; T306-F308 PolarHBondContact O-N 2.87Å; F308-M310 VanDerWaalsContact C-N 3.33Å; F308-M310 PolarHBondContact O-N 2.99Å; F308-M311 PolarHBondContact O-N 3.39Å; F308-C312 VanDerWaalsContact CZ-SG 3.59Å; F308-C312 PolarHBondContact O-N 3.46Å; F308-C312 PolarHBondContact O-SG 2.71Å
309	W	96.2	Very high	94.2	Very high	19 Å²	19	20 Å²	20	7%	0.072	10%	0.099	C	C	.	.	H	α-helix	trans	-68.5	-31	-179.8	-69.9	115.7	0	0	0	113.5	A212 K215 A216 S219 E305 T306 C312 S313	A212-W309 HydrophobicContact CB-CB 3.96Å; K215-W309 HydrophobicContact CB-CE3 4.05Å; K215-W309 HydrophobicContact CB-CZ3 4.42Å; A216-W309 VanDerWaalsContact CB-CD1 3.47Å; A216-W309 HydrophobicContact CB-CD2 3.86Å; A216-W309 HydrophobicContact CB-CG 3.76Å; A216-W309 HydrophobicContact CB-CZ2 4.44Å; S219-W309 WeakPolarHBondContact OG-CH2 2.89Å; E305-W309 PolarHBondContact O-N 3.42Å; T306-W309 PolarHBondContact O-N 3.24Å; W309-C312 HydrophobicContact CE3-CB 4.25Å; W309-C312 WeakPolarHBondContact O-CB 3.44Å; W309-C312 PolarHBondContact O-N 2.64Å; W309-S313 PolarHBondContact O-N 3.39Å; W309-S313 PolarHBondContact O-OG 2.95Å
310	M	97	Very high	93.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.4	-47.8	169.3	-78.2	-67.6	-63.2	0	0	110.6	W206 P207 T210 A212 L298 L302 T306 F308 C312 S313 I314 F390	W206-M310 HydrophobicContact CB-CE 3.8Å; W206-M310 HydrophobicContact CB-SD 4.26Å; P207-M310 HydrophobicContact CB-SD 4.29Å; P207-M310 HydrophobicContact CG-SD 4.22Å; T210-M310 HydrophobicContact CG2-CE 3.65Å; T210-M310 HydrophobicContact CG2-SD 3.94Å; T210-M310 PolarHBondContact OG1-SD 3.28Å; A212-M310 HydrophobicContact CB-CG 4.18Å; A212-M310 HydrophobicContact CB-SD 3.88Å; L298-M310 HydrophobicContact CD1-CB 4.05Å; L298-M310 HydrophobicContact CD2-CB 4.27Å; L298-M310 HydrophobicContact CD2-CE 4.28Å; L302-M310 HydrophobicContact CD1-CB 4.34Å; L302-M310 HydrophobicContact CD1-CG 3.62Å; T306-M310 HydrophobicContact CG2-CG 4.47Å; T306-M310 WeakPolarHBondContact O-CB 3.21Å; T306-M310 VanDerWaalsContact O-CG 3.27Å; T306-M310 WeakPolarHBondContact O-CG 3.36Å; T306-M310 PolarHBondContact O-N 3.48Å; F308-M310 VanDerWaalsContact C-N 3.33Å; F308-M310 PolarHBondContact O-N 2.99Å; M310-C312 VanDerWaalsContact C-N 3.34Å; M310-C312 PolarHBondContact O-N 2.99Å; M310-S313 CarbonylContact O-C 3.53Å; M310-S313 WeakPolarHBondContact O-CA 3.47Å; M310-S313 WeakPolarHBondContact O-CB 3.4Å; M310-S313 PolarHBondContact O-N 2.93Å; M310-I314 WeakPolarHBondContact O-CG1 3.41Å; M310-I314 PolarHBondContact O-N 3.45Å; M310-F390 HydrophobicContact CE-CD1 4.28Å; M310-F390 HydrophobicContact CE-CD2 3.86Å; M310-F390 HydrophobicContact CE-CE1 3.9Å; M310-F390 HydrophobicContact CE-CE2 3.43Å; M310-F390 VanDerWaalsContact CE-CE2 3.43Å; M310-F390 HydrophobicContact CE-CG 4.27Å; M310-F390 HydrophobicContact CE-CZ 3.46Å; M310-F390 VanDerWaalsContact CE-CZ 3.46Å
311	M	96.6	Very high	92.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.4	-37.8	177.5	-167.7	59.7	-176.8	0	0	112.3	L278 M291 I294 V295 A307 F308 S313 I314 I315 F324	L278-M311 HydrophobicContact CD1-CB 3.89Å; L278-M311 HydrophobicContact CD1-CG 3.43Å; L278-M311 VanDerWaalsContact CD1-CG 3.43Å; L278-M311 HydrophobicContact CD2-CB 4.12Å; L278-M311 HydrophobicContact CD2-CG 4.01Å; L278-M311 HydrophobicContact CG-CG 4.38Å; M291-M311 HydrophobicContact CB-CE 4.25Å; M291-M311 HydrophobicContact CE-CE 3.59Å; M291-M311 HydrophobicContact CG-CE 3.96Å; I294-M311 HydrophobicContact CD1-CE 4.46Å; I294-M311 HydrophobicContact CG2-SD 3.93Å; V295-M311 HydrophobicContact CG2-CG 4.17Å; V295-M311 HydrophobicContact CG2-SD 4.46Å; A307-M311 PolarHBondContact O-N 2.97Å; F308-M311 PolarHBondContact O-N 3.39Å; M311-S313 PolarHBondContact O-N 2.81Å; M311-I314 PolarHBondContact O-N 3.19Å; M311-I314 HydrophobicContact SD-CB 4.23Å; M311-I314 HydrophobicContact SD-CD1 4.17Å; M311-I314 HydrophobicContact SD-CG2 4.27Å; M311-I315 HydrophobicContact CE-CD1 3.99Å; M311-I315 HydrophobicContact CE-CG1 3.96Å; M311-I315 HydrophobicContact CG-CD1 3.96Å; M311-I315 HydrophobicContact CG-CG1 4.42Å; M311-I315 VanDerWaalsContact O-CG1 3.26Å; M311-I315 WeakPolarHBondContact O-CG1 3.29Å; M311-I315 PolarHBondContact O-N 3Å; M311-F324 HydrophobicContact CE-CD2 4.31Å; M311-F324 HydrophobicContact CE-CE2 3.78Å; M311-F324 HydrophobicContact CE-CZ 3.99Å
312	C	94.6	Very high	92.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-56.9	-39	170.4	-66.4	0	0	0	0	112.1	Y282 F308 W309 M310 E316	Y282-C312 WeakPolarHBondContact OH-CA 3.37Å; Y282-C312 VanDerWaalsContact OH-CB 3.27Å; Y282-C312 WeakPolarHBondContact OH-CB 3.47Å; Y282-C312 PolarHBondContact OH-SG 2.73Å; Y282-C312 VanDerWaalsContact OH-SG 3.35Å; F308-C312 VanDerWaalsContact CZ-SG 3.59Å; F308-C312 PolarHBondContact O-N 3.46Å; F308-C312 PolarHBondContact O-SG 2.71Å; W309-C312 HydrophobicContact CE3-CB 4.25Å; W309-C312 WeakPolarHBondContact O-CB 3.44Å; W309-C312 PolarHBondContact O-N 2.64Å; M310-C312 VanDerWaalsContact C-N 3.34Å; M310-C312 PolarHBondContact O-N 2.99Å; C312-E316 VanDerWaalsContact O-CB 3.24Å; C312-E316 WeakPolarHBondContact O-CB 3.34Å; C312-E316 VanDerWaalsContact O-CG 3.26Å; C312-E316 WeakPolarHBondContact O-CG 3.34Å; C312-E316 PolarHBondContact O-N 3.39Å
313	S	94.4	Very high	92	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-73.6	-37.5	178.1	-48.4	0	0	0	0	112.2	K215 W309 M310 M311 D317 L318	K215-S313 WeakPolarHBondContact CE-OG 3.42Å; W309-S313 PolarHBondContact O-N 3.39Å; W309-S313 PolarHBondContact O-OG 2.95Å; M310-S313 CarbonylContact O-C 3.53Å; M310-S313 WeakPolarHBondContact O-CA 3.47Å; M310-S313 WeakPolarHBondContact O-CB 3.4Å; M310-S313 PolarHBondContact O-N 2.93Å; M311-S313 PolarHBondContact O-N 2.81Å; S313-D317 WeakPolarHBondContact O-CB 3.43Å; S313-D317 PolarHBondContact O-N 2.75Å; S313-L318 PolarHBondContact O-N 2.93Å
314	I	95.3	Very high	91.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	I	π-helix	trans	-59.3	-47	172.7	-68.9	167	0	0	0	111	I294 L298 M310 M311 L318 L319 F324 L372 F390	I294-I314 HydrophobicContact CG2-CD1 4.12Å; L298-I314 HydrophobicContact CD1-CD1 4.18Å; M310-I314 WeakPolarHBondContact O-CG1 3.41Å; M310-I314 PolarHBondContact O-N 3.45Å; M311-I314 PolarHBondContact O-N 3.19Å; M311-I314 HydrophobicContact SD-CB 4.23Å; M311-I314 HydrophobicContact SD-CD1 4.17Å; M311-I314 HydrophobicContact SD-CG2 4.27Å; I314-L318 HydrophobicContact CG1-CD1 3.99Å; I314-L319 HydrophobicContact CG2-CD1 3.63Å; I314-L319 HydrophobicContact CG2-CG 4.13Å; I314-L319 PolarHBondContact O-N 3.4Å; I314-F324 HydrophobicContact CG2-CE2 4.36Å; I314-L372 HydrophobicContact CG2-CD1 3.91Å; I314-F390 HydrophobicContact CD1-CE1 4.06Å; I314-F390 HydrophobicContact CD1-CZ 4.33Å; I314-F390 HydrophobicContact CG1-CE1 4.02Å
315	I	91.9	Very high	90.7	Very high	15 Å²	15	20.5 Å²	20.5	8%	0.077	11%	0.112	C	C	.	.	I	π-helix	trans	-70.5	-39.5	-178	-65.5	167.9	0	0	0	112	L278 Y282 V285 M291 M311 F324 L487	L278-I315 HydrophobicContact CD2-CD1 4.2Å; Y282-I315 HydrophobicContact CD2-CD1 4.07Å; Y282-I315 HydrophobicContact CE2-CD1 3.96Å; V285-I315 HydrophobicContact CG2-CG2 4.46Å; M291-I315 HydrophobicContact CE-CD1 3.93Å; M311-I315 HydrophobicContact CE-CD1 3.99Å; M311-I315 HydrophobicContact CE-CG1 3.96Å; M311-I315 HydrophobicContact CG-CD1 3.96Å; M311-I315 HydrophobicContact CG-CG1 4.42Å; M311-I315 VanDerWaalsContact O-CG1 3.26Å; M311-I315 WeakPolarHBondContact O-CG1 3.29Å; M311-I315 PolarHBondContact O-N 3Å; I315-F324 HydrophobicContact CG1-CD2 4.02Å; I315-F324 HydrophobicContact CG1-CE2 4.17Å; I315-L487 HydrophobicContact CG2-CD1 3.63Å; I315-L487 HydrophobicContact CG2-CD2 4.34Å
316	E	88.6	Confident	89.1	Confident	54 Å²	54	21.4 Å²	21.4	25%	0.252	13%	0.125	S	C	.	.	I	π-helix	trans	-91.2	-37.3	-172	-71.6	172.8	-162.9	0	0	114.7	K215 Y282 C312 L487 K489	K215-E316 IonicContact NZ-OE2 3.54Å; K215-E316 PolarHBondContact NZ-OE2 3.47Å; Y282-E316 HydrophobicContact CE1-CG 4.18Å; Y282-E316 VanDerWaalsContact CE1-OE1 3.3Å; Y282-E316 WeakPolarHBondContact CE1-OE1 3.47Å; Y282-E316 VanDerWaalsContact CZ-OE1 3.27Å; Y282-E316 PolarHBondContact OH-OE1 2.9Å; C312-E316 VanDerWaalsContact O-CB 3.24Å; C312-E316 WeakPolarHBondContact O-CB 3.34Å; C312-E316 VanDerWaalsContact O-CG 3.26Å; C312-E316 WeakPolarHBondContact O-CG 3.34Å; C312-E316 PolarHBondContact O-N 3.39Å; E316-L487 HydrophobicContact CG-CD1 3.8Å; E316-K489 WeakPolarHBondContact OE1-CE 3.37Å; E316-K489 IonicContact OE1-NZ 3.41Å; E316-K489 PolarHBondContact OE1-NZ 3.41Å; E316-K489 IonicContact OE2-NZ 3.55Å; E316-K489 PolarHBondContact OE2-NZ 2.91Å; E316-K489 VanDerWaalsContact OE2-NZ 3.07Å
317	D	90.7	Very high	87.6	Confident	83 Å²	83	26.5 Å²	26.5	44%	0.444	15%	0.151	S	C	.	.	I	π-helix	trans	-116.6	-30.2	-163.4	-50.7	-31.4	0	0	0	113.1	K215 S313	K215-D317 WeakPolarHBondContact CE-OD2 3.37Å; K215-D317 IonicContact NZ-OD1 2.77Å; K215-D317 PolarHBondContact NZ-OD1 3.46Å; K215-D317 IonicContact NZ-OD2 3.83Å; K215-D317 PolarHBondContact NZ-OD2 3.34Å; S313-D317 WeakPolarHBondContact O-CB 3.43Å; S313-D317 PolarHBondContact O-N 2.75Å
318	L	92.3	Very high	86.4	Confident	26 Å²	26	27.3 Å²	27.3	14%	0.136	16%	0.156	C	C	.	.	I	π-helix	trans	-96.3	-44	-172.5	-63.2	177	0	0	0	113.6	T210 S313 I314 L389 F390 S394	T210-L318 HydrophobicContact CG2-CD1 4.18Å; S313-L318 PolarHBondContact O-N 2.93Å; I314-L318 HydrophobicContact CG1-CD1 3.99Å; L318-L389 HydrophobicContact CD1-CG 4.47Å; L318-F390 HydrophobicContact CD1-CD1 3.59Å; L318-F390 HydrophobicContact CD1-CE1 3.98Å; L318-S394 WeakPolarHBondContact O-CB 3.31Å; L318-S394 PolarHBondContact O-OG 3.48Å
319	L	91.5	Very high	85.8	Confident	12 Å²	12	29.2 Å²	29.2	6%	0.063	17%	0.166	C	C	.	.	S	Bend	trans	-99	153.4	-173.9	-60.2	177.1	0	0	0	112.4	I314 Y323 F324 L372 L397	I314-L319 HydrophobicContact CG2-CD1 3.63Å; I314-L319 HydrophobicContact CG2-CG 4.13Å; I314-L319 PolarHBondContact O-N 3.4Å; L319-Y323 HydrophobicContact CB-CD2 4.22Å; L319-Y323 HydrophobicContact CB-CG 4.12Å; L319-Y323 HydrophobicContact CD1-CD1 3.76Å; L319-Y323 HydrophobicContact CD1-CE1 4.05Å; L319-Y323 HydrophobicContact CD1-CG 4.13Å; L319-Y323 HydrophobicContact CD2-CE1 4.4Å; L319-Y323 HydrophobicContact CD2-CE2 4.5Å; L319-F324 HydrophobicContact CD1-CE2 3.56Å; L319-F324 HydrophobicContact CD1-CZ 3.79Å; L319-L372 HydrophobicContact CD1-CD1 4.44Å; L319-L372 HydrophobicContact CD1-CD2 4.05Å; L319-L372 HydrophobicContact CD2-CD2 3.79Å; L319-L397 HydrophobicContact CD2-CD1 4.04Å
320	P	84.1	Confident	85.3	Confident	21 Å²	21	28.9 Å²	28.9	14%	0.136	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-55.2	154.4	171.7	-24.7	33	0	0	0	112.9	Y323	P320-Y323 HydrophobicContact CB-CD2 4.3Å; P320-Y323 HydrophobicContact CG-CD2 4.14Å; P320-Y323 HydrophobicContact CG-CE2 4.26Å; P320-Y323 WeakPolarHBondContact O-CB 3.41Å; P320-Y323 PolarHBondContact O-N 3.36Å
321	P	76	Confident	84.8	Confident	58 Å²	58	29 Å²	29	38%	0.377	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	153.8	170.7	-23.2	33.7	0	0	0	112.3	Y323 G331	P321-Y323 PolarHBondContact O-N 3.3Å; P321-Y323 VanDerWaalsContact O-N 3.1Å; P321-G331 WeakPolarHBondContact O-CA 3.44Å
322	S	78.9	Confident	84.6	Confident	19 Å²	19	29 Å²	29	13%	0.133	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	16.1	178.5	-54.1	0	0	0	0	115.6	F324 S325 L329 G331 Q485	S322-F324 PolarHBondContact O-N 3.04Å; S322-S325 PolarHBondContact O-N 3.26Å; S322-L329 CarbonylContact O-C 3.6Å; S322-G331 PolarHBondContact O-N 2.84Å; S322-Q485 PolarHBondContact OG-OE1 3.41Å
323	Y	88	Confident	84.4	Confident	5 Å²	5	32.1 Å²	32.1	2%	0.02	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-44.8	176.6	-144.9	-96.9	0	0	0	112.9	L319 P320 P321 L329 G331 V332 D335 F369	L319-Y323 HydrophobicContact CB-CD2 4.22Å; L319-Y323 HydrophobicContact CB-CG 4.12Å; L319-Y323 HydrophobicContact CD1-CD1 3.76Å; L319-Y323 HydrophobicContact CD1-CE1 4.05Å; L319-Y323 HydrophobicContact CD1-CG 4.13Å; L319-Y323 HydrophobicContact CD2-CE1 4.4Å; L319-Y323 HydrophobicContact CD2-CE2 4.5Å; P320-Y323 HydrophobicContact CB-CD2 4.3Å; P320-Y323 HydrophobicContact CG-CD2 4.14Å; P320-Y323 HydrophobicContact CG-CE2 4.26Å; P320-Y323 WeakPolarHBondContact O-CB 3.41Å; P320-Y323 PolarHBondContact O-N 3.36Å; P321-Y323 PolarHBondContact O-N 3.3Å; P321-Y323 VanDerWaalsContact O-N 3.1Å; Y323-L329 WeakPolarHBondContact O-CD2 3.25Å; Y323-G331 VanDerWaalsContact CD2-C 3.44Å; Y323-V332 HydrophobicContact CD1-CB 4.05Å; Y323-V332 HydrophobicContact CD2-CB 4.18Å; Y323-V332 HydrophobicContact CE1-CB 3.86Å; Y323-V332 HydrophobicContact CE1-CG2 4.05Å; Y323-V332 HydrophobicContact CE2-CB 3.98Å; Y323-V332 HydrophobicContact CE2-CG2 4.49Å; Y323-V332 HydrophobicContact CG-CB 4.24Å; Y323-D335 HydrophobicContact CE2-CB 4.36Å; Y323-D335 VanDerWaalsContact CE2-OD2 3.28Å; Y323-D335 WeakPolarHBondContact CE2-OD2 3.38Å; Y323-D335 PolarHBondContact OH-OD2 3.32Å; Y323-F369 WeakPolarHBondContact CE1-O 3.3Å; Y323-F369 WeakPolarHBondContact OH-CB 3.44Å
324	F	85.9	Confident	84.3	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.018	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	19.1	178.4	-61.3	-65	0	0	0	112.4	V285 C288 M291 I294 M311 I314 I315 L319 S322 S326 L370	V285-F324 HydrophobicContact CG1-CB 3.71Å; C288-F324 HydrophobicContact CB-CB 3.91Å; C288-F324 HydrophobicContact CB-CD1 4.23Å; C288-F324 WeakPolarHBondContact CB-O 3.31Å; M291-F324 HydrophobicContact CG-CB 4.37Å; M291-F324 HydrophobicContact CG-CD1 3.6Å; M291-F324 HydrophobicContact CG-CE1 3.95Å; M291-F324 HydrophobicContact CG-CG 3.95Å; M291-F324 HydrophobicContact SD-CB 4.05Å; M291-F324 HydrophobicContact SD-CD1 4.38Å; M291-F324 HydrophobicContact SD-CG 4.19Å; I294-F324 HydrophobicContact CD1-CE1 3.9Å; I294-F324 HydrophobicContact CD1-CZ 3.6Å; M311-F324 HydrophobicContact CE-CD2 4.31Å; M311-F324 HydrophobicContact CE-CE2 3.78Å; M311-F324 HydrophobicContact CE-CZ 3.99Å; I314-F324 HydrophobicContact CG2-CE2 4.36Å; I315-F324 HydrophobicContact CG1-CD2 4.02Å; I315-F324 HydrophobicContact CG1-CE2 4.17Å; L319-F324 HydrophobicContact CD1-CE2 3.56Å; L319-F324 HydrophobicContact CD1-CZ 3.79Å; S322-F324 PolarHBondContact O-N 3.04Å; F324-S326 PolarHBondContact O-N 3.05Å; F324-S326 VanDerWaalsContact O-N 3.14Å; F324-L370 HydrophobicContact CD1-CD1 3.94Å; F324-L370 HydrophobicContact CE1-CD1 4.1Å; F324-L370 VanDerWaalsContact CE1-O 3.31Å; F324-L370 WeakPolarHBondContact CE1-O 3.31Å
325	S	77.2	Confident	84.3	Confident	20 Å²	20	32.2 Å²	32.2	14%	0.14	18%	0.182	C	C	.	.			trans	-63.9	119.8	178.5	-177	0	0	0	0	109.7	S322 L327 S328 L329	S322-S325 PolarHBondContact O-N 3.26Å; S325-L327 PolarHBondContact O-N 2.92Å; S325-S328 PolarHBondContact O-N 3.11Å; S325-L329 VanDerWaalsContact O-CD2 3.22Å; S325-L329 WeakPolarHBondContact O-CD2 3.45Å; S325-L329 WeakPolarHBondContact O-CG 3.37Å; S325-L329 PolarHBondContact O-N 3.2Å
326	S	61.9	Low	84.5	Confident	78 Å²	78	32 Å²	32	55%	0.545	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.2	-176.1	56.1	0	0	0	0	115.1	F324	F324-S326 PolarHBondContact O-N 3.05Å; F324-S326 VanDerWaalsContact O-N 3.14Å
327	L	63.9	Low	84.8	Confident	143 Å²	143	31.6 Å²	31.6	75%	0.749	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-49.7	-179.4	-173.2	63.1	0	0	0	112.5	S325	S325-L327 PolarHBondContact O-N 2.92Å
328	S	71.5	Confident	85.1	Confident	16 Å²	16	27.7 Å²	27.7	11%	0.112	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-24.2	-162.9	67.2	0	0	0	0	115	S325 L330 Q333 E470	S325-S328 PolarHBondContact O-N 3.11Å; S328-L330 PolarHBondContact O-N 3.39Å; S328-L330 WeakPolarHBondContact OG-CG 3.44Å; S328-Q333 PolarHBondContact O-NE2 3.49Å; S328-E470 WeakPolarHBondContact CB-OE1 3.22Å; S328-E470 WeakPolarHBondContact CB-OE2 3.4Å
329	L	84.9	Confident	85.4	Confident	41 Å²	41	26.4 Å²	26.4	22%	0.215	15%	0.152	C	C	.	.			trans	48.8	25.7	-178.2	-62.1	177.1	0	0	0	114.2	C288 S322 Y323 S325 G331 V332 Q333 L370	C288-L329 VanDerWaalsContact SG-CD2 3.52Å; S322-L329 CarbonylContact O-C 3.6Å; Y323-L329 WeakPolarHBondContact O-CD2 3.25Å; S325-L329 VanDerWaalsContact O-CD2 3.22Å; S325-L329 WeakPolarHBondContact O-CD2 3.45Å; S325-L329 WeakPolarHBondContact O-CG 3.37Å; S325-L329 PolarHBondContact O-N 3.2Å; L329-G331 PolarHBondContact O-N 2.98Å; L329-G331 VanDerWaalsContact O-N 3.12Å; L329-V332 HydrophobicContact CB-CG1 3.73Å; L329-V332 HydrophobicContact CD2-CG1 4.5Å; L329-V332 WeakPolarHBondContact O-CG1 3.44Å; L329-V332 PolarHBondContact O-N 2.98Å; L329-V332 VanDerWaalsContact O-N 3.1Å; L329-Q333 PolarHBondContact O-N 3.43Å; L329-L370 HydrophobicContact CD2-CD1 4.24Å
330	L	85.7	Confident	85.6	Confident	12 Å²	12	28.2 Å²	28.2	6%	0.063	16%	0.162	C	C	.	.	H	α-helix	trans	-59.6	-32	-170.6	-68.4	175.9	0	0	0	113.1	S328 S334 L463 L466 M467 E470	S328-L330 PolarHBondContact O-N 3.39Å; S328-L330 WeakPolarHBondContact OG-CG 3.44Å; L330-S334 VanDerWaalsContact O-CB 3.25Å; L330-S334 WeakPolarHBondContact O-CB 3.41Å; L330-S334 PolarHBondContact O-N 2.99Å; L330-L463 HydrophobicContact CB-CD1 3.54Å; L330-L463 HydrophobicContact CD1-CD1 4.25Å; L330-L463 HydrophobicContact CG-CD1 4.44Å; L330-L466 HydrophobicContact CD2-CB 3.73Å; L330-L466 HydrophobicContact CD2-CD1 4.4Å; L330-M467 HydrophobicContact CD1-CG 3.94Å; L330-E470 HydrophobicContact CD2-CG 4.34Å
331	G	87.7	Confident	86.2	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-44	178.7	0	0	0	0	0	112.4	P321 S322 Y323 L329 D335	P321-G331 WeakPolarHBondContact O-CA 3.44Å; S322-G331 PolarHBondContact O-N 2.84Å; Y323-G331 VanDerWaalsContact CD2-C 3.44Å; L329-G331 PolarHBondContact O-N 2.98Å; L329-G331 VanDerWaalsContact O-N 3.12Å; G331-D335 PolarHBondContact O-N 3.15Å
332	V	91.7	Very high	87.2	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-76	-38.8	178.3	60.7	0	0	0	0	111.4	Y323 L329 S334 D335 Q336 L366 F369 L370	Y323-V332 HydrophobicContact CD1-CB 4.05Å; Y323-V332 HydrophobicContact CD2-CB 4.18Å; Y323-V332 HydrophobicContact CE1-CB 3.86Å; Y323-V332 HydrophobicContact CE1-CG2 4.05Å; Y323-V332 HydrophobicContact CE2-CB 3.98Å; Y323-V332 HydrophobicContact CE2-CG2 4.49Å; Y323-V332 HydrophobicContact CG-CB 4.24Å; L329-V332 HydrophobicContact CB-CG1 3.73Å; L329-V332 HydrophobicContact CD2-CG1 4.5Å; L329-V332 WeakPolarHBondContact O-CG1 3.44Å; L329-V332 PolarHBondContact O-N 2.98Å; L329-V332 VanDerWaalsContact O-N 3.1Å; V332-S334 VanDerWaalsContact C-N 3.28Å; V332-S334 PolarHBondContact O-N 3.4Å; V332-D335 WeakPolarHBondContact O-CB 3.4Å; V332-D335 PolarHBondContact O-N 3.26Å; V332-D335 VanDerWaalsContact O-N 3.09Å; V332-Q336 WeakPolarHBondContact O-CG 3.24Å; V332-Q336 PolarHBondContact O-N 2.89Å; V332-L366 HydrophobicContact CG1-CD1 3.94Å; V332-L366 HydrophobicContact CG2-CD1 3.9Å; V332-F369 HydrophobicContact CG2-CB 3.61Å; V332-L370 HydrophobicContact CG1-CD1 4.28Å; V332-L370 HydrophobicContact CG2-CB 4.24Å
333	Q	90.8	Very high	88	Confident	66 Å²	66	26.7 Å²	26.7	31%	0.308	15%	0.146	S	C	.	.	H	α-helix	trans	-60.1	-39.9	175	-68.6	-168.4	67.8	0	0	111.6	S328 L329 Q336 L337 L466	S328-Q333 PolarHBondContact O-NE2 3.49Å; L329-Q333 PolarHBondContact O-N 3.43Å; Q333-Q336 WeakPolarHBondContact O-CB 3.41Å; Q333-Q336 PolarHBondContact O-N 3.49Å; Q333-Q336 VanDerWaalsContact O-N 3.17Å; Q333-L337 PolarHBondContact O-N 3.16Å; Q333-L337 VanDerWaalsContact O-N 3.08Å; Q333-L466 HydrophobicContact CB-CD1 3.61Å
334	S	91.9	Very high	88.3	Confident	3 Å²	3	28.7 Å²	28.7	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-58.7	-46.6	172.7	179	0	0	0	0	111.2	L330 V332 Q336 L337 V338 R459	L330-S334 VanDerWaalsContact O-CB 3.25Å; L330-S334 WeakPolarHBondContact O-CB 3.41Å; L330-S334 PolarHBondContact O-N 2.99Å; V332-S334 VanDerWaalsContact C-N 3.28Å; V332-S334 PolarHBondContact O-N 3.4Å; S334-Q336 VanDerWaalsContact C-N 3.29Å; S334-Q336 PolarHBondContact O-N 2.79Å; S334-L337 PolarHBondContact O-N 3.38Å; S334-L337 VanDerWaalsContact O-N 3.12Å; S334-V338 VanDerWaalsContact O-CG2 3.26Å; S334-V338 WeakPolarHBondContact O-CG2 3.3Å; S334-V338 PolarHBondContact O-N 3.33Å; S334-R459 WeakPolarHBondContact OG-CA 3.47Å; S334-R459 PolarHBondContact OG-O 3.5Å
335	D	95.9	Very high	88.8	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.3	-37.3	174.8	-82.3	9.2	0	0	0	112.4	Y323 G331 V332 L337 V338 L339 F369 F398 R459	Y323-D335 HydrophobicContact CE2-CB 4.36Å; Y323-D335 VanDerWaalsContact CE2-OD2 3.28Å; Y323-D335 WeakPolarHBondContact CE2-OD2 3.38Å; Y323-D335 PolarHBondContact OH-OD2 3.32Å; G331-D335 PolarHBondContact O-N 3.15Å; V332-D335 WeakPolarHBondContact O-CB 3.4Å; V332-D335 PolarHBondContact O-N 3.26Å; V332-D335 VanDerWaalsContact O-N 3.09Å; D335-L337 PolarHBondContact O-N 3.31Å; D335-V338 PolarHBondContact O-N 2.79Å; D335-L339 PolarHBondContact O-N 2.97Å; D335-F369 HydrophobicContact CB-CD1 4.21Å; D335-F369 HydrophobicContact CB-CE1 4.41Å; D335-F369 HydrophobicContact CB-CG 4.42Å; D335-F398 HydrophobicContact CB-CE1 4.17Å; D335-F398 HydrophobicContact CB-CZ 3.92Å; D335-F398 VanDerWaalsContact O-CE1 3.32Å; D335-F398 WeakPolarHBondContact O-CE1 3.45Å; D335-R459 IonicContact OD1-CZ 3.61Å; D335-R459 IonicContact OD1-NE 2.81Å; D335-R459 PolarHBondContact OD1-NE 2.89Å; D335-R459 IonicContact OD1-NH2 3.07Å; D335-R459 PolarHBondContact OD1-NH2 3.08Å; D335-R459 IonicContact OD2-CZ 2.77Å; D335-R459 IonicContact OD2-NE 2.84Å; D335-R459 IonicContact OD2-NH2 3.5Å; D335-R459 PolarHBondContact OD2-NH2 3.32Å
336	Q	95.6	Very high	89.7	Confident	11 Å²	11	33.7 Å²	33.7	5%	0.051	18%	0.178	C	C	.	.	H	α-helix	trans	-64.9	-39.3	175.7	-60.7	-172.4	-82.8	0	0	112.7	V332 Q333 S334 L339 N340 P362 T365 F369	V332-Q336 WeakPolarHBondContact O-CG 3.24Å; V332-Q336 PolarHBondContact O-N 2.89Å; Q333-Q336 WeakPolarHBondContact O-CB 3.41Å; Q333-Q336 PolarHBondContact O-N 3.49Å; Q333-Q336 VanDerWaalsContact O-N 3.17Å; S334-Q336 VanDerWaalsContact C-N 3.29Å; S334-Q336 PolarHBondContact O-N 2.79Å; Q336-L339 PolarHBondContact O-N 3.4Å; Q336-N340 PolarHBondContact O-N 3.22Å; Q336-P362 HydrophobicContact CB-CB 4.27Å; Q336-P362 HydrophobicContact CB-CG 4.41Å; Q336-P362 VanDerWaalsContact NE2-C 3.31Å; Q336-P362 PolarHBondContact NE2-O 2.66Å; Q336-T365 PolarHBondContact NE2-OG1 3.42Å; Q336-T365 VanDerWaalsContact NE2-OG1 3.1Å; Q336-F369 HydrophobicContact CG-CD2 4.2Å
337	L	95.4	Very high	91.3	Very high	45 Å²	45	31 Å²	31	24%	0.236	16%	0.158	C	C	.	.	H	α-helix	trans	-69.8	-36.4	175.5	-66.2	178.7	0	0	0	112	Q333 S334 D335 N340 H341 Y462 L466	Q333-L337 PolarHBondContact O-N 3.16Å; Q333-L337 VanDerWaalsContact O-N 3.08Å; S334-L337 PolarHBondContact O-N 3.38Å; S334-L337 VanDerWaalsContact O-N 3.12Å; D335-L337 PolarHBondContact O-N 3.31Å; L337-N340 PolarHBondContact O-N 3.13Å; L337-H341 PolarHBondContact O-N 3.16Å; L337-Y462 HydrophobicContact CB-CD1 3.65Å; L337-Y462 HydrophobicContact CB-CD2 3.9Å; L337-Y462 HydrophobicContact CB-CE1 4.12Å; L337-Y462 HydrophobicContact CB-CE2 4.34Å; L337-Y462 HydrophobicContact CB-CG 3.52Å; L337-Y462 HydrophobicContact CD1-CD1 3.82Å; L337-Y462 HydrophobicContact CD1-CG 4.13Å; L337-Y462 HydrophobicContact CG-CD1 4.33Å; L337-Y462 HydrophobicContact CG-CG 4.49Å; L337-L466 HydrophobicContact CD1-CD1 3.99Å; L337-L466 HydrophobicContact CD1-CD2 3.92Å; L337-L466 HydrophobicContact CD1-CG 3.86Å
338	V	96.8	Very high	92.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.5	-46.6	171.4	175.8	0	0	0	0	110.1	S334 D335 N340 H341 L342 F398 I455 L458 R459 Y462	S334-V338 VanDerWaalsContact O-CG2 3.26Å; S334-V338 WeakPolarHBondContact O-CG2 3.3Å; S334-V338 PolarHBondContact O-N 3.33Å; D335-V338 PolarHBondContact O-N 2.79Å; V338-N340 VanDerWaalsContact C-N 3.35Å; V338-N340 PolarHBondContact O-N 3.11Å; V338-H341 VanDerWaalsContact O-CB 3.29Å; V338-H341 WeakPolarHBondContact O-CB 3.31Å; V338-H341 PolarHBondContact O-N 3.16Å; V338-H341 VanDerWaalsContact O-N 3.09Å; V338-L342 HydrophobicContact CG1-CD1 4.06Å; V338-L342 HydrophobicContact CG1-CG 4.42Å; V338-L342 VanDerWaalsContact O-CG 3.31Å; V338-L342 WeakPolarHBondContact O-CG 3.4Å; V338-L342 PolarHBondContact O-N 3.49Å; V338-F398 HydrophobicContact CB-CE1 3.69Å; V338-F398 HydrophobicContact CB-CZ 3.94Å; V338-F398 HydrophobicContact CG1-CD1 4.15Å; V338-F398 HydrophobicContact CG1-CE1 3.54Å; V338-F398 HydrophobicContact CG1-CE2 4.43Å; V338-F398 HydrophobicContact CG1-CZ 3.7Å; V338-I455 HydrophobicContact CG1-CD1 4.04Å; V338-L458 HydrophobicContact CG1-CB 4.12Å; V338-L458 HydrophobicContact CG1-CD1 4.16Å; V338-L458 HydrophobicContact CG2-CB 3.84Å; V338-R459 HydrophobicContact CG2-CG 3.91Å; V338-Y462 HydrophobicContact CG2-CD2 3.77Å; V338-Y462 HydrophobicContact CG2-CE2 4.4Å
339	L	97.4	Very high	94.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.8	-44.7	176.6	178.7	63.5	0	0	0	111.9	D335 Q336 H341 L342 L343 L361 T365 F369 F398 A401 L402	D335-L339 PolarHBondContact O-N 2.97Å; Q336-L339 PolarHBondContact O-N 3.4Å; L339-H341 PolarHBondContact O-N 3.45Å; L339-L342 PolarHBondContact O-N 3.24Å; L339-L342 VanDerWaalsContact O-N 3.12Å; L339-L343 PolarHBondContact O-N 3.09Å; L339-L361 HydrophobicContact CD2-CD2 4.12Å; L339-L361 HydrophobicContact CG-CD2 4.32Å; L339-T365 HydrophobicContact CD2-CG2 3.75Å; L339-F369 HydrophobicContact CB-CE2 4.19Å; L339-F369 HydrophobicContact CB-CZ 4.16Å; L339-F369 HydrophobicContact CD2-CE2 3.68Å; L339-F369 HydrophobicContact CD2-CZ 3.97Å; L339-F398 HydrophobicContact CB-CD1 4.22Å; L339-F398 HydrophobicContact CB-CE1 4.43Å; L339-A401 HydrophobicContact CD1-CB 3.77Å; L339-A401 HydrophobicContact CD2-CB 3.78Å; L339-A401 HydrophobicContact CG-CB 4.45Å; L339-L402 HydrophobicContact CD1-CD2 3.98Å; L339-L402 HydrophobicContact CD1-CG 4.05Å
340	N	96	Very high	94.6	Very high	49 Å²	49	31.8 Å²	31.8	26%	0.262	16%	0.161	S	C	.	.	H	α-helix	trans	-59.8	-35.2	174.7	-79.5	-16.2	0	0	0	112.6	Q336 L337 V338 P344 L361 P362	Q336-N340 PolarHBondContact O-N 3.22Å; L337-N340 PolarHBondContact O-N 3.13Å; V338-N340 VanDerWaalsContact C-N 3.35Å; V338-N340 PolarHBondContact O-N 3.11Å; N340-P344 VanDerWaalsContact O-CD 3.26Å; N340-P344 WeakPolarHBondContact O-CD 3.46Å; N340-L361 WeakPolarHBondContact OD1-CB 3.39Å; N340-P362 WeakPolarHBondContact ND2-CD 3.37Å; N340-P362 WeakPolarHBondContact ND2-CG 3.29Å
341	H	96.4	Very high	95.1	Very high	64 Å²	64	32.3 Å²	32.3	30%	0.296	16%	0.164	S	C	.	.	H	α-helix	trans	-67	-38.1	175.2	-170.3	84.1	0	0	0	112.2	L337 V338 L339 P344 F345 Y462	L337-H341 PolarHBondContact O-N 3.16Å; V338-H341 VanDerWaalsContact O-CB 3.29Å; V338-H341 WeakPolarHBondContact O-CB 3.31Å; V338-H341 PolarHBondContact O-N 3.16Å; V338-H341 VanDerWaalsContact O-N 3.09Å; L339-H341 PolarHBondContact O-N 3.45Å; H341-P344 WeakPolarHBondContact O-CD 3.49Å; H341-P344 WeakPolarHBondContact O-CG 3.44Å; H341-F345 AromaticContact CD2-CE2 3.87Å; H341-F345 AromaticContact NE2-CE2 3.78Å; H341-F345 WeakPolarHBondContact O-CD2 3.39Å; H341-F345 WeakPolarHBondContact O-CE2 3.22Å; H341-Y462 HydrophobicContact CB-CE2 3.77Å; H341-Y462 VanDerWaalsContact CB-OH 3.25Å; H341-Y462 WeakPolarHBondContact CB-OH 2.88Å; H341-Y462 VanDerWaalsContact CG-OH 3.27Å; H341-Y462 AromaticContact ND1-CZ 3.96Å; H341-Y462 PolarHBondContact ND1-OH 3.3Å
342	L	97	Very high	95.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-74.6	-31.9	-179.1	-63.7	170.8	0	0	0	112.3	V338 L339 F345 Y346 F398 L402 H449 L450 I455 L458	V338-L342 HydrophobicContact CG1-CD1 4.06Å; V338-L342 HydrophobicContact CG1-CG 4.42Å; V338-L342 VanDerWaalsContact O-CG 3.31Å; V338-L342 WeakPolarHBondContact O-CG 3.4Å; V338-L342 PolarHBondContact O-N 3.49Å; L339-L342 PolarHBondContact O-N 3.24Å; L339-L342 VanDerWaalsContact O-N 3.12Å; L342-F345 WeakPolarHBondContact O-CB 3.49Å; L342-F345 PolarHBondContact O-N 3.23Å; L342-Y346 HydrophobicContact CB-CD2 4.22Å; L342-Y346 HydrophobicContact CB-CE2 4.36Å; L342-Y346 HydrophobicContact CD2-CE2 4.25Å; L342-Y346 WeakPolarHBondContact O-CD2 3.41Å; L342-Y346 PolarHBondContact O-N 3.43Å; L342-F398 HydrophobicContact CD1-CB 4.15Å; L342-F398 HydrophobicContact CD1-CD1 4.08Å; L342-F398 HydrophobicContact CD1-CG 4.22Å; L342-L402 HydrophobicContact CB-CD1 4.42Å; L342-H449 HydrophobicContact CD2-CB 3.66Å; L342-L450 HydrophobicContact CD1-CD2 4.06Å; L342-I455 HydrophobicContact CD1-CD1 3.76Å; L342-I455 HydrophobicContact CD2-CD1 4.38Å; L342-L458 HydrophobicContact CD2-CD1 4.2Å
343	L	95.7	Very high	95.7	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-50.2	-49.3	-175.1	-162.7	71.5	0	0	0	114.9	L339 F345 Y346 L347 D351 L354 L361 L402 L405	L339-L343 PolarHBondContact O-N 3.09Å; L343-F345 PolarHBondContact O-N 3.36Å; L343-Y346 PolarHBondContact O-N 2.95Å; L343-L347 HydrophobicContact CD1-CB 4.15Å; L343-L347 HydrophobicContact CD1-CD1 4.1Å; L343-L347 CarbonylContact O-C 3.53Å; L343-L347 VanDerWaalsContact O-C 3.28Å; L343-L347 WeakPolarHBondContact O-CA 3.45Å; L343-L347 PolarHBondContact O-N 3.15Å; L343-D351 HydrophobicContact CB-CB 4.47Å; L343-D351 HydrophobicContact CD2-CB 3.82Å; L343-D351 HydrophobicContact CG-CB 3.93Å; L343-L354 HydrophobicContact CD2-CD1 4.09Å; L343-L361 HydrophobicContact CD2-CD2 4.15Å; L343-L402 HydrophobicContact CD1-CD2 4.35Å; L343-L405 HydrophobicContact CD1-CD1 3.76Å
344	P	95.9	Very high	95.9	Very high	48 Å²	48	33 Å²	33	31%	0.312	18%	0.176	S	C	.	.	H	α-helix	trans	-65.7	-19.4	179	25.2	-36.1	0	0	0	114.6	N340 H341 P348 D351	N340-P344 VanDerWaalsContact O-CD 3.26Å; N340-P344 WeakPolarHBondContact O-CD 3.46Å; H341-P344 WeakPolarHBondContact O-CD 3.49Å; H341-P344 WeakPolarHBondContact O-CG 3.44Å; P344-P348 WeakPolarHBondContact O-CB 3.32Å; P344-D351 HydrophobicContact CB-CB 4.47Å
345	F	95.2	Very high	96.1	Very high	100 Å²	100	39.3 Å²	39.3	44%	0.439	20%	0.203	S	C	.	.	H	α-helix	trans	-81.2	-39.4	177.3	-61.8	-78.3	0	0	0	111.8	H341 L342 L343 H449	H341-F345 AromaticContact CD2-CE2 3.87Å; H341-F345 AromaticContact NE2-CE2 3.78Å; H341-F345 WeakPolarHBondContact O-CD2 3.39Å; H341-F345 WeakPolarHBondContact O-CE2 3.22Å; L342-F345 WeakPolarHBondContact O-CB 3.49Å; L342-F345 PolarHBondContact O-N 3.23Å; L343-F345 PolarHBondContact O-N 3.36Å; F345-H449 AromaticContact CD1-CE1 3.57Å; F345-H449 AromaticContact CD1-NE2 3.38Å; F345-H449 WeakPolarHBondContact CD1-NE2 3.34Å; F345-H449 AromaticContact CE1-CE1 3.71Å; F345-H449 AromaticContact CE1-NE2 3.97Å; F345-H449 AromaticContact CG-CD2 3.94Å; F345-H449 AromaticContact CG-CE1 3.97Å; F345-H449 AromaticContact CG-NE2 3.71Å
346	Y	95.9	Very high	96	Very high	29 Å²	29	46 Å²	46	11%	0.114	23%	0.234	C	C	.	.	H	α-helix	trans	-97.6	-33	-175.6	-67.8	-81.2	0	0	0	113.9	L342 L343 L402 L445 D446 H449 L450	L342-Y346 HydrophobicContact CB-CD2 4.22Å; L342-Y346 HydrophobicContact CB-CE2 4.36Å; L342-Y346 HydrophobicContact CD2-CE2 4.25Å; L342-Y346 WeakPolarHBondContact O-CD2 3.41Å; L342-Y346 PolarHBondContact O-N 3.43Å; L343-Y346 PolarHBondContact O-N 2.95Å; Y346-L402 HydrophobicContact CD2-CD1 3.61Å; Y346-L402 HydrophobicContact CD2-CD2 4.41Å; Y346-L402 HydrophobicContact CE2-CD1 4.01Å; Y346-L402 HydrophobicContact CG-CD1 3.96Å; Y346-L445 HydrophobicContact CD1-CB 4.27Å; Y346-L445 HydrophobicContact CD1-CD2 3.97Å; Y346-L445 HydrophobicContact CE1-CB 4.02Å; Y346-D446 WeakPolarHBondContact CE1-OD2 3.27Å; Y346-D446 PolarHBondContact OH-O 3.42Å; Y346-D446 PolarHBondContact OH-OD1 3.48Å; Y346-H449 HydrophobicContact CE2-CB 3.86Å; Y346-H449 WeakPolarHBondContact OH-CB 3.44Å; Y346-H449 PolarHBondContact OH-N 2.91Å; Y346-L450 HydrophobicContact CE1-CD1 3.87Å; Y346-L450 HydrophobicContact CE2-CD1 4.08Å; Y346-L450 HydrophobicContact CE2-CG 4.03Å; Y346-L450 WeakPolarHBondContact OH-CD1 3.35Å; Y346-L450 VanDerWaalsContact OH-CG 3.31Å; Y346-L450 WeakPolarHBondContact OH-CG 3.26Å; Y346-L450 PolarHBondContact OH-N 3.34Å
347	L	95.7	Very high	95.9	Very high	21 Å²	21	48 Å²	48	11%	0.11	24%	0.242	C	C	.	.			trans	-138.6	60.9	-173.9	-59.8	172.4	0	0	0	110.9	L343 E349 L350 D351 L405	L343-L347 HydrophobicContact CD1-CB 4.15Å; L343-L347 HydrophobicContact CD1-CD1 4.1Å; L343-L347 CarbonylContact O-C 3.53Å; L343-L347 VanDerWaalsContact O-C 3.28Å; L343-L347 WeakPolarHBondContact O-CA 3.45Å; L343-L347 PolarHBondContact O-N 3.15Å; L347-E349 PolarHBondContact O-N 3.28Å; L347-L350 HydrophobicContact CB-CB 4.03Å; L347-L350 HydrophobicContact CB-CD2 4.45Å; L347-L350 HydrophobicContact CD1-CD2 3.99Å; L347-L350 PolarHBondContact O-N 3.22Å; L347-D351 PolarHBondContact O-N 3.18Å; L347-L405 HydrophobicContact CD1-CB 3.58Å
348	P	96.9	Very high	95.8	Very high	73 Å²	73	54.3 Å²	54.3	47%	0.474	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-37.2	-173.6	22.8	-33.7	0	0	0	114.1	P344 D351 A352	P344-P348 WeakPolarHBondContact O-CB 3.32Å; P348-D351 PolarHBondContact O-N 3.38Å; P348-A352 WeakPolarHBondContact O-CB 3.48Å; P348-A352 PolarHBondContact O-N 3.11Å
349	E	96.9	Very high	95.5	Very high	142 Å²	142	55.5 Å²	55.5	66%	0.664	28%	0.276	S	S	*	.	H	α-helix	trans	-65.6	-43	177.8	-64.5	-176.6	-178.1	0	0	111.2	L347 A352 H353 L413	L347-E349 PolarHBondContact O-N 3.28Å; E349-A352 PolarHBondContact O-N 3.11Å; E349-H353 WeakPolarHBondContact O-CB 3.26Å; E349-H353 PolarHBondContact O-N 3.4Å; E349-L413 HydrophobicContact CB-CD1 4.19Å; E349-L413 HydrophobicContact CB-CD2 4.25Å
350	L	96.5	Very high	95.2	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-65	-46.2	176.1	-175.9	62.2	0	0	0	110.8	L347 A352 H353 L354 L405 I412	L347-L350 HydrophobicContact CB-CB 4.03Å; L347-L350 HydrophobicContact CB-CD2 4.45Å; L347-L350 HydrophobicContact CD1-CD2 3.99Å; L347-L350 PolarHBondContact O-N 3.22Å; L350-A352 VanDerWaalsContact C-N 3.32Å; L350-A352 PolarHBondContact O-N 2.63Å; L350-H353 PolarHBondContact O-N 2.62Å; L350-L354 HydrophobicContact CD1-CD2 4.27Å; L350-L354 HydrophobicContact CD1-CG 4.28Å; L350-L354 HydrophobicContact CG-CD1 4.41Å; L350-L354 HydrophobicContact CG-CG 4.34Å; L350-L354 VanDerWaalsContact O-CG 3.3Å; L350-L354 WeakPolarHBondContact O-CG 3.31Å; L350-L354 PolarHBondContact O-N 3.37Å; L350-L405 HydrophobicContact CD2-CB 3.95Å; L350-L405 HydrophobicContact CD2-CD2 4.38Å; L350-I412 HydrophobicContact CD1-CB 3.98Å; L350-I412 HydrophobicContact CD1-CD1 4.26Å; L350-I412 HydrophobicContact CD1-CG2 3.47Å; L350-I412 VanDerWaalsContact CD1-CG2 3.47Å
351	D	96.6	Very high	95	Very high	23 Å²	23	56.2 Å²	56.2	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-55.5	-45.8	176	174.8	70.1	0	0	0	112.1	L343 P344 L347 P348 L354 K355	L343-D351 HydrophobicContact CB-CB 4.47Å; L343-D351 HydrophobicContact CD2-CB 3.82Å; L343-D351 HydrophobicContact CG-CB 3.93Å; P344-D351 HydrophobicContact CB-CB 4.47Å; L347-D351 PolarHBondContact O-N 3.18Å; P348-D351 PolarHBondContact O-N 3.38Å; D351-L354 PolarHBondContact O-N 3.44Å; D351-K355 VanDerWaalsContact CG-NZ 3.27Å; D351-K355 WeakPolarHBondContact O-CG 3.32Å; D351-K355 PolarHBondContact O-N 2.86Å; D351-K355 WeakPolarHBondContact OD1-CE 3.29Å; D351-K355 IonicContact OD1-NZ 3.35Å; D351-K355 PolarHBondContact OD1-NZ 3.35Å; D351-K355 VanDerWaalsContact OD1-NZ 3.12Å; D351-K355 WeakPolarHBondContact OD2-CE 3.47Å; D351-K355 IonicContact OD2-NZ 3.35Å; D351-K355 PolarHBondContact OD2-NZ 3.17Å
352	A	96.6	Very high	94.8	Very high	54 Å²	54	54.5 Å²	54.5	45%	0.446	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-44.3	176.5	0	0	0	0	0	111.9	P348 E349 L350 K355 E356	P348-A352 WeakPolarHBondContact O-CB 3.48Å; P348-A352 PolarHBondContact O-N 3.11Å; E349-A352 PolarHBondContact O-N 3.11Å; L350-A352 VanDerWaalsContact C-N 3.32Å; L350-A352 PolarHBondContact O-N 2.63Å; A352-K355 PolarHBondContact O-N 3.43Å; A352-E356 PolarHBondContact O-N 3.38Å
353	H	95.9	Very high	94.3	Very high	21 Å²	21	60.8 Å²	60.8	10%	0.097	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-43.4	178.6	-162.7	71.6	0	0	0	112.1	E349 L350 K355 E356 Y357 I412 L413 L415	E349-H353 WeakPolarHBondContact O-CB 3.26Å; E349-H353 PolarHBondContact O-N 3.4Å; L350-H353 PolarHBondContact O-N 2.62Å; H353-K355 VanDerWaalsContact C-N 3.3Å; H353-K355 PolarHBondContact O-N 2.89Å; H353-E356 PolarHBondContact O-N 3.24Å; H353-Y357 AromaticContact CE1-CD2 3.86Å; H353-Y357 AromaticContact CE1-CE2 3.31Å; H353-Y357 WeakPolarHBondContact CE1-CE2 3.47Å; H353-Y357 AromaticContact ND1-CE2 3.69Å; H353-Y357 AromaticContact NE2-CD2 3.92Å; H353-Y357 AromaticContact NE2-CE2 3.72Å; H353-Y357 WeakPolarHBondContact O-CD2 3.26Å; H353-Y357 PolarHBondContact O-N 3.07Å; H353-Y357 VanDerWaalsContact O-N 3.1Å; H353-I412 PolarHBondContact NE2-O 2.87Å; H353-L413 HydrophobicContact CB-CD2 3.76Å; H353-L415 PolarHBondContact CE1-O 3.32Å; H353-L415 PolarHBondContact NE2-O 3Å
354	L	95	Very high	94.1	Very high	6 Å²	6	61.2 Å²	61.2	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-38.4	176	-63.8	-170.8	0	0	0	111.7	L343 L350 D351 E358 I359 L361 I412 I421 L425	L343-L354 HydrophobicContact CD2-CD1 4.09Å; L350-L354 HydrophobicContact CD1-CD2 4.27Å; L350-L354 HydrophobicContact CD1-CG 4.28Å; L350-L354 HydrophobicContact CG-CD1 4.41Å; L350-L354 HydrophobicContact CG-CG 4.34Å; L350-L354 VanDerWaalsContact O-CG 3.3Å; L350-L354 WeakPolarHBondContact O-CG 3.31Å; L350-L354 PolarHBondContact O-N 3.37Å; D351-L354 PolarHBondContact O-N 3.44Å; L354-E358 PolarHBondContact O-N 3.48Å; L354-E358 VanDerWaalsContact O-N 3.15Å; L354-I359 HydrophobicContact CB-CB 4.29Å; L354-I359 HydrophobicContact CD2-CB 4.09Å; L354-I359 HydrophobicContact CD2-CG1 4.45Å; L354-I359 HydrophobicContact CD2-CG2 4.14Å; L354-I359 PolarHBondContact O-N 3.03Å; L354-L361 HydrophobicContact CD1-CD1 4.49Å; L354-I412 HydrophobicContact CD2-CG2 4.47Å; L354-I421 HydrophobicContact CD2-CG2 3.7Å; L354-L425 HydrophobicContact CD1-CD1 4.47Å; L354-L425 HydrophobicContact CD2-CD1 3.73Å
355	K	94.6	Very high	94.1	Very high	136 Å²	136	58.9 Å²	58.9	59%	0.591	30%	0.299	S	S	*	.	H	α-helix	trans	-67.3	-40.1	175.1	-74.1	169.2	-179.3	165.1	0	112.3	D351 A352 H353 Y357 E358	D351-K355 VanDerWaalsContact CG-NZ 3.27Å; D351-K355 WeakPolarHBondContact O-CG 3.32Å; D351-K355 PolarHBondContact O-N 2.86Å; D351-K355 WeakPolarHBondContact OD1-CE 3.29Å; D351-K355 IonicContact OD1-NZ 3.35Å; D351-K355 PolarHBondContact OD1-NZ 3.35Å; D351-K355 VanDerWaalsContact OD1-NZ 3.12Å; D351-K355 WeakPolarHBondContact OD2-CE 3.47Å; D351-K355 IonicContact OD2-NZ 3.35Å; D351-K355 PolarHBondContact OD2-NZ 3.17Å; A352-K355 PolarHBondContact O-N 3.43Å; H353-K355 VanDerWaalsContact C-N 3.3Å; H353-K355 PolarHBondContact O-N 2.89Å; K355-Y357 VanDerWaalsContact C-N 3.33Å; K355-Y357 PolarHBondContact O-N 3.08Å; K355-E358 PolarHBondContact O-N 2.94Å
356	E	94.8	Very high	94	Very high	141 Å²	141	56.6 Å²	56.6	66%	0.659	29%	0.291	S	S	*	.	H	α-helix	trans	-60	-42.3	176.7	-177.2	178.2	168.5	0	0	111.9	A352 H353 E358	A352-E356 PolarHBondContact O-N 3.38Å; H353-E356 PolarHBondContact O-N 3.24Å; E356-E358 VanDerWaalsContact C-N 3.34Å
357	Y	93.9	Very high	93.7	Very high	52 Å²	52	58.9 Å²	58.9	20%	0.204	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	10	180	-73.6	-83.8	0	0	0	114.4	H353 K355 I359 N416 S418 I421	H353-Y357 AromaticContact CE1-CD2 3.86Å; H353-Y357 AromaticContact CE1-CE2 3.31Å; H353-Y357 WeakPolarHBondContact CE1-CE2 3.47Å; H353-Y357 AromaticContact ND1-CE2 3.69Å; H353-Y357 AromaticContact NE2-CD2 3.92Å; H353-Y357 AromaticContact NE2-CE2 3.72Å; H353-Y357 WeakPolarHBondContact O-CD2 3.26Å; H353-Y357 PolarHBondContact O-N 3.07Å; H353-Y357 VanDerWaalsContact O-N 3.1Å; K355-Y357 VanDerWaalsContact C-N 3.33Å; K355-Y357 PolarHBondContact O-N 3.08Å; Y357-I359 PolarHBondContact O-N 3.48Å; Y357-N416 VanDerWaalsContact CE1-O 3.29Å; Y357-N416 WeakPolarHBondContact CE1-O 3.27Å; Y357-N416 VanDerWaalsContact OH-CA 3.3Å; Y357-N416 WeakPolarHBondContact OH-CA 3.15Å; Y357-S418 PolarHBondContact O-OG 3.43Å; Y357-I421 HydrophobicContact CD1-CD1 4.07Å; Y357-I421 HydrophobicContact CD2-CD1 3.61Å; Y357-I421 HydrophobicContact CE2-CD1 4.17Å; Y357-I421 HydrophobicContact CG-CD1 3.57Å
358	E	92.5	Very high	93.7	Very high	179 Å²	179	58 Å²	58	84%	0.836	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	34.4	-179.5	-58.3	-176	167.1	0	0	113.9	L354 K355 E356 S360	L354-E358 PolarHBondContact O-N 3.48Å; L354-E358 VanDerWaalsContact O-N 3.15Å; K355-E358 PolarHBondContact O-N 2.94Å; E356-E358 VanDerWaalsContact C-N 3.34Å; E358-S360 PolarHBondContact O-N 2.93Å
359	I	91.4	Very high	93.7	Very high	24 Å²	24	54.6 Å²	54.6	12%	0.123	28%	0.276	C	S	.	.			trans	-82.2	109.3	178.9	-58.6	-62.5	0	0	0	110.4	L354 Y357 L361 I364 S418 I421 F422 L425	L354-I359 HydrophobicContact CB-CB 4.29Å; L354-I359 HydrophobicContact CD2-CB 4.09Å; L354-I359 HydrophobicContact CD2-CG1 4.45Å; L354-I359 HydrophobicContact CD2-CG2 4.14Å; L354-I359 PolarHBondContact O-N 3.03Å; Y357-I359 PolarHBondContact O-N 3.48Å; I359-L361 PolarHBondContact O-N 2.95Å; I359-I364 HydrophobicContact CG2-CD1 4.25Å; I359-S418 WeakPolarHBondContact CD1-O 3.45Å; I359-I421 HydrophobicContact CG1-CB 4.5Å; I359-I421 HydrophobicContact CG1-CG2 3.96Å; I359-F422 HydrophobicContact CD1-CB 4.4Å; I359-L425 HydrophobicContact CG2-CD1 3.9Å
360	S	90.5	Very high	93.6	Very high	60 Å²	60	48.1 Å²	48.1	42%	0.42	25%	0.246	S	C	.	.			trans	-79.1	99.1	172.5	-174.7	0	0	0	0	110.7	E358 P362 L363	E358-S360 PolarHBondContact O-N 2.93Å; S360-P362 VanDerWaalsContact C-N 3.27Å; S360-L363 WeakPolarHBondContact O-CB 3.09Å; S360-L363 PolarHBondContact O-N 3.37Å
361	L	91.8	Very high	93.5	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-35.1	178	-174.4	63.3	0	0	0	114	L339 N340 L343 L354 I359 L363 I364 T365 L405	L339-L361 HydrophobicContact CD2-CD2 4.12Å; L339-L361 HydrophobicContact CG-CD2 4.32Å; N340-L361 WeakPolarHBondContact OD1-CB 3.39Å; L343-L361 HydrophobicContact CD2-CD2 4.15Å; L354-L361 HydrophobicContact CD1-CD1 4.49Å; I359-L361 PolarHBondContact O-N 2.95Å; L361-L363 PolarHBondContact O-N 2.97Å; L361-L363 VanDerWaalsContact O-N 3.14Å; L361-I364 PolarHBondContact O-N 3.29Å; L361-T365 HydrophobicContact CD1-CG2 3.69Å; L361-T365 HydrophobicContact CD2-CG2 4.41Å; L361-T365 HydrophobicContact CG-CG2 3.71Å; L361-T365 PolarHBondContact O-N 3.49Å; L361-T365 PolarHBondContact O-OG1 2.87Å; L361-L405 HydrophobicContact CD1-CD2 4.34Å; L361-L405 HydrophobicContact CD2-CD1 4.14Å
362	P	90.7	Very high	93.5	Very high	29 Å²	29	47 Å²	47	19%	0.188	24%	0.24	C	C	.	.	H	α-helix	trans	-57.5	-23.2	173.2	-29.6	37	0	0	0	115.6	Q336 N340 S360 I364	Q336-P362 HydrophobicContact CB-CB 4.27Å; Q336-P362 HydrophobicContact CB-CG 4.41Å; Q336-P362 VanDerWaalsContact NE2-C 3.31Å; Q336-P362 PolarHBondContact NE2-O 2.66Å; N340-P362 WeakPolarHBondContact ND2-CD 3.37Å; N340-P362 WeakPolarHBondContact ND2-CG 3.29Å; S360-P362 VanDerWaalsContact C-N 3.27Å; P362-I364 PolarHBondContact O-N 3.43Å
363	L	87.9	Confident	93.5	Very high	131 Å²	131	44.4 Å²	44.4	69%	0.686	22%	0.219	S	C	*	.	H	α-helix	trans	-68.8	-23.8	175.2	-64.8	176.9	0	0	0	112.5	S360 L361 F422	S360-L363 WeakPolarHBondContact O-CB 3.09Å; S360-L363 PolarHBondContact O-N 3.37Å; L361-L363 PolarHBondContact O-N 2.97Å; L361-L363 VanDerWaalsContact O-N 3.14Å; L363-F422 HydrophobicContact CB-CE2 4.32Å
364	I	92	Very high	93.5	Very high	11 Å²	11	44 Å²	44	6%	0.056	22%	0.218	C	C	.	.	H	α-helix	trans	-97.1	-47.5	-177.4	-63	154.2	0	0	0	110.1	I359 L361 P362 L366 W368 F422 L425	I359-I364 HydrophobicContact CG2-CD1 4.25Å; L361-I364 PolarHBondContact O-N 3.29Å; P362-I364 PolarHBondContact O-N 3.43Å; I364-L366 VanDerWaalsContact C-N 3.28Å; I364-L366 PolarHBondContact O-N 3.2Å; I364-W368 HydrophobicContact CG2-CZ2 3.9Å; I364-F422 HydrophobicContact CD1-CD2 3.8Å; I364-F422 HydrophobicContact CD1-CE2 3.93Å; I364-F422 HydrophobicContact CD1-CG 4.5Å; I364-F422 HydrophobicContact CG1-CD2 3.95Å; I364-F422 HydrophobicContact CG1-CE2 3.55Å; I364-F422 HydrophobicContact CG1-CZ 4Å; I364-L425 HydrophobicContact CD1-CB 3.75Å; I364-L425 HydrophobicContact CD1-CD1 3.71Å; I364-L425 HydrophobicContact CD1-CG 4.38Å
365	T	95	Very high	93.3	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-78.1	-9.7	-168.5	59.2	0	0	0	0	114.1	Q336 L339 L361 Q367 W368 F369	Q336-T365 PolarHBondContact NE2-OG1 3.42Å; Q336-T365 VanDerWaalsContact NE2-OG1 3.1Å; L339-T365 HydrophobicContact CD2-CG2 3.75Å; L361-T365 HydrophobicContact CD1-CG2 3.69Å; L361-T365 HydrophobicContact CD2-CG2 4.41Å; L361-T365 HydrophobicContact CG-CG2 3.71Å; L361-T365 PolarHBondContact O-N 3.49Å; L361-T365 PolarHBondContact O-OG1 2.87Å; T365-Q367 VanDerWaalsContact C-N 3.3Å; T365-Q367 PolarHBondContact O-N 3.03Å; T365-W368 HydrophobicContact CG2-CD2 4.24Å; T365-W368 HydrophobicContact CG2-CE3 4Å; T365-W368 HydrophobicContact CG2-CZ3 4.25Å; T365-W368 WeakPolarHBondContact O-CB 3.44Å; T365-W368 PolarHBondContact O-N 3.38Å; T365-W368 VanDerWaalsContact O-N 3.08Å; T365-F369 VanDerWaalsContact O-CD2 3.3Å; T365-F369 WeakPolarHBondContact O-CD2 3.36Å; T365-F369 PolarHBondContact O-N 2.91Å; T365-F369 VanDerWaalsContact O-N 3.08Å
366	L	92.8	Very high	93.2	Very high	51 Å²	51	41.6 Å²	41.6	27%	0.267	22%	0.217	S	C	.	.	H	α-helix	trans	-58.1	-46.6	-178.4	176.4	60.6	0	0	0	110.5	V332 I364 W368 F369 L370	V332-L366 HydrophobicContact CG1-CD1 3.94Å; V332-L366 HydrophobicContact CG2-CD1 3.9Å; I364-L366 VanDerWaalsContact C-N 3.28Å; I364-L366 PolarHBondContact O-N 3.2Å; L366-W368 VanDerWaalsContact C-N 3.32Å; L366-W368 PolarHBondContact O-N 3.11Å; L366-F369 PolarHBondContact O-N 3.42Å; L366-L370 WeakPolarHBondContact O-CB 3.45Å; L366-L370 PolarHBondContact O-N 3.06Å
367	Q	90.9	Very high	93.1	Very high	78 Å²	78	35.5 Å²	35.5	36%	0.364	19%	0.19	S	C	.	.	H	α-helix	trans	-70.1	-30.6	179.3	-68.5	-61	-22	0	0	112.5	T365 T371 V376	T365-Q367 VanDerWaalsContact C-N 3.3Å; T365-Q367 PolarHBondContact O-N 3.03Å; Q367-T371 WeakPolarHBondContact O-CB 3.15Å; Q367-T371 PolarHBondContact O-N 3.06Å; Q367-T371 VanDerWaalsContact O-N 3.14Å; Q367-T371 PolarHBondContact O-OG1 3.02Å; Q367-V376 HydrophobicContact CB-CG1 4.45Å
368	W	95.8	Very high	92.9	Very high	3 Å²	3	36.2 Å²	36.2	1%	0.011	20%	0.201	C	C	.	.	H	α-helix	trans	-61.4	-51.1	177	-60.4	13.1	0	0	0	109.8	I364 T365 L366 L372 Y373 V376 A401 L404 L405 L425 A428 P429	I364-W368 HydrophobicContact CG2-CZ2 3.9Å; T365-W368 HydrophobicContact CG2-CD2 4.24Å; T365-W368 HydrophobicContact CG2-CE3 4Å; T365-W368 HydrophobicContact CG2-CZ3 4.25Å; T365-W368 WeakPolarHBondContact O-CB 3.44Å; T365-W368 PolarHBondContact O-N 3.38Å; T365-W368 VanDerWaalsContact O-N 3.08Å; L366-W368 VanDerWaalsContact C-N 3.32Å; L366-W368 PolarHBondContact O-N 3.11Å; W368-L372 CarbonylContact O-C 3.53Å; W368-L372 WeakPolarHBondContact O-CA 3.37Å; W368-L372 PolarHBondContact O-N 2.92Å; W368-Y373 HydrophobicContact CB-CD1 4.06Å; W368-Y373 HydrophobicContact CB-CE1 3.74Å; W368-Y373 HydrophobicContact CD2-CE1 4.11Å; W368-Y373 AromaticContact CE3-CE1 3.87Å; W368-Y373 HydrophobicContact CE3-CE1 3.87Å; W368-Y373 HydrophobicContact CG-CD1 4.43Å; W368-Y373 HydrophobicContact CG-CE1 4.11Å; W368-Y373 PolarHBondContact O-N 3.35Å; W368-V376 HydrophobicContact CG-CG2 4.22Å; W368-A401 HydrophobicContact CE3-CB 4.31Å; W368-A401 HydrophobicContact CZ3-CB 4.32Å; W368-L404 HydrophobicContact CE3-CD1 4.45Å; W368-L404 HydrophobicContact CH2-CB 4.5Å; W368-L404 HydrophobicContact CZ3-CB 4.41Å; W368-L404 HydrophobicContact CZ3-CD1 4.18Å; W368-L405 HydrophobicContact CH2-CD2 4.32Å; W368-L425 WeakPolarHBondContact CZ2-O 3.44Å; W368-A428 HydrophobicContact CH2-CB 4.46Å; W368-P429 HydrophobicContact CD2-CG 4.23Å; W368-P429 HydrophobicContact CH2-CG 4.25Å; W368-P429 HydrophobicContact CZ2-CG 3.55Å
369	F	96	Very high	92.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-74.6	-51.5	-179.7	-74.9	-69.4	0	0	0	112.3	Y323 V332 D335 Q336 L339 T365 L366 T371 L372 L397 F398 A401	Y323-F369 WeakPolarHBondContact CE1-O 3.3Å; Y323-F369 WeakPolarHBondContact OH-CB 3.44Å; V332-F369 HydrophobicContact CG2-CB 3.61Å; D335-F369 HydrophobicContact CB-CD1 4.21Å; D335-F369 HydrophobicContact CB-CE1 4.41Å; D335-F369 HydrophobicContact CB-CG 4.42Å; Q336-F369 HydrophobicContact CG-CD2 4.2Å; L339-F369 HydrophobicContact CB-CE2 4.19Å; L339-F369 HydrophobicContact CB-CZ 4.16Å; L339-F369 HydrophobicContact CD2-CE2 3.68Å; L339-F369 HydrophobicContact CD2-CZ 3.97Å; T365-F369 VanDerWaalsContact O-CD2 3.3Å; T365-F369 WeakPolarHBondContact O-CD2 3.36Å; T365-F369 PolarHBondContact O-N 2.91Å; T365-F369 VanDerWaalsContact O-N 3.08Å; L366-F369 PolarHBondContact O-N 3.42Å; F369-T371 VanDerWaalsContact C-N 3.27Å; F369-T371 PolarHBondContact O-N 2.98Å; F369-L372 PolarHBondContact O-N 3.14Å; F369-L397 HydrophobicContact CD1-CB 3.89Å; F369-L397 HydrophobicContact CD1-CD1 4.27Å; F369-L397 HydrophobicContact CE1-CB 3.66Å; F369-F398 HydrophobicContact CE1-CD1 4.11Å; F369-F398 HydrophobicContact CE1-CE1 4.08Å; F369-F398 AromaticContact CZ-CD1 3.95Å; F369-F398 HydrophobicContact CZ-CD1 3.95Å; F369-F398 HydrophobicContact CZ-CE1 4.04Å; F369-A401 HydrophobicContact CZ-CB 4.31Å
370	L	93.8	Very high	92.7	Very high	6 Å²	6	28.4 Å²	28.4	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-58.9	-36.6	-175	-176.9	61.6	0	0	0	112.7	Q289 F324 L329 V332 L366	Q289-L370 WeakPolarHBondContact O-CD2 3.39Å; F324-L370 HydrophobicContact CD1-CD1 3.94Å; F324-L370 HydrophobicContact CE1-CD1 4.1Å; F324-L370 VanDerWaalsContact CE1-O 3.31Å; F324-L370 WeakPolarHBondContact CE1-O 3.31Å; L329-L370 HydrophobicContact CD2-CD1 4.24Å; V332-L370 HydrophobicContact CG1-CD1 4.28Å; V332-L370 HydrophobicContact CG2-CB 4.24Å; L366-L370 WeakPolarHBondContact O-CB 3.45Å; L366-L370 PolarHBondContact O-N 3.06Å
371	T	95.1	Very high	92.8	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	7.9	-179.9	71.5	0	0	0	0	113.2	Q367 F369 Y373 S374 S375	Q367-T371 WeakPolarHBondContact O-CB 3.15Å; Q367-T371 PolarHBondContact O-N 3.06Å; Q367-T371 VanDerWaalsContact O-N 3.14Å; Q367-T371 PolarHBondContact O-OG1 3.02Å; F369-T371 VanDerWaalsContact C-N 3.27Å; F369-T371 PolarHBondContact O-N 2.98Å; T371-Y373 PolarHBondContact O-N 2.98Å; T371-S374 VanDerWaalsContact O-CB 3.3Å; T371-S374 WeakPolarHBondContact O-CB 3.45Å; T371-S374 PolarHBondContact O-N 3.23Å; T371-S374 PolarHBondContact O-OG 3.31Å; T371-S375 WeakPolarHBondContact OG1-CB 3.42Å; T371-S375 PolarHBondContact OG1-N 2.98Å; T371-S375 PolarHBondContact OG1-OG 3.08Å
372	L	97	Very high	93	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	47.1	-175.1	-50.8	176	0	0	0	111.4	I294 I314 L319 W368 F369 S374 W386 L389 L397	I294-L372 HydrophobicContact CD1-CD1 3.95Å; I294-L372 HydrophobicContact CD1-CG 3.98Å; I294-L372 HydrophobicContact CG2-CD1 4.46Å; I314-L372 HydrophobicContact CG2-CD1 3.91Å; L319-L372 HydrophobicContact CD1-CD1 4.44Å; L319-L372 HydrophobicContact CD1-CD2 4.05Å; L319-L372 HydrophobicContact CD2-CD2 3.79Å; W368-L372 CarbonylContact O-C 3.53Å; W368-L372 WeakPolarHBondContact O-CA 3.37Å; W368-L372 PolarHBondContact O-N 2.92Å; F369-L372 PolarHBondContact O-N 3.14Å; L372-S374 PolarHBondContact O-N 2.92Å; L372-S374 VanDerWaalsContact O-N 3.09Å; L372-W386 HydrophobicContact CB-CZ2 4.49Å; L372-W386 PolarHBondContact O-NE1 3.43Å; L372-L389 HydrophobicContact CD1-CD2 3.86Å; L372-L389 HydrophobicContact CD2-CD2 4.26Å; L372-L389 HydrophobicContact CG-CD2 4.45Å; L372-L397 HydrophobicContact CD2-CD1 3.79Å; L372-L397 HydrophobicContact CD2-CD2 4.25Å
373	Y	96.6	Very high	93.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	-3.2	-177.6	-64.3	-89.9	0	0	0	116.5	W368 T371 S375 V376 C377 I385 L397 I400 A401 L404	W368-Y373 HydrophobicContact CB-CD1 4.06Å; W368-Y373 HydrophobicContact CB-CE1 3.74Å; W368-Y373 HydrophobicContact CD2-CE1 4.11Å; W368-Y373 AromaticContact CE3-CE1 3.87Å; W368-Y373 HydrophobicContact CE3-CE1 3.87Å; W368-Y373 HydrophobicContact CG-CD1 4.43Å; W368-Y373 HydrophobicContact CG-CE1 4.11Å; W368-Y373 PolarHBondContact O-N 3.35Å; T371-Y373 PolarHBondContact O-N 2.98Å; Y373-S375 PolarHBondContact O-N 3.36Å; Y373-S375 VanDerWaalsContact O-N 3.16Å; Y373-V376 HydrophobicContact CD1-CG2 4.1Å; Y373-V376 PolarHBondContact O-N 3.1Å; Y373-V376 VanDerWaalsContact O-N 3.17Å; Y373-C377 WeakPolarHBondContact O-CB 3.4Å; Y373-C377 PolarHBondContact O-N 3.02Å; Y373-I385 HydrophobicContact CD1-CD1 4.29Å; Y373-I385 HydrophobicContact CD2-CD1 4.18Å; Y373-I385 HydrophobicContact CD2-CG2 3.92Å; Y373-I385 HydrophobicContact CE2-CG2 4.46Å; Y373-I385 HydrophobicContact CG-CD1 3.84Å; Y373-L397 HydrophobicContact CD2-CD2 3.99Å; Y373-L397 HydrophobicContact CE2-CB 4.28Å; Y373-L397 HydrophobicContact CE2-CD2 3.75Å; Y373-L397 PolarHBondContact OH-O 2.66Å; Y373-I400 HydrophobicContact CD1-CG2 4.48Å; Y373-I400 HydrophobicContact CE1-CG2 3.96Å; Y373-I400 HydrophobicContact CE2-CB 4.44Å; Y373-I400 HydrophobicContact CE2-CG2 4.24Å; Y373-A401 WeakPolarHBondContact OH-CA 3.34Å; Y373-A401 WeakPolarHBondContact OH-CB 3.37Å; Y373-A401 PolarHBondContact OH-N 3.06Å; Y373-L404 HydrophobicContact CD1-CD1 4.34Å; Y373-L404 HydrophobicContact CE1-CD1 3.8Å
374	S	94.7	Very high	93.5	Very high	11 Å²	11	18 Å²	18	8%	0.077	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16	-174.1	65.9	0	0	0	0	115.4	L293 N297 T371 L372	L293-S374 VanDerWaalsContact CD2-C 3.48Å; L293-S374 WeakPolarHBondContact CD2-O 3.49Å; N297-S374 WeakPolarHBondContact ND2-CB 3.45Å; T371-S374 VanDerWaalsContact O-CB 3.3Å; T371-S374 WeakPolarHBondContact O-CB 3.45Å; T371-S374 PolarHBondContact O-N 3.23Å; T371-S374 PolarHBondContact O-OG 3.31Å; L372-S374 PolarHBondContact O-N 2.92Å; L372-S374 VanDerWaalsContact O-N 3.09Å
375	S	92.3	Very high	93.7	Very high	52 Å²	52	17.5 Å²	17.5	36%	0.364	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-16.5	175.2	59.7	0	0	0	0	114.9	L293 T371 Y373	L293-S375 VanDerWaalsContact CD2-CB 3.4Å; T371-S375 WeakPolarHBondContact OG1-CB 3.42Å; T371-S375 PolarHBondContact OG1-N 2.98Å; T371-S375 PolarHBondContact OG1-OG 3.08Å; Y373-S375 PolarHBondContact O-N 3.36Å; Y373-S375 VanDerWaalsContact O-N 3.16Å
376	V	92.3	Very high	93.8	Very high	41 Å²	41	17.5 Å²	17.5	25%	0.248	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-24.4	-170	-63.6	0	0	0	0	113.3	Q367 W368 Y373 P429	Q367-V376 HydrophobicContact CB-CG1 4.45Å; W368-V376 HydrophobicContact CG-CG2 4.22Å; Y373-V376 HydrophobicContact CD1-CG2 4.1Å; Y373-V376 PolarHBondContact O-N 3.1Å; Y373-V376 VanDerWaalsContact O-N 3.17Å; V376-P429 HydrophobicContact CB-CB 4.01Å; V376-P429 HydrophobicContact CB-CG 4Å; V376-P429 HydrophobicContact CG2-CB 3.82Å; V376-P429 HydrophobicContact CG2-CG 3.84Å
377	C	92.6	Very high	94	Very high	12 Å²	12	15 Å²	15	8%	0.081	9%	0.092	C	C	.	.	S	Bend	trans	-99.8	150.7	178	-67.2	0	0	0	0	111.6	Y373 L381 T382 P429	Y373-C377 WeakPolarHBondContact O-CB 3.4Å; Y373-C377 PolarHBondContact O-N 3.02Å; C377-L381 HydrophobicContact CB-CB 4.22Å; C377-L381 HydrophobicContact CB-CD2 3.91Å; C377-L381 HydrophobicContact CB-CG 3.99Å; C377-T382 PolarHBondContact O-OG1 3.43Å; C377-P429 VanDerWaalsContact SG-CB 3.53Å
378	P	89.3	Confident	94.3	Very high	68 Å²	68	11.3 Å²	11.3	44%	0.442	8%	0.075	S	C	.	.			trans	-57.4	147.9	162.8	-22.3	33.5	0	0	0	111.7	A380 L381 T382	P378-A380 VanDerWaalsContact C-N 3.28Å; P378-A380 PolarHBondContact O-N 2.98Å; P378-A380 VanDerWaalsContact O-N 3.17Å; P378-L381 PolarHBondContact O-N 3.19Å; P378-T382 PolarHBondContact O-N 3.5Å; P378-T382 PolarHBondContact O-OG1 3.16Å
379	T	90.5	Very high	94.4	Very high	17 Å²	17	11.2 Å²	11.2	10%	0.104	7%	0.074	C	C	.	.	H	α-helix	trans	-55.5	-38.3	-174.3	-60	0	0	0	0	113.5	F97 F99 L300 L381 T382 F383	F97-T379 HydrophobicContact CB-CG2 4.46Å; F97-T379 HydrophobicContact CD1-CG2 3.74Å; F97-T379 HydrophobicContact CD2-CG2 4.02Å; F97-T379 HydrophobicContact CE1-CG2 3.92Å; F97-T379 HydrophobicContact CE2-CG2 4.19Å; F97-T379 HydrophobicContact CG-CG2 3.8Å; F97-T379 HydrophobicContact CZ-CG2 4.14Å; F99-T379 VanDerWaalsContact CE2-OG1 3.26Å; F99-T379 WeakPolarHBondContact CE2-OG1 3.5Å; L300-T379 HydrophobicContact CD1-CG2 4.25Å; T379-L381 VanDerWaalsContact C-N 3.35Å; T379-L381 PolarHBondContact O-N 3.18Å; T379-T382 PolarHBondContact O-N 2.87Å; T379-F383 HydrophobicContact CG2-CD1 4.17Å; T379-F383 HydrophobicContact CG2-CD2 4.06Å; T379-F383 HydrophobicContact CG2-CE1 3.76Å; T379-F383 HydrophobicContact CG2-CE2 3.63Å; T379-F383 HydrophobicContact CG2-CG 4.33Å; T379-F383 HydrophobicContact CG2-CZ 3.47Å; T379-F383 VanDerWaalsContact CG2-CZ 3.47Å; T379-F383 WeakPolarHBondContact O-CB 3.46Å; T379-F383 WeakPolarHBondContact O-CG 3.37Å; T379-F383 PolarHBondContact O-N 3.46Å
380	A	89.4	Confident	94.4	Very high	22 Å²	22	11.5 Å²	11.5	18%	0.182	8%	0.076	C	C	.	.	H	α-helix	trans	-59.2	-43.2	176.2	0	0	0	0	0	112.7	F97 F112 P378 R384 I435	F97-A380 HydrophobicContact CE2-CB 4.39Å; F112-A380 HydrophobicContact CD2-CB 4.24Å; P378-A380 VanDerWaalsContact C-N 3.28Å; P378-A380 PolarHBondContact O-N 2.98Å; P378-A380 VanDerWaalsContact O-N 3.17Å; A380-R384 PolarHBondContact O-N 3.35Å; A380-I435 HydrophobicContact CB-CD1 4.16Å
381	L	92.7	Very high	94.5	Very high	3 Å²	3	12.2 Å²	12.2	2%	0.016	8%	0.078	C	C	.	.	H	α-helix	trans	-70.8	-43.6	175.6	173.6	57.3	0	0	0	111.2	C377 P378 T379 F383 R384 I385 V432 I435 L438	C377-L381 HydrophobicContact CB-CB 4.22Å; C377-L381 HydrophobicContact CB-CD2 3.91Å; C377-L381 HydrophobicContact CB-CG 3.99Å; P378-L381 PolarHBondContact O-N 3.19Å; T379-L381 VanDerWaalsContact C-N 3.35Å; T379-L381 PolarHBondContact O-N 3.18Å; L381-F383 PolarHBondContact O-N 3.4Å; L381-R384 PolarHBondContact O-N 2.92Å; L381-R384 VanDerWaalsContact O-N 3.11Å; L381-I385 HydrophobicContact CD1-CD1 3.98Å; L381-I385 HydrophobicContact CD1-CG1 4.08Å; L381-I385 HydrophobicContact CG-CD1 3.92Å; L381-I385 HydrophobicContact CG-CG1 4.48Å; L381-I385 WeakPolarHBondContact O-CG1 3.28Å; L381-I385 PolarHBondContact O-N 3.32Å; L381-V432 HydrophobicContact CD2-CB 3.97Å; L381-V432 HydrophobicContact CD2-CG1 4.17Å; L381-V432 HydrophobicContact CD2-CG2 4.04Å; L381-I435 HydrophobicContact CB-CD1 4.07Å; L381-I435 HydrophobicContact CB-CG1 4.21Å; L381-I435 HydrophobicContact CD1-CB 4.48Å; L381-I435 HydrophobicContact CD1-CG1 4.22Å; L381-I435 HydrophobicContact CD1-CG2 3.71Å; L381-L438 HydrophobicContact CD1-CD2 3.88Å; L381-L438 HydrophobicContact CD2-CD2 4.34Å
382	T	94.9	Very high	94.4	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.006	9%	0.089	C	C	.	.	H	α-helix	trans	-53.4	-45.1	174	-57.2	0	0	0	0	111.1	C377 P378 T379 R384 I385 W386	C377-T382 PolarHBondContact O-OG1 3.43Å; P378-T382 PolarHBondContact O-N 3.5Å; P378-T382 PolarHBondContact O-OG1 3.16Å; T379-T382 PolarHBondContact O-N 2.87Å; T382-R384 PolarHBondContact O-N 3.12Å; T382-I385 PolarHBondContact O-N 3.49Å; T382-W386 HydrophobicContact CG2-CD2 4.15Å; T382-W386 HydrophobicContact CG2-CG 4.45Å; T382-W386 HydrophobicContact CG2-CZ2 3.95Å; T382-W386 WeakPolarHBondContact O-CB 3.41Å; T382-W386 VanDerWaalsContact O-CG 3.28Å; T382-W386 PolarHBondContact O-N 2.94Å
383	F	95	Very high	94.2	Very high	0 Å²	0	15 Å²	15	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-67.9	-34.1	179.7	-70.6	-2.6	0	0	0	112.9	F97 H199 W206 N297 L300 T379 L381 W386 D387	F97-F383 HydrophobicContact CD1-CE2 4.04Å; F97-F383 AromaticContact CE1-CD2 3.92Å; F97-F383 HydrophobicContact CE1-CD2 3.92Å; F97-F383 AromaticContact CE1-CE2 3.52Å; F97-F383 HydrophobicContact CE1-CE2 3.52Å; F97-F383 HydrophobicContact CZ-CD2 4.32Å; F97-F383 HydrophobicContact CZ-CE2 4.33Å; H199-F383 AromaticContact CE1-CE2 3.91Å; H199-F383 AromaticContact ND1-CD2 3.96Å; W206-F383 HydrophobicContact CH2-CB 4.28Å; W206-F383 AromaticContact CH2-CD1 3.67Å; W206-F383 HydrophobicContact CH2-CD1 3.67Å; W206-F383 HydrophobicContact CH2-CD2 4.37Å; W206-F383 HydrophobicContact CH2-CE1 4.01Å; W206-F383 AromaticContact CH2-CG 3.86Å; W206-F383 HydrophobicContact CH2-CG 3.86Å; W206-F383 HydrophobicContact CH2-CZ 4.49Å; W206-F383 HydrophobicContact CZ2-CB 4.13Å; W206-F383 HydrophobicContact CZ2-CD1 4.35Å; W206-F383 HydrophobicContact CZ2-CG 4.21Å; N297-F383 HydrophobicContact CB-CE1 4.18Å; L300-F383 HydrophobicContact CB-CZ 4.42Å; T379-F383 HydrophobicContact CG2-CD1 4.17Å; T379-F383 HydrophobicContact CG2-CD2 4.06Å; T379-F383 HydrophobicContact CG2-CE1 3.76Å; T379-F383 HydrophobicContact CG2-CE2 3.63Å; T379-F383 HydrophobicContact CG2-CG 4.33Å; T379-F383 HydrophobicContact CG2-CZ 3.47Å; T379-F383 VanDerWaalsContact CG2-CZ 3.47Å; T379-F383 WeakPolarHBondContact O-CB 3.46Å; T379-F383 WeakPolarHBondContact O-CG 3.37Å; T379-F383 PolarHBondContact O-N 3.46Å; L381-F383 PolarHBondContact O-N 3.4Å; F383-W386 HydrophobicContact CD1-CE3 4.33Å; F383-W386 HydrophobicContact CE1-CE3 4.48Å; F383-W386 HydrophobicContact CE1-CZ3 4.44Å; F383-W386 PolarHBondContact O-N 2.8Å; F383-D387 PolarHBondContact O-N 2.87Å
384	R	94.7	Very high	94.1	Very high	1 Å²	1	15.7 Å²	15.7	0%	0.004	10%	0.102	C	C	.	.	H	α-helix	trans	-64.4	-45.4	169.9	-75.3	-59.5	-60.6	129	-5.8	112.5	I178 Q194 L195 A380 L381 T382 W386 D387 L388 I435	I178-R384 PolarHBondContact O-NH1 3.48Å; I178-R384 PolarHBondContact O-NH2 3.45Å; Q194-R384 HydrophobicContact CG-CG 4.08Å; L195-R384 VanDerWaalsContact O-CD 3.22Å; L195-R384 WeakPolarHBondContact O-CD 3.26Å; L195-R384 PolarHBondContact O-NE 3.24Å; A380-R384 PolarHBondContact O-N 3.35Å; L381-R384 PolarHBondContact O-N 2.92Å; L381-R384 VanDerWaalsContact O-N 3.11Å; T382-R384 PolarHBondContact O-N 3.12Å; R384-W386 PolarHBondContact O-N 3.18Å; R384-D387 IonicContact CZ-OD2 3.48Å; R384-D387 IonicContact NH1-OD2 2.66Å; R384-D387 PolarHBondContact NH1-OD2 3.06Å; R384-D387 WeakPolarHBondContact O-CB 3.25Å; R384-D387 PolarHBondContact O-N 3.33Å; R384-L388 WeakPolarHBondContact O-CG 3.31Å; R384-L388 PolarHBondContact O-N 3.08Å; R384-I435 HydrophobicContact CB-CG2 3.87Å; R384-I435 HydrophobicContact CG-CG2 3.66Å
385	I	96.8	Very high	94.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-39.1	176	-64.3	165.2	0	0	0	109.7	Y373 L381 T382 L388 L389 L397 I400	Y373-I385 HydrophobicContact CD1-CD1 4.29Å; Y373-I385 HydrophobicContact CD2-CD1 4.18Å; Y373-I385 HydrophobicContact CD2-CG2 3.92Å; Y373-I385 HydrophobicContact CE2-CG2 4.46Å; Y373-I385 HydrophobicContact CG-CD1 3.84Å; L381-I385 HydrophobicContact CD1-CD1 3.98Å; L381-I385 HydrophobicContact CD1-CG1 4.08Å; L381-I385 HydrophobicContact CG-CD1 3.92Å; L381-I385 HydrophobicContact CG-CG1 4.48Å; L381-I385 WeakPolarHBondContact O-CG1 3.28Å; L381-I385 PolarHBondContact O-N 3.32Å; T382-I385 PolarHBondContact O-N 3.49Å; I385-L388 PolarHBondContact O-N 2.93Å; I385-L389 WeakPolarHBondContact O-CB 3.36Å; I385-L389 PolarHBondContact O-N 2.97Å; I385-L397 HydrophobicContact CG2-CD2 4.42Å; I385-I400 HydrophobicContact CD1-CG2 3.88Å; I385-I400 HydrophobicContact CG1-CD1 4.27Å; I385-I400 HydrophobicContact CG1-CG1 4.22Å; I385-I400 HydrophobicContact CG1-CG2 4.18Å; I385-I400 HydrophobicContact CG2-CG1 4.42Å
386	W	97.6	Very high	94.3	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-72.4	-37.8	179.3	-72.4	13.9	0	0	0	113.6	W206 I294 N297 L298 L372 T382 F383 R384 L388 L389 F390	W206-W386 HydrophobicContact CH2-CB 4.49Å; W206-W386 AromaticContact CH2-CE3 3.86Å; W206-W386 HydrophobicContact CH2-CE3 3.86Å; W206-W386 HydrophobicContact CZ2-CB 4.17Å; W206-W386 HydrophobicContact CZ3-CE3 4.02Å; W206-W386 HydrophobicContact CZ3-CZ3 4.48Å; I294-W386 HydrophobicContact CB-CH2 4.41Å; I294-W386 HydrophobicContact CB-CZ2 4.47Å; I294-W386 HydrophobicContact CG2-CH2 3.82Å; I294-W386 HydrophobicContact CG2-CZ2 3.98Å; I294-W386 WeakPolarHBondContact O-CH2 3.13Å; N297-W386 HydrophobicContact CB-CH2 3.47Å; N297-W386 VanDerWaalsContact CB-CH2 3.47Å; N297-W386 HydrophobicContact CB-CZ2 4.35Å; N297-W386 HydrophobicContact CB-CZ3 3.84Å; L298-W386 HydrophobicContact CD2-CE3 4.09Å; L298-W386 HydrophobicContact CD2-CH2 4.49Å; L298-W386 HydrophobicContact CD2-CZ3 3.6Å; L298-W386 HydrophobicContact CG-CH2 4.17Å; L298-W386 HydrophobicContact CG-CZ3 3.7Å; L372-W386 HydrophobicContact CB-CZ2 4.49Å; L372-W386 PolarHBondContact O-NE1 3.43Å; T382-W386 HydrophobicContact CG2-CD2 4.15Å; T382-W386 HydrophobicContact CG2-CG 4.45Å; T382-W386 HydrophobicContact CG2-CZ2 3.95Å; T382-W386 WeakPolarHBondContact O-CB 3.41Å; T382-W386 VanDerWaalsContact O-CG 3.28Å; T382-W386 PolarHBondContact O-N 2.94Å; F383-W386 HydrophobicContact CD1-CE3 4.33Å; F383-W386 HydrophobicContact CE1-CE3 4.48Å; F383-W386 HydrophobicContact CE1-CZ3 4.44Å; F383-W386 PolarHBondContact O-N 2.8Å; R384-W386 PolarHBondContact O-N 3.18Å; W386-L388 PolarHBondContact O-N 3.38Å; W386-L389 PolarHBondContact O-N 3.15Å; W386-F390 HydrophobicContact CB-CD2 4.38Å; W386-F390 HydrophobicContact CB-CE2 3.81Å; W386-F390 HydrophobicContact CB-CZ 4Å; W386-F390 HydrophobicContact CD2-CZ 4.23Å; W386-F390 HydrophobicContact CE3-CE2 4.37Å; W386-F390 HydrophobicContact CE3-CZ 4.08Å; W386-F390 HydrophobicContact CG-CE2 4.5Å; W386-F390 HydrophobicContact CG-CZ 4.25Å; W386-F390 WeakPolarHBondContact O-CB 3.48Å; W386-F390 WeakPolarHBondContact O-CD2 3.14Å; W386-F390 WeakPolarHBondContact O-CG 3.49Å; W386-F390 PolarHBondContact O-N 2.91Å
387	D	97	Very high	94.5	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-51.6	-44.7	171.2	-64.6	-24.9	0	0	0	110.2	I197 R202 W206 F383 R384 Y391	I197-D387 HydrophobicContact CD1-CB 3.74Å; I197-D387 WeakPolarHBondContact CD1-OD1 3.47Å; I197-D387 HydrophobicContact CG1-CB 3.92Å; R202-D387 IonicContact CZ-OD1 2.63Å; R202-D387 IonicContact CZ-OD2 2.88Å; R202-D387 IonicContact NE-OD1 2.63Å; R202-D387 PolarHBondContact NE-OD1 2.94Å; R202-D387 IonicContact NE-OD2 3.51Å; R202-D387 IonicContact NH2-OD1 3.55Å; R202-D387 IonicContact NH2-OD2 3.09Å; R202-D387 PolarHBondContact NH2-OD2 2.99Å; W206-D387 PolarHBondContact NE1-OD1 3.16Å; F383-D387 PolarHBondContact O-N 2.87Å; R384-D387 IonicContact CZ-OD2 3.48Å; R384-D387 IonicContact NH1-OD2 2.66Å; R384-D387 PolarHBondContact NH1-OD2 3.06Å; R384-D387 WeakPolarHBondContact O-CB 3.25Å; R384-D387 PolarHBondContact O-N 3.33Å; D387-Y391 PolarHBondContact O-N 2.69Å
388	L	97.2	Very high	94.8	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-75.9	-40.3	179	-56	-179.1	0	0	0	112.5	I178 R179 R384 I385 W386 F390 Y391 D392 I396 I439 Y443	I178-L388 HydrophobicContact CG2-CD2 3.87Å; I178-L388 WeakPolarHBondContact O-CD2 3.31Å; R179-L388 HydrophobicContact CG-CD2 4.22Å; R384-L388 WeakPolarHBondContact O-CG 3.31Å; R384-L388 PolarHBondContact O-N 3.08Å; I385-L388 PolarHBondContact O-N 2.93Å; W386-L388 PolarHBondContact O-N 3.38Å; L388-F390 VanDerWaalsContact C-N 3.28Å; L388-F390 PolarHBondContact O-N 3.39Å; L388-Y391 PolarHBondContact O-N 3.06Å; L388-Y391 VanDerWaalsContact O-N 3.08Å; L388-D392 PolarHBondContact O-N 3.27Å; L388-I396 HydrophobicContact CB-CB 4.45Å; L388-I396 HydrophobicContact CB-CD1 4.04Å; L388-I396 HydrophobicContact CB-CG1 3.68Å; L388-I396 HydrophobicContact CD1-CD1 3.78Å; L388-I396 HydrophobicContact CD1-CG1 4.04Å; L388-I439 HydrophobicContact CD1-CD1 3.6Å; L388-I439 HydrophobicContact CD1-CG1 4.23Å; L388-I439 HydrophobicContact CD1-CG2 3.93Å; L388-Y443 HydrophobicContact CD1-CE2 3.95Å; L388-Y443 HydrophobicContact CD2-CE2 4.33Å
389	L	97.3	Very high	95.2	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.3	-40.5	176.9	174.2	63.5	0	0	0	111.7	L318 L372 I385 W386 Y391 G393 I396 L397	L318-L389 HydrophobicContact CD1-CG 4.47Å; L372-L389 HydrophobicContact CD1-CD2 3.86Å; L372-L389 HydrophobicContact CD2-CD2 4.26Å; L372-L389 HydrophobicContact CG-CD2 4.45Å; I385-L389 WeakPolarHBondContact O-CB 3.36Å; I385-L389 PolarHBondContact O-N 2.97Å; W386-L389 PolarHBondContact O-N 3.15Å; L389-Y391 PolarHBondContact O-N 3.17Å; L389-G393 WeakPolarHBondContact O-CA 3.14Å; L389-G393 PolarHBondContact O-N 2.72Å; L389-G393 VanDerWaalsContact O-N 3.1Å; L389-I396 HydrophobicContact CB-CG2 3.86Å; L389-I396 HydrophobicContact CD1-CG2 4.14Å; L389-L397 HydrophobicContact CD1-CD1 4.47Å; L389-L397 HydrophobicContact CD1-CD2 4.32Å; L389-L397 HydrophobicContact CD1-CG 4.27Å
390	F	96.5	Very high	95.5	Very high	7 Å²	7	7.9 Å²	7.9	3%	0.031	5%	0.047	C	C	.	.	H	α-helix	trans	-74.1	-16.5	179.2	-59	-27.2	0	0	0	112.9	W206 L209 T210 L298 M310 I314 L318 W386 L388	W206-F390 HydrophobicContact CB-CD2 3.94Å; W206-F390 HydrophobicContact CB-CE2 4.17Å; W206-F390 AromaticContact CD1-CD2 3.69Å; W206-F390 AromaticContact CD2-CD2 3.87Å; W206-F390 HydrophobicContact CD2-CD2 3.87Å; W206-F390 AromaticContact CD2-CE2 3.56Å; W206-F390 HydrophobicContact CD2-CE2 3.56Å; W206-F390 AromaticContact CE2-CE2 3.86Å; W206-F390 AromaticContact CE3-CE2 3.81Å; W206-F390 HydrophobicContact CE3-CE2 3.81Å; W206-F390 AromaticContact CG-CD2 3.59Å; W206-F390 HydrophobicContact CG-CD2 3.59Å; W206-F390 AromaticContact CG-CE2 3.76Å; W206-F390 HydrophobicContact CG-CE2 3.76Å; W206-F390 HydrophobicContact CZ2-CE2 4.36Å; W206-F390 HydrophobicContact CZ3-CE2 4.31Å; W206-F390 AromaticContact NE1-CD2 3.97Å; L209-F390 HydrophobicContact CB-CB 4.05Å; L209-F390 HydrophobicContact CD1-CB 4.23Å; T210-F390 HydrophobicContact CG2-CB 3.76Å; T210-F390 HydrophobicContact CG2-CD1 3.5Å; T210-F390 HydrophobicContact CG2-CD2 4.35Å; T210-F390 HydrophobicContact CG2-CE1 4.19Å; T210-F390 HydrophobicContact CG2-CG 3.6Å; L298-F390 HydrophobicContact CD2-CZ 4.46Å; M310-F390 HydrophobicContact CE-CD1 4.28Å; M310-F390 HydrophobicContact CE-CD2 3.86Å; M310-F390 HydrophobicContact CE-CE1 3.9Å; M310-F390 HydrophobicContact CE-CE2 3.43Å; M310-F390 VanDerWaalsContact CE-CE2 3.43Å; M310-F390 HydrophobicContact CE-CG 4.27Å; M310-F390 HydrophobicContact CE-CZ 3.46Å; M310-F390 VanDerWaalsContact CE-CZ 3.46Å; I314-F390 HydrophobicContact CD1-CE1 4.06Å; I314-F390 HydrophobicContact CD1-CZ 4.33Å; I314-F390 HydrophobicContact CG1-CE1 4.02Å; L318-F390 HydrophobicContact CD1-CD1 3.59Å; L318-F390 HydrophobicContact CD1-CE1 3.98Å; W386-F390 HydrophobicContact CB-CD2 4.38Å; W386-F390 HydrophobicContact CB-CE2 3.81Å; W386-F390 HydrophobicContact CB-CZ 4Å; W386-F390 HydrophobicContact CD2-CZ 4.23Å; W386-F390 HydrophobicContact CE3-CE2 4.37Å; W386-F390 HydrophobicContact CE3-CZ 4.08Å; W386-F390 HydrophobicContact CG-CE2 4.5Å; W386-F390 HydrophobicContact CG-CZ 4.25Å; W386-F390 WeakPolarHBondContact O-CB 3.48Å; W386-F390 WeakPolarHBondContact O-CD2 3.14Å; W386-F390 WeakPolarHBondContact O-CG 3.49Å; W386-F390 PolarHBondContact O-N 2.91Å; L388-F390 VanDerWaalsContact C-N 3.28Å; L388-F390 PolarHBondContact O-N 3.39Å
391	Y	95.3	Very high	95.9	Very high	20 Å²	20	6.8 Å²	6.8	8%	0.078	4%	0.039	C	C	.	.	H	α-helix	trans	-101	-56.8	179.3	-171.7	-108.4	0	0	0	113.8	Q170 L174 T175 I178 L209 D387 L388 L389	Q170-Y391 HydrophobicContact CG-CE2 3.84Å; L174-Y391 HydrophobicContact CD2-CE2 3.89Å; L174-Y391 HydrophobicContact CG-CE2 4.04Å; T175-Y391 HydrophobicContact CG2-CE1 4.11Å; T175-Y391 PolarHBondContact N-OH 3.07Å; T175-Y391 PolarHBondContact OG1-OH 3.38Å; I178-Y391 HydrophobicContact CB-CD1 4.5Å; I178-Y391 HydrophobicContact CB-CG 4.47Å; I178-Y391 HydrophobicContact CD1-CD1 4.25Å; I178-Y391 HydrophobicContact CD1-CD2 3.24Å; I178-Y391 HydrophobicContact CD1-CE2 3.64Å; I178-Y391 HydrophobicContact CD1-CG 3.58Å; I178-Y391 HydrophobicContact CG2-CD1 4.09Å; I178-Y391 HydrophobicContact CG2-CG 3.95Å; L209-Y391 HydrophobicContact CD2-CD2 3.92Å; D387-Y391 PolarHBondContact O-N 2.69Å; L388-Y391 PolarHBondContact O-N 3.06Å; L388-Y391 VanDerWaalsContact O-N 3.08Å; L389-Y391 PolarHBondContact O-N 3.17Å
392	D	92.1	Very high	96.1	Very high	44 Å²	44	6.7 Å²	6.7	24%	0.235	4%	0.038	C	C	.	.	H	α-helix	trans	-90.4	-7.2	-176.4	-75	-28.9	0	0	0	112.8	R179 L388 Y443	R179-D392 IonicContact CZ-OD1 2.87Å; R179-D392 IonicContact CZ-OD2 2.91Å; R179-D392 IonicContact NE-OD1 3.42Å; R179-D392 IonicContact NE-OD2 3.56Å; R179-D392 PolarHBondContact NE-OD2 2.89Å; R179-D392 VanDerWaalsContact NE-OD2 3.07Å; R179-D392 VanDerWaalsContact NH2-CG 3.32Å; R179-D392 IonicContact NH2-OD1 2.82Å; R179-D392 PolarHBondContact NH2-OD1 2.72Å; R179-D392 IonicContact NH2-OD2 3.33Å; R179-D392 PolarHBondContact NH2-OD2 2.92Å; R179-D392 VanDerWaalsContact NH2-OD2 3.1Å; L388-D392 PolarHBondContact O-N 3.27Å; D392-Y443 PolarHBondContact OD2-OH 3.17Å
393	G	93.4	Very high	96.2	Very high	17 Å²	17	6.6 Å²	6.6	18%	0.175	4%	0.038	C	C	.	.			trans	79	-170.5	-178.5	0	0	0	0	0	113.5	L389 V395 I396	L389-G393 WeakPolarHBondContact O-CA 3.14Å; L389-G393 PolarHBondContact O-N 2.72Å; L389-G393 VanDerWaalsContact O-N 3.1Å; G393-V395 PolarHBondContact O-N 2.92Å; G393-V395 VanDerWaalsContact O-N 3.08Å; G393-I396 WeakPolarHBondContact O-CG2 3.3Å; G393-I396 PolarHBondContact O-N 3.26Å
394	S	94.9	Very high	96.3	Very high	13 Å²	13	6.7 Å²	6.7	9%	0.091	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-4.5	-170.3	54.3	0	0	0	0	115.8	L318 I396 L397 R459	L318-S394 WeakPolarHBondContact O-CB 3.31Å; L318-S394 PolarHBondContact O-OG 3.48Å; S394-I396 PolarHBondContact O-N 3.06Å; S394-L397 WeakPolarHBondContact O-CB 3.25Å; S394-L397 PolarHBondContact O-N 2.99Å; S394-R459 PolarHBondContact OG-NH1 3.28Å; S394-R459 PolarHBondContact OG-NH2 2.99Å
395	V	94.7	Very high	96.3	Very high	15 Å²	15	6.7 Å²	6.7	9%	0.091	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-32.6	172.6	173.8	0	0	0	0	111.2	G393 L397 F398 R399 L450 P452 I455	G393-V395 PolarHBondContact O-N 2.92Å; G393-V395 VanDerWaalsContact O-N 3.08Å; V395-L397 PolarHBondContact O-N 2.92Å; V395-L397 VanDerWaalsContact O-N 3.11Å; V395-F398 PolarHBondContact O-N 3.41Å; V395-R399 PolarHBondContact O-N 2.9Å; V395-L450 VanDerWaalsContact CG1-O 3.26Å; V395-L450 WeakPolarHBondContact CG1-O 3.35Å; V395-P452 HydrophobicContact CG2-CB 4.11Å; V395-P452 HydrophobicContact CG2-CG 4.12Å; V395-I455 HydrophobicContact CG1-CG1 4.37Å; V395-I455 HydrophobicContact CG2-CB 4.31Å; V395-I455 HydrophobicContact CG2-CG1 4.3Å; V395-I455 HydrophobicContact CG2-CG2 4.35Å
396	I	96.4	Very high	96.2	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-58.3	-29.4	-180	-165.2	65.5	0	0	0	112.5	L388 L389 G393 S394 F398 R399 I400 Y443	L388-I396 HydrophobicContact CB-CB 4.45Å; L388-I396 HydrophobicContact CB-CD1 4.04Å; L388-I396 HydrophobicContact CB-CG1 3.68Å; L388-I396 HydrophobicContact CD1-CD1 3.78Å; L388-I396 HydrophobicContact CD1-CG1 4.04Å; L389-I396 HydrophobicContact CB-CG2 3.86Å; L389-I396 HydrophobicContact CD1-CG2 4.14Å; G393-I396 WeakPolarHBondContact O-CG2 3.3Å; G393-I396 PolarHBondContact O-N 3.26Å; S394-I396 PolarHBondContact O-N 3.06Å; I396-F398 PolarHBondContact O-N 3.05Å; I396-R399 HydrophobicContact CD1-CB 4.18Å; I396-R399 PolarHBondContact O-N 2.78Å; I396-R399 VanDerWaalsContact O-N 3.16Å; I396-I400 HydrophobicContact CD1-CG1 4.39Å; I396-I400 HydrophobicContact CG1-CG1 3.98Å; I396-I400 VanDerWaalsContact O-CG1 3.31Å; I396-I400 WeakPolarHBondContact O-CG1 3.34Å; I396-I400 PolarHBondContact O-N 3.2Å; I396-Y443 HydrophobicContact CD1-CE2 4.46Å
397	L	97.3	Very high	96	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-61.2	-34	-179.6	-56.9	177.4	0	0	0	111.3	L319 F369 L372 Y373 I385 L389 S394 V395 A401	L319-L397 HydrophobicContact CD2-CD1 4.04Å; F369-L397 HydrophobicContact CD1-CB 3.89Å; F369-L397 HydrophobicContact CD1-CD1 4.27Å; F369-L397 HydrophobicContact CE1-CB 3.66Å; L372-L397 HydrophobicContact CD2-CD1 3.79Å; L372-L397 HydrophobicContact CD2-CD2 4.25Å; Y373-L397 HydrophobicContact CD2-CD2 3.99Å; Y373-L397 HydrophobicContact CE2-CB 4.28Å; Y373-L397 HydrophobicContact CE2-CD2 3.75Å; Y373-L397 PolarHBondContact OH-O 2.66Å; I385-L397 HydrophobicContact CG2-CD2 4.42Å; L389-L397 HydrophobicContact CD1-CD1 4.47Å; L389-L397 HydrophobicContact CD1-CD2 4.32Å; L389-L397 HydrophobicContact CD1-CG 4.27Å; S394-L397 WeakPolarHBondContact O-CB 3.25Å; S394-L397 PolarHBondContact O-N 2.99Å; V395-L397 PolarHBondContact O-N 2.92Å; V395-L397 VanDerWaalsContact O-N 3.11Å; L397-A401 WeakPolarHBondContact O-CB 3.31Å; L397-A401 PolarHBondContact O-N 3.36Å; L397-A401 VanDerWaalsContact O-N 3.16Å
398	F	97.6	Very high	95.8	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-74.4	-43.3	174.7	-59.5	-74.9	0	0	0	112.3	D335 V338 L339 L342 F369 V395 I396 I400 A401 L402 L450 I455	D335-F398 HydrophobicContact CB-CE1 4.17Å; D335-F398 HydrophobicContact CB-CZ 3.92Å; D335-F398 VanDerWaalsContact O-CE1 3.32Å; D335-F398 WeakPolarHBondContact O-CE1 3.45Å; V338-F398 HydrophobicContact CB-CE1 3.69Å; V338-F398 HydrophobicContact CB-CZ 3.94Å; V338-F398 HydrophobicContact CG1-CD1 4.15Å; V338-F398 HydrophobicContact CG1-CE1 3.54Å; V338-F398 HydrophobicContact CG1-CE2 4.43Å; V338-F398 HydrophobicContact CG1-CZ 3.7Å; L339-F398 HydrophobicContact CB-CD1 4.22Å; L339-F398 HydrophobicContact CB-CE1 4.43Å; L342-F398 HydrophobicContact CD1-CB 4.15Å; L342-F398 HydrophobicContact CD1-CD1 4.08Å; L342-F398 HydrophobicContact CD1-CG 4.22Å; F369-F398 HydrophobicContact CE1-CD1 4.11Å; F369-F398 HydrophobicContact CE1-CE1 4.08Å; F369-F398 AromaticContact CZ-CD1 3.95Å; F369-F398 HydrophobicContact CZ-CD1 3.95Å; F369-F398 HydrophobicContact CZ-CE1 4.04Å; V395-F398 PolarHBondContact O-N 3.41Å; I396-F398 PolarHBondContact O-N 3.05Å; F398-I400 VanDerWaalsContact C-N 3.31Å; F398-I400 PolarHBondContact O-N 2.92Å; F398-A401 PolarHBondContact O-N 3.08Å; F398-L402 WeakPolarHBondContact O-CG 3.43Å; F398-L402 PolarHBondContact O-N 3.02Å; F398-L450 HydrophobicContact CB-CD2 3.9Å; F398-I455 HydrophobicContact CD2-CD1 4.15Å; F398-I455 HydrophobicContact CD2-CG2 3.95Å; F398-I455 HydrophobicContact CE2-CD1 4.45Å; F398-I455 HydrophobicContact CE2-CG2 3.4Å; F398-I455 VanDerWaalsContact CE2-CG2 3.4Å; F398-I455 HydrophobicContact CG-CD1 4.45Å; F398-I455 HydrophobicContact CZ-CG2 4.14Å
399	R	97.2	Very high	95.6	Very high	21 Å²	21	16.6 Å²	16.6	8%	0.079	9%	0.091	C	C	.	.	H	α-helix	trans	-58.6	-44.7	177.5	-69.2	-175.7	174.9	-89.8	-3	111.7	V395 I396 L402 A403 A442 L445 D447 L450	V395-R399 PolarHBondContact O-N 2.9Å; I396-R399 HydrophobicContact CD1-CB 4.18Å; I396-R399 PolarHBondContact O-N 2.78Å; I396-R399 VanDerWaalsContact O-N 3.16Å; R399-L402 PolarHBondContact O-N 2.55Å; R399-A403 VanDerWaalsContact O-CB 3.29Å; R399-A403 WeakPolarHBondContact O-CB 3.46Å; R399-A403 PolarHBondContact O-N 3.05Å; R399-A442 HydrophobicContact CB-CB 4.09Å; R399-A442 PolarHBondContact NH1-O 3.15Å; R399-L445 PolarHBondContact NH1-O 3.48Å; R399-D447 IonicContact CZ-OD1 3.31Å; R399-D447 IonicContact NH1-OD1 3.36Å; R399-D447 IonicContact NH2-OD1 2.7Å; R399-D447 PolarHBondContact NH2-OD1 3.39Å; R399-L450 HydrophobicContact CG-CD1 4.06Å; R399-L450 HydrophobicContact CG-CD2 4.18Å
400	I	97.5	Very high	95.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-66.1	-42.6	176.8	-62.8	-65.2	0	0	0	110.9	Y373 I385 I396 F398 L402 A403 L404 I439 A442	Y373-I400 HydrophobicContact CD1-CG2 4.48Å; Y373-I400 HydrophobicContact CE1-CG2 3.96Å; Y373-I400 HydrophobicContact CE2-CB 4.44Å; Y373-I400 HydrophobicContact CE2-CG2 4.24Å; I385-I400 HydrophobicContact CD1-CG2 3.88Å; I385-I400 HydrophobicContact CG1-CD1 4.27Å; I385-I400 HydrophobicContact CG1-CG1 4.22Å; I385-I400 HydrophobicContact CG1-CG2 4.18Å; I385-I400 HydrophobicContact CG2-CG1 4.42Å; I396-I400 HydrophobicContact CD1-CG1 4.39Å; I396-I400 HydrophobicContact CG1-CG1 3.98Å; I396-I400 VanDerWaalsContact O-CG1 3.31Å; I396-I400 WeakPolarHBondContact O-CG1 3.34Å; I396-I400 PolarHBondContact O-N 3.2Å; F398-I400 VanDerWaalsContact C-N 3.31Å; F398-I400 PolarHBondContact O-N 2.92Å; I400-L402 PolarHBondContact O-N 2.61Å; I400-A403 PolarHBondContact O-N 3.42Å; I400-L404 HydrophobicContact CG2-CD1 3.89Å; I400-L404 HydrophobicContact CG2-CG 4.25Å; I400-L404 WeakPolarHBondContact O-CB 3.41Å; I400-L404 VanDerWaalsContact O-CG 3.25Å; I400-L404 WeakPolarHBondContact O-CG 3.44Å; I400-L404 PolarHBondContact O-N 3.2Å; I400-I439 HydrophobicContact CD1-CD1 3.46Å; I400-I439 VanDerWaalsContact CD1-CD1 3.46Å; I400-A442 HydrophobicContact CD1-CB 4.07Å
401	A	97.5	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.8	-48.4	176.6	0	0	0	0	0	111.4	L339 W368 F369 Y373 L397 F398 L404 L405	L339-A401 HydrophobicContact CD1-CB 3.77Å; L339-A401 HydrophobicContact CD2-CB 3.78Å; L339-A401 HydrophobicContact CG-CB 4.45Å; W368-A401 HydrophobicContact CE3-CB 4.31Å; W368-A401 HydrophobicContact CZ3-CB 4.32Å; F369-A401 HydrophobicContact CZ-CB 4.31Å; Y373-A401 WeakPolarHBondContact OH-CA 3.34Å; Y373-A401 WeakPolarHBondContact OH-CB 3.37Å; Y373-A401 PolarHBondContact OH-N 3.06Å; L397-A401 WeakPolarHBondContact O-CB 3.31Å; L397-A401 PolarHBondContact O-N 3.36Å; L397-A401 VanDerWaalsContact O-N 3.16Å; F398-A401 PolarHBondContact O-N 3.08Å; A401-L404 PolarHBondContact O-N 3.08Å; A401-L405 WeakPolarHBondContact O-CB 3.4Å; A401-L405 WeakPolarHBondContact O-CG 3.48Å; A401-L405 PolarHBondContact O-N 3.16Å
402	L	97.3	Very high	95.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-40	178.3	-69.7	170.1	0	0	0	112	L339 L342 L343 Y346 F398 R399 I400 L405 S406 L445 L450	L339-L402 HydrophobicContact CD1-CD2 3.98Å; L339-L402 HydrophobicContact CD1-CG 4.05Å; L342-L402 HydrophobicContact CB-CD1 4.42Å; L343-L402 HydrophobicContact CD1-CD2 4.35Å; Y346-L402 HydrophobicContact CD2-CD1 3.61Å; Y346-L402 HydrophobicContact CD2-CD2 4.41Å; Y346-L402 HydrophobicContact CE2-CD1 4.01Å; Y346-L402 HydrophobicContact CG-CD1 3.96Å; F398-L402 WeakPolarHBondContact O-CG 3.43Å; F398-L402 PolarHBondContact O-N 3.02Å; R399-L402 PolarHBondContact O-N 2.55Å; I400-L402 PolarHBondContact O-N 2.61Å; L402-L405 PolarHBondContact O-N 3.41Å; L402-S406 VanDerWaalsContact O-CB 3.22Å; L402-S406 WeakPolarHBondContact O-CB 3.41Å; L402-S406 PolarHBondContact O-N 2.92Å; L402-L445 HydrophobicContact CB-CD1 3.62Å; L402-L445 HydrophobicContact CD1-CD1 4.14Å; L402-L450 HydrophobicContact CD1-CD1 4.15Å; L402-L450 HydrophobicContact CD1-CD2 4.12Å
403	A	96.8	Very high	95.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.9	-41.8	176.5	0	0	0	0	0	112.3	R399 I400 S406 H407 L438 V441 A442	R399-A403 VanDerWaalsContact O-CB 3.29Å; R399-A403 WeakPolarHBondContact O-CB 3.46Å; R399-A403 PolarHBondContact O-N 3.05Å; I400-A403 PolarHBondContact O-N 3.42Å; A403-S406 PolarHBondContact O-N 3.16Å; A403-H407 WeakPolarHBondContact O-CB 3.29Å; A403-H407 PolarHBondContact O-N 3.45Å; A403-L438 HydrophobicContact CB-CD1 3.76Å; A403-L438 HydrophobicContact CB-CG 4.47Å; A403-V441 HydrophobicContact CB-CB 4.34Å; A403-V441 HydrophobicContact CB-CG1 3.93Å; A403-A442 HydrophobicContact CB-CB 3.91Å
404	L	96.7	Very high	95.6	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-44.3	174.6	-73.5	171	0	0	0	111.7	W368 Y373 I400 A401 K408 P429 V432 L438	W368-L404 HydrophobicContact CE3-CD1 4.45Å; W368-L404 HydrophobicContact CH2-CB 4.5Å; W368-L404 HydrophobicContact CZ3-CB 4.41Å; W368-L404 HydrophobicContact CZ3-CD1 4.18Å; Y373-L404 HydrophobicContact CD1-CD1 4.34Å; Y373-L404 HydrophobicContact CE1-CD1 3.8Å; I400-L404 HydrophobicContact CG2-CD1 3.89Å; I400-L404 HydrophobicContact CG2-CG 4.25Å; I400-L404 WeakPolarHBondContact O-CB 3.41Å; I400-L404 VanDerWaalsContact O-CG 3.25Å; I400-L404 WeakPolarHBondContact O-CG 3.44Å; I400-L404 PolarHBondContact O-N 3.2Å; A401-L404 PolarHBondContact O-N 3.08Å; L404-K408 PolarHBondContact O-N 3.25Å; L404-P429 HydrophobicContact CD1-CB 4.2Å; L404-P429 HydrophobicContact CD1-CG 4.17Å; L404-V432 HydrophobicContact CD2-CG2 3.4Å; L404-V432 VanDerWaalsContact CD2-CG2 3.4Å; L404-L438 HydrophobicContact CD2-CD1 3.91Å; L404-L438 HydrophobicContact CD2-CD2 3.89Å; L404-L438 HydrophobicContact CG-CD1 4.2Å; L404-L438 HydrophobicContact CG-CD2 4.4Å
405	L	95.7	Very high	95.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.2	-40.8	177.2	-69.1	172.2	0	0	0	111.6	L343 L347 L350 L361 W368 A401 L402 K408 S409 L425	L343-L405 HydrophobicContact CD1-CD1 3.76Å; L347-L405 HydrophobicContact CD1-CB 3.58Å; L350-L405 HydrophobicContact CD2-CB 3.95Å; L350-L405 HydrophobicContact CD2-CD2 4.38Å; L361-L405 HydrophobicContact CD1-CD2 4.34Å; L361-L405 HydrophobicContact CD2-CD1 4.14Å; W368-L405 HydrophobicContact CH2-CD2 4.32Å; A401-L405 WeakPolarHBondContact O-CB 3.4Å; A401-L405 WeakPolarHBondContact O-CG 3.48Å; A401-L405 PolarHBondContact O-N 3.16Å; L402-L405 PolarHBondContact O-N 3.41Å; L405-K408 CarbonylContact O-C 3.31Å; L405-K408 PolarHBondContact O-N 3.05Å; L405-S409 WeakPolarHBondContact O-CA 3.37Å; L405-S409 WeakPolarHBondContact O-CB 3.41Å; L405-S409 PolarHBondContact O-N 3.01Å; L405-L425 HydrophobicContact CD2-CD2 3.33Å
406	S	95	Very high	95.4	Very high	46 Å²	46	36.4 Å²	36.4	32%	0.322	19%	0.19	S	C	.	.	H	α-helix	trans	-60.5	-48	176	-176.7	0	0	0	0	111.3	L402 A403 K408 S409	L402-S406 VanDerWaalsContact O-CB 3.22Å; L402-S406 WeakPolarHBondContact O-CB 3.41Å; L402-S406 PolarHBondContact O-N 2.92Å; A403-S406 PolarHBondContact O-N 3.16Å; S406-K408 PolarHBondContact O-N 3.11Å; S406-S409 WeakPolarHBondContact O-CB 3.5Å; S406-S409 PolarHBondContact O-N 3.03Å
407	H	92.5	Very high	95	Very high	111 Å²	111	39.8 Å²	39.8	51%	0.514	21%	0.208	S	C	.	.	H	α-helix	trans	-61.4	-30.7	179.5	-164.3	99.3	0	0	0	113.1	A403	A403-H407 WeakPolarHBondContact O-CB 3.29Å; A403-H407 PolarHBondContact O-N 3.45Å
408	K	92.4	Very high	94.7	Very high	34 Å²	34	42 Å²	42	15%	0.148	22%	0.223	C	C	.	.	H	α-helix	trans	-95.1	-2.3	176.5	-76	-64.7	-171	-178.1	0	114.4	L404 L405 S406 E410 E411 I412 A428 S431	L404-K408 PolarHBondContact O-N 3.25Å; L405-K408 CarbonylContact O-C 3.31Å; L405-K408 PolarHBondContact O-N 3.05Å; S406-K408 PolarHBondContact O-N 3.11Å; K408-E410 PolarHBondContact O-N 3.07Å; K408-E411 WeakPolarHBondContact CD-OE2 3.28Å; K408-E411 IonicContact NZ-OE2 3.83Å; K408-E411 PolarHBondContact NZ-OE2 3.4Å; K408-E411 PolarHBondContact O-N 3.07Å; K408-I412 HydrophobicContact CB-CD1 3.72Å; K408-I412 HydrophobicContact CB-CG1 4.33Å; K408-I412 WeakPolarHBondContact O-CD1 3.05Å; K408-I412 VanDerWaalsContact O-CG1 3.3Å; K408-I412 WeakPolarHBondContact O-CG1 3.27Å; K408-I412 PolarHBondContact O-N 3.28Å; K408-A428 HydrophobicContact CB-CB 4.44Å; K408-A428 HydrophobicContact CG-CB 3.74Å; K408-S431 WeakPolarHBondContact CE-OG 3.45Å
409	S	93.6	Very high	94.4	Very high	18 Å²	18	46 Å²	46	13%	0.126	25%	0.252	C	S	.	.	H	α-helix	trans	-59.2	-47.9	-171.3	-169.9	0	0	0	0	111.9	L405 S406 E411 I412 L413	L405-S409 WeakPolarHBondContact O-CA 3.37Å; L405-S409 WeakPolarHBondContact O-CB 3.41Å; L405-S409 PolarHBondContact O-N 3.01Å; S406-S409 WeakPolarHBondContact O-CB 3.5Å; S406-S409 PolarHBondContact O-N 3.03Å; S409-E411 VanDerWaalsContact C-N 3.35Å; S409-E411 PolarHBondContact O-N 2.69Å; S409-I412 PolarHBondContact O-N 2.86Å; S409-L413 WeakPolarHBondContact O-CB 3.41Å; S409-L413 WeakPolarHBondContact O-CG 3.4Å; S409-L413 PolarHBondContact O-N 3.04Å
410	E	93.5	Very high	94.2	Very high	174 Å²	174	49.9 Å²	49.9	81%	0.813	27%	0.271	S	S	*	.	H	α-helix	trans	-60.3	-43	179.9	-65.4	-170.9	168.2	0	0	112.5	K408 S414	K408-E410 PolarHBondContact O-N 3.07Å; E410-S414 PolarHBondContact O-N 3.4Å
411	E	94.3	Very high	94	Very high	81 Å²	81	49.9 Å²	49.9	38%	0.379	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-49.5	176.2	-176.1	-170.7	137.4	0	0	110.2	K408 S409 L413 S414 L415 S424	K408-E411 WeakPolarHBondContact CD-OE2 3.28Å; K408-E411 IonicContact NZ-OE2 3.83Å; K408-E411 PolarHBondContact NZ-OE2 3.4Å; K408-E411 PolarHBondContact O-N 3.07Å; S409-E411 VanDerWaalsContact C-N 3.35Å; S409-E411 PolarHBondContact O-N 2.69Å; E411-L413 PolarHBondContact O-N 3.15Å; E411-S414 WeakPolarHBondContact O-CB 3.13Å; E411-S414 PolarHBondContact O-N 3.27Å; E411-S414 VanDerWaalsContact O-N 3.15Å; E411-S414 PolarHBondContact O-OG 3.44Å; E411-L415 WeakPolarHBondContact O-CG 3.47Å; E411-S424 WeakPolarHBondContact OE1-CB 3.35Å; E411-S424 PolarHBondContact OE1-OG 3.15Å
412	I	94.6	Very high	93.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.3	-41.8	-176.1	-67.7	161.3	0	0	0	112.1	L350 H353 L354 K408 S409 S414 L415 I421 L425	L350-I412 HydrophobicContact CD1-CB 3.98Å; L350-I412 HydrophobicContact CD1-CD1 4.26Å; L350-I412 HydrophobicContact CD1-CG2 3.47Å; L350-I412 VanDerWaalsContact CD1-CG2 3.47Å; H353-I412 PolarHBondContact NE2-O 2.87Å; L354-I412 HydrophobicContact CD2-CG2 4.47Å; K408-I412 HydrophobicContact CB-CD1 3.72Å; K408-I412 HydrophobicContact CB-CG1 4.33Å; K408-I412 WeakPolarHBondContact O-CD1 3.05Å; K408-I412 VanDerWaalsContact O-CG1 3.3Å; K408-I412 WeakPolarHBondContact O-CG1 3.27Å; K408-I412 PolarHBondContact O-N 3.28Å; S409-I412 PolarHBondContact O-N 2.86Å; I412-S414 PolarHBondContact O-N 3.36Å; I412-L415 WeakPolarHBondContact O-CB 3.36Å; I412-L415 PolarHBondContact O-N 3.07Å; I412-I421 HydrophobicContact CG2-CG1 4.42Å; I412-I421 HydrophobicContact CG2-CG2 3.84Å; I412-L425 HydrophobicContact CD1-CD2 3.42Å; I412-L425 VanDerWaalsContact CD1-CD2 3.42Å; I412-L425 HydrophobicContact CD1-CG 3.78Å; I412-L425 HydrophobicContact CG1-CG 4.48Å
413	L	95.7	Very high	93.5	Very high	51 Å²	51	59.5 Å²	59.5	27%	0.267	31%	0.314	S	S	.	.	H	α-helix	trans	-64	-24.5	178.2	-70.3	171.2	0	0	0	112.3	E349 H353 S409 E411 L415	E349-L413 HydrophobicContact CB-CD1 4.19Å; E349-L413 HydrophobicContact CB-CD2 4.25Å; H353-L413 HydrophobicContact CB-CD2 3.76Å; S409-L413 WeakPolarHBondContact O-CB 3.41Å; S409-L413 WeakPolarHBondContact O-CG 3.4Å; S409-L413 PolarHBondContact O-N 3.04Å; E411-L413 PolarHBondContact O-N 3.15Å; L413-L415 VanDerWaalsContact C-N 3.33Å
414	S	95.6	Very high	93.4	Very high	79 Å²	79	59.8 Å²	59.8	55%	0.552	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-11.6	175.1	79.8	0	0	0	0	114.3	E410 E411 I412 N416	E410-S414 PolarHBondContact O-N 3.4Å; E411-S414 WeakPolarHBondContact O-CB 3.13Å; E411-S414 PolarHBondContact O-N 3.27Å; E411-S414 VanDerWaalsContact O-N 3.15Å; E411-S414 PolarHBondContact O-OG 3.44Å; I412-S414 PolarHBondContact O-N 3.36Å; S414-N416 PolarHBondContact O-OD1 3.44Å
415	L	95.2	Very high	93.2	Very high	29 Å²	29	59.7 Å²	59.7	15%	0.152	32%	0.316	C	S	.	.			trans	-90.8	134.8	-177.3	-61	173.1	0	0	0	111	H353 E411 I412 L413 Q420 I421	H353-L415 PolarHBondContact CE1-O 3.32Å; H353-L415 PolarHBondContact NE2-O 3Å; E411-L415 WeakPolarHBondContact O-CG 3.47Å; I412-L415 WeakPolarHBondContact O-CB 3.36Å; I412-L415 PolarHBondContact O-N 3.07Å; L413-L415 VanDerWaalsContact C-N 3.33Å; L415-Q420 HydrophobicContact CB-CB 4.42Å; L415-Q420 HydrophobicContact CD1-CB 4.1Å; L415-Q420 HydrophobicContact CD2-CB 4.17Å; L415-Q420 HydrophobicContact CG-CB 4.46Å; L415-I421 HydrophobicContact CB-CG1 3.73Å; L415-I421 HydrophobicContact CD1-CG1 4.44Å
416	N	90.9	Very high	93	Very high	118 Å²	118	61.5 Å²	61.5	63%	0.631	33%	0.329	S	S	*	.			trans	-112.5	20.6	-172.3	-54.1	-12	0	0	0	112.8	Y357 S414	Y357-N416 VanDerWaalsContact CE1-O 3.29Å; Y357-N416 WeakPolarHBondContact CE1-O 3.27Å; Y357-N416 VanDerWaalsContact OH-CA 3.3Å; Y357-N416 WeakPolarHBondContact OH-CA 3.15Å; S414-N416 PolarHBondContact O-OD1 3.44Å
417	N	89.2	Confident	92.8	Very high	72 Å²	72	63 Å²	63	39%	0.385	33%	0.333	S	S	.	.	S	Bend	trans	-145.9	127.3	-175.7	177.4	1.5	0	0	0	110.5	S419 Q420 I421	N417-S419 PolarHBondContact O-N 3.47Å; N417-S419 VanDerWaalsContact O-N 3.13Å; N417-S419 PolarHBondContact OD1-N 3.49Å; N417-S419 VanDerWaalsContact OD1-N 3.1Å; N417-Q420 HydrophobicContact CB-CG 4.36Å; N417-Q420 PolarHBondContact O-N 3.25Å; N417-I421 WeakPolarHBondContact O-CG1 3.36Å; N417-I421 PolarHBondContact O-N 3.07Å
418	S	90.4	Very high	92.9	Very high	45 Å²	45	57.8 Å²	57.8	32%	0.315	31%	0.309	S	S	.	.	H	α-helix	trans	-49	-39.9	178.5	-50.6	0	0	0	0	113.4	Y357 I359 F422	Y357-S418 PolarHBondContact O-OG 3.43Å; I359-S418 WeakPolarHBondContact CD1-O 3.45Å; S418-F422 VanDerWaalsContact O-CB 3.28Å; S418-F422 WeakPolarHBondContact O-CB 3.31Å; S418-F422 PolarHBondContact O-N 3.37Å
419	S	90.3	Very high	92.8	Very high	85 Å²	85	56.1 Å²	56.1	59%	0.594	30%	0.302	S	S	*	.	H	α-helix	trans	-68.4	-38.3	179.8	-55.9	0	0	0	0	113.3	N417 H423	N417-S419 PolarHBondContact O-N 3.47Å; N417-S419 VanDerWaalsContact O-N 3.13Å; N417-S419 PolarHBondContact OD1-N 3.49Å; N417-S419 VanDerWaalsContact OD1-N 3.1Å; S419-H423 WeakPolarHBondContact O-CB 3.34Å; S419-H423 PolarHBondContact O-N 2.82Å; S419-H423 VanDerWaalsContact O-N 3.08Å
420	Q	93.6	Very high	92.5	Very high	103 Å²	103	57.7 Å²	57.7	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-71	-42.2	177.8	-68.6	177.9	-15.9	0	0	110.4	L415 N417 H423 S424	L415-Q420 HydrophobicContact CB-CB 4.42Å; L415-Q420 HydrophobicContact CD1-CB 4.1Å; L415-Q420 HydrophobicContact CD2-CB 4.17Å; L415-Q420 HydrophobicContact CG-CB 4.46Å; N417-Q420 HydrophobicContact CB-CG 4.36Å; N417-Q420 PolarHBondContact O-N 3.25Å; Q420-H423 PolarHBondContact O-N 3.1Å; Q420-S424 WeakPolarHBondContact O-CB 3.3Å; Q420-S424 PolarHBondContact O-N 2.86Å
421	I	93.7	Very high	92.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-50.3	175.3	-65.6	166.1	0	0	0	110.3	L354 Y357 I359 I412 L415 N417 H423 S424 L425	L354-I421 HydrophobicContact CD2-CG2 3.7Å; Y357-I421 HydrophobicContact CD1-CD1 4.07Å; Y357-I421 HydrophobicContact CD2-CD1 3.61Å; Y357-I421 HydrophobicContact CE2-CD1 4.17Å; Y357-I421 HydrophobicContact CG-CD1 3.57Å; I359-I421 HydrophobicContact CG1-CB 4.5Å; I359-I421 HydrophobicContact CG1-CG2 3.96Å; I412-I421 HydrophobicContact CG2-CG1 4.42Å; I412-I421 HydrophobicContact CG2-CG2 3.84Å; L415-I421 HydrophobicContact CB-CG1 3.73Å; L415-I421 HydrophobicContact CD1-CG1 4.44Å; N417-I421 WeakPolarHBondContact O-CG1 3.36Å; N417-I421 PolarHBondContact O-N 3.07Å; I421-H423 VanDerWaalsContact C-N 3.3Å; I421-H423 PolarHBondContact O-N 3.47Å; I421-S424 PolarHBondContact O-N 2.93Å; I421-L425 HydrophobicContact CG2-CD1 3.78Å; I421-L425 HydrophobicContact CG2-CG 4.43Å; I421-L425 WeakPolarHBondContact O-CB 3.4Å; I421-L425 WeakPolarHBondContact O-CG 3.38Å; I421-L425 PolarHBondContact O-N 3.04Å
422	F	92.2	Very high	92	Very high	84 Å²	84	48.6 Å²	48.6	37%	0.368	28%	0.284	S	S	.	.	H	α-helix	trans	-58.8	-41.3	178.5	-174.7	-86	0	0	0	112.1	I359 L363 I364 S418 S426	I359-F422 HydrophobicContact CD1-CB 4.4Å; L363-F422 HydrophobicContact CB-CE2 4.32Å; I364-F422 HydrophobicContact CD1-CD2 3.8Å; I364-F422 HydrophobicContact CD1-CE2 3.93Å; I364-F422 HydrophobicContact CD1-CG 4.5Å; I364-F422 HydrophobicContact CG1-CD2 3.95Å; I364-F422 HydrophobicContact CG1-CE2 3.55Å; I364-F422 HydrophobicContact CG1-CZ 4Å; S418-F422 VanDerWaalsContact O-CB 3.28Å; S418-F422 WeakPolarHBondContact O-CB 3.31Å; S418-F422 PolarHBondContact O-N 3.37Å; F422-S426 VanDerWaalsContact O-CB 3.3Å; F422-S426 WeakPolarHBondContact O-CB 3.05Å; F422-S426 PolarHBondContact O-N 3.43Å; F422-S426 PolarHBondContact O-OG 2.7Å
423	H	92.3	Very high	91.6	Very high	117 Å²	117	55.1 Å²	55.1	54%	0.542	32%	0.324	S	S	.	.	H	α-helix	trans	-67.2	-45.5	177.7	-171	60.9	0	0	0	112.3	S419 Q420 I421 S426 N427	S419-H423 WeakPolarHBondContact O-CB 3.34Å; S419-H423 PolarHBondContact O-N 2.82Å; S419-H423 VanDerWaalsContact O-N 3.08Å; Q420-H423 PolarHBondContact O-N 3.1Å; I421-H423 VanDerWaalsContact C-N 3.3Å; I421-H423 PolarHBondContact O-N 3.47Å; H423-S426 PolarHBondContact O-N 2.99Å; H423-N427 PolarHBondContact CD2-ND2 2.83Å; H423-N427 PolarHBondContact CE1-ND2 2.63Å; H423-N427 PolarHBondContact NE2-ND2 3Å; H423-N427 WeakPolarHBondContact O-CB 3.3Å; H423-N427 VanDerWaalsContact O-CG 3.32Å; H423-N427 PolarHBondContact O-N 2.97Å; H423-N427 PolarHBondContact O-ND2 3.27Å
424	S	93.6	Very high	91.2	Very high	7 Å²	7	56.5 Å²	56.5	5%	0.049	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-46.8	177.8	-175.4	0	0	0	0	111	E411 Q420 I421 S426 N427 A428	E411-S424 WeakPolarHBondContact OE1-CB 3.35Å; E411-S424 PolarHBondContact OE1-OG 3.15Å; Q420-S424 WeakPolarHBondContact O-CB 3.3Å; Q420-S424 PolarHBondContact O-N 2.86Å; I421-S424 PolarHBondContact O-N 2.93Å; S424-S426 PolarHBondContact O-N 3.49Å; S424-N427 PolarHBondContact O-N 2.86Å; S424-A428 PolarHBondContact O-N 3.09Å
425	L	93.2	Very high	91	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.1	-46	174.6	-74.6	164.8	0	0	0	112.3	L354 I359 I364 W368 L405 I412 I421 N427 A428	L354-L425 HydrophobicContact CD1-CD1 4.47Å; L354-L425 HydrophobicContact CD2-CD1 3.73Å; I359-L425 HydrophobicContact CG2-CD1 3.9Å; I364-L425 HydrophobicContact CD1-CB 3.75Å; I364-L425 HydrophobicContact CD1-CD1 3.71Å; I364-L425 HydrophobicContact CD1-CG 4.38Å; W368-L425 WeakPolarHBondContact CZ2-O 3.44Å; L405-L425 HydrophobicContact CD2-CD2 3.33Å; I412-L425 HydrophobicContact CD1-CD2 3.42Å; I412-L425 VanDerWaalsContact CD1-CD2 3.42Å; I412-L425 HydrophobicContact CD1-CG 3.78Å; I412-L425 HydrophobicContact CG1-CG 4.48Å; I421-L425 HydrophobicContact CG2-CD1 3.78Å; I421-L425 HydrophobicContact CG2-CG 4.43Å; I421-L425 WeakPolarHBondContact O-CB 3.4Å; I421-L425 WeakPolarHBondContact O-CG 3.38Å; I421-L425 PolarHBondContact O-N 3.04Å; L425-N427 VanDerWaalsContact C-N 3.26Å; L425-N427 PolarHBondContact O-N 3.3Å; L425-A428 VanDerWaalsContact O-CB 3.26Å; L425-A428 WeakPolarHBondContact O-CB 3.41Å; L425-A428 PolarHBondContact O-N 3.26Å
426	S	91.5	Very high	90.8	Very high	38 Å²	38	54.5 Å²	54.5	27%	0.266	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-33.4	-178.8	-61	0	0	0	0	112.4	F422 H423 S424	F422-S426 VanDerWaalsContact O-CB 3.3Å; F422-S426 WeakPolarHBondContact O-CB 3.05Å; F422-S426 PolarHBondContact O-N 3.43Å; F422-S426 PolarHBondContact O-OG 2.7Å; H423-S426 PolarHBondContact O-N 2.99Å; S424-S426 PolarHBondContact O-N 3.49Å
427	N	91.5	Very high	90.9	Very high	77 Å²	77	53 Å²	53	41%	0.412	30%	0.304	S	S	.	.	H	α-helix	trans	-86.4	-8.1	178.3	-68	-17.3	0	0	0	113.7	H423 S424 L425 P429 G430 S431	H423-N427 PolarHBondContact CD2-ND2 2.83Å; H423-N427 PolarHBondContact CE1-ND2 2.63Å; H423-N427 PolarHBondContact NE2-ND2 3Å; H423-N427 WeakPolarHBondContact O-CB 3.3Å; H423-N427 VanDerWaalsContact O-CG 3.32Å; H423-N427 PolarHBondContact O-N 2.97Å; H423-N427 PolarHBondContact O-ND2 3.27Å; S424-N427 PolarHBondContact O-N 2.86Å; L425-N427 VanDerWaalsContact C-N 3.26Å; L425-N427 PolarHBondContact O-N 3.3Å; N427-P429 VanDerWaalsContact C-CD 3.44Å; N427-P429 VanDerWaalsContact C-N 3.34Å; N427-G430 PolarHBondContact O-N 3.06Å; N427-S431 PolarHBondContact O-N 2.75Å; N427-S431 VanDerWaalsContact O-N 3.15Å
428	A	93.2	Very high	91.1	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.008	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-50	-47.3	-176.2	0	0	0	0	0	113	W368 K408 S424 L425 G430 S431	W368-A428 HydrophobicContact CH2-CB 4.46Å; K408-A428 HydrophobicContact CB-CB 4.44Å; K408-A428 HydrophobicContact CG-CB 3.74Å; S424-A428 PolarHBondContact O-N 3.09Å; L425-A428 VanDerWaalsContact O-CB 3.26Å; L425-A428 WeakPolarHBondContact O-CB 3.41Å; L425-A428 PolarHBondContact O-N 3.26Å; A428-G430 VanDerWaalsContact C-N 3.34Å; A428-G430 PolarHBondContact O-N 3.02Å; A428-S431 PolarHBondContact O-N 3.45Å; A428-S431 PolarHBondContact O-OG 2.85Å
429	P	91.7	Very high	91.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-66.1	-33.6	-179.4	-16.4	30.6	0	0	0	113.8	W368 V376 C377 L404 N427 S431	W368-P429 HydrophobicContact CD2-CG 4.23Å; W368-P429 HydrophobicContact CH2-CG 4.25Å; W368-P429 HydrophobicContact CZ2-CG 3.55Å; V376-P429 HydrophobicContact CB-CB 4.01Å; V376-P429 HydrophobicContact CB-CG 4Å; V376-P429 HydrophobicContact CG2-CB 3.82Å; V376-P429 HydrophobicContact CG2-CG 3.84Å; C377-P429 VanDerWaalsContact SG-CB 3.53Å; L404-P429 HydrophobicContact CD1-CB 4.2Å; L404-P429 HydrophobicContact CD1-CG 4.17Å; N427-P429 VanDerWaalsContact C-CD 3.44Å; N427-P429 VanDerWaalsContact C-N 3.34Å; P429-S431 VanDerWaalsContact C-N 3.33Å
430	G	87	Confident	91.5	Very high	50 Å²	50	47.3 Å²	47.3	52%	0.515	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-77.4	-16.7	179.3	0	0	0	0	0	114.1	N427 A428	N427-G430 PolarHBondContact O-N 3.06Å; A428-G430 VanDerWaalsContact C-N 3.34Å; A428-G430 PolarHBondContact O-N 3.02Å
431	S	87.9	Confident	91.5	Very high	40 Å²	40	43.9 Å²	43.9	28%	0.28	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-88	-2.6	-177.8	68	0	0	0	0	115	K408 N427 A428 P429 T433	K408-S431 WeakPolarHBondContact CE-OG 3.45Å; N427-S431 PolarHBondContact O-N 2.75Å; N427-S431 VanDerWaalsContact O-N 3.15Å; A428-S431 PolarHBondContact O-N 3.45Å; A428-S431 PolarHBondContact O-OG 2.85Å; P429-S431 VanDerWaalsContact C-N 3.33Å; S431-T433 PolarHBondContact O-N 3.17Å
432	V	89.4	Confident	91.6	Very high	25 Å²	25	43.9 Å²	43.9	15%	0.152	25%	0.245	C	C	.	.			trans	-69.9	115.8	-178.1	178.5	0	0	0	0	110	L381 L404 L438	L381-V432 HydrophobicContact CD2-CB 3.97Å; L381-V432 HydrophobicContact CD2-CG1 4.17Å; L381-V432 HydrophobicContact CD2-CG2 4.04Å; L404-V432 HydrophobicContact CD2-CG2 3.4Å; L404-V432 VanDerWaalsContact CD2-CG2 3.4Å; V432-L438 HydrophobicContact CG1-CB 4.24Å; V432-L438 HydrophobicContact CG1-CD2 4.06Å; V432-L438 HydrophobicContact CG2-CD2 4.06Å
433	T	84.8	Confident	91.7	Very high	136 Å²	136	41.5 Å²	41.5	83%	0.834	23%	0.234	S	C	*	.			trans	-95.9	-33.3	176.8	55.7	0	0	0	0	113.1	S431	S431-T433 PolarHBondContact O-N 3.17Å
434	D	88.8	Confident	91.8	Very high	81 Å²	81	40.1 Å²	40.1	43%	0.433	24%	0.238	S	C	.	.			trans	-116.4	104.8	178.3	-168.8	-26.3	0	0	0	110.4	N436 E437 L438	D434-N436 PolarHBondContact OD1-N 3.12Å; D434-E437 HydrophobicContact CB-CB 3.99Å; D434-E437 PolarHBondContact OD1-N 3.49Å; D434-L438 PolarHBondContact O-N 2.99Å
435	I	91.7	Very high	91.8	Very high	33 Å²	33	41 Å²	41	17%	0.169	24%	0.242	C	C	.	.	H	α-helix	trans	-70	-38.2	-179.6	-58.1	168.6	0	0	0	110.8	A380 L381 R384 E437 L438 I439	A380-I435 HydrophobicContact CB-CD1 4.16Å; L381-I435 HydrophobicContact CB-CD1 4.07Å; L381-I435 HydrophobicContact CB-CG1 4.21Å; L381-I435 HydrophobicContact CD1-CB 4.48Å; L381-I435 HydrophobicContact CD1-CG1 4.22Å; L381-I435 HydrophobicContact CD1-CG2 3.71Å; R384-I435 HydrophobicContact CB-CG2 3.87Å; R384-I435 HydrophobicContact CG-CG2 3.66Å; I435-E437 VanDerWaalsContact C-N 3.33Å; I435-E437 PolarHBondContact O-N 3.1Å; I435-L438 PolarHBondContact O-N 3.38Å; I435-I439 HydrophobicContact CG2-CG1 4.41Å; I435-I439 WeakPolarHBondContact O-CG1 3.43Å; I435-I439 PolarHBondContact O-N 3.5Å
436	N	91	Very high	91.4	Very high	32 Å²	32	44.8 Å²	44.8	17%	0.171	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-40.6	-177.3	-65.7	-36.4	0	0	0	110.1	E193 L195 D434 I439 K440	E193-N436 PolarHBondContact O-ND2 3.02Å; L195-N436 PolarHBondContact N-OD1 3.31Å; D434-N436 PolarHBondContact OD1-N 3.12Å; N436-I439 PolarHBondContact O-N 3.35Å; N436-K440 WeakPolarHBondContact O-CG 3.23Å; N436-K440 PolarHBondContact O-N 3.48Å
437	E	91.4	Very high	91.1	Very high	86 Å²	86	48 Å²	48	40%	0.402	28%	0.277	S	S	.	.	H	α-helix	trans	-66	-41.7	176.5	-170.4	59.6	-165.2	0	0	112.4	D434 I435 I439 K440 V441	D434-E437 HydrophobicContact CB-CB 3.99Å; D434-E437 PolarHBondContact OD1-N 3.49Å; I435-E437 VanDerWaalsContact C-N 3.33Å; I435-E437 PolarHBondContact O-N 3.1Å; E437-I439 VanDerWaalsContact C-N 3.29Å; E437-I439 PolarHBondContact O-N 3.36Å; E437-K440 WeakPolarHBondContact O-CB 3.46Å; E437-K440 PolarHBondContact O-N 3.35Å; E437-K440 VanDerWaalsContact O-N 3.15Å; E437-K440 WeakPolarHBondContact OE2-CD 3.22Å; E437-V441 WeakPolarHBondContact O-CG2 3.41Å; E437-V441 PolarHBondContact O-N 3.17Å
438	L	94.3	Very high	90.7	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-57.7	-43.4	173.9	-178.6	72.6	0	0	0	111.6	L381 A403 L404 V432 D434 I435 V441 A442	L381-L438 HydrophobicContact CD1-CD2 3.88Å; L381-L438 HydrophobicContact CD2-CD2 4.34Å; A403-L438 HydrophobicContact CB-CD1 3.76Å; A403-L438 HydrophobicContact CB-CG 4.47Å; L404-L438 HydrophobicContact CD2-CD1 3.91Å; L404-L438 HydrophobicContact CD2-CD2 3.89Å; L404-L438 HydrophobicContact CG-CD1 4.2Å; L404-L438 HydrophobicContact CG-CD2 4.4Å; V432-L438 HydrophobicContact CG1-CB 4.24Å; V432-L438 HydrophobicContact CG1-CD2 4.06Å; V432-L438 HydrophobicContact CG2-CD2 4.06Å; D434-L438 PolarHBondContact O-N 2.99Å; I435-L438 PolarHBondContact O-N 3.38Å; L438-V441 PolarHBondContact O-N 2.78Å; L438-A442 WeakPolarHBondContact O-CB 3.48Å; L438-A442 PolarHBondContact O-N 3.11Å
439	I	94.5	Very high	90.5	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-66.4	-39.8	177.3	-63.2	-45.7	0	0	0	111.1	L388 I400 I435 N436 E437 A442 Y443	L388-I439 HydrophobicContact CD1-CD1 3.6Å; L388-I439 HydrophobicContact CD1-CG1 4.23Å; L388-I439 HydrophobicContact CD1-CG2 3.93Å; I400-I439 HydrophobicContact CD1-CD1 3.46Å; I400-I439 VanDerWaalsContact CD1-CD1 3.46Å; I435-I439 HydrophobicContact CG2-CG1 4.41Å; I435-I439 WeakPolarHBondContact O-CG1 3.43Å; I435-I439 PolarHBondContact O-N 3.5Å; N436-I439 PolarHBondContact O-N 3.35Å; E437-I439 VanDerWaalsContact C-N 3.29Å; E437-I439 PolarHBondContact O-N 3.36Å; I439-A442 WeakPolarHBondContact O-CB 3.48Å; I439-A442 PolarHBondContact O-N 3.31Å; I439-Y443 HydrophobicContact CG2-CD2 3.73Å; I439-Y443 HydrophobicContact CG2-CE2 3.68Å; I439-Y443 VanDerWaalsContact O-CD2 3.3Å; I439-Y443 WeakPolarHBondContact O-CD2 3.38Å; I439-Y443 PolarHBondContact O-N 3.1Å; I439-Y443 VanDerWaalsContact O-N 3.11Å
440	K	93.4	Very high	90.5	Very high	77 Å²	77	50.9 Å²	50.9	34%	0.335	29%	0.287	S	S	.	.	H	α-helix	trans	-58.6	-47.6	173.9	-75.3	173.2	177	-179.2	0	111.5	E186 N436 E437 A442 Y443 S444	E186-K440 VanDerWaalsContact OE1-CE 3.3Å; E186-K440 WeakPolarHBondContact OE1-CE 3.44Å; E186-K440 IonicContact OE1-NZ 3.87Å; E186-K440 PolarHBondContact OE1-NZ 3.14Å; N436-K440 WeakPolarHBondContact O-CG 3.23Å; N436-K440 PolarHBondContact O-N 3.48Å; E437-K440 WeakPolarHBondContact O-CB 3.46Å; E437-K440 PolarHBondContact O-N 3.35Å; E437-K440 VanDerWaalsContact O-N 3.15Å; E437-K440 WeakPolarHBondContact OE2-CD 3.22Å; K440-A442 VanDerWaalsContact C-N 3.33Å; K440-A442 PolarHBondContact O-N 3.12Å; K440-Y443 CarbonylContact O-C 3.38Å; K440-Y443 PolarHBondContact O-N 2.9Å; K440-S444 PolarHBondContact O-N 2.94Å
441	V	94.6	Very high	90.7	Very high	30 Å²	30	53.2 Å²	53.2	18%	0.182	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-42.8	175.3	174.5	0	0	0	0	111.1	A403 E437 L438 Y443 S444 L445	A403-V441 HydrophobicContact CB-CB 4.34Å; A403-V441 HydrophobicContact CB-CG1 3.93Å; E437-V441 WeakPolarHBondContact O-CG2 3.41Å; E437-V441 PolarHBondContact O-N 3.17Å; L438-V441 PolarHBondContact O-N 2.78Å; V441-Y443 VanDerWaalsContact C-N 3.26Å; V441-Y443 PolarHBondContact O-N 3.37Å; V441-S444 WeakPolarHBondContact CA-OG 3.28Å; V441-S444 PolarHBondContact O-N 3.05Å; V441-S444 VanDerWaalsContact O-N 3.11Å; V441-S444 PolarHBondContact O-OG 3.08Å; V441-L445 PolarHBondContact O-N 3.05Å
442	A	96.1	Very high	90.8	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-32.4	178.9	0	0	0	0	0	113.5	R399 I400 A403 L438 I439 K440	R399-A442 HydrophobicContact CB-CB 4.09Å; R399-A442 PolarHBondContact NH1-O 3.15Å; I400-A442 HydrophobicContact CD1-CB 4.07Å; A403-A442 HydrophobicContact CB-CB 3.91Å; L438-A442 WeakPolarHBondContact O-CB 3.48Å; L438-A442 PolarHBondContact O-N 3.11Å; I439-A442 WeakPolarHBondContact O-CB 3.48Å; I439-A442 PolarHBondContact O-N 3.31Å; K440-A442 VanDerWaalsContact C-N 3.33Å; K440-A442 PolarHBondContact O-N 3.12Å
443	Y	94.1	Very high	90.7	Very high	34 Å²	34	56.3 Å²	56.3	13%	0.133	31%	0.306	C	S	.	.	H	α-helix	trans	-91.9	-8.8	175.3	-74.6	-70.2	0	0	0	114.2	R179 L388 D392 I396 I439 K440 V441	R179-Y443 HydrophobicContact CB-CE2 4.06Å; R179-Y443 VanDerWaalsContact CD-CZ 3.45Å; R179-Y443 HydrophobicContact CG-CE1 4.26Å; R179-Y443 HydrophobicContact CG-CE2 3.78Å; R179-Y443 VanDerWaalsContact NE-CE1 3.28Å; R179-Y443 PolarHBondContact NE-OH 3.01Å; L388-Y443 HydrophobicContact CD1-CE2 3.95Å; L388-Y443 HydrophobicContact CD2-CE2 4.33Å; D392-Y443 PolarHBondContact OD2-OH 3.17Å; I396-Y443 HydrophobicContact CD1-CE2 4.46Å; I439-Y443 HydrophobicContact CG2-CD2 3.73Å; I439-Y443 HydrophobicContact CG2-CE2 3.68Å; I439-Y443 VanDerWaalsContact O-CD2 3.3Å; I439-Y443 WeakPolarHBondContact O-CD2 3.38Å; I439-Y443 PolarHBondContact O-N 3.1Å; I439-Y443 VanDerWaalsContact O-N 3.11Å; K440-Y443 CarbonylContact O-C 3.38Å; K440-Y443 PolarHBondContact O-N 2.9Å; V441-Y443 VanDerWaalsContact C-N 3.26Å; V441-Y443 PolarHBondContact O-N 3.37Å
444	S	93.9	Very high	91	Very high	89 Å²	89	52.4 Å²	52.4	62%	0.622	28%	0.279	S	S	*	.	H	α-helix	trans	-85.2	-15	172.5	73.2	0	0	0	0	113.4	K440 V441	K440-S444 PolarHBondContact O-N 2.94Å; V441-S444 WeakPolarHBondContact CA-OG 3.28Å; V441-S444 PolarHBondContact O-N 3.05Å; V441-S444 VanDerWaalsContact O-N 3.11Å; V441-S444 PolarHBondContact O-OG 3.08Å
445	L	93.6	Very high	91.3	Very high	25 Å²	25	48.5 Å²	48.5	13%	0.131	26%	0.259	C	S	.	.	S	Bend	trans	-61.2	134	171.2	-60.5	173.1	0	0	0	109.8	Y346 R399 L402 V441 L450	Y346-L445 HydrophobicContact CD1-CB 4.27Å; Y346-L445 HydrophobicContact CD1-CD2 3.97Å; Y346-L445 HydrophobicContact CE1-CB 4.02Å; R399-L445 PolarHBondContact NH1-O 3.48Å; L402-L445 HydrophobicContact CB-CD1 3.62Å; L402-L445 HydrophobicContact CD1-CD1 4.14Å; V441-L445 PolarHBondContact O-N 3.05Å; L445-L450 HydrophobicContact CB-CD1 3.81Å; L445-L450 HydrophobicContact CD1-CD1 4.1Å
446	D	85.7	Confident	91.1	Very high	80 Å²	80	49.5 Å²	49.5	43%	0.428	27%	0.269	S	S	.	.			trans	-58.7	146.5	-179.9	66	83.8	0	0	0	112	Y346 E448	Y346-D446 WeakPolarHBondContact CE1-OD2 3.27Å; Y346-D446 PolarHBondContact OH-O 3.42Å; Y346-D446 PolarHBondContact OH-OD1 3.48Å; D446-E448 VanDerWaalsContact C-N 3.28Å; D446-E448 PolarHBondContact O-N 2.97Å; D446-E448 WeakPolarHBondContact OD1-CB 3.35Å; D446-E448 PolarHBondContact OD1-N 3.49Å
447	D	84.2	Confident	91	Very high	106 Å²	106	49.2 Å²	49.2	57%	0.567	27%	0.269	S	S	*	.	S	Bend	trans	-80.9	-6.5	-175.9	-70.7	-25.5	0	0	0	113.2	R399 H449 L450 E451	R399-D447 IonicContact CZ-OD1 3.31Å; R399-D447 IonicContact NH1-OD1 3.36Å; R399-D447 IonicContact NH2-OD1 2.7Å; R399-D447 PolarHBondContact NH2-OD1 3.39Å; D447-H449 PolarHBondContact O-N 3.3Å; D447-L450 PolarHBondContact O-N 2.98Å; D447-E451 PolarHBondContact O-N 2.93Å; D447-E451 VanDerWaalsContact O-N 3.07Å
448	E	83.4	Confident	91.1	Very high	92 Å²	92	46.4 Å²	46.4	43%	0.43	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-47.9	-168.9	-176.1	174.9	175.2	0	0	111.7	D446 N454 R583	D446-E448 VanDerWaalsContact C-N 3.28Å; D446-E448 PolarHBondContact O-N 2.97Å; D446-E448 WeakPolarHBondContact OD1-CB 3.35Å; D446-E448 PolarHBondContact OD1-N 3.49Å; E448-N454 PolarHBondContact O-ND2 3.05Å; E448-R583 IonicContact OE1-CZ 2.93Å; E448-R583 IonicContact OE1-NH1 2.54Å; E448-R583 PolarHBondContact OE1-NH1 3.2Å; E448-R583 VanDerWaalsContact OE1-NH1 3.15Å; E448-R583 IonicContact OE1-NH2 2.59Å; E448-R583 PolarHBondContact OE1-NH2 2.9Å
449	H	88.8	Confident	90.9	Very high	45 Å²	45	47.5 Å²	47.5	21%	0.208	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-14.5	179.1	-56	-76.6	0	0	0	113.6	L342 F345 Y346 D447	L342-H449 HydrophobicContact CD2-CB 3.66Å; F345-H449 AromaticContact CD1-CE1 3.57Å; F345-H449 AromaticContact CD1-NE2 3.38Å; F345-H449 WeakPolarHBondContact CD1-NE2 3.34Å; F345-H449 AromaticContact CE1-CE1 3.71Å; F345-H449 AromaticContact CE1-NE2 3.97Å; F345-H449 AromaticContact CG-CD2 3.94Å; F345-H449 AromaticContact CG-CE1 3.97Å; F345-H449 AromaticContact CG-NE2 3.71Å; Y346-H449 HydrophobicContact CE2-CB 3.86Å; Y346-H449 WeakPolarHBondContact OH-CB 3.44Å; Y346-H449 PolarHBondContact OH-N 2.91Å; D447-H449 PolarHBondContact O-N 3.3Å
450	L	92.7	Very high	90.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	7.7	-177.3	-72.9	163.9	0	0	0	113.8	L342 Y346 V395 F398 R399 L402 L445 D447 I455	L342-L450 HydrophobicContact CD1-CD2 4.06Å; Y346-L450 HydrophobicContact CE1-CD1 3.87Å; Y346-L450 HydrophobicContact CE2-CD1 4.08Å; Y346-L450 HydrophobicContact CE2-CG 4.03Å; Y346-L450 WeakPolarHBondContact OH-CD1 3.35Å; Y346-L450 VanDerWaalsContact OH-CG 3.31Å; Y346-L450 WeakPolarHBondContact OH-CG 3.26Å; Y346-L450 PolarHBondContact OH-N 3.34Å; V395-L450 VanDerWaalsContact CG1-O 3.26Å; V395-L450 WeakPolarHBondContact CG1-O 3.35Å; F398-L450 HydrophobicContact CB-CD2 3.9Å; R399-L450 HydrophobicContact CG-CD1 4.06Å; R399-L450 HydrophobicContact CG-CD2 4.18Å; L402-L450 HydrophobicContact CD1-CD1 4.15Å; L402-L450 HydrophobicContact CD1-CD2 4.12Å; L445-L450 HydrophobicContact CB-CD1 3.81Å; L445-L450 HydrophobicContact CD1-CD1 4.1Å; D447-L450 PolarHBondContact O-N 2.98Å; L450-I455 HydrophobicContact CD2-CD1 4.38Å
451	E	90.4	Very high	90.1	Very high	100 Å²	100	54 Å²	54	47%	0.467	29%	0.287	S	S	.	.	S	Bend	trans	-62	136.9	171.7	-163.3	-167.4	143	0	0	111.2	D447 S453 N454 I455	D447-E451 PolarHBondContact O-N 2.93Å; D447-E451 VanDerWaalsContact O-N 3.07Å; E451-S453 PolarHBondContact O-N 3.22Å; E451-S453 PolarHBondContact OE1-OG 3.47Å; E451-N454 HydrophobicContact CB-CB 4.42Å; E451-N454 PolarHBondContact O-N 3.41Å; E451-I455 PolarHBondContact O-N 2.96Å
452	P	89.4	Confident	89.9	Confident	78 Å²	78	54.1 Å²	54.1	51%	0.506	29%	0.285	S	S	.	.	H	α-helix	trans	-53.1	-32.3	179.8	-28.3	33.2	0	0	0	115.2	V395 S456	V395-P452 HydrophobicContact CG2-CB 4.11Å; V395-P452 HydrophobicContact CG2-CG 4.12Å; P452-S456 VanDerWaalsContact O-CB 3.26Å; P452-S456 WeakPolarHBondContact O-CB 3.48Å; P452-S456 PolarHBondContact O-N 2.84Å; P452-S456 PolarHBondContact O-OG 2.9Å
453	S	88.7	Confident	89.3	Confident	52 Å²	52	54.8 Å²	54.8	36%	0.364	29%	0.288	S	S	.	.	H	α-helix	trans	-68	-43.9	177.5	63.1	0	0	0	0	111.7	E451 S456 S457	E451-S453 PolarHBondContact O-N 3.22Å; E451-S453 PolarHBondContact OE1-OG 3.47Å; S453-S456 PolarHBondContact O-N 3.31Å; S453-S457 WeakPolarHBondContact O-CB 3.47Å; S453-S457 PolarHBondContact O-N 3.02Å
454	N	91.7	Very high	88.4	Confident	53 Å²	53	54.5 Å²	54.5	28%	0.283	29%	0.293	S	S	.	.	H	α-helix	trans	-67	-45.9	176.6	-73	-14.9	0	0	0	111.6	E448 E451 S456 S457 L458	E448-N454 PolarHBondContact O-ND2 3.05Å; E451-N454 HydrophobicContact CB-CB 4.42Å; E451-N454 PolarHBondContact O-N 3.41Å; N454-S456 VanDerWaalsContact C-N 3.32Å; N454-S456 PolarHBondContact O-N 2.84Å; N454-S457 WeakPolarHBondContact O-CA 3.39Å; N454-S457 WeakPolarHBondContact O-CB 3.24Å; N454-S457 PolarHBondContact O-N 3.4Å; N454-S457 VanDerWaalsContact O-N 3.07Å; N454-L458 PolarHBondContact O-N 3.25Å
455	I	93.5	Very high	87.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.9	-43.3	174.5	-63.4	-60.6	0	0	0	111.1	V338 L342 V395 F398 L450 E451 S457 L458 R459	V338-I455 HydrophobicContact CG1-CD1 4.04Å; L342-I455 HydrophobicContact CD1-CD1 3.76Å; L342-I455 HydrophobicContact CD2-CD1 4.38Å; V395-I455 HydrophobicContact CG1-CG1 4.37Å; V395-I455 HydrophobicContact CG2-CB 4.31Å; V395-I455 HydrophobicContact CG2-CG1 4.3Å; V395-I455 HydrophobicContact CG2-CG2 4.35Å; F398-I455 HydrophobicContact CD2-CD1 4.15Å; F398-I455 HydrophobicContact CD2-CG2 3.95Å; F398-I455 HydrophobicContact CE2-CD1 4.45Å; F398-I455 HydrophobicContact CE2-CG2 3.4Å; F398-I455 VanDerWaalsContact CE2-CG2 3.4Å; F398-I455 HydrophobicContact CG-CD1 4.45Å; F398-I455 HydrophobicContact CZ-CG2 4.14Å; L450-I455 HydrophobicContact CD2-CD1 4.38Å; E451-I455 PolarHBondContact O-N 2.96Å; I455-S457 VanDerWaalsContact C-N 3.27Å; I455-S457 PolarHBondContact O-N 3.44Å; I455-L458 PolarHBondContact O-N 3.48Å; I455-R459 HydrophobicContact CG2-CG 4.39Å; I455-R459 WeakPolarHBondContact O-CB 3.1Å; I455-R459 VanDerWaalsContact O-CG 3.27Å; I455-R459 WeakPolarHBondContact O-CG 3.43Å; I455-R459 PolarHBondContact O-N 2.83Å
456	S	88.9	Confident	87.3	Confident	54 Å²	54	54.4 Å²	54.4	38%	0.378	28%	0.283	S	S	.	.	H	α-helix	trans	-65.6	-31.2	176.1	-60.5	0	0	0	0	112.8	P452 S453 N454 R460	P452-S456 VanDerWaalsContact O-CB 3.26Å; P452-S456 WeakPolarHBondContact O-CB 3.48Å; P452-S456 PolarHBondContact O-N 2.84Å; P452-S456 PolarHBondContact O-OG 2.9Å; S453-S456 PolarHBondContact O-N 3.31Å; N454-S456 VanDerWaalsContact C-N 3.32Å; N454-S456 PolarHBondContact O-N 2.84Å; S456-R460 WeakPolarHBondContact O-CG 3.48Å; S456-R460 PolarHBondContact O-N 3.09Å; S456-R460 PolarHBondContact O-NE 3.28Å
457	S	88	Confident	86.7	Confident	26 Å²	26	52.4 Å²	52.4	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-53.9	172.9	-167.5	0	0	0	0	111.4	S453 N454 I455 R459 R460 H461 Q576	S453-S457 WeakPolarHBondContact O-CB 3.47Å; S453-S457 PolarHBondContact O-N 3.02Å; N454-S457 WeakPolarHBondContact O-CA 3.39Å; N454-S457 WeakPolarHBondContact O-CB 3.24Å; N454-S457 PolarHBondContact O-N 3.4Å; N454-S457 VanDerWaalsContact O-N 3.07Å; I455-S457 VanDerWaalsContact C-N 3.27Å; I455-S457 PolarHBondContact O-N 3.44Å; S457-R459 PolarHBondContact O-N 3.39Å; S457-R460 PolarHBondContact O-N 3.13Å; S457-H461 PolarHBondContact O-N 3.07Å; S457-H461 VanDerWaalsContact O-N 3.08Å; S457-Q576 PolarHBondContact OG-NE2 3.45Å
458	L	93.1	Very high	86	Confident	27 Å²	27	52.6 Å²	52.6	14%	0.141	28%	0.276	C	S	.	.	H	α-helix	trans	-62.9	-42.1	178.7	-66.8	171.5	0	0	0	112	V338 L342 N454 I455 R460 H461 Y462	V338-L458 HydrophobicContact CG1-CB 4.12Å; V338-L458 HydrophobicContact CG1-CD1 4.16Å; V338-L458 HydrophobicContact CG2-CB 3.84Å; L342-L458 HydrophobicContact CD2-CD1 4.2Å; N454-L458 PolarHBondContact O-N 3.25Å; I455-L458 PolarHBondContact O-N 3.48Å; L458-R460 VanDerWaalsContact C-N 3.29Å; L458-R460 PolarHBondContact O-N 3.08Å; L458-H461 WeakPolarHBondContact O-CB 3.36Å; L458-H461 PolarHBondContact O-N 3.33Å; L458-Y462 HydrophobicContact CB-CD2 4.42Å; L458-Y462 HydrophobicContact CB-CE2 4.42Å; L458-Y462 HydrophobicContact CD2-CE2 4.35Å; L458-Y462 VanDerWaalsContact O-CD2 3.29Å; L458-Y462 WeakPolarHBondContact O-CD2 3.48Å; L458-Y462 PolarHBondContact O-N 2.82Å
459	R	91.1	Very high	85.4	Confident	26 Å²	26	52.7 Å²	52.7	10%	0.098	28%	0.279	C	S	.	.	H	α-helix	trans	-55.2	-43.8	175.1	-80.6	173.1	164.7	161.8	-6.4	112.4	S334 D335 V338 S394 I455 S457 L463	S334-R459 WeakPolarHBondContact OG-CA 3.47Å; S334-R459 PolarHBondContact OG-O 3.5Å; D335-R459 IonicContact OD1-CZ 3.61Å; D335-R459 IonicContact OD1-NE 2.81Å; D335-R459 PolarHBondContact OD1-NE 2.89Å; D335-R459 IonicContact OD1-NH2 3.07Å; D335-R459 PolarHBondContact OD1-NH2 3.08Å; D335-R459 IonicContact OD2-CZ 2.77Å; D335-R459 IonicContact OD2-NE 2.84Å; D335-R459 IonicContact OD2-NH2 3.5Å; D335-R459 PolarHBondContact OD2-NH2 3.32Å; V338-R459 HydrophobicContact CG2-CG 3.91Å; S394-R459 PolarHBondContact OG-NH1 3.28Å; S394-R459 PolarHBondContact OG-NH2 2.99Å; I455-R459 HydrophobicContact CG2-CG 4.39Å; I455-R459 WeakPolarHBondContact O-CB 3.1Å; I455-R459 VanDerWaalsContact O-CG 3.27Å; I455-R459 WeakPolarHBondContact O-CG 3.43Å; I455-R459 PolarHBondContact O-N 2.83Å; S457-R459 PolarHBondContact O-N 3.39Å; R459-L463 WeakPolarHBondContact O-CB 3.44Å; R459-L463 PolarHBondContact O-N 3.4Å
460	R	83.6	Confident	84.3	Confident	110 Å²	110	53.6 Å²	53.6	42%	0.415	28%	0.283	S	S	.	.	H	α-helix	trans	-67.3	-43.5	177.6	-75.9	175.8	-66.6	178.5	8	111.6	S456 S457 L458 L463 A464 V572	S456-R460 WeakPolarHBondContact O-CG 3.48Å; S456-R460 PolarHBondContact O-N 3.09Å; S456-R460 PolarHBondContact O-NE 3.28Å; S457-R460 PolarHBondContact O-N 3.13Å; L458-R460 VanDerWaalsContact C-N 3.29Å; L458-R460 PolarHBondContact O-N 3.08Å; R460-L463 PolarHBondContact O-N 2.99Å; R460-A464 WeakPolarHBondContact O-CB 3.45Å; R460-A464 PolarHBondContact O-N 3.46Å; R460-V572 VanDerWaalsContact NH1-CG1 3.35Å
461	H	87.7	Confident	82.1	Confident	108 Å²	108	56.1 Å²	56.1	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-58.1	-53.7	177.1	175.8	74.5	0	0	0	112	S457 L458 L463 A464 Q465	S457-H461 PolarHBondContact O-N 3.07Å; S457-H461 VanDerWaalsContact O-N 3.08Å; L458-H461 WeakPolarHBondContact O-CB 3.36Å; L458-H461 PolarHBondContact O-N 3.33Å; H461-L463 PolarHBondContact O-N 3.11Å; H461-A464 PolarHBondContact O-N 3.01Å; H461-Q465 PolarHBondContact O-N 3.17Å
462	Y	90.5	Very high	79.5	Confident	31 Å²	31	56.2 Å²	56.2	12%	0.122	32%	0.322	C	S	.	.	H	α-helix	trans	-71	-31.4	-178.8	-72.1	-57.7	0	0	0	113.5	L337 V338 H341 L458 Q465 L466	L337-Y462 HydrophobicContact CB-CD1 3.65Å; L337-Y462 HydrophobicContact CB-CD2 3.9Å; L337-Y462 HydrophobicContact CB-CE1 4.12Å; L337-Y462 HydrophobicContact CB-CE2 4.34Å; L337-Y462 HydrophobicContact CB-CG 3.52Å; L337-Y462 HydrophobicContact CD1-CD1 3.82Å; L337-Y462 HydrophobicContact CD1-CG 4.13Å; L337-Y462 HydrophobicContact CG-CD1 4.33Å; L337-Y462 HydrophobicContact CG-CG 4.49Å; V338-Y462 HydrophobicContact CG2-CD2 3.77Å; V338-Y462 HydrophobicContact CG2-CE2 4.4Å; H341-Y462 HydrophobicContact CB-CE2 3.77Å; H341-Y462 VanDerWaalsContact CB-OH 3.25Å; H341-Y462 WeakPolarHBondContact CB-OH 2.88Å; H341-Y462 VanDerWaalsContact CG-OH 3.27Å; H341-Y462 AromaticContact ND1-CZ 3.96Å; H341-Y462 PolarHBondContact ND1-OH 3.3Å; L458-Y462 HydrophobicContact CB-CD2 4.42Å; L458-Y462 HydrophobicContact CB-CE2 4.42Å; L458-Y462 HydrophobicContact CD2-CE2 4.35Å; L458-Y462 VanDerWaalsContact O-CD2 3.29Å; L458-Y462 WeakPolarHBondContact O-CD2 3.48Å; L458-Y462 PolarHBondContact O-N 2.82Å; Y462-Q465 PolarHBondContact O-N 2.88Å; Y462-L466 VanDerWaalsContact O-CG 3.28Å; Y462-L466 WeakPolarHBondContact O-CG 3.36Å; Y462-L466 PolarHBondContact O-N 3Å
463	L	83.3	Confident	77.1	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.079	33%	0.332	C	S	.	.	H	α-helix	trans	-63.6	-44.6	172.3	179.9	58.7	0	0	0	111.3	L330 R459 R460 H461 Q465 L466 M467 L482	L330-L463 HydrophobicContact CB-CD1 3.54Å; L330-L463 HydrophobicContact CD1-CD1 4.25Å; L330-L463 HydrophobicContact CG-CD1 4.44Å; R459-L463 WeakPolarHBondContact O-CB 3.44Å; R459-L463 PolarHBondContact O-N 3.4Å; R460-L463 PolarHBondContact O-N 2.99Å; H461-L463 PolarHBondContact O-N 3.11Å; L463-Q465 VanDerWaalsContact C-N 3.33Å; L463-Q465 PolarHBondContact O-N 3.28Å; L463-L466 PolarHBondContact O-N 3.49Å; L463-M467 HydrophobicContact CD1-CG 4.47Å; L463-M467 HydrophobicContact CG-SD 4.48Å; L463-M467 VanDerWaalsContact O-CG 3.27Å; L463-M467 WeakPolarHBondContact O-CG 3.36Å; L463-M467 PolarHBondContact O-N 3.42Å; L463-L482 HydrophobicContact CD1-CD1 4.13Å; L463-L482 HydrophobicContact CD2-CD1 3.69Å; L463-L482 HydrophobicContact CD2-CD2 3.52Å; L463-L482 HydrophobicContact CD2-CG 4.22Å; L463-L482 HydrophobicContact CG-CD1 3.92Å; L463-L482 HydrophobicContact CG-CD2 4.31Å
464	A	74.6	Confident	74.4	Confident	28 Å²	28	60.5 Å²	60.5	23%	0.231	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-42.5	175.8	0	0	0	0	0	111.4	R460 H461 M467 V468	R460-A464 WeakPolarHBondContact O-CB 3.45Å; R460-A464 PolarHBondContact O-N 3.46Å; H461-A464 PolarHBondContact O-N 3.01Å; A464-M467 PolarHBondContact O-N 3.46Å; A464-V468 WeakPolarHBondContact O-CG2 3.45Å; A464-V468 PolarHBondContact O-N 3.35Å; A464-V468 VanDerWaalsContact O-N 3.17Å
465	Q	82.5	Confident	71.5	Confident	91 Å²	91	66.2 Å²	66.2	43%	0.425	36%	0.362	S	S	.	.	H	α-helix	trans	-59.6	-50.1	175	-174.2	177.7	-4.9	0	0	112.1	H461 Y462 L463 M467 V468 D469	H461-Q465 PolarHBondContact O-N 3.17Å; Y462-Q465 PolarHBondContact O-N 2.88Å; L463-Q465 VanDerWaalsContact C-N 3.33Å; L463-Q465 PolarHBondContact O-N 3.28Å; Q465-M467 VanDerWaalsContact C-N 3.3Å; Q465-M467 PolarHBondContact O-N 3.19Å; Q465-V468 WeakPolarHBondContact O-CB 3.42Å; Q465-V468 PolarHBondContact O-N 3.41Å; Q465-V468 VanDerWaalsContact O-N 3.14Å; Q465-D469 PolarHBondContact O-N 2.8Å; Q465-D469 VanDerWaalsContact O-N 3.1Å
466	L	81.1	Confident	68.3	Low	21 Å²	21	70 Å²	70	11%	0.11	39%	0.386	C	S	.	.	H	α-helix	trans	-62.6	-35.9	179.6	-70.5	166.6	0	0	0	112.8	L330 Q333 L337 Y462 L463 V468 D469 E470	L330-L466 HydrophobicContact CD2-CB 3.73Å; L330-L466 HydrophobicContact CD2-CD1 4.4Å; Q333-L466 HydrophobicContact CB-CD1 3.61Å; L337-L466 HydrophobicContact CD1-CD1 3.99Å; L337-L466 HydrophobicContact CD1-CD2 3.92Å; L337-L466 HydrophobicContact CD1-CG 3.86Å; Y462-L466 VanDerWaalsContact O-CG 3.28Å; Y462-L466 WeakPolarHBondContact O-CG 3.36Å; Y462-L466 PolarHBondContact O-N 3Å; L463-L466 PolarHBondContact O-N 3.49Å; L466-V468 VanDerWaalsContact C-N 3.33Å; L466-V468 PolarHBondContact O-N 3.25Å; L466-D469 PolarHBondContact O-N 3.37Å; L466-E470 PolarHBondContact O-N 2.95Å
467	M	73	Confident	65.6	Low	37 Å²	37	74.1 Å²	74.1	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-64.6	-36.7	175.5	-73.6	178.2	79.9	0	0	112.6	L330 L463 A464 Q465 G471 P480 L482	L330-M467 HydrophobicContact CD1-CG 3.94Å; L463-M467 HydrophobicContact CD1-CG 4.47Å; L463-M467 HydrophobicContact CG-SD 4.48Å; L463-M467 VanDerWaalsContact O-CG 3.27Å; L463-M467 WeakPolarHBondContact O-CG 3.36Å; L463-M467 PolarHBondContact O-N 3.42Å; A464-M467 PolarHBondContact O-N 3.46Å; Q465-M467 VanDerWaalsContact C-N 3.3Å; Q465-M467 PolarHBondContact O-N 3.19Å; M467-G471 PolarHBondContact O-N 3.17Å; M467-P480 HydrophobicContact CE-CB 4.09Å; M467-L482 HydrophobicContact CE-CB 3.9Å; M467-L482 HydrophobicContact CE-CD1 3.82Å; M467-L482 HydrophobicContact CE-CG 4.47Å; M467-L482 HydrophobicContact CG-CD1 4.37Å; M467-L482 HydrophobicContact SD-CB 4.02Å; M467-L482 HydrophobicContact SD-CD1 3.25Å; M467-L482 WeakPolarHBondContact SD-CD1 3.36Å; M467-L482 HydrophobicContact SD-CG 4.11Å
468	V	70.6	Confident	63	Low	110 Å²	110	76.4 Å²	76.4	67%	0.667	42%	0.42	S	S	*	.	H	α-helix	trans	-66.2	-42.4	174.8	172.7	0	0	0	0	110.2	A464 Q465 L466 G471	A464-V468 WeakPolarHBondContact O-CG2 3.45Å; A464-V468 PolarHBondContact O-N 3.35Å; A464-V468 VanDerWaalsContact O-N 3.17Å; Q465-V468 WeakPolarHBondContact O-CB 3.42Å; Q465-V468 PolarHBondContact O-N 3.41Å; Q465-V468 VanDerWaalsContact O-N 3.14Å; L466-V468 VanDerWaalsContact C-N 3.33Å; L466-V468 PolarHBondContact O-N 3.25Å; V468-G471 PolarHBondContact O-N 2.95Å
469	D	70.6	Confident	59.9	Low	94 Å²	94	83.8 Å²	83.8	50%	0.503	45%	0.446	S	S	.	.	H	α-helix	trans	-66.1	-46.4	-179.8	-67.8	-20.1	0	0	0	112	Q465 L466 G471 S472	Q465-D469 PolarHBondContact O-N 2.8Å; Q465-D469 VanDerWaalsContact O-N 3.1Å; L466-D469 PolarHBondContact O-N 3.37Å; D469-G471 VanDerWaalsContact C-N 3.33Å; D469-G471 PolarHBondContact O-N 3.28Å; D469-S472 PolarHBondContact O-N 3.28Å; D469-S472 PolarHBondContact O-OG 3.28Å; D469-S472 VanDerWaalsContact O-OG 3.06Å
470	E	64.6	Low	57.2	Low	64 Å²	64	86.1 Å²	86.1	30%	0.299	47%	0.465	S	S	.	.	H	α-helix	trans	-66.8	-32.6	174.7	-78	-163.8	157.4	0	0	112.7	S328 L330 L466 S472 V473	S328-E470 WeakPolarHBondContact CB-OE1 3.22Å; S328-E470 WeakPolarHBondContact CB-OE2 3.4Å; L330-E470 HydrophobicContact CD2-CG 4.34Å; L466-E470 PolarHBondContact O-N 2.95Å; E470-S472 PolarHBondContact O-N 2.76Å; E470-S472 VanDerWaalsContact O-N 3.15Å; E470-V473 PolarHBondContact O-N 2.87Å
471	G	47	Very low	54.7	Low	53 Å²	53	81.7 Å²	81.7	55%	0.546	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.7	-179.9	0	0	0	0	0	114.9	M467 V468 D469	M467-G471 PolarHBondContact O-N 3.17Å; V468-G471 PolarHBondContact O-N 2.95Å; D469-G471 VanDerWaalsContact C-N 3.33Å; D469-G471 PolarHBondContact O-N 3.28Å
472	S	36.5	Very low	52.1	Low	103 Å²	103	77.8 Å²	77.8	72%	0.72	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.7	172	77.1	0	0	0	0	114	D469 E470	D469-S472 PolarHBondContact O-N 3.28Å; D469-S472 PolarHBondContact O-OG 3.28Å; D469-S472 VanDerWaalsContact O-OG 3.06Å; E470-S472 PolarHBondContact O-N 2.76Å; E470-S472 VanDerWaalsContact O-N 3.15Å
473	V	39.5	Very low	49.4	Very low	120 Å²	120	78 Å²	78	73%	0.727	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	-13.4	-171.4	-179.1	0	0	0	0	113.6	E470	E470-V473 PolarHBondContact O-N 2.87Å
474	L	31.6	Very low	47.1	Very low	100 Å²	100	86 Å²	86	52%	0.524	47%	0.471	S	S	.	.	S	Bend	trans	-110.6	130	-177.7	-69	166.4	0	0	0	112.6
475	K	29.6	Very low	45.3	Very low	172 Å²	172	87.9 Å²	87.9	75%	0.748	48%	0.475	S	S	*	.			trans	-56.2	147.6	179.7	-73.3	178.7	177.7	176.4	0	112	D477 S478	K475-D477 PolarHBondContact O-N 3.15Å; K475-S478 PolarHBondContact O-N 3.21Å; K475-S478 PolarHBondContact O-OG 3.25Å
476	P	28	Very low	43.2	Very low	80 Å²	80	94 Å²	94	52%	0.519	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-16.7	-168.6	-24	34.3	0	0	0	116.8	S478 V555	P476-S478 PolarHBondContact O-N 2.68Å; P476-V555 HydrophobicContact CB-CG1 3.78Å; P476-V555 HydrophobicContact CG-CG1 4.21Å
477	D	31.3	Very low	41.6	Very low	140 Å²	140	94.9 Å²	94.9	75%	0.749	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	7.1	-175	-62.8	-48.4	0	0	0	114.5	K475	K475-D477 PolarHBondContact O-N 3.15Å
478	S	32.5	Very low	40.3	Very low	74 Å²	74	95.3 Å²	95.3	52%	0.517	51%	0.51	S	S	.	.	S	Bend	trans	-119.3	89.2	-170.5	-39.7	0	0	0	0	111.3	K475 P476 P480	K475-S478 PolarHBondContact O-N 3.21Å; K475-S478 PolarHBondContact O-OG 3.25Å; P476-S478 PolarHBondContact O-N 2.68Å; S478-P480 VanDerWaalsContact O-CD 3.29Å; S478-P480 WeakPolarHBondContact O-CD 3.28Å
479	R	28.5	Very low	39.5	Very low	183 Å²	183	93.7 Å²	93.7	69%	0.691	49%	0.494	S	S	*	.			trans	-49.6	121.2	-178.2	-59.2	175.7	166.5	158.7	-1.3	114.2	D559	R479-D559 WeakPolarHBondContact CD-OD2 3.39Å; R479-D559 WeakPolarHBondContact CG-OD2 3.13Å; R479-D559 IonicContact NE-OD2 3.04Å; R479-D559 PolarHBondContact NE-OD2 3.09Å; R479-D559 VanDerWaalsContact NE-OD2 3.12Å
480	P	34.7	Very low	38.9	Very low	74 Å²	74	92.9 Å²	92.9	48%	0.481	48%	0.484	S	S	.	.			trans	-107.5	100.8	159.5	31	-15	0	0	0	109.2	M467 S478 L562	M467-P480 HydrophobicContact CE-CB 4.09Å; S478-P480 VanDerWaalsContact O-CD 3.29Å; S478-P480 WeakPolarHBondContact O-CD 3.28Å; P480-L562 WeakPolarHBondContact O-CD1 3.42Å
481	N	31.8	Very low	38.3	Very low	17 Å²	17	98.4 Å²	98.4	9%	0.091	51%	0.51	C	S	.	.			trans	-81.4	146.3	175.2	-57.2	-51	0	0	0	109.9	Q485 D559 K561	N481-Q485 HydrophobicContact CB-CG 4.31Å; N481-Q485 VanDerWaalsContact O-CG 3.28Å; N481-Q485 WeakPolarHBondContact O-CG 3.35Å; N481-Q485 PolarHBondContact O-NE2 3Å; N481-D559 PolarHBondContact OD1-OD2 3.45Å; N481-K561 HydrophobicContact CB-CB 3.8Å; N481-K561 HydrophobicContact CB-CD 3.91Å; N481-K561 HydrophobicContact CB-CG 4.47Å; N481-K561 WeakPolarHBondContact ND2-CD 3.25Å; N481-K561 WeakPolarHBondContact OD1-CB 3.37Å; N481-K561 WeakPolarHBondContact OD1-CD 3.49Å
482	L	31.7	Very low	38.5	Very low	27 Å²	27	98.3 Å²	98.3	14%	0.141	49%	0.494	C	S	.	.			trans	-155.5	80.7	166.7	-135.9	135	0	0	0	113.6	L463 M467 V565	L463-L482 HydrophobicContact CD1-CD1 4.13Å; L463-L482 HydrophobicContact CD2-CD1 3.69Å; L463-L482 HydrophobicContact CD2-CD2 3.52Å; L463-L482 HydrophobicContact CD2-CG 4.22Å; L463-L482 HydrophobicContact CG-CD1 3.92Å; L463-L482 HydrophobicContact CG-CD2 4.31Å; M467-L482 HydrophobicContact CE-CB 3.9Å; M467-L482 HydrophobicContact CE-CD1 3.82Å; M467-L482 HydrophobicContact CE-CG 4.47Å; M467-L482 HydrophobicContact CG-CD1 4.37Å; M467-L482 HydrophobicContact SD-CB 4.02Å; M467-L482 HydrophobicContact SD-CD1 3.25Å; M467-L482 WeakPolarHBondContact SD-CD1 3.36Å; M467-L482 HydrophobicContact SD-CG 4.11Å; L482-V565 VanDerWaalsContact CA-CG2 3.48Å; L482-V565 HydrophobicContact CB-CB 4.39Å; L482-V565 HydrophobicContact CB-CG1 3.73Å; L482-V565 HydrophobicContact CB-CG2 4.02Å; L482-V565 WeakPolarHBondContact O-CA 3.32Å; L482-V565 WeakPolarHBondContact O-CB 3.36Å; L482-V565 WeakPolarHBondContact O-CG1 3.25Å; L482-V565 WeakPolarHBondContact O-CG2 3.12Å
483	P	34.7	Very low	38.4	Very low	35 Å²	35	101.9 Å²	101.9	23%	0.227	50%	0.5	C	S	.	.	S	Bend		-144.5	130.2	126.7	40.2	-27.7	0	0	0	110.3	Q485 N564 T568	P483-Q485 PolarHBondContact O-N 2.9Å; P483-N564 VanDerWaalsContact CG-C 3.43Å; P483-N564 HydrophobicContact CG-CB 3.5Å; P483-N564 WeakPolarHBondContact CG-O 3.28Å; P483-T568 HydrophobicContact CB-CG2 4.42Å; P483-T568 WeakPolarHBondContact CB-OG1 3.11Å
484	K	34.7	Very low	38.2	Very low	184 Å²	184	103.7 Å²	103.7	80%	0.8	49%	0.493	S	S	*	.	S	Bend	trans	39.3	69.3	-164.7	-71.3	-176.3	176.4	-179.1	0	109.1	Y486	K484-Y486 PolarHBondContact O-N 3.39Å
485	Q	36.1	Very low	38.2	Very low	67 Å²	67	104.9 Å²	104.9	31%	0.313	51%	0.507	S	S	.	.			trans	-55.9	100.8	171.7	-80.6	-169.7	-23.8	0	0	106.4	S322 N481 P483 L487	S322-Q485 PolarHBondContact OG-OE1 3.41Å; N481-Q485 HydrophobicContact CB-CG 4.31Å; N481-Q485 VanDerWaalsContact O-CG 3.28Å; N481-Q485 WeakPolarHBondContact O-CG 3.35Å; N481-Q485 PolarHBondContact O-NE2 3Å; P483-Q485 PolarHBondContact O-N 2.9Å; Q485-L487 PolarHBondContact O-N 2.91Å
486	Y	38.8	Very low	38.3	Very low	218 Å²	218	104.9 Å²	104.9	86%	0.855	51%	0.507	S	S	*	.			trans	-54.5	104.4	164.5	-89.1	-92.7	0	0	0	103.4	K484 A488	K484-Y486 PolarHBondContact O-N 3.39Å; Y486-A488 PolarHBondContact O-N 2.96Å
487	L	48.1	Very low	38.5	Very low	41 Å²	41	104.6 Å²	104.6	22%	0.215	51%	0.507	C	S	.	.			trans	-43.7	120.3	170.1	-73.1	157.2	0	0	0	106.1	Y282 V285 I315 E316 Q485 K489	Y282-L487 HydrophobicContact CD1-CB 3.9Å; Y282-L487 HydrophobicContact CD1-CD1 4.05Å; Y282-L487 HydrophobicContact CD1-CD2 4.44Å; Y282-L487 HydrophobicContact CD1-CG 4.37Å; Y282-L487 HydrophobicContact CE1-CB 4.31Å; Y282-L487 HydrophobicContact CE1-CD1 3.94Å; V285-L487 HydrophobicContact CG2-CD2 3.53Å; I315-L487 HydrophobicContact CG2-CD1 3.63Å; I315-L487 HydrophobicContact CG2-CD2 4.34Å; E316-L487 HydrophobicContact CG-CD1 3.8Å; Q485-L487 PolarHBondContact O-N 2.91Å; L487-K489 PolarHBondContact O-N 3.25Å
488	A	44.9	Very low	38.6	Very low	45 Å²	45	104.7 Å²	104.7	37%	0.372	51%	0.507	S	S	.	.			trans	-66	92	179	0	0	0	0	0	108	V283 D284 Y486	V283-A488 PolarHBondContact N-O 3.43Å; D284-A488 WeakPolarHBondContact OD2-CB 3.41Å; D284-A488 PolarHBondContact OD2-N 3.35Å; Y486-A488 PolarHBondContact O-N 2.96Å
489	K	55.2	Low	38.8	Very low	76 Å²	76	108.8 Å²	108.8	33%	0.33	52%	0.515	S	S	.	.	B	Isolated β-bridge	trans	-75	131.7	169.3	-68.4	-178.9	-177.9	178.6	0	107.6	L281 Y282 E316 L487 Q491	L281-K489 HydrophobicContact CD1-CB 4.37Å; L281-K489 HydrophobicContact CD1-CG 4.44Å; L281-K489 WeakPolarHBondContact O-CA 3.29Å; Y282-K489 HydrophobicContact CD1-CG 4.17Å; Y282-K489 HydrophobicContact CE1-CD 4.43Å; Y282-K489 HydrophobicContact CE1-CG 4.06Å; E316-K489 WeakPolarHBondContact OE1-CE 3.37Å; E316-K489 IonicContact OE1-NZ 3.41Å; E316-K489 PolarHBondContact OE1-NZ 3.41Å; E316-K489 IonicContact OE2-NZ 3.55Å; E316-K489 PolarHBondContact OE2-NZ 2.91Å; E316-K489 VanDerWaalsContact OE2-NZ 3.07Å; L487-K489 PolarHBondContact O-N 3.25Å; K489-Q491 PolarHBondContact O-N 3.3Å; K489-Q491 VanDerWaalsContact O-N 3.15Å
490	R	58.2	Low	39.2	Very low	77 Å²	77	104.3 Å²	104.3	29%	0.291	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-54.4	123.5	170.7	-67.9	-168.6	-173.2	-168.5	9.4	109.3	D238 W280 L281 V283	D238-R490 IonicContact OD2-CZ 3.07Å; D238-R490 IonicContact OD2-NH1 3.75Å; D238-R490 IonicContact OD2-NH2 3.8Å; D238-R490 PolarHBondContact OD2-NH2 3.35Å; W280-R490 HydrophobicContact CH2-CB 4.13Å; W280-R490 HydrophobicContact CZ3-CB 3.95Å; W280-R490 HydrophobicContact CZ3-CG 4.38Å; W280-R490 VanDerWaalsContact O-CD 3.23Å; W280-R490 WeakPolarHBondContact O-CD 3.44Å; W280-R490 WeakPolarHBondContact O-CG 3.1Å; W280-R490 PolarHBondContact O-NE 2.87Å; L281-R490 PolarHBondContact O-N 3.17Å; V283-R490 HydrophobicContact CG2-CG 3.58Å
491	Q	50.7	Low	39.4	Very low	181 Å²	181	104.6 Å²	104.6	85%	0.846	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-78.9	130.3	175.3	-69.4	-172.6	-11.2	0	0	109.9	K489	K489-Q491 PolarHBondContact O-N 3.3Å; K489-Q491 VanDerWaalsContact O-N 3.15Å
492	F	51.1	Low	39.5	Very low	50 Å²	50	109.3 Å²	109.3	22%	0.219	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-86.1	127.2	178.1	-76.8	-107.8	0	0	0	110.8	P224 V226 L231 L234 W280	P224-F492 WeakPolarHBondContact CD-O 3.49Å; P224-F492 HydrophobicContact CG-CB 3.31Å; P224-F492 HydrophobicContact CG-CG 4.44Å; P224-F492 WeakPolarHBondContact CG-O 3.37Å; V226-F492 HydrophobicContact CB-CD2 4.43Å; V226-F492 HydrophobicContact CB-CE1 4.47Å; V226-F492 HydrophobicContact CB-CE2 4.09Å; V226-F492 HydrophobicContact CB-CZ 4.12Å; V226-F492 HydrophobicContact CG1-CD2 4.29Å; V226-F492 HydrophobicContact CG1-CE1 3.93Å; V226-F492 HydrophobicContact CG1-CE2 3.49Å; V226-F492 VanDerWaalsContact CG1-CE2 3.49Å; V226-F492 HydrophobicContact CG1-CZ 3.28Å; V226-F492 HydrophobicContact CG2-CB 4.21Å; V226-F492 HydrophobicContact CG2-CD1 3.8Å; V226-F492 HydrophobicContact CG2-CD2 3.29Å; V226-F492 HydrophobicContact CG2-CE1 3.86Å; V226-F492 HydrophobicContact CG2-CE2 3.41Å; V226-F492 VanDerWaalsContact CG2-CE2 3.41Å; V226-F492 HydrophobicContact CG2-CG 3.51Å; V226-F492 HydrophobicContact CG2-CZ 3.7Å; L231-F492 HydrophobicContact CD2-CE2 4.17Å; L231-F492 HydrophobicContact CD2-CZ 3.64Å; L231-F492 HydrophobicContact CG-CZ 4.34Å; L234-F492 HydrophobicContact CD1-CD1 4.26Å; L234-F492 HydrophobicContact CD1-CE1 3.33Å; L234-F492 HydrophobicContact CD1-CZ 3.91Å; W280-F492 HydrophobicContact CH2-CE1 4.4Å; W280-F492 HydrophobicContact CH2-CE2 4.35Å; W280-F492 AromaticContact CH2-CZ 3.96Å; W280-F492 HydrophobicContact CH2-CZ 3.96Å; W280-F492 AromaticContact CZ3-CE2 3.98Å; W280-F492 HydrophobicContact CZ3-CE2 3.98Å; W280-F492 AromaticContact CZ3-CZ 3.74Å; W280-F492 HydrophobicContact CZ3-CZ 3.74Å
493	Q	35.7	Very low	39.6	Very low	179 Å²	179	115.6 Å²	115.6	84%	0.836	56%	0.56	S	S	*	*			trans	-120.5	114.9	162.3	-70.1	-171	-10.4	0	0	108
494	R	34.3	Very low	39.8	Very low	158 Å²	158	117.3 Å²	117.3	60%	0.596	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64.7	137	169.8	-85.9	-174.4	177.6	168.5	1.7	108.8	P224 E230 K496	P224-R494 HydrophobicContact CB-CG 4.17Å; E230-R494 IonicContact OE1-NH2 3.78Å; R494-K496 PolarHBondContact O-N 3.41Å; R494-K496 VanDerWaalsContact O-N 3.15Å
495	P	30.7	Very low	39.8	Very low	124 Å²	124	113 Å²	113	81%	0.805	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-60.7	120.6	168.7	24.8	-30.3	0	0	0	108.3	S497	P495-S497 PolarHBondContact O-N 3.46Å
496	K	32.5	Very low	39.9	Very low	173 Å²	173	115.9 Å²	115.9	75%	0.752	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-64.3	127.2	173.2	-69.5	-177.7	179.4	179.3	0	107.8	R494 L498	R494-K496 PolarHBondContact O-N 3.41Å; R494-K496 VanDerWaalsContact O-N 3.15Å; K496-L498 PolarHBondContact O-N 2.94Å
497	S	33.1	Very low	39.8	Very low	73 Å²	73	109.7 Å²	109.7	51%	0.51	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-46.9	133.8	168.7	167.5	0	0	0	0	109.9	P495 F499 T500	P495-S497 PolarHBondContact O-N 3.46Å; S497-F499 PolarHBondContact O-N 3.22Å; S497-T500 PolarHBondContact O-N 3.21Å; S497-T500 PolarHBondContact O-OG1 3.48Å
498	L	33.5	Very low	39.1	Very low	143 Å²	143	112.5 Å²	112.5	75%	0.749	61%	0.609	S	S	*	*	H	α-helix	trans	-51.4	-28.8	-179.3	-112	147	0	0	0	112.5	K496	K496-L498 PolarHBondContact O-N 2.94Å
499	F	34.8	Very low	38.2	Very low	160 Å²	160	118.9 Å²	118.9	70%	0.702	64%	0.637	S	S	*	*	H	α-helix	trans	-73.6	-30.9	178.5	-93.7	-92.2	0	0	0	114.3	S497	S497-F499 PolarHBondContact O-N 3.22Å
500	T	38.9	Very low	36.9	Very low	89 Å²	89	118.2 Å²	118.2	55%	0.546	65%	0.652	S	S	.	*	H	α-helix	trans	-78.9	-23.9	-177.6	-24.2	0	0	0	0	112.1	S497 A504	S497-T500 PolarHBondContact O-N 3.21Å; S497-T500 PolarHBondContact O-OG1 3.48Å; T500-A504 WeakPolarHBondContact O-CB 3.41Å; T500-A504 PolarHBondContact O-N 3.19Å
501	T	38.2	Very low	35.6	Very low	80 Å²	80	123.6 Å²	123.6	49%	0.491	68%	0.68	S	S	.	*	H	α-helix	trans	-79.5	-26.4	178.7	-42.8	0	0	0	0	112.1	S505	T501-S505 PolarHBondContact O-OG 2.9Å
502	L	32.7	Very low	34.5	Very low	116 Å²	116	121.6 Å²	121.6	61%	0.607	68%	0.68	S	S	*	*	H	α-helix	trans	-79	-29.6	178.4	-107.3	145.2	0	0	0	113.7	S505	L502-S505 PolarHBondContact O-OG 3.36Å
503	F	35.6	Very low	33.2	Very low	159 Å²	159	130.4 Å²	130.4	70%	0.697	71%	0.714	S	S	*	*	H	α-helix	trans	-88	-30.2	176.8	-83.4	-79.8	0	0	0	113.4	S505	F503-S505 VanDerWaalsContact C-N 3.31Å; F503-S505 PolarHBondContact O-N 3.34Å
504	A	37.3	Very low	32.9	Very low	70 Å²	70	133.8 Å²	133.8	58%	0.579	72%	0.719	S	S	*	*	H	α-helix	trans	-72.6	-22.5	176.6	0	0	0	0	0	113.2	T500 V506	T500-A504 WeakPolarHBondContact O-CB 3.41Å; T500-A504 PolarHBondContact O-N 3.19Å; A504-V506 VanDerWaalsContact C-N 3.3Å; A504-V506 PolarHBondContact O-N 3.17Å
505	S	35.2	Very low	32.5	Very low	93 Å²	93	136.4 Å²	136.4	65%	0.65	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-6.2	178.4	61.2	0	0	0	0	114.6	T501 L502 F503	T501-S505 PolarHBondContact O-OG 2.9Å; L502-S505 PolarHBondContact O-OG 3.36Å; F503-S505 VanDerWaalsContact C-N 3.31Å; F503-S505 PolarHBondContact O-N 3.34Å
506	V	38.7	Very low	32.5	Very low	128 Å²	128	138.9 Å²	138.9	78%	0.776	73%	0.734	S	S	*	*	S	Bend	trans	-103.4	-12.1	-179.3	178.4	0	0	0	0	112.4	A504	A504-V506 VanDerWaalsContact C-N 3.3Å; A504-V506 PolarHBondContact O-N 3.17Å
507	A	36.6	Very low	32.2	Very low	88 Å²	88	136.3 Å²	136.3	73%	0.727	73%	0.732	S	S	*	*	S	Bend	trans	-116.1	8.6	-166.4	0	0	0	0	0	116.5
508	S	32.3	Very low	31.9	Very low	101 Å²	101	136.3 Å²	136.3	71%	0.706	74%	0.744	S	S	*	*			trans	-149.8	91.8	-178.2	-176.8	0	0	0	0	113
509	N	27.6	Very low	31.6	Very low	178 Å²	178	138.3 Å²	138.3	95%	0.952	75%	0.752	S	S	*	*			trans	-83.7	117.4	155.5	-99.3	-19.1	0	0	0	107.7
510	G	27.7	Very low	31.1	Very low	63 Å²	63	135.5 Å²	135.5	65%	0.649	76%	0.758	S	S	*	*			trans	148.6	107.6	164.1	0	0	0	0	0	116.3
511	Q	30	Very low	30.6	Very low	189 Å²	189	136.7 Å²	136.7	88%	0.883	77%	0.765	S	S	*	*			trans	80	85.5	157	-67.9	179.6	-22.8	0	0	120
512	T	27.1	Very low	29.9	Very low	139 Å²	139	138.3 Å²	138.3	85%	0.853	78%	0.777	S	S	*	*			trans	-3.1	114.2	142	43.3	0	0	0	0	120.4
513	Y	23.9	Very low	29.7	Very low	236 Å²	236	141.6 Å²	141.6	93%	0.925	79%	0.786	S	S	*	*			trans	-109.5	132.8	144.1	-97.5	-96.6	0	0	0	108.9
514	R	30.6	Very low	29	Very low	250 Å²	250	142.6 Å²	142.6	94%	0.943	79%	0.793	S	S	*	*			trans	-89.8	123.4	169	-99.7	-171.6	-179.8	-177.9	1.1	110.5
515	R	24.8	Very low	28.5	Very low	213 Å²	213	149.9 Å²	149.9	80%	0.804	81%	0.807	S	S	*	*			trans	-56.6	163.8	163.6	-72.5	175	175.6	160.4	-1.5	112.5
516	I	30.5	Very low	28	Very low	176 Å²	176	151.1 Å²	151.1	90%	0.903	82%	0.816	S	S	*	*				-150.7	136.7	111	-87.5	142.6	0	0	0	110
517	T	26.6	Very low	27.3	Very low	118 Å²	118	152.8 Å²	152.8	72%	0.724	82%	0.819	S	S	*	*			trans	-109.5	159.7	-179.6	41.9	0	0	0	0	110.8
518	G	27.5	Very low	26.8	Very low	73 Å²	73	152 Å²	152	75%	0.753	82%	0.82	S	S	*	*			trans	110.2	144.4	158.9	0	0	0	0	0	113.6
519	M	27.4	Very low	26.3	Very low	186 Å²	186	154 Å²	154	92%	0.916	82%	0.823	S	S	*	*			cis	-156.7	155.5	12.1	-64.8	-166.9	83.9	0	0	109.4
520	A	23.6	Very low	26.4	Very low	100 Å²	100	153.4 Å²	153.4	83%	0.826	82%	0.82	S	S	*	*			trans	-77.7	143.9	165.9	0	0	0	0	0	111.1
521	V	27.8	Very low	26.1	Very low	115 Å²	115	159 Å²	159	70%	0.697	83%	0.828	S	S	*	*			trans	-147.2	135.3	164.5	-167.2	0	0	0	0	109	F523	V521-F523 HydrophobicContact CG1-CD2 4.42Å; V521-F523 HydrophobicContact CG1-CE2 4.1Å
522	P	24.7	Very low	26	Very low	114 Å²	114	158.4 Å²	158.4	74%	0.74	83%	0.831	S	S	*	*			trans	-93.2	150.1	179.6	35.9	-30.6	0	0	0	111.8
523	F	27.9	Very low	25.9	Very low	185 Å²	185	157 Å²	157	81%	0.811	83%	0.827	S	S	*	*			trans	-144	124.7	165.5	-92.6	-80.6	0	0	0	113.1	V521	V521-F523 HydrophobicContact CG1-CD2 4.42Å; V521-F523 HydrophobicContact CG1-CE2 4.1Å
524	Q	21.7	Very low	26.1	Very low	180 Å²	180	152 Å²	152	84%	0.841	82%	0.823	S	S	*	*			trans	-86.7	144.9	162.7	-70.9	171.2	-65	0	0	109.3
525	Y	26.8	Very low	26.1	Very low	222 Å²	222	145.9 Å²	145.9	87%	0.871	82%	0.819	S	S	*	*			trans	-155.6	142.9	145.8	-99.6	-75.1	0	0	0	112.3
526	S	23.3	Very low	26.2	Very low	120 Å²	120	141.1 Å²	141.1	84%	0.839	82%	0.818	S	S	*	*			trans	-70.2	144.5	-171.4	-61.9	0	0	0	0	115.5
527	I	24.3	Very low	26.2	Very low	162 Å²	162	138.1 Å²	138.1	83%	0.831	81%	0.813	S	S	*	*			trans	-88.5	121.5	167.2	-64.3	171.6	0	0	0	108.7
528	G	25.7	Very low	26.1	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	82%	0.815	S	S	*	*			trans	-111	120.2	167.4	0	0	0	0	0	109.6
529	N	23.4	Very low	26.1	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	82%	0.82	S	S	*	*			trans	-59.9	142.7	173.8	-61.1	-20.7	0	0	0	111.3
530	N	28.1	Very low	26.1	Very low	165 Å²	165	142.4 Å²	142.4	88%	0.882	82%	0.818	S	S	*	*			trans	-162.1	121.4	136.9	-97.7	-15.1	0	0	0	111.3
531	E	22.7	Very low	26	Very low	179 Å²	179	144 Å²	144	84%	0.836	82%	0.822	S	S	*	*			trans	-59.8	146.3	165.5	-61.6	166.1	135.2	0	0	111.1
532	L	27.3	Very low	25.9	Very low	178 Å²	178	147.7 Å²	147.7	93%	0.932	83%	0.828	S	S	*	*			trans	-159.8	121.1	143.8	-103.6	133.9	0	0	0	110.6
533	S	25.7	Very low	25.9	Very low	110 Å²	110	148.8 Å²	148.8	77%	0.769	84%	0.835	S	S	*	*			trans	-77	169.2	-176.8	7.6	0	0	0	0	113.6
534	P	28.4	Very low	25.8	Very low	129 Å²	129	143.8 Å²	143.8	84%	0.838	83%	0.829	S	S	*	*			trans	-95.4	164.3	-156.9	37.3	-33.6	0	0	0	113.8
535	S	29.6	Very low	26	Very low	123 Å²	123	146.2 Å²	146.2	86%	0.86	83%	0.832	S	S	*	*			trans	-136.8	134.3	161.1	58.9	0	0	0	0	111.8
536	S	26.8	Very low	25.9	Very low	113 Å²	113	141.5 Å²	141.5	79%	0.79	83%	0.825	S	S	*	*			trans	-65.7	146.2	-174.1	52.1	0	0	0	0	115.7
537	S	30.8	Very low	25.9	Very low	113 Å²	113	140.8 Å²	140.8	79%	0.79	82%	0.82	S	S	*	*				-172.2	117.5	126.5	54.9	0	0	0	0	112.3
538	S	24.9	Very low	26.1	Very low	112 Å²	112	138.8 Å²	138.8	78%	0.783	82%	0.816	S	S	*	*			trans	-28	132.6	163	54.5	0	0	0	0	117.9
539	I	27.7	Very low	26.1	Very low	166 Å²	166	140 Å²	140	85%	0.851	81%	0.813	S	S	*	*			trans	-155.3	119.5	140.6	-58.3	-170.2	0	0	0	110.8
540	H	26.5	Very low	26.3	Very low	189 Å²	189	140.6 Å²	140.6	88%	0.875	82%	0.815	S	S	*	*			trans	22.2	119.6	156.7	-82.2	-23.3	0	0	0	123
541	C	21.9	Very low	26.3	Very low	133 Å²	133	141.6 Å²	141.6	90%	0.899	81%	0.814	S	S	*	*			trans	-74.2	125.5	160.2	-70	0	0	0	0	113.2
542	K	24.8	Very low	26.5	Very low	192 Å²	192	138.7 Å²	138.7	84%	0.835	80%	0.8	S	S	*	*			trans	-133.6	146.8	150	-83.2	-174	177.1	-179.7	0	107.2	A544	K542-A544 PolarHBondContact O-N 3.27Å
543	P	24.7	Very low	26.5	Very low	137 Å²	137	133.2 Å²	133.2	89%	0.89	79%	0.787	S	S	*	*			trans	-71.8	107.5	-173	30	-31.3	0	0	0	108.9
544	A	26.6	Very low	26.5	Very low	81 Å²	81	134 Å²	134	67%	0.669	79%	0.792	S	S	*	*			trans	-96.7	112.8	175.8	0	0	0	0	0	109.1	K542 V546	K542-A544 PolarHBondContact O-N 3.27Å; A544-V546 PolarHBondContact O-N 2.94Å
545	Y	25.1	Very low	26.6	Very low	231 Å²	231	132.6 Å²	132.6	91%	0.906	78%	0.781	S	S	*	*			trans	-46.9	108.1	153.2	-103.1	-102.5	0	0	0	108.2	S547	Y545-S547 PolarHBondContact O-N 2.98Å
546	V	26	Very low	26.9	Very low	122 Å²	122	132.7 Å²	132.7	74%	0.739	77%	0.768	S	S	*	*			trans	-81.3	98	172.4	179.2	0	0	0	0	107.4	A544 V548	A544-V546 PolarHBondContact O-N 2.94Å; V546-V548 HydrophobicContact CG1-CG2 4.16Å; V546-V548 PolarHBondContact O-N 3.29Å
547	S	23.9	Very low	27.6	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	76%	0.762	S	S	*	*			trans	-65.6	104.5	159.2	56.3	0	0	0	0	108	Y545 S549	Y545-S547 PolarHBondContact O-N 2.98Å; S547-S549 PolarHBondContact O-N 3.37Å
548	V	27.2	Very low	28.4	Very low	121 Å²	121	132.4 Å²	132.4	73%	0.733	76%	0.76	S	S	*	*			trans	-72.2	96.4	169.3	179.8	0	0	0	0	107.3	V546 L550	V546-V548 HydrophobicContact CG1-CG2 4.16Å; V546-V548 PolarHBondContact O-N 3.29Å; V548-L550 PolarHBondContact O-N 3.08Å
549	S	26.4	Very low	29.5	Very low	99 Å²	99	128.2 Å²	128.2	69%	0.692	73%	0.729	S	S	*	*			trans	-64.8	111.7	164.4	53.1	0	0	0	0	108	S547 H551	S547-S549 PolarHBondContact O-N 3.37Å; S549-H551 PolarHBondContact O-N 3.33Å
550	L	27.8	Very low	30.6	Very low	155 Å²	155	124.3 Å²	124.3	81%	0.812	71%	0.714	S	S	*	*			trans	-51.3	102.1	168.5	-83	152.3	0	0	0	108.9	V548 E552	V548-L550 PolarHBondContact O-N 3.08Å; L550-E552 PolarHBondContact O-N 3.04Å
551	H	27.8	Very low	31.3	Very low	186 Å²	186	120.6 Å²	120.6	86%	0.861	70%	0.695	S	S	*	*			trans	-74.4	98.3	171.5	-141.6	-42.4	0	0	0	107.3	S549 G553	S549-H551 PolarHBondContact O-N 3.33Å; H551-G553 PolarHBondContact O-N 2.72Å; H551-G553 VanDerWaalsContact O-N 3.17Å
552	E	26.4	Very low	32.7	Very low	117 Å²	117	118 Å²	118	55%	0.547	67%	0.672	S	S	.	*			trans	-58.5	112.7	169.5	-72	-175.4	130.1	0	0	109.1	L550 R718	L550-E552 PolarHBondContact O-N 3.04Å; E552-R718 IonicContact OE1-CZ 3.12Å; E552-R718 IonicContact OE1-NH1 3.71Å; E552-R718 PolarHBondContact OE1-NH1 2.46Å; E552-R718 IonicContact OE1-NH2 2.81Å
553	G	26.8	Very low	34.3	Very low	63 Å²	63	110.6 Å²	110.6	65%	0.649	64%	0.64	S	S	*	*			trans	-149.7	104.8	179.4	0	0	0	0	0	109.1	H551 V555	H551-G553 PolarHBondContact O-N 2.72Å; H551-G553 VanDerWaalsContact O-N 3.17Å; G553-V555 PolarHBondContact O-N 2.61Å
554	S	26.3	Very low	36.3	Very low	126 Å²	126	108 Å²	108	88%	0.881	62%	0.618	S	S	*	*			trans	-57.6	93.5	-176.9	55.2	0	0	0	0	113.6
555	V	31.4	Very low	38.1	Very low	101 Å²	101	104.5 Å²	104.5	61%	0.612	59%	0.589	S	S	*	*			trans	-143.7	104.7	166.5	-172.6	0	0	0	0	110.1	P476 G553	P476-V555 HydrophobicContact CB-CG1 3.78Å; P476-V555 HydrophobicContact CG-CG1 4.21Å; G553-V555 PolarHBondContact O-N 2.61Å
556	E	36.3	Very low	40.2	Very low	125 Å²	125	97.9 Å²	97.9	58%	0.584	57%	0.566	S	S	*	*			trans	68.4	73.9	153.9	-58.7	-169.4	176.4	0	0	121.8	D558	E556-D558 PolarHBondContact O-N 3.03Å
557	A	41.1	Very low	42.5	Very low	79 Å²	79	93.6 Å²	93.6	65%	0.653	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	21.8	172.4	0	0	0	0	0	116.8	K563	A557-K563 WeakPolarHBondContact O-CE 3.49Å; A557-K563 PolarHBondContact O-NZ 2.64Å
558	D	46.4	Very low	45.2	Very low	140 Å²	140	91.5 Å²	91.5	75%	0.749	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	-2.3	-170.2	-84.7	-26.1	0	0	0	117.1	E556 P560	E556-D558 PolarHBondContact O-N 3.03Å; D558-P560 WeakPolarHBondContact O-CD 3.29Å
559	D	48.6	Very low	47.8	Very low	25 Å²	25	88.6 Å²	88.6	13%	0.134	50%	0.499	C	S	.	.			trans	-82.8	111.7	172.3	-162.9	-25.8	0	0	0	111.9	R479 N481 K561 L562 K563	R479-D559 WeakPolarHBondContact CD-OD2 3.39Å; R479-D559 WeakPolarHBondContact CG-OD2 3.13Å; R479-D559 IonicContact NE-OD2 3.04Å; R479-D559 PolarHBondContact NE-OD2 3.09Å; R479-D559 VanDerWaalsContact NE-OD2 3.12Å; N481-D559 PolarHBondContact OD1-OD2 3.45Å; D559-K561 PolarHBondContact O-N 3.18Å; D559-K561 VanDerWaalsContact O-N 3.17Å; D559-K561 WeakPolarHBondContact OD1-CB 3.48Å; D559-K561 PolarHBondContact OD1-N 3.27Å; D559-L562 HydrophobicContact CB-CB 4.11Å; D559-L562 PolarHBondContact O-N 3.44Å; D559-K563 PolarHBondContact O-N 3.31Å
560	P	51.4	Low	50.6	Low	84 Å²	84	84 Å²	84	55%	0.545	47%	0.467	S	S	.	.	H	α-helix	trans	-60.7	-23.9	178.9	24.8	-34.4	0	0	0	113.6	D558 N564	D558-P560 WeakPolarHBondContact O-CD 3.29Å; P560-N564 PolarHBondContact O-N 3.42Å
561	K	41	Very low	53.4	Low	110 Å²	110	77.4 Å²	77.4	48%	0.478	43%	0.433	S	S	.	.	H	α-helix	trans	-79.6	-34.2	179.5	-71.6	-179.2	-178.6	-172.8	0	111.9	N481 D559 K563 N564 V565	N481-K561 HydrophobicContact CB-CB 3.8Å; N481-K561 HydrophobicContact CB-CD 3.91Å; N481-K561 HydrophobicContact CB-CG 4.47Å; N481-K561 WeakPolarHBondContact ND2-CD 3.25Å; N481-K561 WeakPolarHBondContact OD1-CB 3.37Å; N481-K561 WeakPolarHBondContact OD1-CD 3.49Å; D559-K561 PolarHBondContact O-N 3.18Å; D559-K561 VanDerWaalsContact O-N 3.17Å; D559-K561 WeakPolarHBondContact OD1-CB 3.48Å; D559-K561 PolarHBondContact OD1-N 3.27Å; K561-K563 VanDerWaalsContact C-N 3.27Å; K561-K563 PolarHBondContact O-N 2.82Å; K561-N564 PolarHBondContact O-N 3.01Å; K561-V565 WeakPolarHBondContact O-CG2 3.45Å; K561-V565 PolarHBondContact O-N 3.3Å
562	L	51.1	Low	56.3	Low	78 Å²	78	69.2 Å²	69.2	41%	0.408	40%	0.396	S	S	.	.	H	α-helix	trans	-63.9	-34.7	172.3	-150.1	76.6	0	0	0	111.2	P480 D559 V565 H566	P480-L562 WeakPolarHBondContact O-CD1 3.42Å; D559-L562 HydrophobicContact CB-CB 4.11Å; D559-L562 PolarHBondContact O-N 3.44Å; L562-V565 WeakPolarHBondContact O-CB 3.43Å; L562-V565 WeakPolarHBondContact O-CG2 3.25Å; L562-V565 PolarHBondContact O-N 3.11Å; L562-H566 PolarHBondContact O-N 3.42Å
563	K	59	Low	59.2	Low	37 Å²	37	67.5 Å²	67.5	16%	0.161	39%	0.388	C	S	.	.	H	α-helix	trans	-63.2	-42.7	175.7	-68.1	173.9	-176.8	165.7	0	112.8	A557 D559 K561 V565 Q567 W829	A557-K563 WeakPolarHBondContact O-CE 3.49Å; A557-K563 PolarHBondContact O-NZ 2.64Å; D559-K563 PolarHBondContact O-N 3.31Å; K561-K563 VanDerWaalsContact C-N 3.27Å; K561-K563 PolarHBondContact O-N 2.82Å; K563-V565 VanDerWaalsContact C-N 3.33Å; K563-V565 PolarHBondContact O-N 3.29Å; K563-Q567 VanDerWaalsContact O-CG 3.31Å; K563-Q567 WeakPolarHBondContact O-CG 3.33Å; K563-Q567 PolarHBondContact O-N 3.39Å; K563-W829 HydrophobicContact CD-CD2 4.14Å; K563-W829 HydrophobicContact CD-CG 4.22Å
564	N	66.5	Low	62.4	Low	82 Å²	82	64.5 Å²	64.5	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-69.3	-32.3	179.5	-66.7	-13	0	0	0	111.8	P483 P560 K561 Q567 T568	P483-N564 VanDerWaalsContact CG-C 3.43Å; P483-N564 HydrophobicContact CG-CB 3.5Å; P483-N564 WeakPolarHBondContact CG-O 3.28Å; P560-N564 PolarHBondContact O-N 3.42Å; K561-N564 PolarHBondContact O-N 3.01Å; N564-Q567 WeakPolarHBondContact O-CB 2.88Å; N564-T568 PolarHBondContact O-N 3.29Å; N564-T568 PolarHBondContact O-OG1 3.31Å
565	V	64.8	Low	65.6	Low	8 Å²	8	61.2 Å²	61.2	5%	0.048	33%	0.327	C	S	.	.	H	α-helix	trans	-56.9	-56.9	177.5	-177.9	0	0	0	0	110	L482 K561 L562 K563 Q567 T568 E569	L482-V565 VanDerWaalsContact CA-CG2 3.48Å; L482-V565 HydrophobicContact CB-CB 4.39Å; L482-V565 HydrophobicContact CB-CG1 3.73Å; L482-V565 HydrophobicContact CB-CG2 4.02Å; L482-V565 WeakPolarHBondContact O-CA 3.32Å; L482-V565 WeakPolarHBondContact O-CB 3.36Å; L482-V565 WeakPolarHBondContact O-CG1 3.25Å; L482-V565 WeakPolarHBondContact O-CG2 3.12Å; K561-V565 WeakPolarHBondContact O-CG2 3.45Å; K561-V565 PolarHBondContact O-N 3.3Å; L562-V565 WeakPolarHBondContact O-CB 3.43Å; L562-V565 WeakPolarHBondContact O-CG2 3.25Å; L562-V565 PolarHBondContact O-N 3.11Å; K563-V565 VanDerWaalsContact C-N 3.33Å; K563-V565 PolarHBondContact O-N 3.29Å; V565-Q567 VanDerWaalsContact C-N 3.27Å; V565-Q567 PolarHBondContact O-N 3.26Å; V565-T568 CarbonylContact O-C 3.28Å; V565-T568 WeakPolarHBondContact O-CA 3.36Å; V565-T568 WeakPolarHBondContact O-CB 3.41Å; V565-T568 PolarHBondContact O-N 2.93Å; V565-E569 HydrophobicContact CG1-CG 4.32Å; V565-E569 WeakPolarHBondContact CG1-OE1 3.46Å; V565-E569 PolarHBondContact O-N 3.27Å
566	H	68.5	Low	68.4	Low	92 Å²	92	58.9 Å²	58.9	43%	0.426	31%	0.309	S	S	.	.	H	α-helix	trans	-68.4	-36.6	-169.1	-171.5	48.1	0	0	0	109.8	L562 E569 I570 H714	L562-H566 PolarHBondContact O-N 3.42Å; H566-E569 IonicContact ND1-OE2 2.72Å; H566-E569 PolarHBondContact O-N 3.19Å; H566-I570 WeakPolarHBondContact O-CB 3.37Å; H566-I570 WeakPolarHBondContact O-CD1 3.42Å; H566-I570 WeakPolarHBondContact O-CG1 3.49Å; H566-I570 PolarHBondContact O-N 2.85Å; H566-H714 AromaticContact CD2-CD2 3.62Å
567	Q	74	Confident	71.2	Confident	33 Å²	33	53.1 Å²	53.1	15%	0.154	28%	0.282	C	S	.	.	H	α-helix	trans	-52.1	-58.7	164.7	-78.1	178.7	-4	0	0	111.2	K563 N564 V565 E569 I570 L571 H714 W829 Y831	K563-Q567 VanDerWaalsContact O-CG 3.31Å; K563-Q567 WeakPolarHBondContact O-CG 3.33Å; K563-Q567 PolarHBondContact O-N 3.39Å; N564-Q567 WeakPolarHBondContact O-CB 2.88Å; V565-Q567 VanDerWaalsContact C-N 3.27Å; V565-Q567 PolarHBondContact O-N 3.26Å; Q567-E569 VanDerWaalsContact C-N 3.29Å; Q567-E569 PolarHBondContact O-N 3.16Å; Q567-I570 PolarHBondContact O-N 3.19Å; Q567-I570 VanDerWaalsContact O-N 3.17Å; Q567-L571 PolarHBondContact O-N 2.87Å; Q567-H714 WeakPolarHBondContact CG-CE1 3.47Å; Q567-W829 PolarHBondContact NE2-O 3.31Å; Q567-Y831 WeakPolarHBondContact CA-OH 3.45Å; Q567-Y831 HydrophobicContact CB-CE2 3.98Å; Q567-Y831 VanDerWaalsContact CB-OH 3.23Å; Q567-Y831 WeakPolarHBondContact CB-OH 3.03Å; Q567-Y831 HydrophobicContact CG-CE2 3.88Å; Q567-Y831 PolarHBondContact O-OH 3.46Å
568	T	80	Confident	73.8	Confident	61 Å²	61	49.5 Å²	49.5	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-57.5	-41.9	-176.4	-53	0	0	0	0	112.2	P483 N564 V565 L571 V572	P483-T568 HydrophobicContact CB-CG2 4.42Å; P483-T568 WeakPolarHBondContact CB-OG1 3.11Å; N564-T568 PolarHBondContact O-N 3.29Å; N564-T568 PolarHBondContact O-OG1 3.31Å; V565-T568 CarbonylContact O-C 3.28Å; V565-T568 WeakPolarHBondContact O-CA 3.36Å; V565-T568 WeakPolarHBondContact O-CB 3.41Å; V565-T568 PolarHBondContact O-N 2.93Å; T568-L571 PolarHBondContact O-N 3.4Å; T568-V572 HydrophobicContact CG2-CG2 4.44Å; T568-V572 WeakPolarHBondContact O-CB 3.43Å; T568-V572 WeakPolarHBondContact O-CG2 3.24Å; T568-V572 PolarHBondContact O-N 3.07Å; T568-V572 VanDerWaalsContact O-N 3.11Å
569	E	81.6	Confident	76.1	Confident	60 Å²	60	47.1 Å²	47.1	28%	0.28	24%	0.236	S	C	.	.	H	α-helix	trans	-59.7	-52.2	175.4	-70.5	169.5	167.4	0	0	112.1	V565 H566 Q567 L571 V572 E573	V565-E569 HydrophobicContact CG1-CG 4.32Å; V565-E569 WeakPolarHBondContact CG1-OE1 3.46Å; V565-E569 PolarHBondContact O-N 3.27Å; H566-E569 IonicContact ND1-OE2 2.72Å; H566-E569 PolarHBondContact O-N 3.19Å; Q567-E569 VanDerWaalsContact C-N 3.29Å; Q567-E569 PolarHBondContact O-N 3.16Å; E569-L571 VanDerWaalsContact C-N 3.28Å; E569-L571 PolarHBondContact O-N 2.72Å; E569-V572 WeakPolarHBondContact O-CB 3.31Å; E569-V572 PolarHBondContact O-N 3.09Å; E569-E573 PolarHBondContact O-N 3.48Å
570	I	85.8	Confident	78.3	Confident	3 Å²	3	50 Å²	50	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-55.4	-44.8	178.9	-70.1	169.1	0	0	0	111.1	H566 Q567 V572 L574 A710 V711 H714 Y831	H566-I570 WeakPolarHBondContact O-CB 3.37Å; H566-I570 WeakPolarHBondContact O-CD1 3.42Å; H566-I570 WeakPolarHBondContact O-CG1 3.49Å; H566-I570 PolarHBondContact O-N 2.85Å; Q567-I570 PolarHBondContact O-N 3.19Å; Q567-I570 VanDerWaalsContact O-N 3.17Å; I570-V572 VanDerWaalsContact C-N 3.27Å; I570-V572 PolarHBondContact O-N 2.7Å; I570-L574 WeakPolarHBondContact O-CB 3.26Å; I570-L574 PolarHBondContact O-N 3.1Å; I570-A710 HydrophobicContact CD1-CB 4.25Å; I570-A710 HydrophobicContact CG1-CB 3.96Å; I570-A710 HydrophobicContact CG2-CB 4.12Å; I570-V711 HydrophobicContact CG2-CB 4.23Å; I570-V711 HydrophobicContact CG2-CG2 3.35Å; I570-H714 HydrophobicContact CD1-CB 3.89Å; I570-Y831 HydrophobicContact CB-CE2 4.34Å; I570-Y831 HydrophobicContact CG2-CE2 4.16Å
571	L	87.7	Confident	80.4	Confident	16 Å²	16	46 Å²	46	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-66.7	-31.2	179.8	-178.9	64.7	0	0	0	112.4	Q567 T568 E569 K575 Q839 I840 E843	Q567-L571 PolarHBondContact O-N 2.87Å; T568-L571 PolarHBondContact O-N 3.4Å; E569-L571 VanDerWaalsContact C-N 3.28Å; E569-L571 PolarHBondContact O-N 2.72Å; L571-K575 HydrophobicContact CG-CD 4.42Å; L571-K575 WeakPolarHBondContact O-CG 3.45Å; L571-K575 PolarHBondContact O-N 2.99Å; L571-Q839 HydrophobicContact CD1-CG 4.48Å; L571-Q839 HydrophobicContact CD2-CG 4.42Å; L571-I840 HydrophobicContact CD1-CG1 4.04Å; L571-E843 HydrophobicContact CD1-CG 4.45Å
572	V	87	Confident	83	Confident	14 Å²	14	40.9 Å²	40.9	9%	0.085	20%	0.203	C	C	.	.	H	α-helix	trans	-75	-43.4	-179.5	167.1	0	0	0	0	111.2	R460 T568 E569 I570 L574 K575 Q576	R460-V572 VanDerWaalsContact NH1-CG1 3.35Å; T568-V572 HydrophobicContact CG2-CG2 4.44Å; T568-V572 WeakPolarHBondContact O-CB 3.43Å; T568-V572 WeakPolarHBondContact O-CG2 3.24Å; T568-V572 PolarHBondContact O-N 3.07Å; T568-V572 VanDerWaalsContact O-N 3.11Å; E569-V572 WeakPolarHBondContact O-CB 3.31Å; E569-V572 PolarHBondContact O-N 3.09Å; I570-V572 VanDerWaalsContact C-N 3.27Å; I570-V572 PolarHBondContact O-N 2.7Å; V572-L574 VanDerWaalsContact C-N 3.28Å; V572-L574 PolarHBondContact O-N 3.29Å; V572-K575 PolarHBondContact O-N 2.84Å; V572-Q576 VanDerWaalsContact O-CG 3.3Å; V572-Q576 WeakPolarHBondContact O-CG 3.38Å; V572-Q576 PolarHBondContact O-N 2.96Å
573	E	88	Confident	85.1	Confident	81 Å²	81	43.5 Å²	43.5	38%	0.379	21%	0.208	S	C	.	.	H	α-helix	trans	-60.9	-39.1	172.6	-69.3	179	174.9	0	0	111.6	E569 Q576 S577	E569-E573 PolarHBondContact O-N 3.48Å; E573-Q576 PolarHBondContact O-N 3.5Å; E573-S577 WeakPolarHBondContact O-CB 3.4Å; E573-S577 PolarHBondContact O-N 3.25Å; E573-S577 PolarHBondContact O-OG 2.83Å
574	L	93.7	Very high	86.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.5	-49.4	174.1	179.3	64.7	0	0	0	111.5	I570 V572 Q576 S577 I578 L704 L708 V711 I840 L844	I570-L574 WeakPolarHBondContact O-CB 3.26Å; I570-L574 PolarHBondContact O-N 3.1Å; V572-L574 VanDerWaalsContact C-N 3.28Å; V572-L574 PolarHBondContact O-N 3.29Å; L574-Q576 PolarHBondContact O-N 3.41Å; L574-S577 WeakPolarHBondContact O-CB 3.4Å; L574-S577 PolarHBondContact O-N 2.84Å; L574-I578 HydrophobicContact CD1-CD1 4.13Å; L574-I578 HydrophobicContact CG-CD1 4.02Å; L574-I578 WeakPolarHBondContact O-CG1 3.42Å; L574-I578 PolarHBondContact O-N 3.17Å; L574-L704 HydrophobicContact CD1-CD1 3.85Å; L574-L708 HydrophobicContact CD1-CD2 3.97Å; L574-L708 HydrophobicContact CD1-CG 3.97Å; L574-V711 HydrophobicContact CD2-CG2 4.45Å; L574-I840 HydrophobicContact CD2-CB 4.44Å; L574-I840 HydrophobicContact CD2-CG1 4.16Å; L574-I840 HydrophobicContact CD2-CG2 3.86Å; L574-L844 HydrophobicContact CD1-CD2 4.34Å
575	K	93.3	Very high	88.2	Confident	57 Å²	57	38.5 Å²	38.5	25%	0.248	18%	0.182	C	C	.	.	H	α-helix	trans	-59.4	-45.4	177.6	-78.9	165.7	173.4	-77.3	0	112	L571 V572 I578 Q579 Y602 E843	L571-K575 HydrophobicContact CG-CD 4.42Å; L571-K575 WeakPolarHBondContact O-CG 3.45Å; L571-K575 PolarHBondContact O-N 2.99Å; V572-K575 PolarHBondContact O-N 2.84Å; K575-I578 PolarHBondContact O-N 3.5Å; K575-Q579 VanDerWaalsContact O-CG 3.31Å; K575-Q579 WeakPolarHBondContact O-CG 3.31Å; K575-Q579 PolarHBondContact O-N 3.18Å; K575-Y602 PolarHBondContact NZ-OH 3.44Å; K575-E843 WeakPolarHBondContact CE-OE1 3.41Å; K575-E843 HydrophobicContact CG-CG 4.18Å; K575-E843 IonicContact NZ-OE1 2.8Å; K575-E843 PolarHBondContact NZ-OE1 2.78Å; K575-E843 IonicContact NZ-OE2 3.42Å
576	Q	91.5	Very high	89.6	Confident	52 Å²	52	43 Å²	43	24%	0.243	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-44.8	176.5	-72.8	164.7	-3.6	0	0	111.3	S457 V572 E573 L574 I578 Q579 L580	S457-Q576 PolarHBondContact OG-NE2 3.45Å; V572-Q576 VanDerWaalsContact O-CG 3.3Å; V572-Q576 WeakPolarHBondContact O-CG 3.38Å; V572-Q576 PolarHBondContact O-N 2.96Å; E573-Q576 PolarHBondContact O-N 3.5Å; L574-Q576 PolarHBondContact O-N 3.41Å; Q576-I578 VanDerWaalsContact C-N 3.3Å; Q576-I578 PolarHBondContact O-N 2.82Å; Q576-Q579 PolarHBondContact O-N 2.55Å; Q576-L580 WeakPolarHBondContact O-CG 3.06Å; Q576-L580 PolarHBondContact O-N 3.29Å
577	S	94.3	Very high	90.8	Very high	4 Å²	4	43 Å²	43	3%	0.028	21%	0.205	C	C	.	.	H	α-helix	trans	-58.6	-41.9	177.5	-60.2	0	0	0	0	111.9	E573 L574 I581 S703 S707	E573-S577 WeakPolarHBondContact O-CB 3.4Å; E573-S577 PolarHBondContact O-N 3.25Å; E573-S577 PolarHBondContact O-OG 2.83Å; L574-S577 WeakPolarHBondContact O-CB 3.4Å; L574-S577 PolarHBondContact O-N 2.84Å; S577-I581 WeakPolarHBondContact O-CG1 3.49Å; S577-I581 PolarHBondContact O-N 2.95Å; S577-S703 WeakPolarHBondContact CB-OG 3.37Å; S577-S703 PolarHBondContact OG-O 3.23Å; S577-S703 PolarHBondContact OG-OG 3.32Å; S577-S707 PolarHBondContact OG-OG 3.02Å
578	I	96.6	Very high	91.5	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-67.1	-44.3	176.4	-68.5	162.5	0	0	0	111.1	L574 K575 Q576 L580 I581 V582 L704 E843 L844 V846 L847	L574-I578 HydrophobicContact CD1-CD1 4.13Å; L574-I578 HydrophobicContact CG-CD1 4.02Å; L574-I578 WeakPolarHBondContact O-CG1 3.42Å; L574-I578 PolarHBondContact O-N 3.17Å; K575-I578 PolarHBondContact O-N 3.5Å; Q576-I578 VanDerWaalsContact C-N 3.3Å; Q576-I578 PolarHBondContact O-N 2.82Å; I578-L580 VanDerWaalsContact C-N 3.31Å; I578-L580 PolarHBondContact O-N 3.01Å; I578-I581 PolarHBondContact O-N 3.34Å; I578-V582 HydrophobicContact CG2-CG2 4.4Å; I578-V582 WeakPolarHBondContact O-CG2 3.23Å; I578-V582 PolarHBondContact O-N 3.42Å; I578-L704 HydrophobicContact CG1-CD1 4.04Å; I578-E843 HydrophobicContact CD1-CB 3.61Å; I578-L844 HydrophobicContact CD1-CD2 4.41Å; I578-V846 HydrophobicContact CG2-CB 4.03Å; I578-V846 HydrophobicContact CG2-CG1 3.99Å; I578-L847 HydrophobicContact CG1-CD1 4.17Å; I578-L847 HydrophobicContact CG1-CG 4.34Å; I578-L847 HydrophobicContact CG2-CD2 3.99Å; I578-L847 HydrophobicContact CG2-CG 4.27Å
579	Q	93.7	Very high	91.9	Very high	91 Å²	91	42.8 Å²	42.8	43%	0.425	20%	0.203	S	C	.	.	H	α-helix	trans	-60.8	-39.1	178	-75.2	175.5	-26.8	0	0	112.4	K575 Q576 V582 R583 A598	K575-Q579 VanDerWaalsContact O-CG 3.31Å; K575-Q579 WeakPolarHBondContact O-CG 3.31Å; K575-Q579 PolarHBondContact O-N 3.18Å; Q576-Q579 PolarHBondContact O-N 2.55Å; Q579-V582 PolarHBondContact O-N 2.94Å; Q579-R583 WeakPolarHBondContact O-CB 3.27Å; Q579-R583 PolarHBondContact O-N 3.5Å; Q579-A598 HydrophobicContact CG-CB 4.47Å
580	L	94.4	Very high	92.2	Very high	86 Å²	86	43.7 Å²	43.7	45%	0.45	21%	0.213	S	C	.	.	H	α-helix	trans	-63.2	-41.1	175.3	-70.5	172.7	0	0	0	111.9	Q576 I578 R583 H584 L699	Q576-L580 WeakPolarHBondContact O-CG 3.06Å; Q576-L580 PolarHBondContact O-N 3.29Å; I578-L580 VanDerWaalsContact C-N 3.31Å; I578-L580 PolarHBondContact O-N 3.01Å; L580-R583 PolarHBondContact O-N 2.95Å; L580-H584 WeakPolarHBondContact O-CB 3.21Å; L580-H584 PolarHBondContact O-N 3.4Å; L580-L699 HydrophobicContact CB-CD2 3.94Å; L580-L699 HydrophobicContact CD1-CD2 4.49Å
581	I	96.7	Very high	92.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-45.2	175.1	-64.8	166.2	0	0	0	110.6	S577 I578 R583 H584 F585 I696 L699 V700 L704 L847 F852	S577-I581 WeakPolarHBondContact O-CG1 3.49Å; S577-I581 PolarHBondContact O-N 2.95Å; I578-I581 PolarHBondContact O-N 3.34Å; I581-R583 VanDerWaalsContact C-N 3.31Å; I581-R583 PolarHBondContact O-N 2.63Å; I581-H584 WeakPolarHBondContact O-CB 3.21Å; I581-H584 PolarHBondContact O-N 3.5Å; I581-H584 VanDerWaalsContact O-N 3.17Å; I581-F585 HydrophobicContact CG2-CD2 3.88Å; I581-F585 HydrophobicContact CG2-CE2 3.78Å; I581-F585 WeakPolarHBondContact O-CD2 3.5Å; I581-F585 PolarHBondContact O-N 2.8Å; I581-F585 VanDerWaalsContact O-N 3.1Å; I581-I696 HydrophobicContact CG2-CD1 4.41Å; I581-L699 HydrophobicContact CG1-CB 3.92Å; I581-V700 HydrophobicContact CD1-CG2 4.11Å; I581-L704 HydrophobicContact CD1-CB 4.03Å; I581-L704 HydrophobicContact CD1-CD2 3.79Å; I581-L704 HydrophobicContact CD1-CG 4.41Å; I581-L847 HydrophobicContact CB-CD2 4.03Å; I581-L847 HydrophobicContact CD1-CD1 4.43Å; I581-L847 HydrophobicContact CD1-CD2 4.26Å; I581-L847 HydrophobicContact CG2-CD2 3.78Å; I581-F852 HydrophobicContact CG2-CE1 4.08Å; I581-F852 HydrophobicContact CG2-CZ 3.87Å
582	V	95.9	Very high	91.9	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-43.7	176.9	173.8	0	0	0	0	111.2	I578 Q579 H584 F585 R586 A598 V846 F850	I578-V582 HydrophobicContact CG2-CG2 4.4Å; I578-V582 WeakPolarHBondContact O-CG2 3.23Å; I578-V582 PolarHBondContact O-N 3.42Å; Q579-V582 PolarHBondContact O-N 2.94Å; V582-H584 VanDerWaalsContact C-N 3.33Å; V582-H584 PolarHBondContact O-N 2.88Å; V582-F585 PolarHBondContact O-N 3.44Å; V582-R586 WeakPolarHBondContact O-CG 3.47Å; V582-R586 PolarHBondContact O-N 3.44Å; V582-A598 HydrophobicContact CB-CB 4.24Å; V582-A598 HydrophobicContact CG1-CB 3.83Å; V582-A598 HydrophobicContact CG2-CB 4.35Å; V582-V846 HydrophobicContact CG2-CG1 3.73Å; V582-F850 HydrophobicContact CB-CE2 4.44Å; V582-F850 HydrophobicContact CB-CZ 4.12Å; V582-F850 HydrophobicContact CG1-CZ 4.09Å; V582-F850 HydrophobicContact CG2-CE2 3.74Å; V582-F850 HydrophobicContact CG2-CZ 3.84Å
583	R	94.8	Very high	92.1	Very high	133 Å²	133	55.9 Å²	55.9	50%	0.502	27%	0.269	S	S	.	.	H	α-helix	trans	-62.8	-39.8	177	-176.5	173.7	173.6	152.8	0.6	111.7	E448 Q579 L580 I581 R586 T587	E448-R583 IonicContact OE1-CZ 2.93Å; E448-R583 IonicContact OE1-NH1 2.54Å; E448-R583 PolarHBondContact OE1-NH1 3.2Å; E448-R583 VanDerWaalsContact OE1-NH1 3.15Å; E448-R583 IonicContact OE1-NH2 2.59Å; E448-R583 PolarHBondContact OE1-NH2 2.9Å; Q579-R583 WeakPolarHBondContact O-CB 3.27Å; Q579-R583 PolarHBondContact O-N 3.5Å; L580-R583 PolarHBondContact O-N 2.95Å; I581-R583 VanDerWaalsContact C-N 3.31Å; I581-R583 PolarHBondContact O-N 2.63Å; R583-R586 PolarHBondContact O-N 3.48Å; R583-T587 WeakPolarHBondContact O-CB 3.49Å; R583-T587 PolarHBondContact O-N 3.04Å; R583-T587 PolarHBondContact O-OG1 3.49Å
584	H	95.5	Very high	91.8	Very high	15 Å²	15	54.2 Å²	54.2	7%	0.069	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-52.5	175.8	178.5	89.6	0	0	0	112.1	L580 I581 V582 R586 T587 N588 A687 D693 L699	L580-H584 WeakPolarHBondContact O-CB 3.21Å; L580-H584 PolarHBondContact O-N 3.4Å; I581-H584 WeakPolarHBondContact O-CB 3.21Å; I581-H584 PolarHBondContact O-N 3.5Å; I581-H584 VanDerWaalsContact O-N 3.17Å; V582-H584 VanDerWaalsContact C-N 3.33Å; V582-H584 PolarHBondContact O-N 2.88Å; H584-R586 PolarHBondContact O-N 3.2Å; H584-T587 PolarHBondContact O-N 3.03Å; H584-T587 VanDerWaalsContact O-N 3.16Å; H584-N588 PolarHBondContact CE1-ND2 3.17Å; H584-N588 PolarHBondContact ND1-ND2 3.21Å; H584-N588 PolarHBondContact NE2-ND2 3.31Å; H584-N588 WeakPolarHBondContact O-CB 3.38Å; H584-N588 PolarHBondContact O-N 2.9Å; H584-A687 PolarHBondContact CD2-O 3.47Å; H584-A687 PolarHBondContact NE2-O 2.92Å; H584-D693 IonicContact CE1-OD1 3.84Å; H584-D693 IonicContact CE1-OD2 2.87Å; H584-D693 PolarHBondContact CE1-OD2 3.37Å; H584-D693 IonicContact NE2-OD2 3.21Å; H584-D693 PolarHBondContact NE2-OD2 3.47Å; H584-D693 VanDerWaalsContact NE2-OD2 3.16Å; H584-L699 HydrophobicContact CB-CD1 3.52Å
585	F	95.3	Very high	91.4	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.7	-42.3	177.6	-82.1	-87.8	0	0	0	112.7	I581 V582 T587 D589 H593 A687 I696 F850 F852	I581-F585 HydrophobicContact CG2-CD2 3.88Å; I581-F585 HydrophobicContact CG2-CE2 3.78Å; I581-F585 WeakPolarHBondContact O-CD2 3.5Å; I581-F585 PolarHBondContact O-N 2.8Å; I581-F585 VanDerWaalsContact O-N 3.1Å; V582-F585 PolarHBondContact O-N 3.44Å; F585-T587 PolarHBondContact O-N 2.71Å; F585-D589 CarbonylContact O-C 3.55Å; F585-D589 WeakPolarHBondContact O-CA 3.37Å; F585-D589 PolarHBondContact O-N 2.61Å; F585-H593 HydrophobicContact CB-CB 4.19Å; F585-H593 AromaticContact CD1-CD2 3.56Å; F585-H593 AromaticContact CD1-NE2 3.84Å; F585-A687 HydrophobicContact CD1-CB 3.84Å; F585-A687 HydrophobicContact CE1-CB 4.09Å; F585-A687 HydrophobicContact CG-CB 4.37Å; F585-I696 HydrophobicContact CE2-CD1 4.11Å; F585-F850 HydrophobicContact CB-CD1 3.5Å; F585-F850 VanDerWaalsContact CB-CD1 3.5Å; F585-F850 HydrophobicContact CB-CE1 3.45Å; F585-F850 VanDerWaalsContact CB-CE1 3.45Å; F585-F850 HydrophobicContact CB-CG 4.36Å; F585-F850 HydrophobicContact CB-CZ 4.3Å; F585-F850 HydrophobicContact CD1-CB 4.03Å; F585-F850 AromaticContact CD1-CD1 3.63Å; F585-F850 HydrophobicContact CD1-CD1 3.63Å; F585-F850 HydrophobicContact CD1-CE1 4.47Å; F585-F850 HydrophobicContact CD1-CG 4.07Å; F585-F850 HydrophobicContact CD2-CB 4.06Å; F585-F850 AromaticContact CD2-CD1 3.7Å; F585-F850 HydrophobicContact CD2-CD1 3.7Å; F585-F850 HydrophobicContact CD2-CD2 4.14Å; F585-F850 HydrophobicContact CD2-CE1 4.18Å; F585-F850 AromaticContact CD2-CG 3.68Å; F585-F850 HydrophobicContact CD2-CG 3.68Å; F585-F850 HydrophobicContact CE1-CB 3.72Å; F585-F850 HydrophobicContact CE1-CD1 4.23Å; F585-F850 HydrophobicContact CE1-CG 4.24Å; F585-F850 HydrophobicContact CE2-CB 3.78Å; F585-F850 HydrophobicContact CE2-CD1 4.3Å; F585-F850 HydrophobicContact CE2-CD2 4.36Å; F585-F850 AromaticContact CE2-CG 3.89Å; F585-F850 HydrophobicContact CE2-CG 3.89Å; F585-F850 HydrophobicContact CG-CB 4.18Å; F585-F850 AromaticContact CG-CD1 3.32Å; F585-F850 HydrophobicContact CG-CD1 3.32Å; F585-F850 AromaticContact CG-CE1 3.81Å; F585-F850 HydrophobicContact CG-CE1 3.81Å; F585-F850 AromaticContact CG-CG 3.77Å; F585-F850 HydrophobicContact CG-CG 3.77Å; F585-F850 HydrophobicContact CZ-CB 3.59Å; F585-F850 HydrophobicContact CZ-CG 4.15Å; F585-F852 HydrophobicContact CE2-CD1 4.35Å; F585-F852 AromaticContact CE2-CE1 3.63Å; F585-F852 HydrophobicContact CE2-CE1 3.63Å; F585-F852 AromaticContact CE2-CZ 3.74Å; F585-F852 HydrophobicContact CE2-CZ 3.74Å; F585-F852 HydrophobicContact CZ-CD1 4.12Å; F585-F852 AromaticContact CZ-CE1 3.85Å; F585-F852 HydrophobicContact CZ-CE1 3.85Å; F585-F852 HydrophobicContact CZ-CZ 4.09Å
586	R	94.3	Very high	91.2	Very high	102 Å²	102	55.8 Å²	55.8	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-30.7	175.8	-76.9	174	172.7	-170.2	-5.5	113.1	V582 R583 H584 P590 H593 A596	V582-R586 WeakPolarHBondContact O-CG 3.47Å; V582-R586 PolarHBondContact O-N 3.44Å; R583-R586 PolarHBondContact O-N 3.48Å; H584-R586 PolarHBondContact O-N 3.2Å; R586-P590 WeakPolarHBondContact O-CB 3.4Å; R586-H593 WeakPolarHBondContact CG-O 3.44Å; R586-A596 PolarHBondContact NE-O 2.96Å; R586-A596 PolarHBondContact NH2-O 3.04Å
587	T	92.2	Very high	91.2	Very high	92 Å²	92	56 Å²	56	56%	0.564	31%	0.31	S	S	*	.	H	α-helix	trans	-86.6	-42.9	-177	-53.4	0	0	0	0	111.7	R583 H584 F585	R583-T587 WeakPolarHBondContact O-CB 3.49Å; R583-T587 PolarHBondContact O-N 3.04Å; R583-T587 PolarHBondContact O-OG1 3.49Å; H584-T587 PolarHBondContact O-N 3.03Å; H584-T587 VanDerWaalsContact O-N 3.16Å; F585-T587 PolarHBondContact O-N 2.71Å
588	N	89.9	Confident	90.9	Very high	75 Å²	75	56.8 Å²	56.8	40%	0.401	32%	0.317	S	S	.	.	H	α-helix	trans	-94.4	-15.8	-171.9	-67	-27.4	0	0	0	114	H584 A687 D693	H584-N588 PolarHBondContact CE1-ND2 3.17Å; H584-N588 PolarHBondContact ND1-ND2 3.21Å; H584-N588 PolarHBondContact NE2-ND2 3.31Å; H584-N588 WeakPolarHBondContact O-CB 3.38Å; H584-N588 PolarHBondContact O-N 2.9Å; N588-A687 HydrophobicContact CB-CB 3.75Å; N588-D693 PolarHBondContact ND2-OD2 3.03Å
589	D	87.6	Confident	90.6	Very high	15 Å²	15	64 Å²	64	8%	0.08	35%	0.35	C	S	.	.			trans	-142.8	62.3	172.9	-169.4	-2.3	0	0	0	111	F585 E591 Q592 H593 S685 A687	F585-D589 CarbonylContact O-C 3.55Å; F585-D589 WeakPolarHBondContact O-CA 3.37Å; F585-D589 PolarHBondContact O-N 2.61Å; D589-E591 PolarHBondContact O-N 3.14Å; D589-Q592 PolarHBondContact O-N 3.49Å; D589-Q592 PolarHBondContact OD1-N 2.95Å; D589-Q592 PolarHBondContact OD2-NE2 3.35Å; D589-H593 WeakPolarHBondContact O-CB 3.3Å; D589-H593 PolarHBondContact O-N 3.2Å; D589-H593 IonicContact OD2-CD2 3.09Å; D589-S685 WeakPolarHBondContact CB-OG 3.4Å; D589-S685 WeakPolarHBondContact OD2-CB 3.19Å; D589-S685 PolarHBondContact OD2-OG 3.45Å; D589-A687 HydrophobicContact CB-CB 4.26Å
590	P	87.9	Confident	90.5	Very high	78 Å²	78	60.3 Å²	60.3	51%	0.506	34%	0.335	S	S	.	.	H	α-helix	trans	-64.4	-26.4	-176.5	26	-34.3	0	0	0	112.9	R586 G594	R586-P590 WeakPolarHBondContact O-CB 3.4Å; P590-G594 WeakPolarHBondContact O-CA 3.42Å; P590-G594 PolarHBondContact O-N 3.5Å
591	E	85.5	Confident	90.3	Very high	188 Å²	188	60.4 Å²	60.4	88%	0.879	34%	0.336	S	S	*	.	H	α-helix	trans	-64.2	-43.1	179.4	-64.4	-173.5	174.4	0	0	111.5	D589	D589-E591 PolarHBondContact O-N 3.14Å
592	Q	83.1	Confident	90	Very high	87 Å²	87	65.6 Å²	65.6	41%	0.407	36%	0.357	S	S	.	.	H	α-helix	trans	-87.6	-29.7	176.3	-61	-168.7	41.8	0	0	113.2	D589 Y684	D589-Q592 PolarHBondContact O-N 3.49Å; D589-Q592 PolarHBondContact OD1-N 2.95Å; D589-Q592 PolarHBondContact OD2-NE2 3.35Å; Q592-Y684 PolarHBondContact NE2-O 3.17Å
593	H	89.3	Confident	89.5	Confident	15 Å²	15	67.2 Å²	67.2	7%	0.069	37%	0.368	C	S	.	.	H	α-helix	trans	-127.7	6.5	-163.6	-61.6	-48.6	0	0	0	116.1	F585 R586 D589 G595 A596 F850	F585-H593 HydrophobicContact CB-CB 4.19Å; F585-H593 AromaticContact CD1-CD2 3.56Å; F585-H593 AromaticContact CD1-NE2 3.84Å; R586-H593 WeakPolarHBondContact CG-O 3.44Å; D589-H593 WeakPolarHBondContact O-CB 3.3Å; D589-H593 PolarHBondContact O-N 3.2Å; D589-H593 IonicContact OD2-CD2 3.09Å; H593-G595 PolarHBondContact O-N 3.03Å; H593-G595 VanDerWaalsContact O-N 3.08Å; H593-A596 HydrophobicContact CB-CB 4.38Å; H593-A596 WeakPolarHBondContact O-CB 3.5Å; H593-A596 PolarHBondContact O-N 2.95Å; H593-F850 HydrophobicContact CB-CE1 4.27Å; H593-F850 AromaticContact CG-CD1 3.97Å; H593-F850 AromaticContact ND1-CD1 3.92Å
594	G	82	Confident	88.9	Confident	46 Å²	46	67.1 Å²	67.1	47%	0.474	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.6	178.1	0	0	0	0	0	114.1	P590	P590-G594 WeakPolarHBondContact O-CA 3.42Å; P590-G594 PolarHBondContact O-N 3.5Å
595	G	86.4	Confident	88.4	Confident	79 Å²	79	72.1 Å²	72.1	81%	0.814	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.9	177.3	0	0	0	0	0	116.2	H593 T597	H593-G595 PolarHBondContact O-N 3.03Å; H593-G595 VanDerWaalsContact O-N 3.08Å; G595-T597 PolarHBondContact O-N 2.98Å
596	A	88.7	Confident	87.9	Confident	10 Å²	10	72.7 Å²	72.7	8%	0.083	40%	0.402	C	S	.	.			trans	-62.6	132.6	-175.7	0	0	0	0	0	110.9	R586 H593 F850	R586-A596 PolarHBondContact NE-O 2.96Å; R586-A596 PolarHBondContact NH2-O 3.04Å; H593-A596 HydrophobicContact CB-CB 4.38Å; H593-A596 WeakPolarHBondContact O-CB 3.5Å; H593-A596 PolarHBondContact O-N 2.95Å; A596-F850 HydrophobicContact CB-CE1 3.57Å; A596-F850 HydrophobicContact CB-CZ 3.78Å
597	T	90.7	Very high	87.4	Confident	57 Å²	57	69.8 Å²	69.8	35%	0.35	39%	0.393	S	S	.	.			trans	-82.6	143.8	-176.8	178.2	0	0	0	0	112.3	G595 H599 V846 Q849	G595-T597 PolarHBondContact O-N 2.98Å; T597-H599 PolarHBondContact OG1-N 2.83Å; T597-H599 PolarHBondContact OG1-O 3.15Å; T597-V846 VanDerWaalsContact O-CG1 3.25Å; T597-V846 WeakPolarHBondContact O-CG1 3.32Å; T597-Q849 PolarHBondContact O-NE2 2.77Å
598	A	88.7	Confident	87	Confident	21 Å²	21	72.8 Å²	72.8	17%	0.174	40%	0.398	C	S	.	.			trans	-94.3	-4.5	168.5	0	0	0	0	0	112.9	Q579 V582	Q579-A598 HydrophobicContact CG-CB 4.47Å; V582-A598 HydrophobicContact CB-CB 4.24Å; V582-A598 HydrophobicContact CG1-CB 3.83Å; V582-A598 HydrophobicContact CG2-CB 4.35Å
599	H	90.2	Very high	87	Confident	152 Å²	152	73.7 Å²	73.7	70%	0.704	40%	0.402	S	S	*	.	S	Bend	trans	-94.7	126.6	-178.2	-64	-70.7	0	0	0	110.7	T597	T597-H599 PolarHBondContact OG1-N 2.83Å; T597-H599 PolarHBondContact OG1-O 3.15Å
600	A	90.8	Very high	87	Confident	15 Å²	15	73.4 Å²	73.4	12%	0.124	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-71.1	137.9	173.1	0	0	0	0	0	111.4	Y602 C842 V846	A600-Y602 HydrophobicContact CB-CE1 4.08Å; A600-Y602 HydrophobicContact CB-CE2 4.15Å; A600-C842 HydrophobicContact CB-CB 4.17Å; A600-C842 WeakPolarHBondContact CB-O 3.5Å; A600-V846 HydrophobicContact CB-CG2 3.92Å
601	D	89.8	Confident	87	Confident	87 Å²	87	73.8 Å²	73.8	47%	0.465	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-87.8	120.1	168.9	-173.7	-0.6	0	0	0	109.8	S603 S606 C842	D601-S603 VanDerWaalsContact CG-OG 3.24Å; D601-S603 WeakPolarHBondContact OD1-CB 3.27Å; D601-S603 PolarHBondContact OD1-N 2.97Å; D601-S603 PolarHBondContact OD1-OG 2.95Å; D601-S603 PolarHBondContact OD2-OG 3.04Å; D601-S606 WeakPolarHBondContact OD2-CB 3.16Å; D601-C842 PolarHBondContact O-SG 3.49Å
602	Y	90.7	Very high	87	Confident	110 Å²	110	69 Å²	69	43%	0.431	38%	0.378	S	S	.	.			trans	-103.2	9.6	178.5	-52.5	-80.7	0	0	0	112.8	K575 A600 Q839 C842 E843	K575-Y602 PolarHBondContact NZ-OH 3.44Å; A600-Y602 HydrophobicContact CB-CE1 4.08Å; A600-Y602 HydrophobicContact CB-CE2 4.15Å; Y602-Q839 HydrophobicContact CE1-CG 3.85Å; Y602-C842 HydrophobicContact CD1-CB 3.49Å; Y602-C842 VanDerWaalsContact CD1-CB 3.49Å; Y602-C842 HydrophobicContact CE1-CB 3.66Å; Y602-C842 HydrophobicContact CG-CB 4.44Å; Y602-E843 PolarHBondContact OH-OE1 3.13Å
603	S	86.8	Confident	87	Confident	34 Å²	34	67.7 Å²	67.7	24%	0.238	38%	0.379	C	S	.	.			trans	-66.3	148.8	177	70.8	0	0	0	0	111.6	D601 E605 S606 H607	D601-S603 VanDerWaalsContact CG-OG 3.24Å; D601-S603 WeakPolarHBondContact OD1-CB 3.27Å; D601-S603 PolarHBondContact OD1-N 2.97Å; D601-S603 PolarHBondContact OD1-OG 2.95Å; D601-S603 PolarHBondContact OD2-OG 3.04Å; S603-E605 WeakPolarHBondContact CB-OE2 3.26Å; S603-E605 PolarHBondContact O-N 2.76Å; S603-S606 PolarHBondContact O-N 2.91Å; S603-S606 PolarHBondContact O-OG 2.73Å; S603-S606 WeakPolarHBondContact OG-CB 3.28Å; S603-S606 PolarHBondContact OG-N 3.49Å; S603-H607 PolarHBondContact O-CD2 3.12Å; S603-H607 VanDerWaalsContact O-CD2 3.25Å
604	M	82.2	Confident	86.8	Confident	131 Å²	131	67.8 Å²	67.8	65%	0.645	38%	0.379	S	S	*	.	H	α-helix	trans	-67.5	-27.5	176.3	-74.3	-63.3	-61.6	0	0	112.1	H607	M604-H607 PolarHBondContact O-N 2.65Å
605	E	83.6	Confident	86.6	Confident	121 Å²	121	67.6 Å²	67.6	57%	0.565	37%	0.368	S	S	*	.	H	α-helix	trans	-63.3	-44.9	177.4	-68.1	65	-143.8	0	0	110.6	S603 H607 K608	S603-E605 WeakPolarHBondContact CB-OE2 3.26Å; S603-E605 PolarHBondContact O-N 2.76Å; E605-H607 VanDerWaalsContact C-N 3.26Å; E605-H607 PolarHBondContact O-N 2.73Å; E605-K608 PolarHBondContact O-N 3.19Å; E605-K608 VanDerWaalsContact O-N 3.17Å
606	S	86.3	Confident	86.2	Confident	12 Å²	12	69.5 Å²	69.5	8%	0.084	36%	0.356	C	S	.	.	H	α-helix	trans	-55.6	-41.6	179.7	75.1	0	0	0	0	112.3	D601 S603 K608 L609 R845	D601-S606 WeakPolarHBondContact OD2-CB 3.16Å; S603-S606 PolarHBondContact O-N 2.91Å; S603-S606 PolarHBondContact O-OG 2.73Å; S603-S606 WeakPolarHBondContact OG-CB 3.28Å; S603-S606 PolarHBondContact OG-N 3.49Å; S606-K608 VanDerWaalsContact C-N 3.27Å; S606-K608 PolarHBondContact O-N 2.82Å; S606-L609 PolarHBondContact O-N 3.23Å; S606-L609 VanDerWaalsContact O-N 3.1Å; S606-R845 PolarHBondContact O-NH1 3.33Å; S606-R845 PolarHBondContact OG-NH1 3.21Å
607	H	84	Confident	85.5	Confident	40 Å²	40	70.5 Å²	70.5	19%	0.185	36%	0.361	C	S	.	.	H	α-helix	trans	-63.4	-31.7	-176.6	-74.4	-81	0	0	0	113.1	S603 M604 E605 L609 K841 R845	S603-H607 PolarHBondContact O-CD2 3.12Å; S603-H607 VanDerWaalsContact O-CD2 3.25Å; M604-H607 PolarHBondContact O-N 2.65Å; E605-H607 VanDerWaalsContact C-N 3.26Å; E605-H607 PolarHBondContact O-N 2.73Å; H607-L609 VanDerWaalsContact C-N 3.25Å; H607-L609 PolarHBondContact O-N 3.1Å; H607-K841 PolarHBondContact ND1-NZ 3.28Å; H607-R845 PolarHBondContact CE1-NH2 3.32Å; H607-R845 PolarHBondContact ND1-NH2 2.99Å; H607-R845 VanDerWaalsContact ND1-NH2 3.19Å
608	K	83.7	Confident	84.5	Confident	155 Å²	155	68.3 Å²	68.3	67%	0.674	35%	0.348	S	S	*	.	H	α-helix	trans	-72.6	-23.7	179.1	-64.9	177.2	-177.2	171.2	0	112.1	E605 S606	E605-K608 PolarHBondContact O-N 3.19Å; E605-K608 VanDerWaalsContact O-N 3.17Å; S606-K608 VanDerWaalsContact C-N 3.27Å; S606-K608 PolarHBondContact O-N 2.82Å
609	L	89.1	Confident	83.4	Confident	95 Å²	95	72.7 Å²	72.7	50%	0.497	36%	0.364	S	S	.	.	H	α-helix	trans	-90.9	-8.5	-175.9	-60.8	174.9	0	0	0	113.1	S606 H607 L611 D612 S613	S606-L609 PolarHBondContact O-N 3.23Å; S606-L609 VanDerWaalsContact O-N 3.1Å; H607-L609 VanDerWaalsContact C-N 3.25Å; H607-L609 PolarHBondContact O-N 3.1Å; L609-L611 PolarHBondContact O-N 3.01Å; L609-D612 PolarHBondContact O-N 3.34Å; L609-S613 VanDerWaalsContact O-CB 3.25Å; L609-S613 WeakPolarHBondContact O-CB 3.47Å; L609-S613 PolarHBondContact O-N 3.35Å; L609-S613 PolarHBondContact O-OG 3.27Å
610	D	88.5	Confident	82.1	Confident	9 Å²	9	72.4 Å²	72.4	5%	0.048	36%	0.363	C	S	.	.	H	α-helix	trans	-59.9	-49.3	-173.8	-68.2	-20.6	0	0	0	112.3	S613 Y614 L810 K841 R845	D610-S613 PolarHBondContact O-N 3.37Å; D610-Y614 PolarHBondContact O-N 2.62Å; D610-L810 HydrophobicContact CB-CD2 3.91Å; D610-L810 HydrophobicContact CB-CG 4.48Å; D610-K841 WeakPolarHBondContact OD2-CE 3.45Å; D610-K841 IonicContact OD2-NZ 3.68Å; D610-K841 PolarHBondContact OD2-NZ 3.03Å; D610-R845 WeakPolarHBondContact OD1-CD 3.26Å; D610-R845 IonicContact OD1-CZ 2.64Å; D610-R845 IonicContact OD1-NE 2.98Å; D610-R845 PolarHBondContact OD1-NE 3.18Å; D610-R845 VanDerWaalsContact OD1-NE 3.09Å; D610-R845 IonicContact OD1-NH1 3.09Å; D610-R845 PolarHBondContact OD1-NH1 3.41Å; D610-R845 IonicContact OD2-CZ 2.64Å; D610-R845 VanDerWaalsContact OD2-CZ 3.29Å; D610-R845 IonicContact OD2-NE 3.99Å; D610-R845 IonicContact OD2-NH1 2.68Å; D610-R845 PolarHBondContact OD2-NH1 2.8Å; D610-R845 IonicContact OD2-NH2 3.12Å
611	L	86.3	Confident	80.8	Confident	85 Å²	85	75.3 Å²	75.3	45%	0.445	37%	0.371	S	S	.	.	H	α-helix	trans	-67.7	-43.3	179	-177.4	63.2	0	0	0	111.4	L609 S613 Y614 V615 P769	L609-L611 PolarHBondContact O-N 3.01Å; L611-S613 VanDerWaalsContact C-N 3.3Å; L611-S613 PolarHBondContact O-N 3.48Å; L611-Y614 HydrophobicContact CD1-CD1 4.3Å; L611-Y614 PolarHBondContact O-N 2.7Å; L611-V615 HydrophobicContact CD1-CG2 4.36Å; L611-V615 HydrophobicContact CG-CG2 4.41Å; L611-V615 VanDerWaalsContact O-CG2 3.31Å; L611-V615 WeakPolarHBondContact O-CG2 3.33Å; L611-V615 PolarHBondContact O-N 3.37Å; L611-P769 HydrophobicContact CD1-CG 3.83Å
612	D	85.4	Confident	79.5	Confident	87 Å²	87	78.4 Å²	78.4	47%	0.465	38%	0.376	S	S	.	.	H	α-helix	trans	-62	-40.6	178.3	-71.1	-15.8	0	0	0	111.3	L609 V615 Q616	L609-D612 PolarHBondContact O-N 3.34Å; D612-V615 PolarHBondContact O-N 2.89Å; D612-Q616 WeakPolarHBondContact O-CB 3.45Å; D612-Q616 VanDerWaalsContact O-CG 3.24Å; D612-Q616 WeakPolarHBondContact O-CG 3.18Å; D612-Q616 PolarHBondContact O-N 3.25Å
613	S	84.5	Confident	78.5	Confident	60 Å²	60	76.8 Å²	76.8	42%	0.42	37%	0.369	S	S	.	.	H	α-helix	trans	-63.2	-43.9	176.2	-59	0	0	0	0	111.2	L609 D610 L611 Q616 V617	L609-S613 VanDerWaalsContact O-CB 3.25Å; L609-S613 WeakPolarHBondContact O-CB 3.47Å; L609-S613 PolarHBondContact O-N 3.35Å; L609-S613 PolarHBondContact O-OG 3.27Å; D610-S613 PolarHBondContact O-N 3.37Å; L611-S613 VanDerWaalsContact C-N 3.3Å; L611-S613 PolarHBondContact O-N 3.48Å; S613-Q616 PolarHBondContact O-N 2.86Å; S613-V617 WeakPolarHBondContact O-CG2 3.13Å; S613-V617 PolarHBondContact O-N 2.97Å; S613-V617 VanDerWaalsContact O-N 3.08Å
614	Y	83.7	Confident	78	Confident	18 Å²	18	76.6 Å²	76.6	7%	0.071	36%	0.363	C	S	.	.	H	α-helix	trans	-61.7	-48.7	174	167.5	-106.1	0	0	0	111.6	D610 L611 Q616 V617 V618 V766 P769 L807	D610-Y614 PolarHBondContact O-N 2.62Å; L611-Y614 HydrophobicContact CD1-CD1 4.3Å; L611-Y614 PolarHBondContact O-N 2.7Å; Y614-Q616 VanDerWaalsContact C-N 3.32Å; Y614-Q616 PolarHBondContact O-N 3.14Å; Y614-V617 PolarHBondContact O-N 2.63Å; Y614-V617 VanDerWaalsContact O-N 3.17Å; Y614-V618 HydrophobicContact CD1-CG2 4.35Å; Y614-V618 HydrophobicContact CD2-CG2 3.85Å; Y614-V618 HydrophobicContact CE1-CG2 3.96Å; Y614-V618 HydrophobicContact CE2-CG2 3.4Å; Y614-V618 VanDerWaalsContact CE2-CG2 3.4Å; Y614-V618 HydrophobicContact CG-CG2 4.31Å; Y614-V618 VanDerWaalsContact CZ-CG2 3.47Å; Y614-V618 VanDerWaalsContact O-CG2 3.28Å; Y614-V618 WeakPolarHBondContact O-CG2 3.13Å; Y614-V618 PolarHBondContact O-N 3.31Å; Y614-V766 HydrophobicContact CE1-CG1 3.64Å; Y614-P769 HydrophobicContact CD1-CG 4.26Å; Y614-P769 HydrophobicContact CE1-CG 4.16Å; Y614-L807 HydrophobicContact CD1-CD2 4.04Å; Y614-L807 HydrophobicContact CD2-CD2 3.34Å; Y614-L807 HydrophobicContact CD2-CG 3.88Å; Y614-L807 HydrophobicContact CE1-CD2 4.1Å; Y614-L807 HydrophobicContact CE2-CD1 3.79Å; Y614-L807 HydrophobicContact CE2-CD2 3.41Å; Y614-L807 VanDerWaalsContact CE2-CD2 3.41Å; Y614-L807 HydrophobicContact CE2-CG 3.55Å; Y614-L807 HydrophobicContact CG-CD2 3.66Å
615	V	79.3	Confident	77.9	Confident	41 Å²	41	70.4 Å²	70.4	25%	0.248	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-42.2	179.5	171.3	0	0	0	0	111.1	L611 D612 V617 V618 Q619	L611-V615 HydrophobicContact CD1-CG2 4.36Å; L611-V615 HydrophobicContact CG-CG2 4.41Å; L611-V615 VanDerWaalsContact O-CG2 3.31Å; L611-V615 WeakPolarHBondContact O-CG2 3.33Å; L611-V615 PolarHBondContact O-N 3.37Å; D612-V615 PolarHBondContact O-N 2.89Å; V615-V617 PolarHBondContact O-N 2.91Å; V615-V618 PolarHBondContact O-N 3.12Å; V615-Q619 HydrophobicContact CG1-CG 4.29Å; V615-Q619 WeakPolarHBondContact O-CB 3.42Å; V615-Q619 VanDerWaalsContact O-CG 3.26Å; V615-Q619 WeakPolarHBondContact O-CG 3.13Å; V615-Q619 PolarHBondContact O-N 3.17Å
616	Q	77.6	Confident	77.9	Confident	119 Å²	119	68.1 Å²	68.1	56%	0.556	32%	0.321	S	S	*	.	H	α-helix	trans	-60.8	-43.8	175.6	-75.8	174.7	19.9	0	0	112.1	D612 S613 Y614 Q619 H620	D612-Q616 WeakPolarHBondContact O-CB 3.45Å; D612-Q616 VanDerWaalsContact O-CG 3.24Å; D612-Q616 WeakPolarHBondContact O-CG 3.18Å; D612-Q616 PolarHBondContact O-N 3.25Å; S613-Q616 PolarHBondContact O-N 2.86Å; Y614-Q616 VanDerWaalsContact C-N 3.32Å; Y614-Q616 PolarHBondContact O-N 3.14Å; Q616-Q619 PolarHBondContact O-N 3.05Å; Q616-H620 PolarHBondContact O-N 2.9Å; Q616-H620 PolarHBondContact O-ND1 3.16Å
617	V	74	Confident	78.1	Confident	32 Å²	32	67.5 Å²	67.5	19%	0.194	32%	0.317	C	S	.	.	H	α-helix	trans	-64.6	-42.8	176.6	171.9	0	0	0	0	111	S613 Y614 V615 Q619 H620 R621 K682	S613-V617 WeakPolarHBondContact O-CG2 3.13Å; S613-V617 PolarHBondContact O-N 2.97Å; S613-V617 VanDerWaalsContact O-N 3.08Å; Y614-V617 PolarHBondContact O-N 2.63Å; Y614-V617 VanDerWaalsContact O-N 3.17Å; V615-V617 PolarHBondContact O-N 2.91Å; V617-Q619 PolarHBondContact O-N 2.62Å; V617-H620 PolarHBondContact O-N 3.03Å; V617-R621 PolarHBondContact O-N 3Å; V617-K682 HydrophobicContact CG1-CG 4.24Å; V617-K682 HydrophobicContact CG2-CG 4.39Å
618	V	68.4	Low	78.2	Confident	11 Å²	11	69 Å²	69	7%	0.067	33%	0.326	C	S	.	.	H	α-helix	trans	-64.8	-39.4	179.6	177.5	0	0	0	0	111.8	Y614 V615 H620 R621 V766	Y614-V618 HydrophobicContact CD1-CG2 4.35Å; Y614-V618 HydrophobicContact CD2-CG2 3.85Å; Y614-V618 HydrophobicContact CE1-CG2 3.96Å; Y614-V618 HydrophobicContact CE2-CG2 3.4Å; Y614-V618 VanDerWaalsContact CE2-CG2 3.4Å; Y614-V618 HydrophobicContact CG-CG2 4.31Å; Y614-V618 VanDerWaalsContact CZ-CG2 3.47Å; Y614-V618 VanDerWaalsContact O-CG2 3.28Å; Y614-V618 WeakPolarHBondContact O-CG2 3.13Å; Y614-V618 PolarHBondContact O-N 3.31Å; V615-V618 PolarHBondContact O-N 3.12Å; V618-H620 VanDerWaalsContact C-N 3.28Å; V618-H620 PolarHBondContact O-N 3.12Å; V618-R621 WeakPolarHBondContact O-CB 3.5Å; V618-R621 WeakPolarHBondContact O-CG 3.48Å; V618-R621 PolarHBondContact O-N 3.45Å; V618-V766 HydrophobicContact CB-CG2 4.26Å; V618-V766 HydrophobicContact CG1-CB 4.44Å; V618-V766 HydrophobicContact CG1-CG1 4.18Å; V618-V766 HydrophobicContact CG1-CG2 3.64Å
619	Q	66.4	Low	78.4	Confident	112 Å²	112	65.1 Å²	65.1	52%	0.523	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-26.2	179.3	-77.1	175.6	-8.8	0	0	113.9	V615 Q616 V617	V615-Q619 HydrophobicContact CG1-CG 4.29Å; V615-Q619 WeakPolarHBondContact O-CB 3.42Å; V615-Q619 VanDerWaalsContact O-CG 3.26Å; V615-Q619 WeakPolarHBondContact O-CG 3.13Å; V615-Q619 PolarHBondContact O-N 3.17Å; Q616-Q619 PolarHBondContact O-N 3.05Å; V617-Q619 PolarHBondContact O-N 2.62Å
620	H	63.6	Low	78.4	Confident	146 Å²	146	65.4 Å²	65.4	68%	0.676	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	16.4	-179.4	-61.6	84.4	0	0	0	112.9	Q616 V617 V618 R622	Q616-H620 PolarHBondContact O-N 2.9Å; Q616-H620 PolarHBondContact O-ND1 3.16Å; V617-H620 PolarHBondContact O-N 3.03Å; V618-H620 VanDerWaalsContact C-N 3.28Å; V618-H620 PolarHBondContact O-N 3.12Å; H620-R622 PolarHBondContact O-N 2.99Å; H620-R622 VanDerWaalsContact O-N 3.16Å
621	R	63.6	Low	78.7	Confident	76 Å²	76	65.9 Å²	65.9	29%	0.287	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-58.8	118.3	177	-78.8	178.1	-179.2	-159	0.4	109.8	V617 V618 E805	V617-R621 PolarHBondContact O-N 3Å; V618-R621 WeakPolarHBondContact O-CB 3.5Å; V618-R621 WeakPolarHBondContact O-CG 3.48Å; V618-R621 PolarHBondContact O-N 3.45Å; R621-E805 IonicContact NH1-OE2 3.96Å; R621-E805 IonicContact NH2-OE2 2.61Å; R621-E805 PolarHBondContact NH2-OE2 2.92Å; R621-E805 VanDerWaalsContact NH2-OE2 3.09Å
622	R	62.7	Low	78.9	Confident	153 Å²	153	68.3 Å²	68.3	58%	0.577	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-92.8	129.1	166.7	-63.8	-171.5	179.6	-170	-2.2	108	H620 T648	H620-R622 PolarHBondContact O-N 2.99Å; H620-R622 VanDerWaalsContact O-N 3.16Å; R622-T648 HydrophobicContact CB-CG2 3.88Å; R622-T648 HydrophobicContact CG-CG2 4.41Å
623	R	69.8	Low	79.1	Confident	75 Å²	75	69.6 Å²	69.6	28%	0.283	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	143	174.4	-76.2	177	60.4	-164.6	-6.4	108.7	T648 I649 S652	R623-T648 CarbonylContact O-C 3.41Å; R623-T648 WeakPolarHBondContact O-CA 3.33Å; R623-I649 HydrophobicContact CB-CB 3.68Å; R623-I649 HydrophobicContact CB-CG1 4.11Å; R623-I649 HydrophobicContact CB-CG2 4.34Å; R623-I649 PolarHBondContact O-N 2.89Å; R623-S652 VanDerWaalsContact CZ-OG 3.27Å; R623-S652 PolarHBondContact NH1-OG 2.85Å; R623-S652 PolarHBondContact NH2-OG 3.32Å
624	R	75.2	Confident	79.1	Confident	31 Å²	31	75 Å²	75	12%	0.117	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	158	173.4	-84.4	178.1	-84.1	179.7	25.2	111.3	I646 L647 L677 E679 Y684	R624-I646 HydrophobicContact CB-CG2 4.11Å; R624-I646 HydrophobicContact CG-CG2 4.18Å; R624-L647 CarbonylContact C-O 3.58Å; R624-L647 WeakPolarHBondContact CA-O 3.44Å; R624-L647 WeakPolarHBondContact CB-O 3.36Å; R624-L647 VanDerWaalsContact CG-O 3.29Å; R624-L647 WeakPolarHBondContact CG-O 3.05Å; R624-L677 HydrophobicContact CB-CD1 4.46Å; R624-L677 PolarHBondContact O-N 3.39Å; R624-E679 HydrophobicContact CB-CG 4.11Å; R624-E679 IonicContact CZ-OE1 3.57Å; R624-E679 IonicContact CZ-OE2 3.01Å; R624-E679 VanDerWaalsContact NE-CD 3.26Å; R624-E679 IonicContact NE-OE1 2.82Å; R624-E679 PolarHBondContact NE-OE1 3.34Å; R624-E679 IonicContact NE-OE2 3.29Å; R624-E679 PolarHBondContact NE-OE2 3.29Å; R624-E679 VanDerWaalsContact NH2-CD 3.3Å; R624-E679 IonicContact NH2-OE1 2.61Å; R624-E679 PolarHBondContact NH2-OE1 3.45Å; R624-E679 IonicContact NH2-OE2 2.64Å; R624-E679 PolarHBondContact NH2-OE2 3Å; R624-Y684 VanDerWaalsContact CZ-N 3.28Å; R624-Y684 VanDerWaalsContact NH2-CA 3.35Å
625	A	81	Confident	79.1	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	144.7	174.8	0	0	0	0	0	110.7	L647 I649 V674 E675	A625-L647 PolarHBondContact N-O 3.31Å; A625-L647 PolarHBondContact O-N 2.7Å; A625-I649 HydrophobicContact CB-CD1 3.69Å; A625-I649 HydrophobicContact CB-CG1 4.15Å; A625-V674 HydrophobicContact CB-CB 3.7Å; A625-V674 HydrophobicContact CB-CG2 3.61Å; A625-E675 CarbonylContact C-O 3.48Å; A625-E675 WeakPolarHBondContact CA-O 3.49Å; A625-E675 WeakPolarHBondContact CB-O 3.34Å
626	K	83.4	Confident	79.3	Confident	73 Å²	73	84.2 Å²	84.2	32%	0.317	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.7	175.5	179.4	177.1	-178.9	177.9	0	109.6	L628 N644 D645 I646 V674 E675 L677	K626-L628 PolarHBondContact O-N 3.16Å; K626-N644 WeakPolarHBondContact CE-OD1 3.43Å; K626-N644 PolarHBondContact NZ-OD1 3.19Å; K626-D645 CarbonylContact C-O 3.42Å; K626-D645 WeakPolarHBondContact CA-O 3.16Å; K626-I646 HydrophobicContact CB-CD1 3.85Å; K626-I646 HydrophobicContact CD-CD1 4.5Å; K626-I646 HydrophobicContact CG-CD1 3.91Å; K626-V674 CarbonylContact O-C 3.56Å; K626-V674 WeakPolarHBondContact O-CA 3.35Å; K626-E675 PolarHBondContact N-O 2.86Å; K626-E675 PolarHBondContact O-N 2.96Å; K626-L677 HydrophobicContact CB-CD1 4.28Å; K626-L677 HydrophobicContact CB-CD2 3.87Å; K626-L677 HydrophobicContact CB-CG 4Å
627	A	89.5	Confident	79.9	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	122.4	172.4	0	0	0	0	0	110.9	F641 H642 N644 D645	A627-F641 HydrophobicContact CB-CD2 3.35Å; A627-F641 HydrophobicContact CB-CE2 3.69Å; A627-F641 HydrophobicContact CB-CG 4.17Å; A627-H642 WeakPolarHBondContact CB-O 3.25Å; A627-N644 WeakPolarHBondContact O-CA 3.27Å; A627-N644 PolarHBondContact O-N 3.2Å; A627-D645 HydrophobicContact CB-CB 4.3Å; A627-D645 PolarHBondContact N-O 2.72Å
628	L	85.6	Confident	80.7	Confident	71 Å²	71	82.2 Å²	82.2	37%	0.372	38%	0.38	S	S	.	.	S	Bend	trans	-83.2	-25.7	177.1	-66.8	176.4	0	0	0	112.3	K626 K643 F673 E675	K626-L628 PolarHBondContact O-N 3.16Å; L628-K643 WeakPolarHBondContact O-CD 2.99Å; L628-K643 VanDerWaalsContact O-CE 3.32Å; L628-K643 WeakPolarHBondContact O-CE 3.45Å; L628-K643 WeakPolarHBondContact O-CG 3.44Å; L628-F673 WeakPolarHBondContact CB-O 3.31Å; L628-F673 PolarHBondContact N-O 3.38Å; L628-E675 HydrophobicContact CD1-CB 4.15Å; L628-E675 HydrophobicContact CD2-CB 3.81Å; L628-E675 HydrophobicContact CG-CB 4.02Å
629	I	88.4	Confident	81.9	Confident	74 Å²	74	81.8 Å²	81.8	38%	0.379	38%	0.377	S	S	.	.	S	Bend	trans	-144.2	166.1	-178.9	63.4	173.9	0	0	0	110.1	F641 F673	I629-F641 WeakPolarHBondContact O-CE2 3.24Å; I629-F673 HydrophobicContact CD1-CB 4.26Å; I629-F673 HydrophobicContact CD1-CD1 3.44Å; I629-F673 VanDerWaalsContact CD1-CD1 3.44Å; I629-F673 HydrophobicContact CD1-CD2 3.81Å; I629-F673 HydrophobicContact CD1-CE1 3.57Å; I629-F673 HydrophobicContact CD1-CE2 3.91Å; I629-F673 HydrophobicContact CD1-CG 3.58Å; I629-F673 HydrophobicContact CD1-CZ 3.81Å; I629-F673 HydrophobicContact CG1-CB 3.93Å; I629-F673 HydrophobicContact CG1-CD1 4.09Å; I629-F673 HydrophobicContact CG1-CD2 4.07Å; I629-F673 HydrophobicContact CG1-CG 3.79Å
630	D	90.5	Very high	83.2	Confident	100 Å²	100	79.9 Å²	79.9	54%	0.535	37%	0.369	S	S	.	.			trans	-71.1	142.7	171.1	-53.6	-36.3	0	0	0	110.2	H642 K643	D630-H642 VanDerWaalsContact OD1-CA 3.31Å; D630-H642 WeakPolarHBondContact OD1-CA 3.3Å; D630-K643 WeakPolarHBondContact OD1-CB 2.8Å; D630-K643 PolarHBondContact OD1-N 3.22Å
631	F	93.5	Very high	84.6	Confident	19 Å²	19	73 Å²	73	8%	0.083	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-135.1	108.9	175.2	-179.6	-120.4	0	0	0	109.5	E638 L639 Q640 F641 W668 F669 P670 F673	F631-E638 HydrophobicContact CE1-CB 4.42Å; F631-E638 HydrophobicContact CZ-CG 4.43Å; F631-L639 WeakPolarHBondContact CD1-O 3.43Å; F631-Q640 WeakPolarHBondContact O-CA 3.5Å; F631-Q640 WeakPolarHBondContact O-CG 3.49Å; F631-F641 HydrophobicContact CB-CD1 4.24Å; F631-F641 HydrophobicContact CB-CD2 3.81Å; F631-F641 HydrophobicContact CB-CE1 3.88Å; F631-F641 HydrophobicContact CB-CE2 3.39Å; F631-F641 HydrophobicContact CB-CG 4.23Å; F631-F641 HydrophobicContact CB-CZ 3.43Å; F631-F641 VanDerWaalsContact CB-CZ 3.43Å; F631-F641 HydrophobicContact CD1-CD1 4.16Å; F631-F641 AromaticContact CD1-CE1 3.66Å; F631-F641 HydrophobicContact CD1-CE1 3.66Å; F631-F641 AromaticContact CD1-CZ 3.95Å; F631-F641 HydrophobicContact CD1-CZ 3.95Å; F631-F641 HydrophobicContact CG-CE1 4.13Å; F631-F641 HydrophobicContact CG-CE2 4.4Å; F631-F641 AromaticContact CG-CZ 3.96Å; F631-F641 HydrophobicContact CG-CZ 3.96Å; F631-F641 PolarHBondContact N-O 2.61Å; F631-F641 PolarHBondContact O-N 3.09Å; F631-W668 HydrophobicContact CZ-CZ3 4.42Å; F631-F669 HydrophobicContact CD1-CB 3.97Å; F631-F669 HydrophobicContact CE1-CB 3.8Å; F631-P670 HydrophobicContact CD2-CG 4.49Å; F631-P670 HydrophobicContact CE2-CG 3.98Å; F631-P670 HydrophobicContact CZ-CG 4.21Å; F631-F673 HydrophobicContact CB-CD2 4.09Å; F631-F673 AromaticContact CD2-CD2 3.73Å; F631-F673 HydrophobicContact CD2-CD2 3.73Å; F631-F673 AromaticContact CD2-CE2 3.63Å; F631-F673 HydrophobicContact CD2-CE2 3.63Å; F631-F673 HydrophobicContact CE2-CD2 4.49Å; F631-F673 HydrophobicContact CE2-CE2 4.23Å; F631-F673 HydrophobicContact CG-CD2 4.06Å; F631-F673 HydrophobicContact CG-CE2 4.41Å
632	E	90.8	Very high	85.9	Confident	137 Å²	137	74.4 Å²	74.4	64%	0.64	35%	0.346	S	S	*	.			trans	-86.3	135	175.2	-68.3	-175.4	164.3	0	0	110.2
633	R	89.4	Confident	87	Confident	114 Å²	114	72.8 Å²	72.8	43%	0.43	34%	0.343	S	S	.	.			trans	-76.8	137	174.9	69.4	-179.6	-176.1	-177.7	-1	111.6	E638 Q640	R633-E638 VanDerWaalsContact CA-OE2 3.3Å; R633-E638 WeakPolarHBondContact CA-OE2 3.39Å; R633-E638 HydrophobicContact CB-CB 3.73Å; R633-Q640 HydrophobicContact CB-CB 4.01Å; R633-Q640 HydrophobicContact CG-CB 4Å
634	F	84.6	Confident	87.4	Confident	172 Å²	172	73.6 Å²	73.6	75%	0.754	35%	0.353	S	S	*	.	S	Bend	trans	-103	-34.1	169.2	-66.2	-82.8	0	0	0	112	E638	F634-E638 PolarHBondContact N-OE2 3.29Å
635	E	84.8	Confident	87.9	Confident	121 Å²	121	74.3 Å²	74.3	57%	0.565	36%	0.36	S	S	*	.	S	Bend	trans	-112.5	161.3	-179.7	-65.9	-72.7	169.3	0	0	111.4	D637 E638	E635-D637 VanDerWaalsContact C-N 3.26Å; E635-D637 WeakPolarHBondContact CB-OD1 2.99Å; E635-D637 PolarHBondContact O-N 3.04Å; E635-E638 HydrophobicContact CB-CG 4.32Å; E635-E638 PolarHBondContact O-N 3.29Å
636	V	83.5	Confident	88	Confident	133 Å²	133	76.4 Å²	76.4	81%	0.806	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-24.8	-175.6	178.2	0	0	0	0	112.6
637	D	88.9	Confident	88	Confident	89 Å²	89	72.9 Å²	72.9	48%	0.476	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.2	179.5	62.7	-28	0	0	0	113.6	E635 G667 W668	E635-D637 VanDerWaalsContact C-N 3.26Å; E635-D637 WeakPolarHBondContact CB-OD1 2.99Å; E635-D637 PolarHBondContact O-N 3.04Å; D637-G667 CarbonylContact O-C 3.56Å; D637-G667 WeakPolarHBondContact O-CA 3.45Å; D637-W668 PolarHBondContact O-N 2.96Å; D637-W668 PolarHBondContact OD1-NE1 3.04Å; D637-W668 PolarHBondContact OD2-NE1 3.2Å
638	E	91.7	Very high	87.7	Confident	19 Å²	19	74.1 Å²	74.1	9%	0.089	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-86.7	137.4	174.3	-75.7	177.1	-173.1	0	0	112.1	F631 R633 F634 E635 W668	F631-E638 HydrophobicContact CE1-CB 4.42Å; F631-E638 HydrophobicContact CZ-CG 4.43Å; R633-E638 VanDerWaalsContact CA-OE2 3.3Å; R633-E638 WeakPolarHBondContact CA-OE2 3.39Å; R633-E638 HydrophobicContact CB-CB 3.73Å; F634-E638 PolarHBondContact N-OE2 3.29Å; E635-E638 HydrophobicContact CB-CG 4.32Å; E635-E638 PolarHBondContact O-N 3.29Å; E638-W668 WeakPolarHBondContact CA-O 3.43Å; E638-W668 VanDerWaalsContact CD-CZ2 3.46Å; E638-W668 HydrophobicContact CG-CD2 3.83Å; E638-W668 HydrophobicContact CG-CE3 4.21Å; E638-W668 HydrophobicContact CG-CH2 3.6Å; E638-W668 HydrophobicContact CG-CZ2 3.14Å; E638-W668 HydrophobicContact CG-CZ3 4.11Å; E638-W668 WeakPolarHBondContact OE1-CH2 3.08Å; E638-W668 WeakPolarHBondContact OE1-CZ2 3.32Å
639	L	93.2	Very high	87.5	Confident	3 Å²	3	71.2 Å²	71.2	2%	0.016	35%	0.347	C	S	.	.			trans	-91.4	107.9	176.6	-174.9	68	0	0	0	111.2	F631 F641 L647 L662 Q665 W668 F669	F631-L639 WeakPolarHBondContact CD1-O 3.43Å; L639-F641 WeakPolarHBondContact O-CD1 3.31Å; L639-L647 HydrophobicContact CD2-CD2 3.87Å; L639-L662 HydrophobicContact CD1-CB 4.12Å; L639-L662 HydrophobicContact CD2-CB 4.27Å; L639-L662 HydrophobicContact CG-CB 4.45Å; L639-Q665 HydrophobicContact CD1-CB 4.04Å; L639-Q665 WeakPolarHBondContact CD1-O 3.28Å; L639-W668 PolarHBondContact N-O 3.46Å; L639-F669 HydrophobicContact CB-CD1 4.19Å; L639-F669 HydrophobicContact CD2-CD1 3.93Å; L639-F669 HydrophobicContact CD2-CE1 4.09Å
640	Q	93.5	Very high	87.2	Confident	72 Å²	72	71.6 Å²	71.6	34%	0.336	35%	0.349	S	S	.	.			trans	-74.7	137.4	175.5	174.2	169.6	0.7	0	0	112.1	F631 R633	F631-Q640 WeakPolarHBondContact O-CA 3.5Å; F631-Q640 WeakPolarHBondContact O-CG 3.49Å; R633-Q640 HydrophobicContact CB-CB 4.01Å; R633-Q640 HydrophobicContact CG-CB 4Å
641	F	93	Very high	86.7	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.009	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-151.8	161.3	174.8	54.8	-105	0	0	0	113.1	A627 I629 F631 L639 D645 L647 L662 F669 F673 V674	A627-F641 HydrophobicContact CB-CD2 3.35Å; A627-F641 HydrophobicContact CB-CE2 3.69Å; A627-F641 HydrophobicContact CB-CG 4.17Å; I629-F641 WeakPolarHBondContact O-CE2 3.24Å; F631-F641 HydrophobicContact CB-CD1 4.24Å; F631-F641 HydrophobicContact CB-CD2 3.81Å; F631-F641 HydrophobicContact CB-CE1 3.88Å; F631-F641 HydrophobicContact CB-CE2 3.39Å; F631-F641 HydrophobicContact CB-CG 4.23Å; F631-F641 HydrophobicContact CB-CZ 3.43Å; F631-F641 VanDerWaalsContact CB-CZ 3.43Å; F631-F641 HydrophobicContact CD1-CD1 4.16Å; F631-F641 AromaticContact CD1-CE1 3.66Å; F631-F641 HydrophobicContact CD1-CE1 3.66Å; F631-F641 AromaticContact CD1-CZ 3.95Å; F631-F641 HydrophobicContact CD1-CZ 3.95Å; F631-F641 HydrophobicContact CG-CE1 4.13Å; F631-F641 HydrophobicContact CG-CE2 4.4Å; F631-F641 AromaticContact CG-CZ 3.96Å; F631-F641 HydrophobicContact CG-CZ 3.96Å; F631-F641 PolarHBondContact N-O 2.61Å; F631-F641 PolarHBondContact O-N 3.09Å; L639-F641 WeakPolarHBondContact O-CD1 3.31Å; F641-D645 HydrophobicContact CB-CB 4.13Å; F641-L647 HydrophobicContact CB-CD2 3.76Å; F641-L647 HydrophobicContact CD1-CD1 3.64Å; F641-L647 HydrophobicContact CD1-CD2 3.69Å; F641-L647 HydrophobicContact CD1-CG 4.29Å; F641-L647 HydrophobicContact CD2-CD1 4.49Å; F641-L647 HydrophobicContact CE1-CD1 3.68Å; F641-L647 HydrophobicContact CG-CD1 4.06Å; F641-L647 HydrophobicContact CG-CD2 3.93Å; F641-L647 HydrophobicContact CZ-CD1 4.15Å; F641-L662 HydrophobicContact CB-CD2 3.8Å; F641-F669 HydrophobicContact CE1-CB 3.53Å; F641-F669 HydrophobicContact CE1-CD1 4.3Å; F641-F669 HydrophobicContact CE1-CD2 4.02Å; F641-F669 AromaticContact CE1-CG 3.69Å; F641-F669 HydrophobicContact CE1-CG 3.69Å; F641-F669 HydrophobicContact CZ-CB 4.22Å; F641-F669 HydrophobicContact CZ-CD2 4.37Å; F641-F669 HydrophobicContact CZ-CG 4.42Å; F641-F673 HydrophobicContact CE2-CB 4.27Å; F641-F673 HydrophobicContact CZ-CB 4Å; F641-V674 HydrophobicContact CE1-CG1 4.39Å; F641-V674 HydrophobicContact CE2-CG1 4.38Å; F641-V674 HydrophobicContact CZ-CG1 3.88Å
642	H	91.2	Very high	86	Confident	104 Å²	104	69.9 Å²	69.9	48%	0.481	34%	0.343	S	S	.	.			trans	-107	157.3	174.8	-56.6	85.1	0	0	0	110.7	A627 D630 N644 D645	A627-H642 WeakPolarHBondContact CB-O 3.25Å; D630-H642 VanDerWaalsContact OD1-CA 3.31Å; D630-H642 WeakPolarHBondContact OD1-CA 3.3Å; H642-N644 PolarHBondContact O-N 3.29Å; H642-D645 PolarHBondContact N-OD2 3.12Å; H642-D645 IonicContact ND1-OD2 3.37Å; H642-D645 WeakPolarHBondContact O-CB 3.22Å; H642-D645 VanDerWaalsContact O-CG 3.26Å; H642-D645 PolarHBondContact O-N 3.45Å
643	K	85.5	Confident	85.3	Confident	120 Å²	120	70.4 Å²	70.4	52%	0.522	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	130.2	175.6	-179.5	174.1	-178.1	177.9	0	110.6	L628 D630	L628-K643 WeakPolarHBondContact O-CD 2.99Å; L628-K643 VanDerWaalsContact O-CE 3.32Å; L628-K643 WeakPolarHBondContact O-CE 3.45Å; L628-K643 WeakPolarHBondContact O-CG 3.44Å; D630-K643 WeakPolarHBondContact OD1-CB 2.8Å; D630-K643 PolarHBondContact OD1-N 3.22Å
644	N	78.7	Confident	84.9	Confident	91 Å²	91	69 Å²	69	49%	0.487	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	1.9	-173.2	-46	-65.3	0	0	0	116.4	K626 A627 H642	K626-N644 WeakPolarHBondContact CE-OD1 3.43Å; K626-N644 PolarHBondContact NZ-OD1 3.19Å; A627-N644 WeakPolarHBondContact O-CA 3.27Å; A627-N644 PolarHBondContact O-N 3.2Å; H642-N644 PolarHBondContact O-N 3.29Å
645	D	85.3	Confident	84.5	Confident	47 Å²	47	68.6 Å²	68.6	25%	0.251	35%	0.351	S	S	.	.			trans	-62.1	147	168.4	-74.5	-10	0	0	0	110.6	K626 A627 F641 H642 L662	K626-D645 CarbonylContact C-O 3.42Å; K626-D645 WeakPolarHBondContact CA-O 3.16Å; A627-D645 HydrophobicContact CB-CB 4.3Å; A627-D645 PolarHBondContact N-O 2.72Å; F641-D645 HydrophobicContact CB-CB 4.13Å; H642-D645 PolarHBondContact N-OD2 3.12Å; H642-D645 IonicContact ND1-OD2 3.37Å; H642-D645 WeakPolarHBondContact O-CB 3.22Å; H642-D645 VanDerWaalsContact O-CG 3.26Å; H642-D645 PolarHBondContact O-N 3.45Å; D645-L662 HydrophobicContact CB-CD1 4.42Å; D645-L662 HydrophobicContact CB-CD2 4.06Å; D645-L662 WeakPolarHBondContact OD2-CD2 3.17Å
646	I	82.3	Confident	84.4	Confident	43 Å²	43	69.4 Å²	69.4	22%	0.221	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	110.4	178.7	-55.6	-44.5	0	0	0	109.7	R624 K626 L662 L677	R624-I646 HydrophobicContact CB-CG2 4.11Å; R624-I646 HydrophobicContact CG-CG2 4.18Å; K626-I646 HydrophobicContact CB-CD1 3.85Å; K626-I646 HydrophobicContact CD-CD1 4.5Å; K626-I646 HydrophobicContact CG-CD1 3.91Å; I646-L662 WeakPolarHBondContact O-CD1 3.4Å; I646-L677 HydrophobicContact CD1-CD1 3.65Å; I646-L677 HydrophobicContact CG1-CD1 4.3Å; I646-L677 HydrophobicContact CG2-CD1 3.75Å
647	L	85	Confident	84.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134.4	-174.5	-53.7	166	0	0	0	109.9	R624 A625 L639 F641 L662 F669 V674	R624-L647 CarbonylContact C-O 3.58Å; R624-L647 WeakPolarHBondContact CA-O 3.44Å; R624-L647 WeakPolarHBondContact CB-O 3.36Å; R624-L647 VanDerWaalsContact CG-O 3.29Å; R624-L647 WeakPolarHBondContact CG-O 3.05Å; A625-L647 PolarHBondContact N-O 3.31Å; A625-L647 PolarHBondContact O-N 2.7Å; L639-L647 HydrophobicContact CD2-CD2 3.87Å; F641-L647 HydrophobicContact CB-CD2 3.76Å; F641-L647 HydrophobicContact CD1-CD1 3.64Å; F641-L647 HydrophobicContact CD1-CD2 3.69Å; F641-L647 HydrophobicContact CD1-CG 4.29Å; F641-L647 HydrophobicContact CD2-CD1 4.49Å; F641-L647 HydrophobicContact CE1-CD1 3.68Å; F641-L647 HydrophobicContact CG-CD1 4.06Å; F641-L647 HydrophobicContact CG-CD2 3.93Å; F641-L647 HydrophobicContact CZ-CD1 4.15Å; L647-L662 HydrophobicContact CD2-CB 3.87Å; L647-L662 HydrophobicContact CD2-CD1 4.35Å; L647-L662 HydrophobicContact CD2-CD2 3.88Å; L647-L662 HydrophobicContact CD2-CG 4.24Å; L647-F669 HydrophobicContact CD1-CE1 4.34Å; L647-F669 HydrophobicContact CD1-CE2 4.25Å; L647-F669 HydrophobicContact CD1-CZ 4.14Å; L647-V674 HydrophobicContact CD1-CB 4.41Å; L647-V674 HydrophobicContact CD1-CG1 3.39Å
648	T	81.6	Confident	84.7	Confident	25 Å²	25	62.5 Å²	62.5	15%	0.153	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	114.7	170.4	-57.6	0	0	0	0	110	R622 R623 I650 G660 E661	R622-T648 HydrophobicContact CB-CG2 3.88Å; R622-T648 HydrophobicContact CG-CG2 4.41Å; R623-T648 CarbonylContact O-C 3.41Å; R623-T648 WeakPolarHBondContact O-CA 3.33Å; T648-I650 PolarHBondContact O-N 2.74Å; T648-G660 CarbonylContact O-C 3.58Å; T648-G660 VanDerWaalsContact O-C 3.27Å; T648-G660 WeakPolarHBondContact O-CA 3.1Å; T648-E661 PolarHBondContact N-O 2.79Å; T648-E661 PolarHBondContact O-N 3.46Å
649	I	83.2	Confident	84.6	Confident	10 Å²	10	65 Å²	65	5%	0.051	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	119.6	176.1	-48.5	-57.9	0	0	0	109.5	R623 A625 W658 F669 L676	R623-I649 HydrophobicContact CB-CB 3.68Å; R623-I649 HydrophobicContact CB-CG1 4.11Å; R623-I649 HydrophobicContact CB-CG2 4.34Å; R623-I649 PolarHBondContact O-N 2.89Å; A625-I649 HydrophobicContact CB-CD1 3.69Å; A625-I649 HydrophobicContact CB-CG1 4.15Å; I649-W658 HydrophobicContact CD1-CE3 3.9Å; I649-W658 HydrophobicContact CD1-CZ3 4.47Å; I649-F669 HydrophobicContact CD1-CE1 4.46Å; I649-F669 HydrophobicContact CD1-CE2 4.3Å; I649-F669 HydrophobicContact CD1-CZ 3.52Å; I649-L676 HydrophobicContact CG1-CD2 4.24Å
650	I	81.2	Confident	84.3	Confident	82 Å²	82	64.8 Å²	64.8	42%	0.421	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-43.8	175.4	-65.1	170.6	0	0	0	110.4	T648 I659 E661 Q666	T648-I650 PolarHBondContact O-N 2.74Å; I650-I659 HydrophobicContact CB-CB 4.45Å; I650-I659 HydrophobicContact CB-CG2 4.17Å; I650-I659 HydrophobicContact CD1-CG2 4.39Å; I650-I659 HydrophobicContact CG2-CG2 4.46Å; I650-I659 PolarHBondContact N-O 2.77Å; I650-E661 HydrophobicContact CD1-CB 3.97Å; I650-Q666 HydrophobicContact CD1-CB 4.29Å; I650-Q666 HydrophobicContact CD1-CG 3.61Å
651	N	80.2	Confident	84.1	Confident	59 Å²	59	63.2 Å²	63.2	32%	0.316	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	135.6	179.4	-173.4	-39.9	0	0	0	109.6	D653 W658 I659	N651-D653 PolarHBondContact ND2-OD2 2.89Å; N651-D653 WeakPolarHBondContact OD1-CB 3.44Å; N651-D653 PolarHBondContact OD1-N 2.82Å; N651-D653 PolarHBondContact OD1-OD2 3.48Å; N651-W658 CarbonylContact O-C 3.58Å; N651-W658 WeakPolarHBondContact O-CA 3.46Å; N651-W658 WeakPolarHBondContact O-CB 3.44Å; N651-I659 HydrophobicContact CB-CB 4.05Å; N651-I659 HydrophobicContact CB-CD1 4.11Å; N651-I659 HydrophobicContact CB-CG1 4.23Å; N651-I659 PolarHBondContact N-O 3.27Å; N651-I659 VanDerWaalsContact N-O 3.1Å; N651-I659 PolarHBondContact O-N 3.08Å
652	S	78.7	Confident	83.8	Confident	25 Å²	25	64.2 Å²	64.2	18%	0.175	32%	0.324	C	S	.	.			trans	-134.7	27	174.6	85.6	0	0	0	0	113.2	R623 D654 W658	R623-S652 VanDerWaalsContact CZ-OG 3.27Å; R623-S652 PolarHBondContact NH1-OG 2.85Å; R623-S652 PolarHBondContact NH2-OG 3.32Å; S652-D654 PolarHBondContact O-N 2.88Å; S652-W658 VanDerWaalsContact CA-CD1 3.47Å
653	D	75.1	Confident	83.4	Confident	147 Å²	147	65.8 Å²	65.8	79%	0.786	34%	0.336	S	S	*	.			trans	-65	-24	-176.7	-62.5	-26	0	0	0	111.8	N651	N651-D653 PolarHBondContact ND2-OD2 2.89Å; N651-D653 WeakPolarHBondContact OD1-CB 3.44Å; N651-D653 PolarHBondContact OD1-N 2.82Å; N651-D653 PolarHBondContact OD1-OD2 3.48Å
654	D	81.2	Confident	83	Confident	84 Å²	84	67.3 Å²	67.3	45%	0.449	35%	0.35	S	S	.	.	S	Bend	trans	-94	138.5	175.9	-177.5	-75.8	0	0	0	111.5	S652 H656 C657 W658	S652-D654 PolarHBondContact O-N 2.88Å; D654-H656 PolarHBondContact O-N 3.37Å; D654-H656 WeakPolarHBondContact OD1-CA 3.37Å; D654-H656 PolarHBondContact OD1-N 2.9Å; D654-C657 WeakPolarHBondContact CB-O 3.24Å; D654-C657 PolarHBondContact OD1-N 3.1Å; D654-W658 PolarHBondContact O-NE1 3.22Å
655	E	77.4	Confident	83.4	Confident	164 Å²	164	67.6 Å²	67.6	77%	0.766	35%	0.348	S	S	*	.	S	Bend	trans	-69.9	-18.7	-176.3	-67.8	-171.7	169.1	0	0	114
656	H	82.2	Confident	83.6	Confident	138 Å²	138	71.1 Å²	71.1	64%	0.639	36%	0.363	S	S	*	.	S	Bend	trans	-119.7	-27.2	-169.7	-60.8	-30.9	0	0	0	113	D654 P670 A671	D654-H656 PolarHBondContact O-N 3.37Å; D654-H656 WeakPolarHBondContact OD1-CA 3.37Å; D654-H656 PolarHBondContact OD1-N 2.9Å; H656-P670 CarbonylContact O-C 3.45Å; H656-P670 WeakPolarHBondContact O-CA 3.31Å; H656-A671 PolarHBondContact O-N 3.43Å
657	C	87.3	Confident	84	Confident	44 Å²	44	69.4 Å²	69.4	30%	0.297	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	114.4	-170.8	-166	0	0	0	0	111.1	D654 F669	D654-C657 WeakPolarHBondContact CB-O 3.24Å; D654-C657 PolarHBondContact OD1-N 3.1Å; C657-F669 WeakPolarHBondContact CA-O 2.99Å
658	W	91.2	Very high	84.4	Confident	33 Å²	33	73 Å²	73	13%	0.125	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	152.6	179.6	-64.8	-9.6	0	0	0	110.6	I649 N651 S652 D654 W668 F669 A671 V674 L676	I649-W658 HydrophobicContact CD1-CE3 3.9Å; I649-W658 HydrophobicContact CD1-CZ3 4.47Å; N651-W658 CarbonylContact O-C 3.58Å; N651-W658 WeakPolarHBondContact O-CA 3.46Å; N651-W658 WeakPolarHBondContact O-CB 3.44Å; S652-W658 VanDerWaalsContact CA-CD1 3.47Å; D654-W658 PolarHBondContact O-NE1 3.22Å; W658-W668 CarbonylContact O-C 3.56Å; W658-W668 WeakPolarHBondContact O-CA 3.22Å; W658-F669 HydrophobicContact CB-CE1 4.46Å; W658-F669 HydrophobicContact CB-CE2 3.88Å; W658-F669 HydrophobicContact CB-CZ 3.85Å; W658-F669 HydrophobicContact CE3-CE2 4.13Å; W658-F669 HydrophobicContact CE3-CZ 4.47Å; W658-F669 PolarHBondContact N-O 2.73Å; W658-F669 PolarHBondContact O-N 3Å; W658-A671 HydrophobicContact CD2-CB 3.62Å; W658-A671 HydrophobicContact CE3-CB 4.16Å; W658-A671 HydrophobicContact CG-CB 3.97Å; W658-A671 HydrophobicContact CH2-CB 4.23Å; W658-A671 HydrophobicContact CZ2-CB 3.73Å; W658-A671 HydrophobicContact CZ3-CB 4.43Å; W658-V674 HydrophobicContact CE3-CG2 3.8Å; W658-V674 HydrophobicContact CZ3-CG2 3.6Å; W658-L676 HydrophobicContact CH2-CD1 3.45Å; W658-L676 VanDerWaalsContact CH2-CD1 3.45Å; W658-L676 HydrophobicContact CH2-CD2 4.49Å; W658-L676 HydrophobicContact CH2-CG 3.77Å; W658-L676 HydrophobicContact CZ2-CD1 4.32Å; W658-L676 HydrophobicContact CZ3-CD1 3.98Å; W658-L676 HydrophobicContact CZ3-CD2 4.22Å; W658-L676 HydrophobicContact CZ3-CG 3.76Å
659	I	89.2	Confident	85	Confident	71 Å²	71	71.8 Å²	71.8	36%	0.364	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133.4	171.8	-54.1	176.9	0	0	0	107.6	I650 N651 G667	I650-I659 HydrophobicContact CB-CB 4.45Å; I650-I659 HydrophobicContact CB-CG2 4.17Å; I650-I659 HydrophobicContact CD1-CG2 4.39Å; I650-I659 HydrophobicContact CG2-CG2 4.46Å; I650-I659 PolarHBondContact N-O 2.77Å; N651-I659 HydrophobicContact CB-CB 4.05Å; N651-I659 HydrophobicContact CB-CD1 4.11Å; N651-I659 HydrophobicContact CB-CG1 4.23Å; N651-I659 PolarHBondContact N-O 3.27Å; N651-I659 VanDerWaalsContact N-O 3.1Å; N651-I659 PolarHBondContact O-N 3.08Å; I659-G667 WeakPolarHBondContact CA-O 2.97Å
660	G	88.5	Confident	85.4	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	-172	171.7	0	0	0	0	0	114.2	T648 Q666 G667	T648-G660 CarbonylContact O-C 3.58Å; T648-G660 VanDerWaalsContact O-C 3.27Å; T648-G660 WeakPolarHBondContact O-CA 3.1Å; G660-Q666 VanDerWaalsContact O-CA 3.24Å; G660-Q666 WeakPolarHBondContact O-CA 3.11Å; G660-G667 PolarHBondContact N-O 3.17Å; G660-G667 PolarHBondContact O-N 2.91Å
661	E	87.7	Confident	85.6	Confident	38 Å²	38	68.9 Å²	68.9	18%	0.178	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	134.4	-173.6	-169.4	-180	136.4	0	0	111	T648 I650 Q665 Q666	T648-E661 PolarHBondContact N-O 2.79Å; T648-E661 PolarHBondContact O-N 3.46Å; I650-E661 HydrophobicContact CD1-CB 3.97Å; E661-Q665 CarbonylContact C-O 3.4Å; E661-Q665 WeakPolarHBondContact CA-O 3.14Å; E661-Q666 HydrophobicContact CB-CG 3.93Å; E661-Q666 HydrophobicContact CG-CG 3.78Å; E661-Q666 PolarHBondContact OE2-NE2 3.06Å
662	L	87.9	Confident	86.1	Confident	23 Å²	23	73.8 Å²	73.8	12%	0.12	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	126.9	172.4	-177.1	68	0	0	0	108.6	L639 F641 D645 I646 L647 D664 Q665	L639-L662 HydrophobicContact CD1-CB 4.12Å; L639-L662 HydrophobicContact CD2-CB 4.27Å; L639-L662 HydrophobicContact CG-CB 4.45Å; F641-L662 HydrophobicContact CB-CD2 3.8Å; D645-L662 HydrophobicContact CB-CD1 4.42Å; D645-L662 HydrophobicContact CB-CD2 4.06Å; D645-L662 WeakPolarHBondContact OD2-CD2 3.17Å; I646-L662 WeakPolarHBondContact O-CD1 3.4Å; L647-L662 HydrophobicContact CD2-CB 3.87Å; L647-L662 HydrophobicContact CD2-CD1 4.35Å; L647-L662 HydrophobicContact CD2-CD2 3.88Å; L647-L662 HydrophobicContact CD2-CG 4.24Å; L662-D664 PolarHBondContact O-N 3.25Å; L662-Q665 PolarHBondContact N-O 3.23Å; L662-Q665 WeakPolarHBondContact O-CB 3.5Å; L662-Q665 PolarHBondContact O-N 3.39Å
663	N	82.1	Confident	86.7	Confident	138 Å²	138	74.8 Å²	74.8	74%	0.738	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	49.7	179.5	-58.5	-38.9	0	0	0	113.4	Q665	N663-Q665 PolarHBondContact O-N 3.39Å
664	D	78.2	Confident	87.3	Confident	151 Å²	151	68.2 Å²	68.2	81%	0.807	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	7.7	-176.9	-54.9	-49.9	0	0	0	115.3	L662	L662-D664 PolarHBondContact O-N 3.25Å
665	Q	85.4	Confident	87.3	Confident	97 Å²	97	69.6 Å²	69.6	45%	0.453	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	133	170.7	-60.2	-167	13.9	0	0	109.4	L639 E661 L662 N663	L639-Q665 HydrophobicContact CD1-CB 4.04Å; L639-Q665 WeakPolarHBondContact CD1-O 3.28Å; E661-Q665 CarbonylContact C-O 3.4Å; E661-Q665 WeakPolarHBondContact CA-O 3.14Å; L662-Q665 PolarHBondContact N-O 3.23Å; L662-Q665 WeakPolarHBondContact O-CB 3.5Å; L662-Q665 PolarHBondContact O-N 3.39Å; N663-Q665 PolarHBondContact O-N 3.39Å
666	Q	90.5	Very high	87.1	Confident	121 Å²	121	65 Å²	65	57%	0.565	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	143.3	174	-67	-175.5	-1.4	0	0	110.2	I650 G660 E661	I650-Q666 HydrophobicContact CD1-CB 4.29Å; I650-Q666 HydrophobicContact CD1-CG 3.61Å; G660-Q666 VanDerWaalsContact O-CA 3.24Å; G660-Q666 WeakPolarHBondContact O-CA 3.11Å; E661-Q666 HydrophobicContact CB-CG 3.93Å; E661-Q666 HydrophobicContact CG-CG 3.78Å; E661-Q666 PolarHBondContact OE2-NE2 3.06Å
667	G	91.3	Very high	86.3	Confident	7 Å²	7	60 Å²	60	7%	0.072	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.6	171.9	177.2	0	0	0	0	0	112	D637 I659 G660	D637-G667 CarbonylContact O-C 3.56Å; D637-G667 WeakPolarHBondContact O-CA 3.45Å; I659-G667 WeakPolarHBondContact CA-O 2.97Å; G660-G667 PolarHBondContact N-O 3.17Å; G660-G667 PolarHBondContact O-N 2.91Å
668	W	93.5	Very high	84.5	Confident	76 Å²	76	62.8 Å²	62.8	29%	0.288	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	154.6	175.6	68.9	-96.6	0	0	0	111.7	F631 D637 E638 L639 W658	F631-W668 HydrophobicContact CZ-CZ3 4.42Å; D637-W668 PolarHBondContact O-N 2.96Å; D637-W668 PolarHBondContact OD1-NE1 3.04Å; D637-W668 PolarHBondContact OD2-NE1 3.2Å; E638-W668 WeakPolarHBondContact CA-O 3.43Å; E638-W668 VanDerWaalsContact CD-CZ2 3.46Å; E638-W668 HydrophobicContact CG-CD2 3.83Å; E638-W668 HydrophobicContact CG-CE3 4.21Å; E638-W668 HydrophobicContact CG-CH2 3.6Å; E638-W668 HydrophobicContact CG-CZ2 3.14Å; E638-W668 HydrophobicContact CG-CZ3 4.11Å; E638-W668 WeakPolarHBondContact OE1-CH2 3.08Å; E638-W668 WeakPolarHBondContact OE1-CZ2 3.32Å; L639-W668 PolarHBondContact N-O 3.46Å; W658-W668 CarbonylContact O-C 3.56Å; W658-W668 WeakPolarHBondContact O-CA 3.22Å
669	F	92.6	Very high	82.7	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	159.5	173.8	58.4	-93.1	0	0	0	112.2	F631 L639 F641 L647 I649 C657 W658 A671 V674	F631-F669 HydrophobicContact CD1-CB 3.97Å; F631-F669 HydrophobicContact CE1-CB 3.8Å; L639-F669 HydrophobicContact CB-CD1 4.19Å; L639-F669 HydrophobicContact CD2-CD1 3.93Å; L639-F669 HydrophobicContact CD2-CE1 4.09Å; F641-F669 HydrophobicContact CE1-CB 3.53Å; F641-F669 HydrophobicContact CE1-CD1 4.3Å; F641-F669 HydrophobicContact CE1-CD2 4.02Å; F641-F669 AromaticContact CE1-CG 3.69Å; F641-F669 HydrophobicContact CE1-CG 3.69Å; F641-F669 HydrophobicContact CZ-CB 4.22Å; F641-F669 HydrophobicContact CZ-CD2 4.37Å; F641-F669 HydrophobicContact CZ-CG 4.42Å; L647-F669 HydrophobicContact CD1-CE1 4.34Å; L647-F669 HydrophobicContact CD1-CE2 4.25Å; L647-F669 HydrophobicContact CD1-CZ 4.14Å; I649-F669 HydrophobicContact CD1-CE1 4.46Å; I649-F669 HydrophobicContact CD1-CE2 4.3Å; I649-F669 HydrophobicContact CD1-CZ 3.52Å; C657-F669 WeakPolarHBondContact CA-O 2.99Å; W658-F669 HydrophobicContact CB-CE1 4.46Å; W658-F669 HydrophobicContact CB-CE2 3.88Å; W658-F669 HydrophobicContact CB-CZ 3.85Å; W658-F669 HydrophobicContact CE3-CE2 4.13Å; W658-F669 HydrophobicContact CE3-CZ 4.47Å; W658-F669 PolarHBondContact N-O 2.73Å; W658-F669 PolarHBondContact O-N 3Å; F669-A671 PolarHBondContact O-N 3.5Å; F669-V674 HydrophobicContact CD2-CG1 3.82Å; F669-V674 HydrophobicContact CD2-CG2 4.47Å; F669-V674 HydrophobicContact CE2-CB 4.33Å; F669-V674 HydrophobicContact CE2-CG1 3.62Å; F669-V674 HydrophobicContact CE2-CG2 3.72Å
670	P	92.1	Very high	80.9	Confident	20 Å²	20	61.9 Å²	61.9	13%	0.13	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	123.1	178.2	-20.7	33.4	0	0	0	112.9	F631 H656 K672 F673	F631-P670 HydrophobicContact CD2-CG 4.49Å; F631-P670 HydrophobicContact CE2-CG 3.98Å; F631-P670 HydrophobicContact CZ-CG 4.21Å; H656-P670 CarbonylContact O-C 3.45Å; H656-P670 WeakPolarHBondContact O-CA 3.31Å; P670-K672 HydrophobicContact CB-CG 3.98Å; P670-K672 PolarHBondContact O-N 2.86Å; P670-K672 VanDerWaalsContact O-N 3.13Å; P670-F673 HydrophobicContact CB-CD1 4.29Å; P670-F673 HydrophobicContact CB-CD2 4.09Å; P670-F673 HydrophobicContact CB-CE2 4.35Å; P670-F673 HydrophobicContact CB-CG 4.05Å; P670-F673 HydrophobicContact CG-CD2 3.92Å; P670-F673 HydrophobicContact CG-CE2 3.94Å; P670-F673 HydrophobicContact CG-CG 4.4Å; P670-F673 HydrophobicContact CG-CZ 4.43Å; P670-F673 WeakPolarHBondContact O-CB 3.34Å; P670-F673 PolarHBondContact O-N 2.74Å
671	A	86.6	Confident	79.2	Confident	10 Å²	10	62.4 Å²	62.4	8%	0.083	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-54.9	-35.4	180	0	0	0	0	0	113.3	H656 W658 F669 F673 V674	H656-A671 PolarHBondContact O-N 3.43Å; W658-A671 HydrophobicContact CD2-CB 3.62Å; W658-A671 HydrophobicContact CE3-CB 4.16Å; W658-A671 HydrophobicContact CG-CB 3.97Å; W658-A671 HydrophobicContact CH2-CB 4.23Å; W658-A671 HydrophobicContact CZ2-CB 3.73Å; W658-A671 HydrophobicContact CZ3-CB 4.43Å; F669-A671 PolarHBondContact O-N 3.5Å; A671-F673 PolarHBondContact O-N 3.32Å; A671-F673 VanDerWaalsContact O-N 3.15Å; A671-V674 WeakPolarHBondContact O-CG2 3.15Å; A671-V674 PolarHBondContact O-N 3.49Å
672	K	89.2	Confident	78	Confident	163 Å²	163	64.1 Å²	64.1	71%	0.709	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-64	-14.1	177.5	55.2	164.2	178.4	-179.1	0	114.9	P670 V674	P670-K672 HydrophobicContact CB-CG 3.98Å; P670-K672 PolarHBondContact O-N 2.86Å; P670-K672 VanDerWaalsContact O-N 3.13Å; K672-V674 VanDerWaalsContact C-N 3.33Å
673	F	91.4	Very high	77.2	Confident	45 Å²	45	68.4 Å²	68.4	20%	0.197	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-92	-1.8	-178.1	-69.4	2.2	0	0	0	112.5	L628 I629 F631 F641 P670 A671	L628-F673 WeakPolarHBondContact CB-O 3.31Å; L628-F673 PolarHBondContact N-O 3.38Å; I629-F673 HydrophobicContact CD1-CB 4.26Å; I629-F673 HydrophobicContact CD1-CD1 3.44Å; I629-F673 VanDerWaalsContact CD1-CD1 3.44Å; I629-F673 HydrophobicContact CD1-CD2 3.81Å; I629-F673 HydrophobicContact CD1-CE1 3.57Å; I629-F673 HydrophobicContact CD1-CE2 3.91Å; I629-F673 HydrophobicContact CD1-CG 3.58Å; I629-F673 HydrophobicContact CD1-CZ 3.81Å; I629-F673 HydrophobicContact CG1-CB 3.93Å; I629-F673 HydrophobicContact CG1-CD1 4.09Å; I629-F673 HydrophobicContact CG1-CD2 4.07Å; I629-F673 HydrophobicContact CG1-CG 3.79Å; F631-F673 HydrophobicContact CB-CD2 4.09Å; F631-F673 AromaticContact CD2-CD2 3.73Å; F631-F673 HydrophobicContact CD2-CD2 3.73Å; F631-F673 AromaticContact CD2-CE2 3.63Å; F631-F673 HydrophobicContact CD2-CE2 3.63Å; F631-F673 HydrophobicContact CE2-CD2 4.49Å; F631-F673 HydrophobicContact CE2-CE2 4.23Å; F631-F673 HydrophobicContact CG-CD2 4.06Å; F631-F673 HydrophobicContact CG-CE2 4.41Å; F641-F673 HydrophobicContact CE2-CB 4.27Å; F641-F673 HydrophobicContact CZ-CB 4Å; P670-F673 HydrophobicContact CB-CD1 4.29Å; P670-F673 HydrophobicContact CB-CD2 4.09Å; P670-F673 HydrophobicContact CB-CE2 4.35Å; P670-F673 HydrophobicContact CB-CG 4.05Å; P670-F673 HydrophobicContact CG-CD2 3.92Å; P670-F673 HydrophobicContact CG-CE2 3.94Å; P670-F673 HydrophobicContact CG-CG 4.4Å; P670-F673 HydrophobicContact CG-CZ 4.43Å; P670-F673 WeakPolarHBondContact O-CB 3.34Å; P670-F673 PolarHBondContact O-N 2.74Å; A671-F673 PolarHBondContact O-N 3.32Å; A671-F673 VanDerWaalsContact O-N 3.15Å
674	V	87.4	Confident	76.8	Confident	10 Å²	10	63.1 Å²	63.1	6%	0.061	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153	-175.8	-50.7	0	0	0	0	110.2	A625 K626 F641 L647 W658 F669 A671 K672	A625-V674 HydrophobicContact CB-CB 3.7Å; A625-V674 HydrophobicContact CB-CG2 3.61Å; K626-V674 CarbonylContact O-C 3.56Å; K626-V674 WeakPolarHBondContact O-CA 3.35Å; F641-V674 HydrophobicContact CE1-CG1 4.39Å; F641-V674 HydrophobicContact CE2-CG1 4.38Å; F641-V674 HydrophobicContact CZ-CG1 3.88Å; L647-V674 HydrophobicContact CD1-CB 4.41Å; L647-V674 HydrophobicContact CD1-CG1 3.39Å; W658-V674 HydrophobicContact CE3-CG2 3.8Å; W658-V674 HydrophobicContact CZ3-CG2 3.6Å; F669-V674 HydrophobicContact CD2-CG1 3.82Å; F669-V674 HydrophobicContact CD2-CG2 4.47Å; F669-V674 HydrophobicContact CE2-CB 4.33Å; F669-V674 HydrophobicContact CE2-CG1 3.62Å; F669-V674 HydrophobicContact CE2-CG2 3.72Å; A671-V674 WeakPolarHBondContact O-CG2 3.15Å; A671-V674 PolarHBondContact O-N 3.49Å; K672-V674 VanDerWaalsContact C-N 3.33Å
675	E	81.8	Confident	77.1	Confident	112 Å²	112	56 Å²	56	52%	0.523	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.7	169.7	178.6	177.8	-170.7	0	0	107.2	A625 K626 L628 L677	A625-E675 CarbonylContact C-O 3.48Å; A625-E675 WeakPolarHBondContact CA-O 3.49Å; A625-E675 WeakPolarHBondContact CB-O 3.34Å; K626-E675 PolarHBondContact N-O 2.86Å; K626-E675 PolarHBondContact O-N 2.96Å; L628-E675 HydrophobicContact CD1-CB 4.15Å; L628-E675 HydrophobicContact CD2-CB 3.81Å; L628-E675 HydrophobicContact CG-CB 4.02Å; E675-L677 PolarHBondContact O-N 3.34Å; E675-L677 VanDerWaalsContact O-N 3.12Å
676	L	73.3	Confident	76.9	Confident	69 Å²	69	54.2 Å²	54.2	36%	0.361	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	121.7	173.2	-86.9	156.1	0	0	0	108.8	I649 W658	I649-L676 HydrophobicContact CG1-CD2 4.24Å; W658-L676 HydrophobicContact CH2-CD1 3.45Å; W658-L676 VanDerWaalsContact CH2-CD1 3.45Å; W658-L676 HydrophobicContact CH2-CD2 4.49Å; W658-L676 HydrophobicContact CH2-CG 3.77Å; W658-L676 HydrophobicContact CZ2-CD1 4.32Å; W658-L676 HydrophobicContact CZ3-CD1 3.98Å; W658-L676 HydrophobicContact CZ3-CD2 4.22Å; W658-L676 HydrophobicContact CZ3-CG 3.76Å
677	L	64.4	Low	76.9	Confident	31 Å²	31	48.5 Å²	48.5	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	130.1	170.5	-69.7	175.5	0	0	0	107.2	R624 K626 I646 E675 E679	R624-L677 HydrophobicContact CB-CD1 4.46Å; R624-L677 PolarHBondContact O-N 3.39Å; K626-L677 HydrophobicContact CB-CD1 4.28Å; K626-L677 HydrophobicContact CB-CD2 3.87Å; K626-L677 HydrophobicContact CB-CG 4Å; I646-L677 HydrophobicContact CD1-CD1 3.65Å; I646-L677 HydrophobicContact CG1-CD1 4.3Å; I646-L677 HydrophobicContact CG2-CD1 3.75Å; E675-L677 PolarHBondContact O-N 3.34Å; E675-L677 VanDerWaalsContact O-N 3.12Å; L677-E679 HydrophobicContact CB-CG 3.53Å; L677-E679 PolarHBondContact O-N 3.02Å
678	D	51.3	Low	76.8	Confident	104 Å²	104	48.2 Å²	48.2	56%	0.556	24%	0.236	S	C	*	.			trans	-72.2	73.2	176.1	-172.8	4	0	0	0	109.1	R680 H853	D678-R680 PolarHBondContact O-N 3.31Å; D678-R680 WeakPolarHBondContact OD1-CG 3.46Å; D678-R680 IonicContact OD1-CZ 2.72Å; D678-R680 IonicContact OD1-NE 3.68Å; D678-R680 PolarHBondContact OD1-NE 3.45Å; D678-R680 IonicContact OD1-NH2 3.57Å; D678-R680 IonicContact OD2-CZ 3.68Å; D678-R680 IonicContact OD2-NE 3.84Å; D678-R680 PolarHBondContact OD2-NE 3.23Å; D678-R680 IonicContact OD2-NH2 3.4Å; D678-R680 PolarHBondContact OD2-NH2 2.9Å; D678-H853 PolarHBondContact O-NE2 3.26Å
679	E	51.8	Low	76.3	Confident	21 Å²	21	45.5 Å²	45.5	10%	0.098	23%	0.228	C	C	.	.			trans	-92.1	95.1	-173.9	-58.2	-141.1	146.2	0	0	111.7	R624 L677 H853	R624-E679 HydrophobicContact CB-CG 4.11Å; R624-E679 IonicContact CZ-OE1 3.57Å; R624-E679 IonicContact CZ-OE2 3.01Å; R624-E679 VanDerWaalsContact NE-CD 3.26Å; R624-E679 IonicContact NE-OE1 2.82Å; R624-E679 PolarHBondContact NE-OE1 3.34Å; R624-E679 IonicContact NE-OE2 3.29Å; R624-E679 PolarHBondContact NE-OE2 3.29Å; R624-E679 VanDerWaalsContact NH2-CD 3.3Å; R624-E679 IonicContact NH2-OE1 2.61Å; R624-E679 PolarHBondContact NH2-OE1 3.45Å; R624-E679 IonicContact NH2-OE2 2.64Å; R624-E679 PolarHBondContact NH2-OE2 3Å; L677-E679 HydrophobicContact CB-CG 3.53Å; L677-E679 PolarHBondContact O-N 3.02Å; E679-H853 WeakPolarHBondContact CG-CE1 3.13Å; E679-H853 IonicContact OE1-CE1 2.68Å
680	R	51.6	Low	76	Confident	64 Å²	64	46.3 Å²	46.3	24%	0.242	23%	0.232	C	C	.	.			trans	-94.6	102.7	170	-47.6	-165.4	-167.4	172.9	6	105.9	D678 N804 E805	D678-R680 PolarHBondContact O-N 3.31Å; D678-R680 WeakPolarHBondContact OD1-CG 3.46Å; D678-R680 IonicContact OD1-CZ 2.72Å; D678-R680 IonicContact OD1-NE 3.68Å; D678-R680 PolarHBondContact OD1-NE 3.45Å; D678-R680 IonicContact OD1-NH2 3.57Å; D678-R680 IonicContact OD2-CZ 3.68Å; D678-R680 IonicContact OD2-NE 3.84Å; D678-R680 PolarHBondContact OD2-NE 3.23Å; D678-R680 IonicContact OD2-NH2 3.4Å; D678-R680 PolarHBondContact OD2-NH2 2.9Å; R680-N804 CarbonylContact C-O 3.53Å; R680-E805 WeakPolarHBondContact CB-OE2 3.29Å; R680-E805 WeakPolarHBondContact CD-OE1 3.45Å; R680-E805 WeakPolarHBondContact CD-OE2 3.29Å; R680-E805 IonicContact CZ-OE1 2.83Å; R680-E805 IonicContact NE-OE1 3.46Å; R680-E805 IonicContact NH1-OE1 2.65Å; R680-E805 PolarHBondContact NH1-OE1 3.46Å
681	G	52.6	Low	75.2	Confident	11 Å²	11	48.5 Å²	48.5	11%	0.113	26%	0.258	C	S	.	.	S	Bend	trans	122.5	-155.4	165.6	0	0	0	0	0	117.2
682	K	64.2	Low	74.7	Confident	74 Å²	74	52.2 Å²	52.2	32%	0.322	28%	0.28	S	S	.	.	S	Bend	trans	-56.5	171.4	-172.5	-74.6	175.6	173.6	-177.9	0	113.5	V617 Y684 S848 Q849 A851	V617-K682 HydrophobicContact CG1-CG 4.24Å; V617-K682 HydrophobicContact CG2-CG 4.39Å; K682-Y684 PolarHBondContact O-N 3.48Å; K682-S848 VanDerWaalsContact CE-O 3.28Å; K682-S848 WeakPolarHBondContact CE-O 3.47Å; K682-S848 PolarHBondContact NZ-O 3.12Å; K682-Q849 VanDerWaalsContact CD-O 3.31Å; K682-Q849 WeakPolarHBondContact CD-O 3.46Å; K682-Q849 PolarHBondContact NZ-O 3.04Å; K682-A851 HydrophobicContact CB-CB 4.14Å
683	N	69.6	Low	74.3	Confident	112 Å²	112	45.9 Å²	45.9	60%	0.599	25%	0.254	S	S	*	.	S	Bend	trans	-45.7	131.5	172.8	-67.1	-14.8	0	0	0	110.9	S685 A851	N683-S685 PolarHBondContact O-N 3.49Å; N683-A851 WeakPolarHBondContact O-CB 3.26Å
684	Y	75.4	Confident	74	Confident	27 Å²	27	53.3 Å²	53.3	11%	0.106	28%	0.28	C	S	.	.			trans	-59.6	136.1	-176.3	173	-97.9	0	0	0	108.3	Q592 R624 K682 P686 D689 V692	Q592-Y684 PolarHBondContact NE2-O 3.17Å; R624-Y684 VanDerWaalsContact CZ-N 3.28Å; R624-Y684 VanDerWaalsContact NH2-CA 3.35Å; K682-Y684 PolarHBondContact O-N 3.48Å; Y684-P686 HydrophobicContact CD1-CG 4.34Å; Y684-P686 HydrophobicContact CE1-CB 4.31Å; Y684-P686 HydrophobicContact CE1-CG 3.84Å; Y684-D689 HydrophobicContact CE2-CB 3.95Å; Y684-D689 VanDerWaalsContact CE2-OD2 3.28Å; Y684-D689 WeakPolarHBondContact CE2-OD2 3.45Å; Y684-D689 PolarHBondContact OH-OD2 3.1Å; Y684-V692 WeakPolarHBondContact OH-CG2 3.37Å
685	S	83.6	Confident	74.1	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.014	31%	0.306	C	S	.	.			trans	-123.8	121.8	171.9	-178.4	0	0	0	0	107.7	D589 N683 A687 G688	D589-S685 WeakPolarHBondContact CB-OG 3.4Å; D589-S685 WeakPolarHBondContact OD2-CB 3.19Å; D589-S685 PolarHBondContact OD2-OG 3.45Å; N683-S685 PolarHBondContact O-N 3.49Å; S685-A687 PolarHBondContact O-N 2.91Å; S685-A687 VanDerWaalsContact O-N 3.1Å; S685-G688 PolarHBondContact O-N 3.48Å
686	P	81.3	Confident	74.7	Confident	59 Å²	59	53 Å²	53	38%	0.383	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-53.7	-28.7	173	-24	31.8	0	0	0	112.6	Y684 G688 D689 V692	Y684-P686 HydrophobicContact CD1-CG 4.34Å; Y684-P686 HydrophobicContact CE1-CB 4.31Å; Y684-P686 HydrophobicContact CE1-CG 3.84Å; P686-G688 PolarHBondContact O-N 2.94Å; P686-D689 PolarHBondContact O-N 2.96Å; P686-V692 HydrophobicContact CB-CG1 4.07Å
687	A	89.7	Confident	75.4	Confident	2 Å²	2	50.8 Å²	50.8	2%	0.017	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-64.9	-23.7	178.1	0	0	0	0	0	113.4	H584 F585 N588 D589 S685	H584-A687 PolarHBondContact CD2-O 3.47Å; H584-A687 PolarHBondContact NE2-O 2.92Å; F585-A687 HydrophobicContact CD1-CB 3.84Å; F585-A687 HydrophobicContact CE1-CB 4.09Å; F585-A687 HydrophobicContact CG-CB 4.37Å; N588-A687 HydrophobicContact CB-CB 3.75Å; D589-A687 HydrophobicContact CB-CB 4.26Å; S685-A687 PolarHBondContact O-N 2.91Å; S685-A687 VanDerWaalsContact O-N 3.1Å
688	G	88.7	Confident	76.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-96.8	-3.8	-179.5	0	0	0	0	0	115.3	S685 P686 H853	S685-G688 PolarHBondContact O-N 3.48Å; P686-G688 PolarHBondContact O-N 2.94Å; G688-H853 PolarHBondContact O-N 2.94Å
689	D	84.2	Confident	78.6	Confident	20 Å²	20	47.9 Å²	47.9	11%	0.107	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-98.8	115.8	-174.2	-176.4	-22.2	0	0	0	110.8	Y684 P686 G691 V692 D693 H853	Y684-D689 HydrophobicContact CE2-CB 3.95Å; Y684-D689 VanDerWaalsContact CE2-OD2 3.28Å; Y684-D689 WeakPolarHBondContact CE2-OD2 3.45Å; Y684-D689 PolarHBondContact OH-OD2 3.1Å; P686-D689 PolarHBondContact O-N 2.96Å; D689-G691 PolarHBondContact O-N 3.04Å; D689-G691 WeakPolarHBondContact OD1-CA 2.85Å; D689-G691 PolarHBondContact OD1-N 2.87Å; D689-V692 HydrophobicContact CB-CB 4.13Å; D689-V692 HydrophobicContact CB-CG2 4.18Å; D689-V692 PolarHBondContact O-N 3.28Å; D689-V692 VanDerWaalsContact O-N 3.08Å; D689-V692 PolarHBondContact OD1-N 2.55Å; D689-D693 PolarHBondContact O-N 3.03Å; D689-H853 WeakPolarHBondContact CA-O 3.49Å; D689-H853 HydrophobicContact CB-CB 3.84Å
690	D	86.6	Confident	80.8	Confident	17 Å²	17	46.9 Å²	46.9	9%	0.091	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-12.5	-179.2	63.1	13.9	0	0	0	114.8	I696 I697 R701 H853 L854 S855	D690-I696 HydrophobicContact CB-CG2 3.9Å; D690-I697 HydrophobicContact CB-CD1 4.05Å; D690-I697 HydrophobicContact CB-CG1 3.48Å; D690-I697 VanDerWaalsContact CB-CG1 3.48Å; D690-R701 IonicContact OD2-CZ 2.91Å; D690-R701 IonicContact OD2-NH1 3.91Å; D690-R701 PolarHBondContact OD2-NH1 2.92Å; D690-R701 IonicContact OD2-NH2 3.16Å; D690-R701 PolarHBondContact OD2-NH2 2.64Å; D690-H853 PolarHBondContact N-O 3.45Å; D690-L854 HydrophobicContact CB-CD2 3.99Å; D690-L854 WeakPolarHBondContact OD2-CA 3.22Å; D690-S855 PolarHBondContact OD1-N 3.45Å; D690-S855 VanDerWaalsContact OD1-N 3.12Å; D690-S855 PolarHBondContact OD2-N 3.42Å
691	G	74.6	Confident	82.7	Confident	66 Å²	66	44.8 Å²	44.8	68%	0.68	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-23.2	167.9	0	0	0	0	0	113.6	D689	D689-G691 PolarHBondContact O-N 3.04Å; D689-G691 WeakPolarHBondContact OD1-CA 2.85Å; D689-G691 PolarHBondContact OD1-N 2.87Å
692	V	75.9	Confident	84.3	Confident	88 Å²	88	46.7 Å²	46.7	53%	0.533	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-53.6	-177.4	179	0	0	0	0	111.8	Y684 P686 D689	Y684-V692 WeakPolarHBondContact OH-CG2 3.37Å; P686-V692 HydrophobicContact CB-CG1 4.07Å; D689-V692 HydrophobicContact CB-CB 4.13Å; D689-V692 HydrophobicContact CB-CG2 4.18Å; D689-V692 PolarHBondContact O-N 3.28Å; D689-V692 VanDerWaalsContact O-N 3.08Å; D689-V692 PolarHBondContact OD1-N 2.55Å
693	D	82.2	Confident	85.7	Confident	30 Å²	30	44.9 Å²	44.9	16%	0.16	27%	0.267	C	S	.	.			trans	-112	106.1	179.8	-171.8	-15.4	0	0	0	111	H584 N588 D689 L695 I696	H584-D693 IonicContact CE1-OD1 3.84Å; H584-D693 IonicContact CE1-OD2 2.87Å; H584-D693 PolarHBondContact CE1-OD2 3.37Å; H584-D693 IonicContact NE2-OD2 3.21Å; H584-D693 PolarHBondContact NE2-OD2 3.47Å; H584-D693 VanDerWaalsContact NE2-OD2 3.16Å; N588-D693 PolarHBondContact ND2-OD2 3.03Å; D689-D693 PolarHBondContact O-N 3.03Å; D693-L695 PolarHBondContact O-N 3.2Å; D693-L695 VanDerWaalsContact OD1-CB 3.3Å; D693-L695 WeakPolarHBondContact OD1-CB 3.2Å; D693-L695 PolarHBondContact OD1-N 3.29Å; D693-I696 WeakPolarHBondContact O-CG2 3.14Å; D693-I696 PolarHBondContact O-N 3.42Å
694	R	85.2	Confident	87	Confident	201 Å²	201	39.6 Å²	39.6	76%	0.758	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-17.3	-178.1	-65	-174.2	179.3	-144	-0.7	113.7	I696 I697	R694-I696 VanDerWaalsContact C-N 3.28Å; R694-I696 PolarHBondContact O-N 3.06Å; R694-I697 HydrophobicContact CB-CD1 4.17Å; R694-I697 HydrophobicContact CG-CD1 4.3Å; R694-I697 VanDerWaalsContact O-CB 3.3Å; R694-I697 WeakPolarHBondContact O-CB 3.31Å; R694-I697 PolarHBondContact O-N 3.47Å
695	L	88.8	Confident	88	Confident	115 Å²	115	38.5 Å²	38.5	60%	0.602	24%	0.235	S	C	*	.	H	α-helix	trans	-66.4	-33.5	179.7	-66.7	173.1	0	0	0	111.3	D693 I697 G698 L699	D693-L695 PolarHBondContact O-N 3.2Å; D693-L695 VanDerWaalsContact OD1-CB 3.3Å; D693-L695 WeakPolarHBondContact OD1-CB 3.2Å; D693-L695 PolarHBondContact OD1-N 3.29Å; L695-I697 PolarHBondContact O-N 3Å; L695-G698 PolarHBondContact O-N 3Å; L695-L699 PolarHBondContact O-N 3.19Å; L695-L699 VanDerWaalsContact O-N 3.11Å
696	I	93	Very high	88.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61	-28.5	178.6	-159	59.8	0	0	0	112	I581 F585 D690 D693 R694 L699 V700 F852 L854	I581-I696 HydrophobicContact CG2-CD1 4.41Å; F585-I696 HydrophobicContact CE2-CD1 4.11Å; D690-I696 HydrophobicContact CB-CG2 3.9Å; D693-I696 WeakPolarHBondContact O-CG2 3.14Å; D693-I696 PolarHBondContact O-N 3.42Å; R694-I696 VanDerWaalsContact C-N 3.28Å; R694-I696 PolarHBondContact O-N 3.06Å; I696-L699 HydrophobicContact CD1-CD1 4.41Å; I696-L699 PolarHBondContact O-N 3.48Å; I696-V700 HydrophobicContact CD1-CG2 4.11Å; I696-V700 HydrophobicContact CG1-CG2 4.07Å; I696-V700 WeakPolarHBondContact O-CB 3.28Å; I696-V700 WeakPolarHBondContact O-CG2 3.42Å; I696-V700 PolarHBondContact O-N 3.06Å; I696-F852 HydrophobicContact CD1-CE1 4.19Å; I696-L854 HydrophobicContact CG1-CD2 4.24Å; I696-L854 HydrophobicContact CG2-CD2 3.95Å
697	I	88.1	Confident	89	Confident	23 Å²	23	41.1 Å²	41.1	12%	0.118	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-47.7	174.8	-57.6	167.3	0	0	0	110.1	D690 R694 L695 R701 Y858	D690-I697 HydrophobicContact CB-CD1 4.05Å; D690-I697 HydrophobicContact CB-CG1 3.48Å; D690-I697 VanDerWaalsContact CB-CG1 3.48Å; R694-I697 HydrophobicContact CB-CD1 4.17Å; R694-I697 HydrophobicContact CG-CD1 4.3Å; R694-I697 VanDerWaalsContact O-CB 3.3Å; R694-I697 WeakPolarHBondContact O-CB 3.31Å; R694-I697 PolarHBondContact O-N 3.47Å; L695-I697 PolarHBondContact O-N 3Å; I697-R701 WeakPolarHBondContact O-CA 2.9Å; I697-R701 VanDerWaalsContact O-CB 3.32Å; I697-R701 WeakPolarHBondContact O-CB 3.43Å; I697-R701 PolarHBondContact O-N 3.26Å; I697-Y858 HydrophobicContact CD1-CE2 3.77Å; I697-Y858 HydrophobicContact CG2-CE1 4.04Å
698	G	88.7	Confident	89.3	Confident	39 Å²	39	41.1 Å²	41.1	40%	0.402	24%	0.241	S	C	.	.	I	π-helix	trans	-66.6	-42.9	179.7	0	0	0	0	0	112.1	L695 G702 S703	L695-G698 PolarHBondContact O-N 3Å; G698-G702 CarbonylContact O-C 3.6Å; G698-G702 WeakPolarHBondContact O-CA 3.42Å; G698-G702 PolarHBondContact O-N 3.19Å; G698-S703 PolarHBondContact O-N 2.84Å
699	L	95.7	Very high	89.6	Confident	34 Å²	34	42 Å²	42	18%	0.178	25%	0.25	C	C	.	.	I	π-helix	trans	-64.5	-46.3	178.8	-63.9	178.7	0	0	0	112	L580 I581 H584 L695 I696 S703 L704	L580-L699 HydrophobicContact CB-CD2 3.94Å; L580-L699 HydrophobicContact CD1-CD2 4.49Å; I581-L699 HydrophobicContact CG1-CB 3.92Å; H584-L699 HydrophobicContact CB-CD1 3.52Å; L695-L699 PolarHBondContact O-N 3.19Å; L695-L699 VanDerWaalsContact O-N 3.11Å; I696-L699 HydrophobicContact CD1-CD1 4.41Å; I696-L699 PolarHBondContact O-N 3.48Å; L699-S703 VanDerWaalsContact O-CB 3.27Å; L699-S703 WeakPolarHBondContact O-CB 3.37Å; L699-S703 PolarHBondContact O-N 2.82Å; L699-L704 PolarHBondContact O-N 2.92Å
700	V	96.3	Very high	90	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.255	C	S	.	.	I	π-helix	trans	-79.7	-56.8	-177.5	177.1	0	0	0	0	111.8	I581 I696 L704 C705 L803 F852 L854	I581-V700 HydrophobicContact CD1-CG2 4.11Å; I696-V700 HydrophobicContact CD1-CG2 4.11Å; I696-V700 HydrophobicContact CG1-CG2 4.07Å; I696-V700 WeakPolarHBondContact O-CB 3.28Å; I696-V700 WeakPolarHBondContact O-CG2 3.42Å; I696-V700 PolarHBondContact O-N 3.06Å; V700-L704 PolarHBondContact O-N 2.66Å; V700-C705 WeakPolarHBondContact O-CB 3.27Å; V700-C705 PolarHBondContact O-N 3.08Å; V700-C705 PolarHBondContact O-SG 3.37Å; V700-L803 HydrophobicContact CG1-CD1 3.59Å; V700-L803 HydrophobicContact CG2-CD1 4.08Å; V700-F852 HydrophobicContact CG2-CE1 4.26Å; V700-L854 HydrophobicContact CB-CD1 4.32Å; V700-L854 HydrophobicContact CG1-CD1 3.83Å; V700-L854 HydrophobicContact CG2-CD1 4.11Å
701	R	93	Very high	90.3	Very high	21 Å²	21	41.4 Å²	41.4	8%	0.079	25%	0.25	C	S	.	.	I	π-helix	trans	-80.5	-28.3	-174.1	-63.8	-175.8	-180	78.7	-5.1	113	D690 I697 C705 S855	D690-R701 IonicContact OD2-CZ 2.91Å; D690-R701 IonicContact OD2-NH1 3.91Å; D690-R701 PolarHBondContact OD2-NH1 2.92Å; D690-R701 IonicContact OD2-NH2 3.16Å; D690-R701 PolarHBondContact OD2-NH2 2.64Å; I697-R701 WeakPolarHBondContact O-CA 2.9Å; I697-R701 VanDerWaalsContact O-CB 3.32Å; I697-R701 WeakPolarHBondContact O-CB 3.43Å; I697-R701 PolarHBondContact O-N 3.26Å; R701-C705 WeakPolarHBondContact O-CB 3.44Å; R701-S855 PolarHBondContact NH2-O 3.37Å
702	G	86.1	Confident	91.3	Very high	50 Å²	50	38.5 Å²	38.5	52%	0.515	22%	0.219	S	C	.	.	I	π-helix	trans	-87.7	-37.8	179.4	0	0	0	0	0	114.3	G698 H706	G698-G702 CarbonylContact O-C 3.6Å; G698-G702 WeakPolarHBondContact O-CA 3.42Å; G698-G702 PolarHBondContact O-N 3.19Å; G702-H706 WeakPolarHBondContact O-CB 3.4Å
703	S	93.4	Very high	92	Very high	37 Å²	37	37.2 Å²	37.2	26%	0.259	21%	0.214	S	C	.	.	I	π-helix	trans	-107.9	-61	-175.2	-159.9	0	0	0	0	113.1	S577 G698 L699 C705 H706 S707	S577-S703 WeakPolarHBondContact CB-OG 3.37Å; S577-S703 PolarHBondContact OG-O 3.23Å; S577-S703 PolarHBondContact OG-OG 3.32Å; G698-S703 PolarHBondContact O-N 2.84Å; L699-S703 VanDerWaalsContact O-CB 3.27Å; L699-S703 WeakPolarHBondContact O-CB 3.37Å; L699-S703 PolarHBondContact O-N 2.82Å; S703-C705 PolarHBondContact O-N 3.48Å; S703-H706 PolarHBondContact O-N 3.48Å; S703-S707 PolarHBondContact O-N 2.77Å; S703-S707 PolarHBondContact O-OG 3.32Å
704	L	96.6	Very high	92.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-63.6	-44.2	-175.3	179	66.9	0	0	0	112.4	L574 I578 I581 L699 V700 H706 S707 L708 I799 L803 L844 L847	L574-L704 HydrophobicContact CD1-CD1 3.85Å; I578-L704 HydrophobicContact CG1-CD1 4.04Å; I581-L704 HydrophobicContact CD1-CB 4.03Å; I581-L704 HydrophobicContact CD1-CD2 3.79Å; I581-L704 HydrophobicContact CD1-CG 4.41Å; L699-L704 PolarHBondContact O-N 2.92Å; V700-L704 PolarHBondContact O-N 2.66Å; L704-H706 VanDerWaalsContact C-N 3.31Å; L704-H706 PolarHBondContact O-N 3.45Å; L704-S707 WeakPolarHBondContact CA-OG 3.39Å; L704-S707 PolarHBondContact O-OG 2.63Å; L704-L708 HydrophobicContact CD1-CD1 4.22Å; L704-L708 HydrophobicContact CD1-CG 4.48Å; L704-L708 HydrophobicContact CG-CD1 4.18Å; L704-L708 WeakPolarHBondContact O-CB 3.2Å; L704-L708 WeakPolarHBondContact O-CG 3.37Å; L704-L708 PolarHBondContact O-N 3.38Å; L704-I799 HydrophobicContact CD2-CG2 4.39Å; L704-L803 HydrophobicContact CD2-CD1 3.88Å; L704-L803 HydrophobicContact CD2-CD2 4.39Å; L704-L844 HydrophobicContact CD1-CD2 4.44Å; L704-L847 HydrophobicContact CD1-CD1 4.23Å; L704-L847 HydrophobicContact CD2-CD1 3.6Å
705	C	96.2	Very high	92.4	Very high	4 Å²	4	27 Å²	27	3%	0.027	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-37	177	-77.8	0	0	0	0	112.8	V700 R701 S703 G709 R796	V700-C705 WeakPolarHBondContact O-CB 3.27Å; V700-C705 PolarHBondContact O-N 3.08Å; V700-C705 PolarHBondContact O-SG 3.37Å; R701-C705 WeakPolarHBondContact O-CB 3.44Å; S703-C705 PolarHBondContact O-N 3.48Å; C705-G709 PolarHBondContact O-N 3.36Å; C705-R796 HydrophobicContact CB-CG 3.66Å
706	H	92.3	Very high	92.4	Very high	116 Å²	116	22.3 Å²	22.3	54%	0.537	15%	0.15	S	C	.	.	H	α-helix	trans	-67	-50.1	178.5	-178.1	77.7	0	0	0	111.1	G702 S703 L704 L708 G709 A710	G702-H706 WeakPolarHBondContact O-CB 3.4Å; S703-H706 PolarHBondContact O-N 3.48Å; L704-H706 VanDerWaalsContact C-N 3.31Å; L704-H706 PolarHBondContact O-N 3.45Å; H706-L708 PolarHBondContact O-N 2.71Å; H706-G709 WeakPolarHBondContact O-CA 3.39Å; H706-G709 PolarHBondContact O-N 3.28Å; H706-G709 VanDerWaalsContact O-N 3.08Å; H706-A710 PolarHBondContact O-N 2.76Å
707	S	93.7	Very high	92.2	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-40.5	177.7	48.2	0	0	0	0	112.4	S577 S703 L704 A710 V711	S577-S707 PolarHBondContact OG-OG 3.02Å; S703-S707 PolarHBondContact O-N 2.77Å; S703-S707 PolarHBondContact O-OG 3.32Å; L704-S707 WeakPolarHBondContact CA-OG 3.39Å; L704-S707 PolarHBondContact O-OG 2.63Å; S707-A710 WeakPolarHBondContact O-CB 3.35Å; S707-A710 PolarHBondContact O-N 3.1Å; S707-V711 WeakPolarHBondContact O-CG2 3.37Å; S707-V711 PolarHBondContact O-N 3.09Å; S707-V711 VanDerWaalsContact O-N 3.1Å
708	L	96.3	Very high	91.6	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-38.1	171.4	-77.5	174.5	0	0	0	112.8	L574 L704 H706 A710 V711 F712 F795 I799 L808 L844	L574-L708 HydrophobicContact CD1-CD2 3.97Å; L574-L708 HydrophobicContact CD1-CG 3.97Å; L704-L708 HydrophobicContact CD1-CD1 4.22Å; L704-L708 HydrophobicContact CD1-CG 4.48Å; L704-L708 HydrophobicContact CG-CD1 4.18Å; L704-L708 WeakPolarHBondContact O-CB 3.2Å; L704-L708 WeakPolarHBondContact O-CG 3.37Å; L704-L708 PolarHBondContact O-N 3.38Å; H706-L708 PolarHBondContact O-N 2.71Å; L708-A710 VanDerWaalsContact C-N 3.25Å; L708-A710 PolarHBondContact O-N 2.92Å; L708-V711 WeakPolarHBondContact O-CB 3.14Å; L708-V711 PolarHBondContact O-N 2.98Å; L708-F712 WeakPolarHBondContact O-CD2 3.47Å; L708-F712 PolarHBondContact O-N 3.12Å; L708-F795 HydrophobicContact CB-CE1 4.28Å; L708-F795 HydrophobicContact CB-CZ 4.15Å; L708-I799 HydrophobicContact CD1-CD1 3.81Å; L708-I799 HydrophobicContact CD1-CG1 4.22Å; L708-I799 HydrophobicContact CD1-CG2 4.01Å; L708-L808 HydrophobicContact CD1-CD2 4.24Å; L708-L844 HydrophobicContact CD1-CD2 4.12Å; L708-L844 HydrophobicContact CD2-CD1 4.18Å; L708-L844 HydrophobicContact CD2-CD2 4.12Å
709	G	94.2	Very high	90.3	Very high	18 Å²	18	33 Å²	33	19%	0.186	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-39.7	173.2	0	0	0	0	0	112.2	C705 H706 F712 S713	C705-G709 PolarHBondContact O-N 3.36Å; H706-G709 WeakPolarHBondContact O-CA 3.39Å; H706-G709 PolarHBondContact O-N 3.28Å; H706-G709 VanDerWaalsContact O-N 3.08Å; G709-F712 PolarHBondContact O-N 3.31Å; G709-S713 VanDerWaalsContact O-CB 3.29Å; G709-S713 WeakPolarHBondContact O-CB 3.33Å; G709-S713 PolarHBondContact O-N 3.18Å; G709-S713 PolarHBondContact O-OG 3.45Å
710	A	92.3	Very high	88.3	Confident	25 Å²	25	43.3 Å²	43.3	21%	0.207	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-43.6	174.6	0	0	0	0	0	112.2	I570 H706 S707 L708 F712 S713 H714	I570-A710 HydrophobicContact CD1-CB 4.25Å; I570-A710 HydrophobicContact CG1-CB 3.96Å; I570-A710 HydrophobicContact CG2-CB 4.12Å; H706-A710 PolarHBondContact O-N 2.76Å; S707-A710 WeakPolarHBondContact O-CB 3.35Å; S707-A710 PolarHBondContact O-N 3.1Å; L708-A710 VanDerWaalsContact C-N 3.25Å; L708-A710 PolarHBondContact O-N 2.92Å; A710-F712 PolarHBondContact O-N 2.88Å; A710-S713 PolarHBondContact O-N 3.02Å; A710-H714 WeakPolarHBondContact O-CB 3.47Å; A710-H714 PolarHBondContact O-N 3.25Å
711	V	93.8	Very high	86.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-55.5	-48	173.5	170.6	0	0	0	0	111.7	I570 L574 S707 L708 S713 H714 F812 Y831 L832 I840	I570-V711 HydrophobicContact CG2-CB 4.23Å; I570-V711 HydrophobicContact CG2-CG2 3.35Å; L574-V711 HydrophobicContact CD2-CG2 4.45Å; S707-V711 WeakPolarHBondContact O-CG2 3.37Å; S707-V711 PolarHBondContact O-N 3.09Å; S707-V711 VanDerWaalsContact O-N 3.1Å; L708-V711 WeakPolarHBondContact O-CB 3.14Å; L708-V711 PolarHBondContact O-N 2.98Å; V711-S713 VanDerWaalsContact C-N 3.35Å; V711-H714 PolarHBondContact O-N 3.14Å; V711-F812 HydrophobicContact CG1-CE2 4.18Å; V711-F812 HydrophobicContact CG1-CZ 4.13Å; V711-Y831 HydrophobicContact CG1-CD2 4.39Å; V711-Y831 HydrophobicContact CG1-CG 4.44Å; V711-L832 HydrophobicContact CG1-CD1 4.18Å; V711-I840 HydrophobicContact CG1-CD1 3.69Å; V711-I840 HydrophobicContact CG2-CD1 4.22Å
712	F	94.4	Very high	83.9	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-74.1	-23.6	-179.4	-87.8	-98.4	0	0	0	113.2	L708 G709 A710 P729 F732 I733 F795 F812 L815 Y826 L832	L708-F712 WeakPolarHBondContact O-CD2 3.47Å; L708-F712 PolarHBondContact O-N 3.12Å; G709-F712 PolarHBondContact O-N 3.31Å; A710-F712 PolarHBondContact O-N 2.88Å; F712-P729 HydrophobicContact CB-CB 3.85Å; F712-P729 HydrophobicContact CB-CG 3.98Å; F712-P729 HydrophobicContact CD1-CB 4.18Å; F712-P729 HydrophobicContact CG-CB 4.43Å; F712-F732 HydrophobicContact CD1-CD1 4.34Å; F712-F732 HydrophobicContact CD1-CE1 4.39Å; F712-F732 HydrophobicContact CE1-CD1 4.25Å; F712-F732 AromaticContact CE1-CE1 3.98Å; F712-F732 HydrophobicContact CE1-CE1 3.98Å; F712-I733 HydrophobicContact CD1-CD1 4.14Å; F712-I733 HydrophobicContact CD1-CG1 4.35Å; F712-I733 HydrophobicContact CE1-CD1 3.83Å; F712-I733 HydrophobicContact CE1-CG1 3.84Å; F712-F795 HydrophobicContact CB-CE2 4.38Å; F712-F795 HydrophobicContact CB-CZ 4.39Å; F712-F795 HydrophobicContact CD1-CE2 4.19Å; F712-F795 AromaticContact CD2-CE2 3.86Å; F712-F795 HydrophobicContact CD2-CE2 3.86Å; F712-F795 AromaticContact CD2-CZ 3.74Å; F712-F795 HydrophobicContact CD2-CZ 3.74Å; F712-F795 HydrophobicContact CE1-CE2 4.42Å; F712-F795 HydrophobicContact CE2-CE2 4.1Å; F712-F795 HydrophobicContact CE2-CZ 4.16Å; F712-F795 AromaticContact CG-CE2 3.9Å; F712-F795 HydrophobicContact CG-CE2 3.9Å; F712-F795 HydrophobicContact CG-CZ 4.09Å; F712-F795 HydrophobicContact CZ-CE2 4.38Å; F712-F812 HydrophobicContact CD2-CE2 4.42Å; F712-F812 AromaticContact CE2-CD2 3.8Å; F712-F812 HydrophobicContact CE2-CD2 3.8Å; F712-F812 AromaticContact CE2-CE2 3.66Å; F712-F812 HydrophobicContact CE2-CE2 3.66Å; F712-F812 AromaticContact CZ-CD2 3.92Å; F712-F812 HydrophobicContact CZ-CD2 3.92Å; F712-F812 AromaticContact CZ-CE2 4Å; F712-F812 HydrophobicContact CZ-CE2 4Å; F712-L815 HydrophobicContact CE1-CD1 4.09Å; F712-L815 HydrophobicContact CZ-CD1 3.92Å; F712-Y826 WeakPolarHBondContact O-CE1 3.49Å; F712-Y826 PolarHBondContact O-OH 3.11Å; F712-L832 HydrophobicContact CD1-CD2 4.02Å; F712-L832 HydrophobicContact CE1-CD2 4Å
713	S	91.6	Very high	81.8	Confident	61 Å²	61	57.2 Å²	57.2	43%	0.427	30%	0.303	S	S	.	.	H	α-helix	trans	-82.5	-24.6	174.5	-60.5	0	0	0	0	111.8	G709 A710 V711 G715 L716	G709-S713 VanDerWaalsContact O-CB 3.29Å; G709-S713 WeakPolarHBondContact O-CB 3.33Å; G709-S713 PolarHBondContact O-N 3.18Å; G709-S713 PolarHBondContact O-OG 3.45Å; A710-S713 PolarHBondContact O-N 3.02Å; V711-S713 VanDerWaalsContact C-N 3.35Å; S713-G715 PolarHBondContact O-N 3.1Å; S713-L716 WeakPolarHBondContact O-CB 3.34Å; S713-L716 PolarHBondContact O-N 3.44Å
714	H	88.2	Confident	79.4	Confident	10 Å²	10	60 Å²	60	5%	0.046	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	104.8	-176.8	-175.3	-95.6	0	0	0	112.7	H566 Q567 I570 A710 V711 W829 S830 Y831	H566-H714 AromaticContact CD2-CD2 3.62Å; Q567-H714 WeakPolarHBondContact CG-CE1 3.47Å; I570-H714 HydrophobicContact CD1-CB 3.89Å; A710-H714 WeakPolarHBondContact O-CB 3.47Å; A710-H714 PolarHBondContact O-N 3.25Å; V711-H714 PolarHBondContact O-N 3.14Å; H714-W829 AromaticContact CE1-CE3 3.59Å; H714-W829 AromaticContact CE1-CZ3 3.74Å; H714-W829 PolarHBondContact CE1-O 3.49Å; H714-W829 AromaticContact NE2-CE3 3.93Å; H714-W829 AromaticContact NE2-CZ3 3.73Å; H714-S830 WeakPolarHBondContact O-CB 3.24Å; H714-Y831 HydrophobicContact CB-CD2 4.34Å; H714-Y831 AromaticContact ND1-CD2 3.85Å
715	G	87.3	Confident	77.1	Confident	5 Å²	5	66.7 Å²	66.7	5%	0.052	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	16.8	178.8	0	0	0	0	0	115.5	S713 K717 Y826 H827	S713-G715 PolarHBondContact O-N 3.1Å; G715-K717 PolarHBondContact O-N 2.79Å; G715-Y826 CarbonylContact O-C 3.37Å; G715-Y826 WeakPolarHBondContact O-CA 3.26Å; G715-H827 PolarHBondContact O-CD2 3.24Å; G715-H827 PolarHBondContact O-N 3.06Å
716	L	89.9	Confident	75.1	Confident	17 Å²	17	68.9 Å²	68.9	9%	0.089	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-64.5	127.4	168.4	-170.8	67.9	0	0	0	110.3	S713 R718 C727 P729 W825 Y826	S713-L716 WeakPolarHBondContact O-CB 3.34Å; S713-L716 PolarHBondContact O-N 3.44Å; L716-R718 PolarHBondContact O-N 2.87Å; L716-C727 HydrophobicContact CD2-CB 4.49Å; L716-C727 WeakPolarHBondContact CD2-O 3.21Å; L716-P729 HydrophobicContact CD2-CG 4.24Å; L716-W825 HydrophobicContact CD1-CB 4.41Å; L716-W825 HydrophobicContact CD1-CE3 4.23Å; L716-Y826 HydrophobicContact CB-CD1 4.42Å; L716-Y826 HydrophobicContact CB-CE1 4.06Å; L716-Y826 HydrophobicContact CD1-CD1 4.45Å; L716-Y826 HydrophobicContact CD1-CE1 3.93Å; L716-Y826 HydrophobicContact CD1-CE2 4.07Å
717	K	88.1	Confident	74.2	Confident	67 Å²	67	64.5 Å²	64.5	29%	0.291	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-75.4	122.4	-179.3	-64.4	-176.7	-161.7	164.5	0	110.4	G715 C727 S823 K824 W825 Y826	G715-K717 PolarHBondContact O-N 2.79Å; K717-C727 PolarHBondContact O-SG 3.28Å; K717-S823 PolarHBondContact NZ-O 3.17Å; K717-K824 WeakPolarHBondContact CD-O 3.5Å; K717-K824 WeakPolarHBondContact CE-O 3.3Å; K717-K824 PolarHBondContact NZ-O 2.81Å; K717-W825 WeakPolarHBondContact CB-O 3.45Å; K717-W825 VanDerWaalsContact CG-O 3.32Å; K717-W825 WeakPolarHBondContact CG-O 3.46Å; K717-W825 PolarHBondContact N-O 3.47Å; K717-Y826 VanDerWaalsContact CE-C 3.42Å; K717-Y826 WeakPolarHBondContact CE-O 3.47Å
718	R	75	Confident	73.9	Confident	132 Å²	132	65.5 Å²	65.5	50%	0.498	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-100.6	124.4	173.8	-58.3	-173.6	-171.4	-174.4	-0.8	110.8	E552 L716 R720 D724	E552-R718 IonicContact OE1-CZ 3.12Å; E552-R718 IonicContact OE1-NH1 3.71Å; E552-R718 PolarHBondContact OE1-NH1 2.46Å; E552-R718 IonicContact OE1-NH2 2.81Å; L716-R718 PolarHBondContact O-N 2.87Å; R718-R720 PolarHBondContact O-N 2.95Å; R718-D724 WeakPolarHBondContact CD-OD1 3.32Å; R718-D724 IonicContact CZ-OD1 3.64Å; R718-D724 IonicContact NE-OD1 3.8Å; R718-D724 IonicContact NH1-OD1 2.74Å; R718-D724 PolarHBondContact NH1-OD1 2.92Å
719	P	61	Low	73.7	Confident	87 Å²	87	65.9 Å²	65.9	57%	0.565	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-63.4	128.2	174.4	-17.3	29.1	0	0	0	110.8	L721	P719-L721 PolarHBondContact O-N 3.13Å
720	R	53.6	Low	73.8	Confident	252 Å²	252	65.1 Å²	65.1	95%	0.951	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-6	-176.7	-66.1	-174.1	178.8	-175.5	-1.8	115.2	R718	R718-R720 PolarHBondContact O-N 2.95Å
721	L	53.9	Low	73.7	Confident	165 Å²	165	67.1 Å²	67.1	86%	0.864	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-12	-167.6	-113.2	99.3	0	0	0	115.8	P719	P719-L721 PolarHBondContact O-N 3.13Å
722	L	44.8	Very low	73.7	Confident	138 Å²	138	67.1 Å²	67.1	72%	0.723	37%	0.365	S	S	*	.	S	Bend	trans	-123.5	130	167.6	-85	84.6	0	0	0	105.2
723	G	41.1	Very low	73.8	Confident	59 Å²	59	66.9 Å²	66.9	61%	0.608	36%	0.364	S	S	*	.			trans	-48.9	166.2	179.8	0	0	0	0	0	113.2	T725	G723-T725 PolarHBondContact O-N 3.27Å; G723-T725 PolarHBondContact O-OG1 3.48Å
724	D	43.7	Very low	73.8	Confident	96 Å²	96	66.5 Å²	66.5	51%	0.513	36%	0.356	S	S	.	.	S	Bend	trans	-46.1	-5.3	-166.7	-90.3	-49.4	0	0	0	118.2	R718 G726	R718-D724 WeakPolarHBondContact CD-OD1 3.32Å; R718-D724 IonicContact CZ-OD1 3.64Å; R718-D724 IonicContact NE-OD1 3.8Å; R718-D724 IonicContact NH1-OD1 2.74Å; R718-D724 PolarHBondContact NH1-OD1 2.92Å; D724-G726 VanDerWaalsContact C-N 3.27Å; D724-G726 PolarHBondContact O-N 3.03Å; D724-G726 VanDerWaalsContact O-N 3.12Å
725	T	48	Very low	74	Confident	141 Å²	141	69 Å²	69	87%	0.865	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	16.3	-174.5	60.1	0	0	0	0	115.7	G723	G723-T725 PolarHBondContact O-N 3.27Å; G723-T725 PolarHBondContact O-OG1 3.48Å
726	G	54.5	Low	74.2	Confident	49 Å²	49	68.7 Å²	68.7	51%	0.505	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-11.5	-164.2	0	0	0	0	0	118.5	D724	D724-G726 VanDerWaalsContact C-N 3.27Å; D724-G726 PolarHBondContact O-N 3.03Å; D724-G726 VanDerWaalsContact O-N 3.12Å
727	C	72.8	Confident	74.2	Confident	24 Å²	24	68.1 Å²	68.1	16%	0.162	36%	0.362	C	S	.	.			trans	-135.9	101.7	-173.7	-164.9	0	0	0	0	110.9	L716 K717 W825	L716-C727 HydrophobicContact CD2-CB 4.49Å; L716-C727 WeakPolarHBondContact CD2-O 3.21Å; K717-C727 PolarHBondContact O-SG 3.28Å; C727-W825 VanDerWaalsContact SG-CZ3 3.56Å
728	H	88	Confident	74.1	Confident	23 Å²	23	67 Å²	67	11%	0.106	37%	0.365	C	S	.	.			trans	-116.9	146	178.7	-174.5	-87.5	0	0	0	109.7	W730 H731 M791 D792	H728-W730 WeakPolarHBondContact ND1-CB 3.33Å; H728-W730 PolarHBondContact ND1-N 2.96Å; H728-W730 PolarHBondContact O-N 2.82Å; H728-H731 PolarHBondContact O-N 2.92Å; H728-H731 VanDerWaalsContact O-N 3.12Å; H728-M791 HydrophobicContact CB-CE 3.38Å; H728-M791 HydrophobicContact CB-SD 3.68Å; H728-M791 VanDerWaalsContact CE1-C 3.48Å; H728-M791 WeakPolarHBondContact CE1-CB 3.41Å; H728-M791 VanDerWaalsContact ND1-CB 3.31Å; H728-M791 WeakPolarHBondContact ND1-CB 3.15Å; H728-D792 IonicContact CE1-OD1 3.86Å; H728-D792 IonicContact NE2-OD1 3.73Å; H728-D792 PolarHBondContact NE2-OD1 2.78Å
729	P	92.6	Very high	74.8	Confident	9 Å²	9	64.7 Å²	64.7	6%	0.058	36%	0.359	C	S	.	.	H	α-helix	trans	-51	-32.1	177.8	-32.1	37.7	0	0	0	115.5	F712 L716 H731 F732 I733	F712-P729 HydrophobicContact CB-CB 3.85Å; F712-P729 HydrophobicContact CB-CG 3.98Å; F712-P729 HydrophobicContact CD1-CB 4.18Å; F712-P729 HydrophobicContact CG-CB 4.43Å; L716-P729 HydrophobicContact CD2-CG 4.24Å; P729-H731 VanDerWaalsContact C-N 3.3Å; P729-H731 PolarHBondContact O-N 2.91Å; P729-F732 WeakPolarHBondContact O-CB 3.13Å; P729-F732 PolarHBondContact O-N 2.82Å; P729-F732 VanDerWaalsContact O-N 3.11Å; P729-I733 WeakPolarHBondContact O-CG1 3.3Å; P729-I733 PolarHBondContact O-N 2.8Å
730	W	94.5	Very high	75.8	Confident	1 Å²	1	64 Å²	64	0%	0.004	35%	0.348	C	S	.	.	H	α-helix	trans	-53.6	-42.5	177.7	-169.1	-99.4	0	0	0	113.3	H728 F732 I733 E734 I777 I780 N781 M791 K794 F795 L798	H728-W730 WeakPolarHBondContact ND1-CB 3.33Å; H728-W730 PolarHBondContact ND1-N 2.96Å; H728-W730 PolarHBondContact O-N 2.82Å; W730-F732 VanDerWaalsContact C-N 3.31Å; W730-F732 PolarHBondContact O-N 3.34Å; W730-I733 WeakPolarHBondContact O-CB 3.29Å; W730-I733 PolarHBondContact O-N 3.2Å; W730-I733 VanDerWaalsContact O-N 3.11Å; W730-E734 PolarHBondContact NE1-OE1 2.89Å; W730-E734 WeakPolarHBondContact O-CG 3.05Å; W730-E734 PolarHBondContact O-N 3.29Å; W730-I777 HydrophobicContact CZ2-CG2 4.24Å; W730-I780 HydrophobicContact CH2-CB 4.11Å; W730-I780 HydrophobicContact CH2-CD1 4.15Å; W730-I780 HydrophobicContact CH2-CG2 3.53Å; W730-I780 HydrophobicContact CZ2-CB 4.35Å; W730-I780 HydrophobicContact CZ2-CG2 3.75Å; W730-N781 WeakPolarHBondContact CZ2-OD1 3.39Å; W730-N781 PolarHBondContact NE1-OD1 2.87Å; W730-N781 VanDerWaalsContact NE1-OD1 3.1Å; W730-M791 HydrophobicContact CB-CB 3.97Å; W730-M791 HydrophobicContact CB-CG 4.25Å; W730-M791 HydrophobicContact CB-SD 4.14Å; W730-M791 HydrophobicContact CG-CB 4.38Å; W730-M791 HydrophobicContact CG-CG 4.44Å; W730-K794 HydrophobicContact CD2-CB 3.67Å; W730-K794 HydrophobicContact CD2-CD 4.08Å; W730-K794 VanDerWaalsContact CE2-CD 3.49Å; W730-K794 HydrophobicContact CE3-CB 3.64Å; W730-K794 HydrophobicContact CG-CB 4.49Å; W730-K794 HydrophobicContact CG-CD 4.41Å; W730-K794 HydrophobicContact CH2-CB 3.69Å; W730-K794 HydrophobicContact CZ2-CB 3.7Å; W730-K794 HydrophobicContact CZ2-CD 3.81Å; W730-K794 HydrophobicContact CZ2-CG 4.32Å; W730-K794 HydrophobicContact CZ3-CB 3.66Å; W730-K794 WeakPolarHBondContact CZ3-O 3.39Å; W730-F795 HydrophobicContact CE3-CB 4.27Å; W730-L798 HydrophobicContact CH2-CB 4.33Å; W730-L798 HydrophobicContact CZ3-CB 3.93Å; W730-L798 HydrophobicContact CZ3-CD2 4.1Å
731	H	92.1	Very high	77.1	Confident	68 Å²	68	52.2 Å²	52.2	32%	0.315	30%	0.304	S	S	.	.	H	α-helix	trans	-66	-34.6	179.4	-66.7	-44.8	0	0	0	113	H728 P729 E734 E735 W825	H728-H731 PolarHBondContact O-N 2.92Å; H728-H731 VanDerWaalsContact O-N 3.12Å; P729-H731 VanDerWaalsContact C-N 3.3Å; P729-H731 PolarHBondContact O-N 2.91Å; H731-E734 IonicContact ND1-OE2 3.38Å; H731-E734 PolarHBondContact ND1-OE2 3.12Å; H731-E735 WeakPolarHBondContact O-CB 3.29Å; H731-E735 PolarHBondContact O-N 3.21Å; H731-E735 VanDerWaalsContact O-N 3.15Å; H731-W825 HydrophobicContact CB-CH2 3.32Å; H731-W825 HydrophobicContact CB-CZ2 3.9Å; H731-W825 HydrophobicContact CB-CZ3 3.88Å
732	F	93.7	Very high	78.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-45.1	171.4	155.9	-102.6	0	0	0	110.9	F712 P729 W730 E734 E735 A736 L815 V821 V822 W825 Y826 L832	F712-F732 HydrophobicContact CD1-CD1 4.34Å; F712-F732 HydrophobicContact CD1-CE1 4.39Å; F712-F732 HydrophobicContact CE1-CD1 4.25Å; F712-F732 AromaticContact CE1-CE1 3.98Å; F712-F732 HydrophobicContact CE1-CE1 3.98Å; P729-F732 WeakPolarHBondContact O-CB 3.13Å; P729-F732 PolarHBondContact O-N 2.82Å; P729-F732 VanDerWaalsContact O-N 3.11Å; W730-F732 VanDerWaalsContact C-N 3.31Å; W730-F732 PolarHBondContact O-N 3.34Å; F732-E734 PolarHBondContact O-N 3.23Å; F732-E735 PolarHBondContact O-N 3.18Å; F732-A736 HydrophobicContact CD2-CB 4.47Å; F732-A736 HydrophobicContact CE2-CB 4.02Å; F732-A736 HydrophobicContact CZ-CB 4.18Å; F732-A736 VanDerWaalsContact O-CB 3.27Å; F732-A736 WeakPolarHBondContact O-CB 3.35Å; F732-A736 PolarHBondContact O-N 3.26Å; F732-L815 HydrophobicContact CE1-CB 4.22Å; F732-L815 HydrophobicContact CZ-CB 4.21Å; F732-L815 WeakPolarHBondContact CZ-O 3.04Å; F732-V821 HydrophobicContact CD2-CG1 3.92Å; F732-V821 HydrophobicContact CE2-CG1 4.06Å; F732-V822 HydrophobicContact CE2-CB 4.42Å; F732-V822 HydrophobicContact CE2-CG2 3.73Å; F732-V822 HydrophobicContact CZ-CG2 3.9Å; F732-W825 HydrophobicContact CB-CB 4.12Å; F732-W825 HydrophobicContact CB-CD2 3.86Å; F732-W825 HydrophobicContact CB-CE3 4.27Å; F732-W825 HydrophobicContact CB-CG 3.78Å; F732-W825 HydrophobicContact CD2-CB 3.93Å; F732-W825 AromaticContact CD2-CD1 3.76Å; F732-W825 AromaticContact CD2-CG 3.91Å; F732-W825 HydrophobicContact CD2-CG 3.91Å; F732-W825 HydrophobicContact CG-CB 4.34Å; F732-W825 HydrophobicContact CG-CG 4.3Å; F732-Y826 HydrophobicContact CB-CE2 4.18Å; F732-Y826 AromaticContact CD1-CE2 3.71Å; F732-Y826 HydrophobicContact CD1-CE2 3.71Å; F732-Y826 HydrophobicContact CD2-CD2 4.3Å; F732-Y826 AromaticContact CD2-CE2 3.77Å; F732-Y826 HydrophobicContact CD2-CE2 3.77Å; F732-Y826 HydrophobicContact CE1-CE2 4.02Å; F732-Y826 HydrophobicContact CE2-CD2 4.43Å; F732-Y826 HydrophobicContact CE2-CE2 4.07Å; F732-Y826 AromaticContact CG-CE2 3.59Å; F732-Y826 HydrophobicContact CG-CE2 3.59Å; F732-Y826 HydrophobicContact CZ-CE2 4.18Å; F732-L832 HydrophobicContact CD1-CD2 4.13Å; F732-L832 HydrophobicContact CE1-CD2 3.34Å; F732-L832 HydrophobicContact CZ-CD2 3.68Å
733	I	94.8	Very high	79.5	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-46.1	-179.2	-68.8	167	0	0	0	110.8	F712 P729 W730 A736 A737 I777 F795 L798 L815	F712-I733 HydrophobicContact CD1-CD1 4.14Å; F712-I733 HydrophobicContact CD1-CG1 4.35Å; F712-I733 HydrophobicContact CE1-CD1 3.83Å; F712-I733 HydrophobicContact CE1-CG1 3.84Å; P729-I733 WeakPolarHBondContact O-CG1 3.3Å; P729-I733 PolarHBondContact O-N 2.8Å; W730-I733 WeakPolarHBondContact O-CB 3.29Å; W730-I733 PolarHBondContact O-N 3.2Å; W730-I733 VanDerWaalsContact O-N 3.11Å; I733-A736 PolarHBondContact O-N 3.29Å; I733-A737 WeakPolarHBondContact O-CB 3.45Å; I733-A737 PolarHBondContact O-N 3.01Å; I733-I777 HydrophobicContact CG2-CD1 3.63Å; I733-I777 HydrophobicContact CG2-CG1 4.25Å; I733-F795 HydrophobicContact CD1-CD2 3.61Å; I733-F795 HydrophobicContact CD1-CE2 3.78Å; I733-L798 HydrophobicContact CD1-CD2 4.23Å; I733-L798 HydrophobicContact CG2-CD2 3.64Å; I733-L815 HydrophobicContact CB-CD2 4.46Å; I733-L815 HydrophobicContact CG1-CD1 4.23Å; I733-L815 HydrophobicContact CG1-CD2 4.46Å; I733-L815 HydrophobicContact CG2-CD2 4.27Å
734	E	92.5	Very high	80.9	Confident	54 Å²	54	56.2 Å²	56.2	25%	0.252	29%	0.292	S	S	.	.	H	α-helix	trans	-59.4	-47.2	176.3	-70.9	178.2	131.2	0	0	112	W730 H731 F732 A738 I777 N781	W730-E734 PolarHBondContact NE1-OE1 2.89Å; W730-E734 WeakPolarHBondContact O-CG 3.05Å; W730-E734 PolarHBondContact O-N 3.29Å; H731-E734 IonicContact ND1-OE2 3.38Å; H731-E734 PolarHBondContact ND1-OE2 3.12Å; F732-E734 PolarHBondContact O-N 3.23Å; E734-A738 VanDerWaalsContact O-CB 3.3Å; E734-A738 WeakPolarHBondContact O-CB 3.21Å; E734-A738 PolarHBondContact O-N 2.86Å; E734-I777 HydrophobicContact CG-CG2 4.12Å; E734-N781 PolarHBondContact OE1-ND2 3.12Å; E734-N781 PolarHBondContact OE1-OD1 3.46Å
735	E	91.6	Very high	82.3	Confident	61 Å²	61	56 Å²	56	29%	0.285	29%	0.287	S	S	.	.	H	α-helix	trans	-67.6	-41.4	-180	-174.4	174.5	170.3	0	0	112.1	H731 F732 K739 V821 K824 W825	H731-E735 WeakPolarHBondContact O-CB 3.29Å; H731-E735 PolarHBondContact O-N 3.21Å; H731-E735 VanDerWaalsContact O-N 3.15Å; F732-E735 PolarHBondContact O-N 3.18Å; E735-K739 VanDerWaalsContact O-CB 3.31Å; E735-K739 WeakPolarHBondContact O-CB 3.26Å; E735-K739 PolarHBondContact O-N 3.19Å; E735-V821 HydrophobicContact CB-CG1 4.03Å; E735-V821 HydrophobicContact CG-CG1 3.78Å; E735-V821 HydrophobicContact CG-CG2 4.27Å; E735-K824 WeakPolarHBondContact OE1-CD 3.32Å; E735-K824 IonicContact OE1-NZ 3Å; E735-K824 PolarHBondContact OE1-NZ 3.35Å; E735-K824 IonicContact OE2-NZ 3.15Å; E735-K824 PolarHBondContact OE2-NZ 3.13Å; E735-W825 WeakPolarHBondContact OE2-CZ2 3.47Å; E735-W825 PolarHBondContact OE2-NE1 3.32Å
736	A	92.1	Very high	83.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-48.6	179.7	0	0	0	0	0	110.8	F732 I733 A738 K739 E740 L815 V821	F732-A736 HydrophobicContact CD2-CB 4.47Å; F732-A736 HydrophobicContact CE2-CB 4.02Å; F732-A736 HydrophobicContact CZ-CB 4.18Å; F732-A736 VanDerWaalsContact O-CB 3.27Å; F732-A736 WeakPolarHBondContact O-CB 3.35Å; F732-A736 PolarHBondContact O-N 3.26Å; I733-A736 PolarHBondContact O-N 3.29Å; A736-A738 PolarHBondContact O-N 2.93Å; A736-K739 WeakPolarHBondContact O-CB 3.04Å; A736-K739 PolarHBondContact O-N 3.49Å; A736-K739 VanDerWaalsContact O-N 3.13Å; A736-E740 WeakPolarHBondContact O-CG 3.34Å; A736-E740 PolarHBondContact O-N 3.15Å; A736-L815 HydrophobicContact CB-CD2 3.65Å; A736-V821 HydrophobicContact CB-CG1 4.08Å
737	A	89.5	Confident	84.2	Confident	4 Å²	4	54.2 Å²	54.2	3%	0.033	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-41.1	178.7	0	0	0	0	0	112.7	I733 K739 E740 L773 I777	I733-A737 WeakPolarHBondContact O-CB 3.45Å; I733-A737 PolarHBondContact O-N 3.01Å; A737-K739 VanDerWaalsContact C-N 3.26Å; A737-K739 PolarHBondContact O-N 3.44Å; A737-E740 PolarHBondContact O-N 3.14Å; A737-L773 HydrophobicContact CB-CD2 4.23Å; A737-L773 HydrophobicContact CB-CG 4.17Å; A737-I777 HydrophobicContact CB-CD1 3.29Å
738	A	87.3	Confident	83.9	Confident	44 Å²	44	53.3 Å²	53.3	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-32.8	174.9	0	0	0	0	0	112.4	E734 A736 E742 Y774	E734-A738 VanDerWaalsContact O-CB 3.3Å; E734-A738 WeakPolarHBondContact O-CB 3.21Å; E734-A738 PolarHBondContact O-N 2.86Å; A736-A738 PolarHBondContact O-N 2.93Å; A738-E742 PolarHBondContact O-N 3.23Å; A738-Y774 HydrophobicContact CB-CE2 4.46Å
739	K	87.9	Confident	83	Confident	83 Å²	83	57.1 Å²	57.1	36%	0.361	28%	0.28	S	S	.	.	H	α-helix	trans	-69.9	-37.3	-179.6	-170	60.5	172.5	179.3	0	112.9	E735 A736 A737 V741 E742 V821	E735-K739 VanDerWaalsContact O-CB 3.31Å; E735-K739 WeakPolarHBondContact O-CB 3.26Å; E735-K739 PolarHBondContact O-N 3.19Å; A736-K739 WeakPolarHBondContact O-CB 3.04Å; A736-K739 PolarHBondContact O-N 3.49Å; A736-K739 VanDerWaalsContact O-N 3.13Å; A737-K739 VanDerWaalsContact C-N 3.26Å; A737-K739 PolarHBondContact O-N 3.44Å; K739-V741 VanDerWaalsContact C-N 3.35Å; K739-E742 VanDerWaalsContact CD-OE2 3.26Å; K739-E742 WeakPolarHBondContact CD-OE2 3.38Å; K739-E742 VanDerWaalsContact CE-OE2 3.31Å; K739-E742 WeakPolarHBondContact CE-OE2 2.85Å; K739-E742 IonicContact NZ-OE1 2.94Å; K739-E742 IonicContact NZ-OE2 3.72Å; K739-E742 PolarHBondContact NZ-OE2 2.82Å; K739-E742 WeakPolarHBondContact O-CB 3.12Å; K739-E742 PolarHBondContact O-N 3.16Å; K739-V821 HydrophobicContact CB-CG2 3.95Å; K739-V821 HydrophobicContact CG-CG2 3.89Å
740	E	82.6	Confident	82	Confident	72 Å²	72	59.7 Å²	59.7	34%	0.336	30%	0.298	S	S	.	.	H	α-helix	trans	-67.7	-35.3	-178.9	-65.4	-55.7	130.5	0	0	112	A736 A737 I814 S818	A736-E740 WeakPolarHBondContact O-CG 3.34Å; A736-E740 PolarHBondContact O-N 3.15Å; A737-E740 PolarHBondContact O-N 3.14Å; E740-I814 HydrophobicContact CB-CG2 4.38Å; E740-I814 HydrophobicContact CG-CG2 3.76Å; E740-S818 WeakPolarHBondContact OE1-CB 3.46Å; E740-S818 PolarHBondContact OE1-OG 3.28Å
741	V	80.1	Confident	80.8	Confident	6 Å²	6	63.4 Å²	63.4	4%	0.036	31%	0.313	C	S	.	.	S	Bend	trans	-89.1	-3.6	176.9	-59.3	0	0	0	0	114.1	K739 R743 D744 F745 V748 Y774	K739-V741 VanDerWaalsContact C-N 3.35Å; V741-R743 VanDerWaalsContact C-N 3.31Å; V741-R743 PolarHBondContact O-N 3.02Å; V741-D744 CarbonylContact O-C 3.58Å; V741-D744 PolarHBondContact O-N 3.15Å; V741-F745 HydrophobicContact CG2-CD2 4.29Å; V741-F745 WeakPolarHBondContact O-CA 3.41Å; V741-F745 PolarHBondContact O-N 2.97Å; V741-V748 HydrophobicContact CB-CG1 4.22Å; V741-V748 HydrophobicContact CB-CG2 4.35Å; V741-V748 HydrophobicContact CG1-CG1 4.09Å; V741-V748 HydrophobicContact CG1-CG2 4.48Å; V741-Y774 HydrophobicContact CG1-CD2 4.45Å; V741-Y774 HydrophobicContact CG1-CG 4.19Å; V741-Y774 HydrophobicContact CG2-CD1 4.46Å; V741-Y774 HydrophobicContact CG2-CD2 3.45Å; V741-Y774 VanDerWaalsContact CG2-CD2 3.45Å; V741-Y774 HydrophobicContact CG2-CE2 3.71Å; V741-Y774 HydrophobicContact CG2-CG 3.88Å
742	E	79.7	Confident	79.7	Confident	109 Å²	109	61.3 Å²	61.3	51%	0.509	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-61.9	-36.3	-171.5	-170.7	-173.2	-151.9	0	0	112.9	A738 K739 D744	A738-E742 PolarHBondContact O-N 3.23Å; K739-E742 VanDerWaalsContact CD-OE2 3.26Å; K739-E742 WeakPolarHBondContact CD-OE2 3.38Å; K739-E742 VanDerWaalsContact CE-OE2 3.31Å; K739-E742 WeakPolarHBondContact CE-OE2 2.85Å; K739-E742 IonicContact NZ-OE1 2.94Å; K739-E742 IonicContact NZ-OE2 3.72Å; K739-E742 PolarHBondContact NZ-OE2 2.82Å; K739-E742 WeakPolarHBondContact O-CB 3.12Å; K739-E742 PolarHBondContact O-N 3.16Å; E742-D744 VanDerWaalsContact C-N 3.27Å; E742-D744 PolarHBondContact O-N 3.32Å
743	R	70.4	Confident	78.5	Confident	232 Å²	232	63.5 Å²	63.5	88%	0.875	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-63.9	-35.4	-177.6	-69.5	-173.9	178.6	-174.3	2.8	112.6	V741	V741-R743 VanDerWaalsContact C-N 3.31Å; V741-R743 PolarHBondContact O-N 3.02Å
744	D	70.3	Confident	77	Confident	104 Å²	104	65.6 Å²	65.6	56%	0.556	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-119.2	25.7	-175.3	-63.9	-55.3	0	0	0	111.2	V741 E742 S746 S747 V748	V741-D744 CarbonylContact O-C 3.58Å; V741-D744 PolarHBondContact O-N 3.15Å; E742-D744 VanDerWaalsContact C-N 3.27Å; E742-D744 PolarHBondContact O-N 3.32Å; D744-S746 VanDerWaalsContact C-N 3.3Å; D744-S746 PolarHBondContact O-N 2.92Å; D744-S746 VanDerWaalsContact O-N 3.16Å; D744-S747 CarbonylContact O-C 3.47Å; D744-S747 WeakPolarHBondContact O-CA 3.49Å; D744-S747 WeakPolarHBondContact O-CB 3.21Å; D744-S747 PolarHBondContact O-N 3.24Å; D744-V748 HydrophobicContact CB-CG2 4.13Å; D744-V748 WeakPolarHBondContact O-CG2 3.45Å; D744-V748 PolarHBondContact O-N 3.11Å
745	F	74.2	Confident	75.7	Confident	93 Å²	93	63.4 Å²	63.4	41%	0.408	32%	0.319	S	S	.	.	H	α-helix	trans	-52.5	-46.3	-168.5	-173.4	-90.2	0	0	0	112.8	V741 S747 Y749 Y774	V741-F745 HydrophobicContact CG2-CD2 4.29Å; V741-F745 WeakPolarHBondContact O-CA 3.41Å; V741-F745 PolarHBondContact O-N 2.97Å; F745-S747 VanDerWaalsContact C-N 3.32Å; F745-S747 PolarHBondContact O-N 3.25Å; F745-Y749 WeakPolarHBondContact O-CB 3.48Å; F745-Y749 PolarHBondContact O-N 2.96Å; F745-Y774 HydrophobicContact CE2-CE2 4.47Å; F745-Y774 AromaticContact CE2-CZ 3.95Å; F745-Y774 VanDerWaalsContact CE2-OH 3.32Å; F745-Y774 WeakPolarHBondContact CE2-OH 3.34Å
746	S	69.3	Low	74.2	Confident	92 Å²	92	66.1 Å²	66.1	64%	0.643	33%	0.329	S	S	*	.	H	α-helix	trans	-63.2	-38.3	177.9	-56.7	0	0	0	0	112.5	D744 S750	D744-S746 VanDerWaalsContact C-N 3.3Å; D744-S746 PolarHBondContact O-N 2.92Å; D744-S746 VanDerWaalsContact O-N 3.16Å; S746-S750 WeakPolarHBondContact O-CB 3.36Å; S746-S750 PolarHBondContact O-N 3.12Å; S746-S750 PolarHBondContact O-OG 3.5Å
747	S	71.4	Confident	72.8	Confident	59 Å²	59	70.6 Å²	70.6	41%	0.413	36%	0.357	S	S	.	.	H	α-helix	trans	-71.8	-47.7	179	-179.3	0	0	0	0	111	D744 F745 S750 R751	D744-S747 CarbonylContact O-C 3.47Å; D744-S747 WeakPolarHBondContact O-CA 3.49Å; D744-S747 WeakPolarHBondContact O-CB 3.21Å; D744-S747 PolarHBondContact O-N 3.24Å; F745-S747 VanDerWaalsContact C-N 3.32Å; F745-S747 PolarHBondContact O-N 3.25Å; S747-S750 PolarHBondContact O-N 2.94Å; S747-R751 WeakPolarHBondContact O-CB 3.27Å; S747-R751 PolarHBondContact O-N 3.26Å; S747-R751 PolarHBondContact OG-NH2 3.14Å
748	V	67.1	Low	71.3	Confident	6 Å²	6	76.6 Å²	76.6	4%	0.036	38%	0.382	C	S	.	.	H	α-helix	trans	-60.7	-49.7	176.1	171.8	0	0	0	0	110.6	V741 D744 S750 R751 L752 E771	V741-V748 HydrophobicContact CB-CG1 4.22Å; V741-V748 HydrophobicContact CB-CG2 4.35Å; V741-V748 HydrophobicContact CG1-CG1 4.09Å; V741-V748 HydrophobicContact CG1-CG2 4.48Å; D744-V748 HydrophobicContact CB-CG2 4.13Å; D744-V748 WeakPolarHBondContact O-CG2 3.45Å; D744-V748 PolarHBondContact O-N 3.11Å; V748-S750 PolarHBondContact O-N 3.1Å; V748-R751 PolarHBondContact O-N 3.01Å; V748-L752 HydrophobicContact CG1-CD1 3.81Å; V748-L752 HydrophobicContact CG1-CG 4.26Å; V748-L752 WeakPolarHBondContact O-CB 3.35Å; V748-L752 VanDerWaalsContact O-CG 3.27Å; V748-L752 WeakPolarHBondContact O-CG 3.39Å; V748-L752 PolarHBondContact O-N 3.32Å; V748-E771 HydrophobicContact CG1-CG 4.01Å; V748-E771 HydrophobicContact CG2-CG 4.23Å
749	Y	70.4	Confident	69.9	Low	102 Å²	102	81.7 Å²	81.7	40%	0.4	39%	0.392	S	S	.	.	H	α-helix	trans	-59.8	-47.3	177.8	-175.6	-93.1	0	0	0	111.3	F745 R751 L752 V753	F745-Y749 WeakPolarHBondContact O-CB 3.48Å; F745-Y749 PolarHBondContact O-N 2.96Å; Y749-R751 VanDerWaalsContact C-N 3.3Å; Y749-R751 PolarHBondContact O-N 2.7Å; Y749-L752 PolarHBondContact O-N 2.73Å; Y749-V753 HydrophobicContact CD1-CG2 4Å; Y749-V753 HydrophobicContact CE1-CG2 3.64Å; Y749-V753 HydrophobicContact CE2-CG2 4.45Å; Y749-V753 WeakPolarHBondContact O-CB 3.49Å; Y749-V753 VanDerWaalsContact O-CG2 3.29Å; Y749-V753 WeakPolarHBondContact O-CG2 3.31Å; Y749-V753 PolarHBondContact O-N 2.91Å
750	S	71.1	Confident	68.4	Low	63 Å²	63	80 Å²	80	44%	0.441	39%	0.387	S	S	.	.	H	α-helix	trans	-59.2	-43.3	176	-59.8	0	0	0	0	111.2	S746 S747 V748 V753 L754	S746-S750 WeakPolarHBondContact O-CB 3.36Å; S746-S750 PolarHBondContact O-N 3.12Å; S746-S750 PolarHBondContact O-OG 3.5Å; S747-S750 PolarHBondContact O-N 2.94Å; V748-S750 PolarHBondContact O-N 3.1Å; S750-V753 PolarHBondContact O-N 3.04Å; S750-L754 WeakPolarHBondContact O-CB 3.44Å; S750-L754 WeakPolarHBondContact O-CG 3.47Å; S750-L754 PolarHBondContact O-N 2.95Å
751	R	68.3	Low	67	Low	80 Å²	80	81 Å²	81	30%	0.302	39%	0.394	S	S	.	.	H	α-helix	trans	-66.1	-41.5	178.4	-158.6	177.8	-37.6	97.6	2.9	112.1	S747 V748 Y749 L754 C755 L767 E771	S747-R751 WeakPolarHBondContact O-CB 3.27Å; S747-R751 PolarHBondContact O-N 3.26Å; S747-R751 PolarHBondContact OG-NH2 3.14Å; V748-R751 PolarHBondContact O-N 3.01Å; Y749-R751 VanDerWaalsContact C-N 3.3Å; Y749-R751 PolarHBondContact O-N 2.7Å; R751-L754 PolarHBondContact O-N 3.25Å; R751-C755 VanDerWaalsContact O-CB 3.25Å; R751-C755 WeakPolarHBondContact O-CB 3.26Å; R751-C755 PolarHBondContact O-N 3.16Å; R751-C755 PolarHBondContact O-SG 2.95Å; R751-L767 HydrophobicContact CG-CD2 4.4Å; R751-E771 IonicContact CZ-OE1 3.82Å; R751-E771 IonicContact NH1-OE1 3Å; R751-E771 PolarHBondContact NH1-OE1 3.48Å; R751-E771 IonicContact NH1-OE2 2.96Å; R751-E771 PolarHBondContact NH1-OE2 2.96Å; R751-E771 IonicContact NH2-OE1 3.59Å
752	L	68.5	Low	65.6	Low	23 Å²	23	85.1 Å²	85.1	12%	0.12	41%	0.413	C	S	.	.	H	α-helix	trans	-64	-41	175.6	-71	173.8	0	0	0	111.9	V748 Y749 K756 L767 Y774 R775	V748-L752 HydrophobicContact CG1-CD1 3.81Å; V748-L752 HydrophobicContact CG1-CG 4.26Å; V748-L752 WeakPolarHBondContact O-CB 3.35Å; V748-L752 VanDerWaalsContact O-CG 3.27Å; V748-L752 WeakPolarHBondContact O-CG 3.39Å; V748-L752 PolarHBondContact O-N 3.32Å; Y749-L752 PolarHBondContact O-N 2.73Å; L752-K756 WeakPolarHBondContact O-CB 3.28Å; L752-K756 PolarHBondContact O-N 3.24Å; L752-L767 HydrophobicContact CD2-CD1 3.88Å; L752-L767 HydrophobicContact CD2-CD2 4.09Å; L752-Y774 HydrophobicContact CD1-CD1 3.69Å; L752-Y774 HydrophobicContact CD1-CE1 4.13Å; L752-R775 HydrophobicContact CD2-CB 3.9Å; L752-R775 HydrophobicContact CD2-CG 4.2Å
753	V	68.7	Low	64	Low	46 Å²	46	86.1 Å²	86.1	28%	0.279	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-44.9	174.4	171.3	0	0	0	0	110.6	Y749 S750 K756 T757	Y749-V753 HydrophobicContact CD1-CG2 4Å; Y749-V753 HydrophobicContact CE1-CG2 3.64Å; Y749-V753 HydrophobicContact CE2-CG2 4.45Å; Y749-V753 WeakPolarHBondContact O-CB 3.49Å; Y749-V753 VanDerWaalsContact O-CG2 3.29Å; Y749-V753 WeakPolarHBondContact O-CG2 3.31Å; Y749-V753 PolarHBondContact O-N 2.91Å; S750-V753 PolarHBondContact O-N 3.04Å; V753-K756 PolarHBondContact O-N 3.48Å; V753-T757 VanDerWaalsContact O-CB 3.25Å; V753-T757 WeakPolarHBondContact O-CB 3.5Å; V753-T757 PolarHBondContact O-N 2.78Å; V753-T757 PolarHBondContact O-OG1 3.48Å
754	L	64.9	Low	62.9	Low	44 Å²	44	78.8 Å²	78.8	23%	0.23	40%	0.401	C	S	.	.	H	α-helix	trans	-64.3	-46.2	177.3	-72.7	172.4	0	0	0	111.3	S750 R751 K756 T757 F758 L760 Y968	S750-L754 WeakPolarHBondContact O-CB 3.44Å; S750-L754 WeakPolarHBondContact O-CG 3.47Å; S750-L754 PolarHBondContact O-N 2.95Å; R751-L754 PolarHBondContact O-N 3.25Å; L754-K756 VanDerWaalsContact C-N 3.29Å; L754-K756 PolarHBondContact O-N 3.29Å; L754-T757 PolarHBondContact O-N 2.88Å; L754-F758 HydrophobicContact CD2-CD2 3.82Å; L754-F758 HydrophobicContact CD2-CE2 3.57Å; L754-F758 WeakPolarHBondContact O-CB 3.44Å; L754-F758 PolarHBondContact O-N 3.03Å; L754-L760 HydrophobicContact CB-CD1 3.87Å; L754-Y968 HydrophobicContact CD1-CE2 4.32Å
755	C	64	Low	62	Low	9 Å²	9	81.4 Å²	81.4	6%	0.061	41%	0.408	C	S	.	.	H	α-helix	trans	-55.8	-45.1	174.2	-74.3	0	0	0	0	110.8	R751 R759 L760	R751-C755 VanDerWaalsContact O-CB 3.25Å; R751-C755 WeakPolarHBondContact O-CB 3.26Å; R751-C755 PolarHBondContact O-N 3.16Å; R751-C755 PolarHBondContact O-SG 2.95Å; C755-R759 CarbonylContact O-C 3.6Å; C755-R759 WeakPolarHBondContact O-CA 3.28Å; C755-R759 PolarHBondContact O-N 2.97Å; C755-L760 PolarHBondContact O-N 2.91Å
756	K	61.5	Low	61.4	Low	118 Å²	118	79.5 Å²	79.5	51%	0.513	40%	0.404	S	S	.	.	H	α-helix	trans	-70	-42.5	178.1	-171.6	172.7	-173.1	169.9	0	113.4	L752 V753 L754 M927 N928	L752-K756 WeakPolarHBondContact O-CB 3.28Å; L752-K756 PolarHBondContact O-N 3.24Å; V753-K756 PolarHBondContact O-N 3.48Å; L754-K756 VanDerWaalsContact C-N 3.29Å; L754-K756 PolarHBondContact O-N 3.29Å; K756-M927 WeakPolarHBondContact CE-O 3.49Å; K756-M927 PolarHBondContact NZ-O 3.26Å; K756-N928 PolarHBondContact NZ-OD1 3.1Å
757	T	61	Low	61.5	Low	93 Å²	93	75.7 Å²	75.7	57%	0.571	38%	0.376	S	S	*	.	H	α-helix	trans	-70.7	-42.7	-174.6	-55.3	0	0	0	0	112	V753 L754	V753-T757 VanDerWaalsContact O-CB 3.25Å; V753-T757 WeakPolarHBondContact O-CB 3.5Å; V753-T757 PolarHBondContact O-N 2.78Å; V753-T757 PolarHBondContact O-OG1 3.48Å; L754-T757 PolarHBondContact O-N 2.88Å
758	F	59.5	Low	61.9	Low	131 Å²	131	74.5 Å²	74.5	58%	0.575	37%	0.368	S	S	*	.	H	α-helix	trans	-105.1	6.8	-176.4	-63.9	-78.1	0	0	0	112.8	L754 L760	L754-F758 HydrophobicContact CD2-CD2 3.82Å; L754-F758 HydrophobicContact CD2-CE2 3.57Å; L754-F758 WeakPolarHBondContact O-CB 3.44Å; L754-F758 PolarHBondContact O-N 3.03Å; F758-L760 HydrophobicContact CB-CD1 4.37Å; F758-L760 HydrophobicContact CB-CD2 3.62Å; F758-L760 HydrophobicContact CB-CG 3.73Å; F758-L760 PolarHBondContact O-N 3.19Å
759	R	57.8	Low	62.9	Low	151 Å²	151	74.6 Å²	74.6	57%	0.57	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	40.5	-174.2	-47.1	-168.4	-175.1	164.3	-3.1	112.4	C755 D761 E762	C755-R759 CarbonylContact O-C 3.6Å; C755-R759 WeakPolarHBondContact O-CA 3.28Å; C755-R759 PolarHBondContact O-N 2.97Å; R759-D761 VanDerWaalsContact CA-OD1 3.31Å; R759-D761 WeakPolarHBondContact CA-OD1 3.26Å; R759-D761 PolarHBondContact O-N 2.94Å; R759-D761 VanDerWaalsContact O-N 3.13Å; R759-E762 HydrophobicContact CB-CB 4.5Å; R759-E762 HydrophobicContact CB-CG 3.74Å; R759-E762 WeakPolarHBondContact CB-OE2 3.44Å; R759-E762 WeakPolarHBondContact CD-OE1 3.47Å; R759-E762 IonicContact NH1-OE1 3.7Å; R759-E762 WeakPolarHBondContact O-CA 3.24Å; R759-E762 WeakPolarHBondContact O-CB 3.38Å; R759-E762 VanDerWaalsContact O-CG 3.24Å; R759-E762 WeakPolarHBondContact O-CG 3.33Å; R759-E762 PolarHBondContact O-N 2.91Å
760	L	56	Low	63.7	Low	48 Å²	48	73.1 Å²	73.1	25%	0.251	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-68.2	-12.4	-176.6	-52.2	172.5	0	0	0	112.8	L754 C755 F758 E762 E763	L754-L760 HydrophobicContact CB-CD1 3.87Å; C755-L760 PolarHBondContact O-N 2.91Å; F758-L760 HydrophobicContact CB-CD1 4.37Å; F758-L760 HydrophobicContact CB-CD2 3.62Å; F758-L760 HydrophobicContact CB-CG 3.73Å; F758-L760 PolarHBondContact O-N 3.19Å; L760-E762 PolarHBondContact O-N 2.74Å; L760-E763 PolarHBondContact O-N 3.39Å; L760-E763 VanDerWaalsContact O-N 3.15Å
761	D	52.7	Low	64.4	Low	92 Å²	92	71.3 Å²	71.3	49%	0.492	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-63.7	-19.4	164.7	53.4	-24.8	0	0	0	112.6	R759 E763	R759-D761 VanDerWaalsContact CA-OD1 3.31Å; R759-D761 WeakPolarHBondContact CA-OD1 3.26Å; R759-D761 PolarHBondContact O-N 2.94Å; R759-D761 VanDerWaalsContact O-N 3.13Å; D761-E763 VanDerWaalsContact C-N 3.34Å
762	E	50.1	Low	65.2	Low	92 Å²	92	67.6 Å²	67.6	43%	0.43	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-75	-17.6	170.6	-56.1	177	166.1	0	0	112.7	R759 L760	R759-E762 HydrophobicContact CB-CB 4.5Å; R759-E762 HydrophobicContact CB-CG 3.74Å; R759-E762 WeakPolarHBondContact CB-OE2 3.44Å; R759-E762 WeakPolarHBondContact CD-OE1 3.47Å; R759-E762 IonicContact NH1-OE1 3.7Å; R759-E762 WeakPolarHBondContact O-CA 3.24Å; R759-E762 WeakPolarHBondContact O-CB 3.38Å; R759-E762 VanDerWaalsContact O-CG 3.24Å; R759-E762 WeakPolarHBondContact O-CG 3.33Å; R759-E762 PolarHBondContact O-N 2.91Å; L760-E762 PolarHBondContact O-N 2.74Å
763	E	46.4	Very low	66.3	Low	130 Å²	130	66.5 Å²	66.5	61%	0.607	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-103.8	25	-174.8	-65.1	-168.3	157.6	0	0	115.1	L760 D761 K765	L760-E763 PolarHBondContact O-N 3.39Å; L760-E763 VanDerWaalsContact O-N 3.15Å; D761-E763 VanDerWaalsContact C-N 3.34Å; E763-K765 PolarHBondContact O-N 3.12Å
764	C	47.3	Very low	67.2	Low	78 Å²	78	66.2 Å²	66.2	53%	0.527	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	14.7	173	-66.4	0	0	0	0	116.9	V766	C764-V766 PolarHBondContact O-N 3.44Å
765	K	53	Low	68.2	Low	160 Å²	160	67 Å²	67	70%	0.696	32%	0.324	S	S	*	.			trans	-82.3	95.5	168	-76.4	178.5	-177.4	162.7	0	109.2	E763 L767	E763-K765 PolarHBondContact O-N 3.12Å; K765-L767 PolarHBondContact O-N 3.47Å; K765-L767 VanDerWaalsContact O-N 3.14Å
766	V	60.6	Low	69.4	Low	53 Å²	53	67 Å²	67	32%	0.321	32%	0.324	S	S	.	.			trans	-61.1	111.5	-171.4	-170.9	0	0	0	0	110.7	Y614 V618 C764 S768	Y614-V766 HydrophobicContact CE1-CG1 3.64Å; V618-V766 HydrophobicContact CB-CG2 4.26Å; V618-V766 HydrophobicContact CG1-CB 4.44Å; V618-V766 HydrophobicContact CG1-CG1 4.18Å; V618-V766 HydrophobicContact CG1-CG2 3.64Å; C764-V766 PolarHBondContact O-N 3.44Å; V766-S768 PolarHBondContact O-N 2.95Å
767	L	72.3	Confident	70.8	Confident	11 Å²	11	61.9 Å²	61.9	6%	0.058	30%	0.302	C	S	.	.			trans	-56.1	136	160.8	-71.6	174.2	0	0	0	108.3	R751 L752 K765 E771 V772	R751-L767 HydrophobicContact CG-CD2 4.4Å; L752-L767 HydrophobicContact CD2-CD1 3.88Å; L752-L767 HydrophobicContact CD2-CD2 4.09Å; K765-L767 PolarHBondContact O-N 3.47Å; K765-L767 VanDerWaalsContact O-N 3.14Å; L767-E771 WeakPolarHBondContact CA-OE2 3.45Å; L767-E771 HydrophobicContact CB-CB 4.11Å; L767-E771 HydrophobicContact CD2-CB 4.23Å; L767-E771 WeakPolarHBondContact CD2-OE2 3.35Å; L767-V772 HydrophobicContact CB-CG2 3.73Å
768	S	79.1	Confident	72.1	Confident	35 Å²	35	60.5 Å²	60.5	25%	0.245	29%	0.289	C	S	.	.			trans	-62.6	153.5	178.1	87.1	0	0	0	0	110.4	V766 E770 E771 V772	V766-S768 PolarHBondContact O-N 2.95Å; S768-E770 WeakPolarHBondContact CB-OE2 3.4Å; S768-E770 PolarHBondContact O-N 3.45Å; S768-E770 VanDerWaalsContact O-N 3.08Å; S768-E770 PolarHBondContact OG-OE2 2.93Å; S768-E771 PolarHBondContact N-OE2 3.32Å; S768-E771 VanDerWaalsContact N-OE2 3.08Å; S768-E771 WeakPolarHBondContact O-CA 3.23Å; S768-E771 WeakPolarHBondContact O-CB 3.27Å; S768-E771 PolarHBondContact O-N 3.4Å; S768-E771 WeakPolarHBondContact OG-CG 3.47Å; S768-E771 PolarHBondContact OG-N 3.19Å; S768-V772 WeakPolarHBondContact O-CG2 2.7Å; S768-V772 PolarHBondContact O-N 3.17Å
769	P	87.8	Confident	73.3	Confident	8 Å²	8	57.7 Å²	57.7	5%	0.052	29%	0.286	C	S	.	.	H	α-helix	trans	-51.3	-33.5	177.4	-30.5	38.1	0	0	0	114.3	L611 Y614 L773 L807 L810 W811 I814	L611-P769 HydrophobicContact CD1-CG 3.83Å; Y614-P769 HydrophobicContact CD1-CG 4.26Å; Y614-P769 HydrophobicContact CE1-CG 4.16Å; P769-L773 WeakPolarHBondContact O-CB 3.44Å; P769-L773 PolarHBondContact O-N 3.22Å; P769-L807 HydrophobicContact CB-CD1 4.33Å; P769-L807 HydrophobicContact CB-CD2 3.95Å; P769-L807 HydrophobicContact CG-CD2 3.98Å; P769-L810 HydrophobicContact CG-CD1 4.28Å; P769-W811 PolarHBondContact O-NE1 3.41Å; P769-I814 HydrophobicContact CB-CD1 3.86Å
770	E	87.9	Confident	74.9	Confident	70 Å²	70	50.7 Å²	50.7	33%	0.327	26%	0.26	S	S	.	.	H	α-helix	trans	-65.6	-41.8	174.5	-56.1	77.7	-174.5	0	0	112.2	S768 L773 Y774 I814	S768-E770 WeakPolarHBondContact CB-OE2 3.4Å; S768-E770 PolarHBondContact O-N 3.45Å; S768-E770 VanDerWaalsContact O-N 3.08Å; S768-E770 PolarHBondContact OG-OE2 2.93Å; E770-L773 PolarHBondContact O-N 2.81Å; E770-Y774 WeakPolarHBondContact O-CB 3.32Å; E770-Y774 PolarHBondContact O-N 2.81Å; E770-I814 HydrophobicContact CB-CD1 4.46Å; E770-I814 HydrophobicContact CG-CD1 3.81Å; E770-I814 HydrophobicContact CG-CG1 4.1Å; E770-I814 HydrophobicContact CG-CG2 4.18Å
771	E	84.2	Confident	76.6	Confident	25 Å²	25	49.5 Å²	49.5	12%	0.117	25%	0.253	C	S	.	.	H	α-helix	trans	-69.4	-40	178.7	-66.3	165.2	178.8	0	0	111.2	V748 R751 L767 S768 Y774 R775	V748-E771 HydrophobicContact CG1-CG 4.01Å; V748-E771 HydrophobicContact CG2-CG 4.23Å; R751-E771 IonicContact CZ-OE1 3.82Å; R751-E771 IonicContact NH1-OE1 3Å; R751-E771 PolarHBondContact NH1-OE1 3.48Å; R751-E771 IonicContact NH1-OE2 2.96Å; R751-E771 PolarHBondContact NH1-OE2 2.96Å; R751-E771 IonicContact NH2-OE1 3.59Å; L767-E771 WeakPolarHBondContact CA-OE2 3.45Å; L767-E771 HydrophobicContact CB-CB 4.11Å; L767-E771 HydrophobicContact CD2-CB 4.23Å; L767-E771 WeakPolarHBondContact CD2-OE2 3.35Å; S768-E771 PolarHBondContact N-OE2 3.32Å; S768-E771 VanDerWaalsContact N-OE2 3.08Å; S768-E771 WeakPolarHBondContact O-CA 3.23Å; S768-E771 WeakPolarHBondContact O-CB 3.27Å; S768-E771 PolarHBondContact O-N 3.4Å; S768-E771 WeakPolarHBondContact OG-CG 3.47Å; S768-E771 PolarHBondContact OG-N 3.19Å; E771-Y774 PolarHBondContact O-N 3.12Å; E771-R775 VanDerWaalsContact O-CB 3.26Å; E771-R775 WeakPolarHBondContact O-CB 3.36Å; E771-R775 PolarHBondContact O-N 3.05Å
772	V	86.3	Confident	78.1	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-42.5	173.8	-174.6	0	0	0	0	110.5	L767 S768 T776 E805 L807 W811	L767-V772 HydrophobicContact CB-CG2 3.73Å; S768-V772 WeakPolarHBondContact O-CG2 2.7Å; S768-V772 PolarHBondContact O-N 3.17Å; V772-T776 VanDerWaalsContact O-CB 3.3Å; V772-T776 WeakPolarHBondContact O-CB 3.35Å; V772-T776 PolarHBondContact O-N 3.04Å; V772-T776 PolarHBondContact O-OG1 3.38Å; V772-E805 HydrophobicContact CG1-CG 4.04Å; V772-E805 WeakPolarHBondContact CG1-OE1 3.18Å; V772-L807 HydrophobicContact CB-CD1 3.93Å; V772-L807 HydrophobicContact CG1-CD1 3.9Å; V772-L807 HydrophobicContact CG2-CD1 4.24Å; V772-W811 HydrophobicContact CB-CZ2 4.47Å; V772-W811 HydrophobicContact CG1-CZ2 3.8Å
773	L	91.2	Very high	79.7	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-59.9	-50.6	175.5	176.9	59.9	0	0	0	111.3	A737 P769 E770 R775 T776 I777 L798 W811 I814 L815	A737-L773 HydrophobicContact CB-CD2 4.23Å; A737-L773 HydrophobicContact CB-CG 4.17Å; P769-L773 WeakPolarHBondContact O-CB 3.44Å; P769-L773 PolarHBondContact O-N 3.22Å; E770-L773 PolarHBondContact O-N 2.81Å; L773-R775 PolarHBondContact O-N 2.94Å; L773-T776 PolarHBondContact O-N 3.46Å; L773-I777 HydrophobicContact CD1-CD1 3.72Å; L773-I777 HydrophobicContact CD1-CG1 4.26Å; L773-I777 HydrophobicContact CG-CD1 3.94Å; L773-I777 WeakPolarHBondContact O-CG1 3.47Å; L773-I777 PolarHBondContact O-N 3.45Å; L773-L798 HydrophobicContact CD1-CD1 4.02Å; L773-W811 HydrophobicContact CB-CD2 4.3Å; L773-W811 HydrophobicContact CB-CG 4.22Å; L773-W811 HydrophobicContact CD1-CB 4.23Å; L773-W811 HydrophobicContact CD1-CD2 3.73Å; L773-W811 HydrophobicContact CD1-CE3 3.9Å; L773-W811 HydrophobicContact CD1-CG 3.88Å; L773-W811 HydrophobicContact CD2-CB 4.48Å; L773-W811 HydrophobicContact CD2-CG 4.45Å; L773-W811 HydrophobicContact CG-CG 4.4Å; L773-I814 HydrophobicContact CD2-CB 4.35Å; L773-I814 HydrophobicContact CD2-CG2 3.87Å; L773-L815 HydrophobicContact CD2-CD2 4.32Å; L773-L815 HydrophobicContact CD2-CG 4.39Å
774	Y	87.6	Confident	81.8	Confident	40 Å²	40	39.6 Å²	39.6	16%	0.157	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-46.7	179.8	-179.2	-95.5	0	0	0	111.9	A738 V741 F745 L752 E770 E771 T776 I777 H778	A738-Y774 HydrophobicContact CB-CE2 4.46Å; V741-Y774 HydrophobicContact CG1-CD2 4.45Å; V741-Y774 HydrophobicContact CG1-CG 4.19Å; V741-Y774 HydrophobicContact CG2-CD1 4.46Å; V741-Y774 HydrophobicContact CG2-CD2 3.45Å; V741-Y774 VanDerWaalsContact CG2-CD2 3.45Å; V741-Y774 HydrophobicContact CG2-CE2 3.71Å; V741-Y774 HydrophobicContact CG2-CG 3.88Å; F745-Y774 HydrophobicContact CE2-CE2 4.47Å; F745-Y774 AromaticContact CE2-CZ 3.95Å; F745-Y774 VanDerWaalsContact CE2-OH 3.32Å; F745-Y774 WeakPolarHBondContact CE2-OH 3.34Å; L752-Y774 HydrophobicContact CD1-CD1 3.69Å; L752-Y774 HydrophobicContact CD1-CE1 4.13Å; E770-Y774 WeakPolarHBondContact O-CB 3.32Å; E770-Y774 PolarHBondContact O-N 2.81Å; E771-Y774 PolarHBondContact O-N 3.12Å; Y774-T776 VanDerWaalsContact C-N 3.33Å; Y774-T776 PolarHBondContact O-N 3.14Å; Y774-I777 PolarHBondContact O-N 3.1Å; Y774-H778 PolarHBondContact O-N 2.71Å
775	R	85.8	Confident	83.7	Confident	60 Å²	60	39.6 Å²	39.6	23%	0.226	20%	0.204	C	C	.	.	H	α-helix	trans	-57.5	-45.1	175.4	-179	-173.3	68.5	179.5	2	111.9	L752 E771 L773 H778 S779 E805	L752-R775 HydrophobicContact CD2-CB 3.9Å; L752-R775 HydrophobicContact CD2-CG 4.2Å; E771-R775 VanDerWaalsContact O-CB 3.26Å; E771-R775 WeakPolarHBondContact O-CB 3.36Å; E771-R775 PolarHBondContact O-N 3.05Å; L773-R775 PolarHBondContact O-N 2.94Å; R775-H778 PolarHBondContact O-N 3.35Å; R775-S779 PolarHBondContact O-N 3.41Å; R775-E805 IonicContact NH2-OE1 3.75Å; R775-E805 PolarHBondContact NH2-OE1 3.06Å
776	T	90.1	Very high	85.2	Confident	8 Å²	8	39.2 Å²	39.2	5%	0.049	21%	0.209	C	C	.	.	H	α-helix	trans	-65.1	-45.9	-177.7	-59.8	0	0	0	0	111.3	V772 L773 Y774 H778 S779 I780 L798 W811	V772-T776 VanDerWaalsContact O-CB 3.3Å; V772-T776 WeakPolarHBondContact O-CB 3.35Å; V772-T776 PolarHBondContact O-N 3.04Å; V772-T776 PolarHBondContact O-OG1 3.38Å; L773-T776 PolarHBondContact O-N 3.46Å; Y774-T776 VanDerWaalsContact C-N 3.33Å; Y774-T776 PolarHBondContact O-N 3.14Å; T776-H778 VanDerWaalsContact C-N 3.33Å; T776-H778 PolarHBondContact O-N 3Å; T776-S779 PolarHBondContact O-N 3.14Å; T776-I780 HydrophobicContact CG2-CD1 3.88Å; T776-I780 HydrophobicContact CG2-CG1 4.5Å; T776-I780 WeakPolarHBondContact O-CG1 3.4Å; T776-I780 PolarHBondContact O-N 2.82Å; T776-L798 HydrophobicContact CG2-CD1 3.92Å; T776-W811 HydrophobicContact CG2-CH2 3.9Å; T776-W811 HydrophobicContact CG2-CZ3 4.26Å
777	I	91.3	Very high	86.2	Confident	11 Å²	11	37.7 Å²	37.7	6%	0.056	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-42.8	176.9	-70	164.1	0	0	0	111	W730 I733 E734 A737 L773 Y774 S779 I780 N781 L798	W730-I777 HydrophobicContact CZ2-CG2 4.24Å; I733-I777 HydrophobicContact CG2-CD1 3.63Å; I733-I777 HydrophobicContact CG2-CG1 4.25Å; E734-I777 HydrophobicContact CG-CG2 4.12Å; A737-I777 HydrophobicContact CB-CD1 3.29Å; L773-I777 HydrophobicContact CD1-CD1 3.72Å; L773-I777 HydrophobicContact CD1-CG1 4.26Å; L773-I777 HydrophobicContact CG-CD1 3.94Å; L773-I777 WeakPolarHBondContact O-CG1 3.47Å; L773-I777 PolarHBondContact O-N 3.45Å; Y774-I777 PolarHBondContact O-N 3.1Å; I777-S779 PolarHBondContact O-N 3.28Å; I777-I780 PolarHBondContact O-N 3.03Å; I777-N781 WeakPolarHBondContact O-CB 3.25Å; I777-N781 PolarHBondContact O-N 3.24Å; I777-L798 HydrophobicContact CG1-CD1 3.99Å
778	H	86.9	Confident	86.8	Confident	65 Å²	65	44.5 Å²	44.5	30%	0.301	24%	0.238	S	C	.	.	H	α-helix	trans	-60.8	-44.7	176.5	-170.9	-77.9	0	0	0	111.7	Y774 R775 T776 N781 M782 M927	Y774-H778 PolarHBondContact O-N 2.71Å; R775-H778 PolarHBondContact O-N 3.35Å; T776-H778 VanDerWaalsContact C-N 3.33Å; T776-H778 PolarHBondContact O-N 3Å; H778-N781 PolarHBondContact O-N 2.97Å; H778-M782 VanDerWaalsContact O-CG 3.31Å; H778-M782 WeakPolarHBondContact O-CG 3.46Å; H778-M782 PolarHBondContact O-N 3.44Å; H778-M927 VanDerWaalsContact CE1-CE 3.41Å; H778-M927 WeakPolarHBondContact CE1-CE 3.49Å
779	S	85.3	Confident	87	Confident	72 Å²	72	43.3 Å²	43.3	50%	0.503	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-42.7	176.8	179.8	0	0	0	0	112.7	R775 T776 I777 M782 S783	R775-S779 PolarHBondContact O-N 3.41Å; T776-S779 PolarHBondContact O-N 3.14Å; I777-S779 PolarHBondContact O-N 3.28Å; S779-M782 PolarHBondContact O-N 3.03Å; S779-S783 PolarHBondContact O-N 2.96Å; S779-S783 PolarHBondContact O-OG 2.88Å
780	I	91	Very high	87.1	Confident	4 Å²	4	48 Å²	48	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-62.2	-48.8	175.9	-70.2	168.2	0	0	0	110.2	W730 T776 I777 M782 S783 H784 K794 L798	W730-I780 HydrophobicContact CH2-CB 4.11Å; W730-I780 HydrophobicContact CH2-CD1 4.15Å; W730-I780 HydrophobicContact CH2-CG2 3.53Å; W730-I780 HydrophobicContact CZ2-CB 4.35Å; W730-I780 HydrophobicContact CZ2-CG2 3.75Å; T776-I780 HydrophobicContact CG2-CD1 3.88Å; T776-I780 HydrophobicContact CG2-CG1 4.5Å; T776-I780 WeakPolarHBondContact O-CG1 3.4Å; T776-I780 PolarHBondContact O-N 2.82Å; I777-I780 PolarHBondContact O-N 3.03Å; I780-M782 PolarHBondContact O-N 2.65Å; I780-S783 PolarHBondContact O-N 2.88Å; I780-S783 PolarHBondContact O-OG 3.22Å; I780-S783 VanDerWaalsContact O-OG 3.08Å; I780-H784 HydrophobicContact CG2-CB 4.47Å; I780-H784 WeakPolarHBondContact O-CB 3.42Å; I780-H784 PolarHBondContact O-N 2.92Å; I780-H784 PolarHBondContact O-ND1 3.33Å; I780-K794 HydrophobicContact CG2-CB 3.72Å; I780-K794 HydrophobicContact CG2-CD 4.38Å; I780-K794 HydrophobicContact CG2-CG 3.91Å; I780-L798 HydrophobicContact CD1-CB 3.81Å; I780-L798 HydrophobicContact CD1-CD1 4.17Å
781	N	90.9	Very high	87.2	Confident	22 Å²	22	47.1 Å²	47.1	12%	0.118	25%	0.248	C	C	.	.	H	α-helix	trans	-56.2	-50.4	178.2	-80.2	-19.4	0	0	0	111.8	W730 E734 I777 H778 S783 H784 D785 K794	W730-N781 WeakPolarHBondContact CZ2-OD1 3.39Å; W730-N781 PolarHBondContact NE1-OD1 2.87Å; W730-N781 VanDerWaalsContact NE1-OD1 3.1Å; E734-N781 PolarHBondContact OE1-ND2 3.12Å; E734-N781 PolarHBondContact OE1-OD1 3.46Å; I777-N781 WeakPolarHBondContact O-CB 3.25Å; I777-N781 PolarHBondContact O-N 3.24Å; H778-N781 PolarHBondContact O-N 2.97Å; N781-S783 PolarHBondContact O-N 3.4Å; N781-H784 PolarHBondContact O-N 3.41Å; N781-D785 WeakPolarHBondContact O-CB 3.28Å; N781-D785 PolarHBondContact O-N 3.02Å; N781-K794 PolarHBondContact OD1-NZ 2.87Å
782	M	84.9	Confident	87.5	Confident	69 Å²	69	49.4 Å²	49.4	34%	0.34	26%	0.261	S	S	.	.	H	α-helix	trans	-57.2	-51.7	178.4	-67.3	-62.6	97.9	0	0	112.5	H778 S779 I780 L786	H778-M782 VanDerWaalsContact O-CG 3.31Å; H778-M782 WeakPolarHBondContact O-CG 3.46Å; H778-M782 PolarHBondContact O-N 3.44Å; S779-M782 PolarHBondContact O-N 3.03Å; I780-M782 PolarHBondContact O-N 2.65Å; M782-L786 VanDerWaalsContact O-CD1 3.3Å; M782-L786 WeakPolarHBondContact O-CD1 3.4Å; M782-L786 WeakPolarHBondContact O-CG 3.47Å; M782-L786 PolarHBondContact O-N 3.41Å
783	S	84	Confident	87.8	Confident	37 Å²	37	50 Å²	50	26%	0.259	26%	0.264	S	S	.	.	H	α-helix	trans	-68.1	-39.3	-177.5	52.2	0	0	0	0	113.6	S779 I780 N781	S779-S783 PolarHBondContact O-N 2.96Å; S779-S783 PolarHBondContact O-OG 2.88Å; I780-S783 PolarHBondContact O-N 2.88Å; I780-S783 PolarHBondContact O-OG 3.22Å; I780-S783 VanDerWaalsContact O-OG 3.08Å; N781-S783 PolarHBondContact O-N 3.4Å
784	H	90.8	Very high	88	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-86.6	-33.2	-172.1	-71.3	61.8	0	0	0	112.7	I780 N781 L786 A787 N788 A789 K794 S797	I780-H784 HydrophobicContact CG2-CB 4.47Å; I780-H784 WeakPolarHBondContact O-CB 3.42Å; I780-H784 PolarHBondContact O-N 2.92Å; I780-H784 PolarHBondContact O-ND1 3.33Å; N781-H784 PolarHBondContact O-N 3.41Å; H784-L786 VanDerWaalsContact C-N 3.33Å; H784-A787 CarbonylContact O-C 3.57Å; H784-A787 PolarHBondContact O-N 3.25Å; H784-N788 PolarHBondContact O-N 2.88Å; H784-N788 VanDerWaalsContact O-N 3.16Å; H784-A789 HydrophobicContact CB-CB 3.94Å; H784-A789 WeakPolarHBondContact O-CB 3.25Å; H784-A789 PolarHBondContact O-N 3.02Å; H784-K794 HydrophobicContact CB-CD 4.26Å; H784-K794 HydrophobicContact CB-CG 3.68Å; H784-S797 PolarHBondContact NE2-OG 3.15Å
785	D	87.1	Confident	88.4	Confident	78 Å²	78	48.8 Å²	48.8	42%	0.417	26%	0.26	S	S	.	.	H	α-helix	trans	-66.3	-38.5	174.4	-70.2	-34.4	0	0	0	110.9	N781 A787 N788 K794	N781-D785 WeakPolarHBondContact O-CB 3.28Å; N781-D785 PolarHBondContact O-N 3.02Å; D785-A787 PolarHBondContact O-N 3.33Å; D785-N788 PolarHBondContact O-N 3.03Å; D785-K794 WeakPolarHBondContact OD1-CE 3.49Å; D785-K794 IonicContact OD1-NZ 2.62Å; D785-K794 PolarHBondContact OD1-NZ 3.44Å; D785-K794 IonicContact OD2-NZ 3.75Å; D785-K794 PolarHBondContact OD2-NZ 2.96Å; D785-K794 VanDerWaalsContact OD2-NZ 3.09Å
786	L	84.2	Confident	88.8	Confident	152 Å²	152	48.7 Å²	48.7	80%	0.796	26%	0.259	S	S	*	.	H	α-helix	trans	-58.1	-32.8	172.4	-73.9	171.5	0	0	0	112.7	M782 H784	M782-L786 VanDerWaalsContact O-CD1 3.3Å; M782-L786 WeakPolarHBondContact O-CD1 3.4Å; M782-L786 WeakPolarHBondContact O-CG 3.47Å; M782-L786 PolarHBondContact O-N 3.41Å; H784-L786 VanDerWaalsContact C-N 3.33Å
787	A	81.5	Confident	89	Confident	21 Å²	21	48.6 Å²	48.6	17%	0.174	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	2.2	177.9	0	0	0	0	0	113.9	H784 D785 A789 L860	H784-A787 CarbonylContact O-C 3.57Å; H784-A787 PolarHBondContact O-N 3.25Å; D785-A787 PolarHBondContact O-N 3.33Å; A787-A789 PolarHBondContact O-N 3.17Å; A787-L860 HydrophobicContact CB-CD1 4.46Å; A787-L860 HydrophobicContact CB-CD2 3.83Å
788	N	84	Confident	89.3	Confident	153 Å²	153	48.3 Å²	48.3	82%	0.818	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	38.8	-169.8	-68.1	-45.1	0	0	0	112.9	H784 D785	H784-N788 PolarHBondContact O-N 2.88Å; H784-N788 VanDerWaalsContact O-N 3.16Å; D785-N788 PolarHBondContact O-N 3.03Å
789	A	84.4	Confident	89.7	Confident	11 Å²	11	45.5 Å²	45.5	9%	0.091	24%	0.244	C	C	.	.			trans	-72	144.7	-176.7	0	0	0	0	0	111.7	H784 A787 I793 L860 L863	H784-A789 HydrophobicContact CB-CB 3.94Å; H784-A789 WeakPolarHBondContact O-CB 3.25Å; H784-A789 PolarHBondContact O-N 3.02Å; A787-A789 PolarHBondContact O-N 3.17Å; A789-I793 HydrophobicContact CB-CB 4.2Å; A789-I793 HydrophobicContact CB-CD1 4.01Å; A789-I793 HydrophobicContact CB-CG2 4.3Å; A789-L860 HydrophobicContact CB-CD2 3.63Å; A789-L863 HydrophobicContact CB-CD1 3.97Å
790	H	89	Confident	90.2	Very high	106 Å²	106	42 Å²	42	49%	0.491	22%	0.22	S	C	.	.			trans	-62.8	150.8	175.7	-165.6	-105.6	0	0	0	111.3	D792 I793 K794	H790-D792 IonicContact CE1-OD2 2.73Å; H790-D792 PolarHBondContact CE1-OD2 2.84Å; H790-D792 PolarHBondContact ND1-N 3.07Å; H790-D792 IonicContact ND1-OD2 3.77Å; H790-D792 PolarHBondContact ND1-OD2 2.77Å; H790-D792 PolarHBondContact O-N 3.05Å; H790-I793 HydrophobicContact CB-CD1 4.35Å; H790-I793 HydrophobicContact CB-CG1 4.35Å; H790-I793 WeakPolarHBondContact O-CA 3.29Å; H790-I793 VanDerWaalsContact O-CB 3.32Å; H790-I793 WeakPolarHBondContact O-CB 3.4Å; H790-I793 PolarHBondContact O-N 2.84Å; H790-K794 PolarHBondContact O-N 2.81Å
791	M	90.7	Very high	90.2	Very high	51 Å²	51	42.4 Å²	42.4	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-61.8	-26.2	-179.9	-67.8	-176.6	-79.7	0	0	113.2	H728 W730 I793 K794 F795	H728-M791 HydrophobicContact CB-CE 3.38Å; H728-M791 HydrophobicContact CB-SD 3.68Å; H728-M791 VanDerWaalsContact CE1-C 3.48Å; H728-M791 WeakPolarHBondContact CE1-CB 3.41Å; H728-M791 VanDerWaalsContact ND1-CB 3.31Å; H728-M791 WeakPolarHBondContact ND1-CB 3.15Å; W730-M791 HydrophobicContact CB-CB 3.97Å; W730-M791 HydrophobicContact CB-CG 4.25Å; W730-M791 HydrophobicContact CB-SD 4.14Å; W730-M791 HydrophobicContact CG-CB 4.38Å; W730-M791 HydrophobicContact CG-CG 4.44Å; M791-I793 VanDerWaalsContact C-N 3.29Å; M791-I793 PolarHBondContact O-N 3.33Å; M791-K794 WeakPolarHBondContact O-CB 3.36Å; M791-K794 PolarHBondContact O-N 2.85Å; M791-F795 PolarHBondContact O-N 3.1Å
792	D	90.6	Very high	90.3	Very high	73 Å²	73	41.3 Å²	41.3	39%	0.39	22%	0.217	S	C	.	.	H	α-helix	trans	-65.1	-31.5	171	-70.7	-47.6	0	0	0	113	H728 H790 R796	H728-D792 IonicContact CE1-OD1 3.86Å; H728-D792 IonicContact NE2-OD1 3.73Å; H728-D792 PolarHBondContact NE2-OD1 2.78Å; H790-D792 IonicContact CE1-OD2 2.73Å; H790-D792 PolarHBondContact CE1-OD2 2.84Å; H790-D792 PolarHBondContact ND1-N 3.07Å; H790-D792 IonicContact ND1-OD2 3.77Å; H790-D792 PolarHBondContact ND1-OD2 2.77Å; H790-D792 PolarHBondContact O-N 3.05Å; D792-R796 VanDerWaalsContact O-CG 3.29Å; D792-R796 WeakPolarHBondContact O-CG 3.06Å; D792-R796 PolarHBondContact O-N 2.81Å; D792-R796 VanDerWaalsContact O-N 3.09Å; D792-R796 PolarHBondContact O-NE 2.7Å
793	I	92.9	Very high	90.7	Very high	16 Å²	16	38.3 Å²	38.3	8%	0.082	20%	0.203	C	C	.	.	H	α-helix	trans	-68.4	-48.6	174.8	-59	174.1	0	0	0	108.2	A789 H790 M791 F795 R796 S797 E859 L860 L863	A789-I793 HydrophobicContact CB-CB 4.2Å; A789-I793 HydrophobicContact CB-CD1 4.01Å; A789-I793 HydrophobicContact CB-CG2 4.3Å; H790-I793 HydrophobicContact CB-CD1 4.35Å; H790-I793 HydrophobicContact CB-CG1 4.35Å; H790-I793 WeakPolarHBondContact O-CA 3.29Å; H790-I793 VanDerWaalsContact O-CB 3.32Å; H790-I793 WeakPolarHBondContact O-CB 3.4Å; H790-I793 PolarHBondContact O-N 2.84Å; M791-I793 VanDerWaalsContact C-N 3.29Å; M791-I793 PolarHBondContact O-N 3.33Å; I793-F795 VanDerWaalsContact C-N 3.29Å; I793-F795 PolarHBondContact O-N 3.39Å; I793-R796 PolarHBondContact O-N 3.22Å; I793-R796 VanDerWaalsContact O-N 3.14Å; I793-S797 PolarHBondContact O-N 3.34Å; I793-S797 PolarHBondContact O-OG 3.15Å; I793-S797 VanDerWaalsContact O-OG 3.06Å; I793-E859 HydrophobicContact CG2-CB 3.88Å; I793-L860 HydrophobicContact CG2-CD2 4.33Å; I793-L863 HydrophobicContact CD1-CD1 3.75Å
794	K	95	Very high	90.9	Very high	10 Å²	10	37.5 Å²	37.5	4%	0.043	20%	0.196	C	C	.	.	H	α-helix	trans	-54.5	-45.4	175	-62.9	-169.8	174.5	-170.2	0	112	W730 I780 N781 H784 D785 H790 M791 R796 S797 L798	W730-K794 HydrophobicContact CD2-CB 3.67Å; W730-K794 HydrophobicContact CD2-CD 4.08Å; W730-K794 VanDerWaalsContact CE2-CD 3.49Å; W730-K794 HydrophobicContact CE3-CB 3.64Å; W730-K794 HydrophobicContact CG-CB 4.49Å; W730-K794 HydrophobicContact CG-CD 4.41Å; W730-K794 HydrophobicContact CH2-CB 3.69Å; W730-K794 HydrophobicContact CZ2-CB 3.7Å; W730-K794 HydrophobicContact CZ2-CD 3.81Å; W730-K794 HydrophobicContact CZ2-CG 4.32Å; W730-K794 HydrophobicContact CZ3-CB 3.66Å; W730-K794 WeakPolarHBondContact CZ3-O 3.39Å; I780-K794 HydrophobicContact CG2-CB 3.72Å; I780-K794 HydrophobicContact CG2-CD 4.38Å; I780-K794 HydrophobicContact CG2-CG 3.91Å; N781-K794 PolarHBondContact OD1-NZ 2.87Å; H784-K794 HydrophobicContact CB-CD 4.26Å; H784-K794 HydrophobicContact CB-CG 3.68Å; D785-K794 WeakPolarHBondContact OD1-CE 3.49Å; D785-K794 IonicContact OD1-NZ 2.62Å; D785-K794 PolarHBondContact OD1-NZ 3.44Å; D785-K794 IonicContact OD2-NZ 3.75Å; D785-K794 PolarHBondContact OD2-NZ 2.96Å; D785-K794 VanDerWaalsContact OD2-NZ 3.09Å; H790-K794 PolarHBondContact O-N 2.81Å; M791-K794 WeakPolarHBondContact O-CB 3.36Å; M791-K794 PolarHBondContact O-N 2.85Å; K794-R796 PolarHBondContact O-N 3Å; K794-S797 PolarHBondContact O-N 3.32Å; K794-L798 PolarHBondContact O-N 3.2Å
795	F	95.2	Very high	90.7	Very high	5 Å²	5	37.6 Å²	37.6	2%	0.022	20%	0.196	C	C	.	.	H	α-helix	trans	-58.2	-48.3	177.3	-179	-102.7	0	0	0	111.8	L708 F712 W730 I733 M791 I793 S797 L798 I799	L708-F795 HydrophobicContact CB-CE1 4.28Å; L708-F795 HydrophobicContact CB-CZ 4.15Å; F712-F795 HydrophobicContact CB-CE2 4.38Å; F712-F795 HydrophobicContact CB-CZ 4.39Å; F712-F795 HydrophobicContact CD1-CE2 4.19Å; F712-F795 AromaticContact CD2-CE2 3.86Å; F712-F795 HydrophobicContact CD2-CE2 3.86Å; F712-F795 AromaticContact CD2-CZ 3.74Å; F712-F795 HydrophobicContact CD2-CZ 3.74Å; F712-F795 HydrophobicContact CE1-CE2 4.42Å; F712-F795 HydrophobicContact CE2-CE2 4.1Å; F712-F795 HydrophobicContact CE2-CZ 4.16Å; F712-F795 AromaticContact CG-CE2 3.9Å; F712-F795 HydrophobicContact CG-CE2 3.9Å; F712-F795 HydrophobicContact CG-CZ 4.09Å; F712-F795 HydrophobicContact CZ-CE2 4.38Å; W730-F795 HydrophobicContact CE3-CB 4.27Å; I733-F795 HydrophobicContact CD1-CD2 3.61Å; I733-F795 HydrophobicContact CD1-CE2 3.78Å; M791-F795 PolarHBondContact O-N 3.1Å; I793-F795 VanDerWaalsContact C-N 3.29Å; I793-F795 PolarHBondContact O-N 3.39Å; F795-S797 PolarHBondContact O-N 3.31Å; F795-L798 WeakPolarHBondContact O-CB 3.45Å; F795-L798 PolarHBondContact O-N 3.14Å; F795-L798 VanDerWaalsContact O-N 3.17Å; F795-I799 HydrophobicContact CD1-CG1 4.4Å; F795-I799 HydrophobicContact CE1-CD1 4.37Å; F795-I799 HydrophobicContact CE1-CG1 4.08Å; F795-I799 HydrophobicContact CE2-CD1 4.36Å; F795-I799 HydrophobicContact CZ-CD1 4.06Å; F795-I799 HydrophobicContact CZ-CG1 4.28Å; F795-I799 WeakPolarHBondContact O-CG1 3.32Å; F795-I799 PolarHBondContact O-N 3.34Å; F795-I799 VanDerWaalsContact O-N 3.07Å
796	R	95.2	Very high	90.8	Very high	58 Å²	58	34.6 Å²	34.6	22%	0.219	18%	0.179	C	C	.	.	H	α-helix	trans	-65.7	-37.5	179.5	-71.6	-177.7	-77.8	140.4	9.5	112.9	C705 D792 I793 K794 L798 I799 C800 E859	C705-R796 HydrophobicContact CB-CG 3.66Å; D792-R796 VanDerWaalsContact O-CG 3.29Å; D792-R796 WeakPolarHBondContact O-CG 3.06Å; D792-R796 PolarHBondContact O-N 2.81Å; D792-R796 VanDerWaalsContact O-N 3.09Å; D792-R796 PolarHBondContact O-NE 2.7Å; I793-R796 PolarHBondContact O-N 3.22Å; I793-R796 VanDerWaalsContact O-N 3.14Å; K794-R796 PolarHBondContact O-N 3Å; R796-L798 VanDerWaalsContact C-N 3.3Å; R796-L798 PolarHBondContact O-N 2.97Å; R796-I799 PolarHBondContact O-N 3.07Å; R796-C800 PolarHBondContact O-N 3.29Å; R796-C800 PolarHBondContact O-SG 3.09Å; R796-E859 VanDerWaalsContact CZ-CD 3.42Å; R796-E859 IonicContact CZ-OE1 3.51Å; R796-E859 IonicContact CZ-OE2 3.09Å; R796-E859 IonicContact NE-OE2 2.71Å; R796-E859 IonicContact NH1-OE1 2.9Å; R796-E859 PolarHBondContact NH1-OE1 2.66Å; R796-E859 IonicContact NH1-OE2 2.78Å; R796-E859 PolarHBondContact NH1-OE2 2.75Å; R796-E859 IonicContact NH2-OE1 3.49Å; R796-E859 PolarHBondContact NH2-OE1 3.36Å; R796-E859 IonicContact NH2-OE2 3.79Å; R796-E859 PolarHBondContact NH2-OE2 2.54Å
797	S	94.6	Very high	91.2	Very high	5 Å²	5	27.4 Å²	27.4	4%	0.035	14%	0.142	C	C	.	.	H	α-helix	trans	-63.6	-35.1	173.3	-59.6	0	0	0	0	112.8	H784 I793 K794 F795 S801 P856	H784-S797 PolarHBondContact NE2-OG 3.15Å; I793-S797 PolarHBondContact O-N 3.34Å; I793-S797 PolarHBondContact O-OG 3.15Å; I793-S797 VanDerWaalsContact O-OG 3.06Å; K794-S797 PolarHBondContact O-N 3.32Å; F795-S797 PolarHBondContact O-N 3.31Å; S797-S801 WeakPolarHBondContact O-CB 3.24Å; S797-S801 PolarHBondContact O-N 2.95Å; S797-S801 PolarHBondContact O-OG 2.87Å; S797-P856 VanDerWaalsContact CB-O 3.22Å; S797-P856 WeakPolarHBondContact CB-O 3.42Å; S797-P856 PolarHBondContact OG-O 3.02Å
798	L	96.5	Very high	91.9	Very high	6 Å²	6	27 Å²	27	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-66.1	-44.4	172.4	-178.8	68.2	0	0	0	111.6	W730 I733 L773 T776 I777 I780 K794 F795 R796 C800 S801 G802 W811	W730-L798 HydrophobicContact CH2-CB 4.33Å; W730-L798 HydrophobicContact CZ3-CB 3.93Å; W730-L798 HydrophobicContact CZ3-CD2 4.1Å; I733-L798 HydrophobicContact CD1-CD2 4.23Å; I733-L798 HydrophobicContact CG2-CD2 3.64Å; L773-L798 HydrophobicContact CD1-CD1 4.02Å; T776-L798 HydrophobicContact CG2-CD1 3.92Å; I777-L798 HydrophobicContact CG1-CD1 3.99Å; I780-L798 HydrophobicContact CD1-CB 3.81Å; I780-L798 HydrophobicContact CD1-CD1 4.17Å; K794-L798 PolarHBondContact O-N 3.2Å; F795-L798 WeakPolarHBondContact O-CB 3.45Å; F795-L798 PolarHBondContact O-N 3.14Å; F795-L798 VanDerWaalsContact O-N 3.17Å; R796-L798 VanDerWaalsContact C-N 3.3Å; R796-L798 PolarHBondContact O-N 2.97Å; L798-C800 PolarHBondContact O-N 3.08Å; L798-S801 PolarHBondContact O-N 2.98Å; L798-G802 PolarHBondContact O-N 3.08Å; L798-W811 HydrophobicContact CD1-CE3 3.97Å; L798-W811 HydrophobicContact CD1-CZ3 3.62Å; L798-W811 HydrophobicContact CG-CE3 4.44Å; L798-W811 HydrophobicContact CG-CZ3 4.32Å
799	I	96.9	Very high	92.4	Very high	5 Å²	5	20 Å²	20	3%	0.026	10%	0.099	C	C	.	.	H	α-helix	trans	-60	-46.9	176.2	-57.6	-49.1	0	0	0	110.6	L704 L708 F795 R796 S801 G802 L803 L808	L704-I799 HydrophobicContact CD2-CG2 4.39Å; L708-I799 HydrophobicContact CD1-CD1 3.81Å; L708-I799 HydrophobicContact CD1-CG1 4.22Å; L708-I799 HydrophobicContact CD1-CG2 4.01Å; F795-I799 HydrophobicContact CD1-CG1 4.4Å; F795-I799 HydrophobicContact CE1-CD1 4.37Å; F795-I799 HydrophobicContact CE1-CG1 4.08Å; F795-I799 HydrophobicContact CE2-CD1 4.36Å; F795-I799 HydrophobicContact CZ-CD1 4.06Å; F795-I799 HydrophobicContact CZ-CG1 4.28Å; F795-I799 WeakPolarHBondContact O-CG1 3.32Å; F795-I799 PolarHBondContact O-N 3.34Å; F795-I799 VanDerWaalsContact O-N 3.07Å; R796-I799 PolarHBondContact O-N 3.07Å; I799-S801 VanDerWaalsContact C-N 3.34Å; I799-S801 PolarHBondContact O-N 3.49Å; I799-G802 PolarHBondContact O-N 3.32Å; I799-L803 HydrophobicContact CG2-CD1 4.44Å; I799-L803 WeakPolarHBondContact O-CG 3.32Å; I799-L803 PolarHBondContact O-N 3.48Å; I799-L808 HydrophobicContact CD1-CD1 3.83Å; I799-L808 HydrophobicContact CG2-CD1 4.46Å; I799-L808 HydrophobicContact CG2-CD2 4.05Å
800	C	94.1	Very high	92.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-59.4	-45.1	177.1	-64.3	0	0	0	0	111.5	R796 L798 G802 L803 N804 L854	R796-C800 PolarHBondContact O-N 3.29Å; R796-C800 PolarHBondContact O-SG 3.09Å; L798-C800 PolarHBondContact O-N 3.08Å; C800-G802 VanDerWaalsContact C-N 3.31Å; C800-G802 PolarHBondContact O-N 3.45Å; C800-L803 PolarHBondContact O-N 2.72Å; C800-N804 VanDerWaalsContact O-CG 3.26Å; C800-N804 PolarHBondContact O-N 3.19Å; C800-N804 PolarHBondContact O-OD1 3.43Å; C800-L854 HydrophobicContact CB-CB 3.89Å; C800-L854 HydrophobicContact CB-CD1 4.15Å
801	S	91.6	Very high	93.2	Very high	11 Å²	11	15.3 Å²	15.3	8%	0.077	8%	0.075	C	C	.	.	H	α-helix	trans	-64.2	-36.5	178	-55.8	0	0	0	0	112.1	S797 L798 I799 N804 E805	S797-S801 WeakPolarHBondContact O-CB 3.24Å; S797-S801 PolarHBondContact O-N 2.95Å; S797-S801 PolarHBondContact O-OG 2.87Å; L798-S801 PolarHBondContact O-N 2.98Å; I799-S801 VanDerWaalsContact C-N 3.34Å; I799-S801 PolarHBondContact O-N 3.49Å; S801-N804 PolarHBondContact O-N 3.09Å; S801-E805 WeakPolarHBondContact O-CB 3.13Å; S801-E805 VanDerWaalsContact O-CG 3.3Å; S801-E805 WeakPolarHBondContact O-CG 3.24Å; S801-E805 PolarHBondContact O-N 3.21Å
802	G	93.2	Very high	93.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-70.9	-30.8	177.4	0	0	0	0	0	113.5	L798 I799 C800 Q806 L807 L808	L798-G802 PolarHBondContact O-N 3.08Å; I799-G802 PolarHBondContact O-N 3.32Å; C800-G802 VanDerWaalsContact C-N 3.31Å; C800-G802 PolarHBondContact O-N 3.45Å; G802-Q806 CarbonylContact O-C 3.44Å; G802-Q806 PolarHBondContact O-N 3.32Å; G802-Q806 VanDerWaalsContact O-N 3.11Å; G802-L807 PolarHBondContact O-N 3.36Å; G802-L808 PolarHBondContact O-N 3.27Å
803	L	94	Very high	93.7	Very high	5 Å²	5	12 Å²	12	3%	0.026	6%	0.057	C	C	.	.	H	α-helix	trans	-71.3	-45.9	171.3	-70.1	174.1	0	0	0	111.3	V700 L704 I799 C800 E805 Q806 L808 L847 F852 L854	V700-L803 HydrophobicContact CG1-CD1 3.59Å; V700-L803 HydrophobicContact CG2-CD1 4.08Å; L704-L803 HydrophobicContact CD2-CD1 3.88Å; L704-L803 HydrophobicContact CD2-CD2 4.39Å; I799-L803 HydrophobicContact CG2-CD1 4.44Å; I799-L803 WeakPolarHBondContact O-CG 3.32Å; I799-L803 PolarHBondContact O-N 3.48Å; C800-L803 PolarHBondContact O-N 2.72Å; L803-E805 VanDerWaalsContact C-N 3.31Å; L803-E805 PolarHBondContact O-N 3.32Å; L803-Q806 PolarHBondContact O-N 3.15Å; L803-L808 HydrophobicContact CD2-CB 4.47Å; L803-L808 HydrophobicContact CD2-CD2 3.68Å; L803-L808 HydrophobicContact CG-CD2 4.03Å; L803-L847 HydrophobicContact CD2-CB 4.01Å; L803-L847 HydrophobicContact CD2-CD1 3.72Å; L803-F852 HydrophobicContact CB-CB 4.14Å; L803-F852 HydrophobicContact CB-CD1 4.4Å; L803-F852 HydrophobicContact CB-CD2 3.82Å; L803-F852 HydrophobicContact CB-CE2 4.29Å; L803-F852 HydrophobicContact CB-CG 3.87Å; L803-F852 HydrophobicContact CD1-CD1 4.44Å; L803-F852 HydrophobicContact CD1-CE1 4.34Å; L803-F852 HydrophobicContact CD2-CD2 4.37Å; L803-F852 HydrophobicContact CD2-CE2 4Å; L803-F852 HydrophobicContact CD2-CZ 4.26Å; L803-L854 HydrophobicContact CB-CD1 4.18Å; L803-L854 HydrophobicContact CD1-CD1 3.82Å
804	N	88	Confident	93.7	Very high	21 Å²	21	11.9 Å²	11.9	11%	0.112	6%	0.056	C	C	.	.	H	α-helix	trans	-57.1	-46.8	174.2	-64	-6.4	0	0	0	110.1	R680 C800 S801 Q806 F852 L854	R680-N804 CarbonylContact C-O 3.53Å; C800-N804 VanDerWaalsContact O-CG 3.26Å; C800-N804 PolarHBondContact O-N 3.19Å; C800-N804 PolarHBondContact O-OD1 3.43Å; S801-N804 PolarHBondContact O-N 3.09Å; N804-Q806 PolarHBondContact O-N 3.2Å; N804-F852 WeakPolarHBondContact OD1-CB 3.4Å; N804-F852 PolarHBondContact OD1-O 3.5Å; N804-L854 PolarHBondContact ND2-N 2.92Å; N804-L854 PolarHBondContact ND2-O 3.24Å; N804-L854 WeakPolarHBondContact OD1-CB 3.43Å; N804-L854 PolarHBondContact OD1-N 3.15Å
805	E	85.8	Confident	93.7	Very high	3 Å²	3	11.7 Å²	11.7	1%	0.014	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-8.1	178.2	-68.3	-79.1	-159.1	0	0	114.4	R621 R680 V772 R775 S801 L803 L807 W811	R621-E805 IonicContact NH1-OE2 3.96Å; R621-E805 IonicContact NH2-OE2 2.61Å; R621-E805 PolarHBondContact NH2-OE2 2.92Å; R621-E805 VanDerWaalsContact NH2-OE2 3.09Å; R680-E805 WeakPolarHBondContact CB-OE2 3.29Å; R680-E805 WeakPolarHBondContact CD-OE1 3.45Å; R680-E805 WeakPolarHBondContact CD-OE2 3.29Å; R680-E805 IonicContact CZ-OE1 2.83Å; R680-E805 IonicContact NE-OE1 3.46Å; R680-E805 IonicContact NH1-OE1 2.65Å; R680-E805 PolarHBondContact NH1-OE1 3.46Å; V772-E805 HydrophobicContact CG1-CG 4.04Å; V772-E805 WeakPolarHBondContact CG1-OE1 3.18Å; R775-E805 IonicContact NH2-OE1 3.75Å; R775-E805 PolarHBondContact NH2-OE1 3.06Å; S801-E805 WeakPolarHBondContact O-CB 3.13Å; S801-E805 VanDerWaalsContact O-CG 3.3Å; S801-E805 WeakPolarHBondContact O-CG 3.24Å; S801-E805 PolarHBondContact O-N 3.21Å; L803-E805 VanDerWaalsContact C-N 3.31Å; L803-E805 PolarHBondContact O-N 3.32Å; E805-L807 HydrophobicContact CB-CB 4.13Å; E805-L807 HydrophobicContact CB-CD1 4.07Å; E805-L807 HydrophobicContact CB-CG 4.1Å; E805-L807 PolarHBondContact O-N 3.3Å; E805-L807 VanDerWaalsContact O-N 3.16Å; E805-W811 HydrophobicContact CB-CH2 4.49Å; E805-W811 HydrophobicContact CB-CZ2 4.23Å; E805-W811 HydrophobicContact CG-CH2 4.31Å; E805-W811 HydrophobicContact CG-CZ2 4.21Å
806	Q	89.6	Confident	93.6	Very high	15 Å²	15	11.8 Å²	11.8	7%	0.07	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	19.4	-171	-51.7	-175.3	0.5	0	0	114.1	G802 L803 N804 H809 F850	G802-Q806 CarbonylContact O-C 3.44Å; G802-Q806 PolarHBondContact O-N 3.32Å; G802-Q806 VanDerWaalsContact O-N 3.11Å; L803-Q806 PolarHBondContact O-N 3.15Å; N804-Q806 PolarHBondContact O-N 3.2Å; Q806-H809 PolarHBondContact O-CE1 2.85Å; Q806-H809 PolarHBondContact O-ND1 3.48Å; Q806-F850 PolarHBondContact NE2-O 2.93Å
807	L	92.6	Very high	93.3	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.066	C	C	.	.			trans	-101.9	-2.7	-175.3	-74.8	177.4	0	0	0	113.5	Y614 P769 V772 G802 E805 H809 L810 W811	Y614-L807 HydrophobicContact CD1-CD2 4.04Å; Y614-L807 HydrophobicContact CD2-CD2 3.34Å; Y614-L807 HydrophobicContact CD2-CG 3.88Å; Y614-L807 HydrophobicContact CE1-CD2 4.1Å; Y614-L807 HydrophobicContact CE2-CD1 3.79Å; Y614-L807 HydrophobicContact CE2-CD2 3.41Å; Y614-L807 VanDerWaalsContact CE2-CD2 3.41Å; Y614-L807 HydrophobicContact CE2-CG 3.55Å; Y614-L807 HydrophobicContact CG-CD2 3.66Å; P769-L807 HydrophobicContact CB-CD1 4.33Å; P769-L807 HydrophobicContact CB-CD2 3.95Å; P769-L807 HydrophobicContact CG-CD2 3.98Å; V772-L807 HydrophobicContact CB-CD1 3.93Å; V772-L807 HydrophobicContact CG1-CD1 3.9Å; V772-L807 HydrophobicContact CG2-CD1 4.24Å; G802-L807 PolarHBondContact O-N 3.36Å; E805-L807 HydrophobicContact CB-CB 4.13Å; E805-L807 HydrophobicContact CB-CD1 4.07Å; E805-L807 HydrophobicContact CB-CG 4.1Å; E805-L807 PolarHBondContact O-N 3.3Å; E805-L807 VanDerWaalsContact O-N 3.16Å; L807-H809 PolarHBondContact O-N 2.94Å; L807-L810 HydrophobicContact CD2-CB 4.25Å; L807-L810 HydrophobicContact CD2-CD1 3.56Å; L807-L810 CarbonylContact O-C 3.27Å; L807-L810 WeakPolarHBondContact O-CA 3.27Å; L807-L810 WeakPolarHBondContact O-CB 3.39Å; L807-L810 PolarHBondContact O-N 3.42Å; L807-W811 HydrophobicContact CB-CD2 4.17Å; L807-W811 HydrophobicContact CB-CG 4.18Å; L807-W811 HydrophobicContact CB-CZ2 4.18Å; L807-W811 HydrophobicContact CD1-CZ2 4.18Å; L807-W811 PolarHBondContact O-N 2.86Å
808	L	95.7	Very high	92.9	Very high	12 Å²	12	12 Å²	12	6%	0.063	7%	0.067	C	C	.	.	H	α-helix	trans	-50.1	-41.6	-171.7	-178.3	59.7	0	0	0	114.1	L708 I799 G802 L803 F812 L844	L708-L808 HydrophobicContact CD1-CD2 4.24Å; I799-L808 HydrophobicContact CD1-CD1 3.83Å; I799-L808 HydrophobicContact CG2-CD1 4.46Å; I799-L808 HydrophobicContact CG2-CD2 4.05Å; G802-L808 PolarHBondContact O-N 3.27Å; L803-L808 HydrophobicContact CD2-CB 4.47Å; L803-L808 HydrophobicContact CD2-CD2 3.68Å; L803-L808 HydrophobicContact CG-CD2 4.03Å; L808-F812 WeakPolarHBondContact O-CB 3.3Å; L808-F812 PolarHBondContact O-N 2.94Å; L808-L844 HydrophobicContact CD2-CD2 4Å; L808-L844 HydrophobicContact CG-CD1 4.43Å; L808-L844 HydrophobicContact CG-CD2 4.46Å
809	H	95.2	Very high	92.5	Very high	8 Å²	8	16.5 Å²	16.5	4%	0.037	10%	0.095	C	C	.	.	H	α-helix	trans	-69.6	-37.3	177.8	63.4	-70.6	0	0	0	113.3	Q806 L807 E813 K841 L844 R845	Q806-H809 PolarHBondContact O-CE1 2.85Å; Q806-H809 PolarHBondContact O-ND1 3.48Å; L807-H809 PolarHBondContact O-N 2.94Å; H809-E813 PolarHBondContact O-N 3.35Å; H809-K841 HydrophobicContact CB-CG 4.47Å; H809-L844 HydrophobicContact CB-CB 3.9Å; H809-R845 HydrophobicContact CB-CB 4.17Å
810	L	94.5	Very high	92.2	Very high	12 Å²	12	24.7 Å²	24.7	6%	0.063	13%	0.13	C	C	.	.	H	α-helix	trans	-71.8	-40.4	173.5	-74.6	169.4	0	0	0	111.4	D610 P769 L807 F812 E813 I814	D610-L810 HydrophobicContact CB-CD2 3.91Å; D610-L810 HydrophobicContact CB-CG 4.48Å; P769-L810 HydrophobicContact CG-CD1 4.28Å; L807-L810 HydrophobicContact CD2-CB 4.25Å; L807-L810 HydrophobicContact CD2-CD1 3.56Å; L807-L810 CarbonylContact O-C 3.27Å; L807-L810 WeakPolarHBondContact O-CA 3.27Å; L807-L810 WeakPolarHBondContact O-CB 3.39Å; L807-L810 PolarHBondContact O-N 3.42Å; L810-F812 VanDerWaalsContact C-N 3.3Å; L810-F812 PolarHBondContact O-N 3.49Å; L810-E813 WeakPolarHBondContact O-CB 3.17Å; L810-E813 PolarHBondContact O-N 3.17Å; L810-I814 WeakPolarHBondContact O-CD1 3.43Å; L810-I814 VanDerWaalsContact O-CG1 3.24Å; L810-I814 WeakPolarHBondContact O-CG1 3.42Å; L810-I814 PolarHBondContact O-N 3.43Å
811	W	96.3	Very high	92.1	Very high	5 Å²	5	24.9 Å²	24.9	2%	0.019	13%	0.132	C	C	.	.	H	α-helix	trans	-60.6	-40.5	173.2	-70.6	-2.2	0	0	0	111.6	P769 V772 L773 T776 L798 E805 L807 E813 I814 L815	P769-W811 PolarHBondContact O-NE1 3.41Å; V772-W811 HydrophobicContact CB-CZ2 4.47Å; V772-W811 HydrophobicContact CG1-CZ2 3.8Å; L773-W811 HydrophobicContact CB-CD2 4.3Å; L773-W811 HydrophobicContact CB-CG 4.22Å; L773-W811 HydrophobicContact CD1-CB 4.23Å; L773-W811 HydrophobicContact CD1-CD2 3.73Å; L773-W811 HydrophobicContact CD1-CE3 3.9Å; L773-W811 HydrophobicContact CD1-CG 3.88Å; L773-W811 HydrophobicContact CD2-CB 4.48Å; L773-W811 HydrophobicContact CD2-CG 4.45Å; L773-W811 HydrophobicContact CG-CG 4.4Å; T776-W811 HydrophobicContact CG2-CH2 3.9Å; T776-W811 HydrophobicContact CG2-CZ3 4.26Å; L798-W811 HydrophobicContact CD1-CE3 3.97Å; L798-W811 HydrophobicContact CD1-CZ3 3.62Å; L798-W811 HydrophobicContact CG-CE3 4.44Å; L798-W811 HydrophobicContact CG-CZ3 4.32Å; E805-W811 HydrophobicContact CB-CH2 4.49Å; E805-W811 HydrophobicContact CB-CZ2 4.23Å; E805-W811 HydrophobicContact CG-CH2 4.31Å; E805-W811 HydrophobicContact CG-CZ2 4.21Å; L807-W811 HydrophobicContact CB-CD2 4.17Å; L807-W811 HydrophobicContact CB-CG 4.18Å; L807-W811 HydrophobicContact CB-CZ2 4.18Å; L807-W811 HydrophobicContact CD1-CZ2 4.18Å; L807-W811 PolarHBondContact O-N 2.86Å; W811-E813 VanDerWaalsContact C-N 3.34Å; W811-E813 PolarHBondContact O-N 2.9Å; W811-I814 PolarHBondContact O-N 2.71Å; W811-L815 VanDerWaalsContact O-CG 3.23Å; W811-L815 WeakPolarHBondContact O-CG 3.46Å; W811-L815 PolarHBondContact O-N 3.46Å
812	F	96.1	Very high	92.1	Very high	6 Å²	6	24.5 Å²	24.5	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-41.2	175	-170.2	-101.3	0	0	0	112.2	V711 F712 L808 L810 C816 W837 I840 L844	V711-F812 HydrophobicContact CG1-CE2 4.18Å; V711-F812 HydrophobicContact CG1-CZ 4.13Å; F712-F812 HydrophobicContact CD2-CE2 4.42Å; F712-F812 AromaticContact CE2-CD2 3.8Å; F712-F812 HydrophobicContact CE2-CD2 3.8Å; F712-F812 AromaticContact CE2-CE2 3.66Å; F712-F812 HydrophobicContact CE2-CE2 3.66Å; F712-F812 AromaticContact CZ-CD2 3.92Å; F712-F812 HydrophobicContact CZ-CD2 3.92Å; F712-F812 AromaticContact CZ-CE2 4Å; F712-F812 HydrophobicContact CZ-CE2 4Å; L808-F812 WeakPolarHBondContact O-CB 3.3Å; L808-F812 PolarHBondContact O-N 2.94Å; L810-F812 VanDerWaalsContact C-N 3.3Å; L810-F812 PolarHBondContact O-N 3.49Å; F812-C816 WeakPolarHBondContact O-CB 3.33Å; F812-C816 PolarHBondContact O-N 3.04Å; F812-C816 PolarHBondContact O-SG 3.31Å; F812-W837 HydrophobicContact CE1-CB 3.74Å; F812-W837 WeakPolarHBondContact CE1-O 2.79Å; F812-W837 HydrophobicContact CZ-CB 4.3Å; F812-I840 HydrophobicContact CD1-CB 4.47Å; F812-I840 HydrophobicContact CD1-CG2 3.98Å; F812-I840 HydrophobicContact CE1-CB 3.71Å; F812-I840 HydrophobicContact CE1-CG2 3.46Å; F812-I840 VanDerWaalsContact CE1-CG2 3.46Å; F812-I840 HydrophobicContact CE2-CG2 4.1Å; F812-I840 HydrophobicContact CG-CG2 4.49Å; F812-I840 HydrophobicContact CZ-CB 4.03Å; F812-I840 HydrophobicContact CZ-CD1 4.14Å; F812-I840 HydrophobicContact CZ-CG2 3.53Å; F812-L844 HydrophobicContact CB-CD1 4.04Å; F812-L844 HydrophobicContact CD2-CD1 4.36Å; F812-L844 HydrophobicContact CG-CD1 4.06Å
813	E	94.7	Very high	92	Very high	50 Å²	50	26.1 Å²	26.1	23%	0.234	14%	0.14	C	C	.	.	H	α-helix	trans	-62.3	-46.7	173.4	177.5	171.3	-138.9	0	0	112.7	H809 L810 W811 L815 C816 S817 W837 K841	H809-E813 PolarHBondContact O-N 3.35Å; L810-E813 WeakPolarHBondContact O-CB 3.17Å; L810-E813 PolarHBondContact O-N 3.17Å; W811-E813 VanDerWaalsContact C-N 3.34Å; W811-E813 PolarHBondContact O-N 2.9Å; E813-L815 VanDerWaalsContact C-N 3.31Å; E813-L815 PolarHBondContact O-N 3.44Å; E813-C816 CarbonylContact O-C 3.47Å; E813-C816 PolarHBondContact O-N 3.27Å; E813-C816 VanDerWaalsContact O-N 3.16Å; E813-S817 VanDerWaalsContact O-CB 3.27Å; E813-S817 WeakPolarHBondContact O-CB 3.34Å; E813-S817 PolarHBondContact O-N 2.99Å; E813-S817 PolarHBondContact O-OG 3.08Å; E813-W837 HydrophobicContact CB-CZ3 3.98Å; E813-W837 HydrophobicContact CG-CH2 3.93Å; E813-W837 HydrophobicContact CG-CZ3 3.85Å; E813-K841 HydrophobicContact CB-CD 4.14Å; E813-K841 HydrophobicContact CG-CD 4.49Å; E813-K841 IonicContact OE1-NZ 3.02Å; E813-K841 PolarHBondContact OE1-NZ 3.02Å; E813-K841 WeakPolarHBondContact OE2-CE 3.38Å; E813-K841 IonicContact OE2-NZ 2.74Å; E813-K841 PolarHBondContact OE2-NZ 2.81Å
814	I	93.6	Very high	91.9	Very high	12 Å²	12	31.4 Å²	31.4	6%	0.062	16%	0.163	C	C	.	.	H	α-helix	trans	-57.6	-47.1	178.5	-69.4	161.9	0	0	0	110	E740 P769 E770 L773 L810 W811 C816 S817 S818	E740-I814 HydrophobicContact CB-CG2 4.38Å; E740-I814 HydrophobicContact CG-CG2 3.76Å; P769-I814 HydrophobicContact CB-CD1 3.86Å; E770-I814 HydrophobicContact CB-CD1 4.46Å; E770-I814 HydrophobicContact CG-CD1 3.81Å; E770-I814 HydrophobicContact CG-CG1 4.1Å; E770-I814 HydrophobicContact CG-CG2 4.18Å; L773-I814 HydrophobicContact CD2-CB 4.35Å; L773-I814 HydrophobicContact CD2-CG2 3.87Å; L810-I814 WeakPolarHBondContact O-CD1 3.43Å; L810-I814 VanDerWaalsContact O-CG1 3.24Å; L810-I814 WeakPolarHBondContact O-CG1 3.42Å; L810-I814 PolarHBondContact O-N 3.43Å; W811-I814 PolarHBondContact O-N 2.71Å; I814-C816 VanDerWaalsContact C-N 3.35Å; I814-C816 PolarHBondContact O-N 3.23Å; I814-S817 PolarHBondContact O-N 3.46Å; I814-S818 PolarHBondContact O-N 2.75Å
815	L	94.6	Very high	92.1	Very high	6 Å²	6	32.3 Å²	32.3	3%	0.031	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-41.1	177.2	-68	171.9	0	0	0	112.2	F712 F732 I733 A736 L773 W811 E813 V822	F712-L815 HydrophobicContact CE1-CD1 4.09Å; F712-L815 HydrophobicContact CZ-CD1 3.92Å; F732-L815 HydrophobicContact CE1-CB 4.22Å; F732-L815 HydrophobicContact CZ-CB 4.21Å; F732-L815 WeakPolarHBondContact CZ-O 3.04Å; I733-L815 HydrophobicContact CB-CD2 4.46Å; I733-L815 HydrophobicContact CG1-CD1 4.23Å; I733-L815 HydrophobicContact CG1-CD2 4.46Å; I733-L815 HydrophobicContact CG2-CD2 4.27Å; A736-L815 HydrophobicContact CB-CD2 3.65Å; L773-L815 HydrophobicContact CD2-CD2 4.32Å; L773-L815 HydrophobicContact CD2-CG 4.39Å; W811-L815 VanDerWaalsContact O-CG 3.23Å; W811-L815 WeakPolarHBondContact O-CG 3.46Å; W811-L815 PolarHBondContact O-N 3.46Å; E813-L815 VanDerWaalsContact C-N 3.31Å; E813-L815 PolarHBondContact O-N 3.44Å; L815-V822 VanDerWaalsContact O-CG2 3.27Å; L815-V822 WeakPolarHBondContact O-CG2 3.24Å
816	C	93.2	Very high	92.4	Very high	8 Å²	8	32.1 Å²	32.1	5%	0.054	16%	0.164	C	C	.	.	H	α-helix	trans	-75.4	-25	178.7	-64.4	0	0	0	0	113.3	F812 E813 I814 S818 W837	F812-C816 WeakPolarHBondContact O-CB 3.33Å; F812-C816 PolarHBondContact O-N 3.04Å; F812-C816 PolarHBondContact O-SG 3.31Å; E813-C816 CarbonylContact O-C 3.47Å; E813-C816 PolarHBondContact O-N 3.27Å; E813-C816 VanDerWaalsContact O-N 3.16Å; I814-C816 VanDerWaalsContact C-N 3.35Å; I814-C816 PolarHBondContact O-N 3.23Å; C816-S818 VanDerWaalsContact C-N 3.29Å; C816-S818 PolarHBondContact O-N 3.43Å; C816-W837 HydrophobicContact CB-CB 4.27Å; C816-W837 HydrophobicContact CB-CD2 3.81Å; C816-W837 HydrophobicContact CB-CE3 4.11Å; C816-W837 HydrophobicContact CB-CG 3.85Å
817	S	89.2	Confident	92.4	Very high	59 Å²	59	34.8 Å²	34.8	41%	0.413	18%	0.176	S	C	.	.	H	α-helix	trans	-74.2	-19.4	-178.8	-64.7	0	0	0	0	113.1	E813 I814 V819	E813-S817 VanDerWaalsContact O-CB 3.27Å; E813-S817 WeakPolarHBondContact O-CB 3.34Å; E813-S817 PolarHBondContact O-N 2.99Å; E813-S817 PolarHBondContact O-OG 3.08Å; I814-S817 PolarHBondContact O-N 3.46Å; S817-V819 PolarHBondContact O-N 3.38Å
818	S	86.4	Confident	92	Very high	7 Å²	7	38.5 Å²	38.5	5%	0.049	20%	0.2	C	C	.	.			trans	-76	65.5	176	-149.5	0	0	0	0	112.1	E740 I814 C816 K820 V821 V822	E740-S818 WeakPolarHBondContact OE1-CB 3.46Å; E740-S818 PolarHBondContact OE1-OG 3.28Å; I814-S818 PolarHBondContact O-N 2.75Å; C816-S818 VanDerWaalsContact C-N 3.29Å; C816-S818 PolarHBondContact O-N 3.43Å; S818-K820 PolarHBondContact O-N 3.19Å; S818-V821 WeakPolarHBondContact O-CA 3.36Å; S818-V821 PolarHBondContact O-N 2.83Å; S818-V821 WeakPolarHBondContact OG-CG2 3.47Å; S818-V822 WeakPolarHBondContact O-CG2 3.45Å; S818-V822 PolarHBondContact O-N 3.46Å
819	V	88.2	Confident	91.4	Very high	101 Å²	101	41.9 Å²	41.9	61%	0.612	21%	0.212	S	C	*	.	H	α-helix	trans	-50.3	-38	-169.7	-178.9	0	0	0	0	113.1	S817 S823	S817-V819 PolarHBondContact O-N 3.38Å; V819-S823 WeakPolarHBondContact O-CB 3.28Å; V819-S823 PolarHBondContact O-N 2.98Å; V819-S823 PolarHBondContact O-OG 3.28Å
820	K	89.4	Confident	91.1	Very high	177 Å²	177	41.5 Å²	41.5	77%	0.77	21%	0.211	S	C	*	.	H	α-helix	trans	-66.2	-44.7	178.2	-70.1	-176.6	-179.5	177.9	0	111.8	S818 K824	S818-K820 PolarHBondContact O-N 3.19Å; K820-K824 PolarHBondContact O-N 2.47Å
821	V	91.6	Very high	90.9	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.03	21%	0.21	C	C	.	.	H	α-helix	trans	-71.9	-48.2	179.6	-176.2	0	0	0	0	109.7	F732 E735 A736 K739 S818 S823 K824 W825	F732-V821 HydrophobicContact CD2-CG1 3.92Å; F732-V821 HydrophobicContact CE2-CG1 4.06Å; E735-V821 HydrophobicContact CB-CG1 4.03Å; E735-V821 HydrophobicContact CG-CG1 3.78Å; E735-V821 HydrophobicContact CG-CG2 4.27Å; A736-V821 HydrophobicContact CB-CG1 4.08Å; K739-V821 HydrophobicContact CB-CG2 3.95Å; K739-V821 HydrophobicContact CG-CG2 3.89Å; S818-V821 WeakPolarHBondContact O-CA 3.36Å; S818-V821 PolarHBondContact O-N 2.83Å; S818-V821 WeakPolarHBondContact OG-CG2 3.47Å; V821-S823 VanDerWaalsContact C-N 3.29Å; V821-S823 PolarHBondContact O-N 3.35Å; V821-K824 WeakPolarHBondContact O-CA 3.33Å; V821-K824 VanDerWaalsContact O-CB 3.24Å; V821-K824 WeakPolarHBondContact O-CB 3.45Å; V821-K824 PolarHBondContact O-N 3.02Å; V821-W825 VanDerWaalsContact O-CD1 3.26Å; V821-W825 PolarHBondContact O-N 3Å; V821-W825 VanDerWaalsContact O-N 3.08Å
822	V	92.3	Very high	90.7	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-54.9	-45.3	174.8	175	0	0	0	0	111.2	F732 L815 S818 K824 W825 Y826 L832 R833	F732-V822 HydrophobicContact CE2-CB 4.42Å; F732-V822 HydrophobicContact CE2-CG2 3.73Å; F732-V822 HydrophobicContact CZ-CG2 3.9Å; L815-V822 VanDerWaalsContact O-CG2 3.27Å; L815-V822 WeakPolarHBondContact O-CG2 3.24Å; S818-V822 WeakPolarHBondContact O-CG2 3.45Å; S818-V822 PolarHBondContact O-N 3.46Å; V822-K824 PolarHBondContact O-N 3.47Å; V822-W825 PolarHBondContact O-N 3.4Å; V822-Y826 WeakPolarHBondContact O-CB 3.4Å; V822-Y826 PolarHBondContact O-N 3.31Å; V822-L832 HydrophobicContact CG1-CB 4.24Å; V822-L832 WeakPolarHBondContact CG1-O 3.48Å; V822-R833 HydrophobicContact CG1-CB 3.73Å; V822-R833 HydrophobicContact CG1-CG 3.94Å
823	S	91.6	Very high	90.4	Very high	34 Å²	34	45.5 Å²	45.5	24%	0.238	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-24.2	178.7	-64.7	0	0	0	0	113.6	K717 V819 V821 R833	K717-S823 PolarHBondContact NZ-O 3.17Å; V819-S823 WeakPolarHBondContact O-CB 3.28Å; V819-S823 PolarHBondContact O-N 2.98Å; V819-S823 PolarHBondContact O-OG 3.28Å; V821-S823 VanDerWaalsContact C-N 3.29Å; V821-S823 PolarHBondContact O-N 3.35Å; S823-R833 PolarHBondContact OG-NE 2.93Å; S823-R833 VanDerWaalsContact OG-NE 3.1Å
824	K	91.2	Very high	90	Very high	115 Å²	115	44.3 Å²	44.3	50%	0.5	22%	0.222	S	C	.	.	H	α-helix	trans	-70.3	-50.5	172.3	-179.2	-170.2	178.3	-169	0	110	K717 E735 K820 V821 V822	K717-K824 WeakPolarHBondContact CD-O 3.5Å; K717-K824 WeakPolarHBondContact CE-O 3.3Å; K717-K824 PolarHBondContact NZ-O 2.81Å; E735-K824 WeakPolarHBondContact OE1-CD 3.32Å; E735-K824 IonicContact OE1-NZ 3Å; E735-K824 PolarHBondContact OE1-NZ 3.35Å; E735-K824 IonicContact OE2-NZ 3.15Å; E735-K824 PolarHBondContact OE2-NZ 3.13Å; K820-K824 PolarHBondContact O-N 2.47Å; V821-K824 WeakPolarHBondContact O-CA 3.33Å; V821-K824 VanDerWaalsContact O-CB 3.24Å; V821-K824 WeakPolarHBondContact O-CB 3.45Å; V821-K824 PolarHBondContact O-N 3.02Å; V822-K824 PolarHBondContact O-N 3.47Å
825	W	92.4	Very high	89.5	Confident	40 Å²	40	49.2 Å²	49.2	15%	0.152	25%	0.254	C	S	.	.	H	α-helix	trans	-85.9	-28.6	-171	-70.7	94.5	0	0	0	115.2	L716 K717 C727 H731 F732 E735 V821 V822	L716-W825 HydrophobicContact CD1-CB 4.41Å; L716-W825 HydrophobicContact CD1-CE3 4.23Å; K717-W825 WeakPolarHBondContact CB-O 3.45Å; K717-W825 VanDerWaalsContact CG-O 3.32Å; K717-W825 WeakPolarHBondContact CG-O 3.46Å; K717-W825 PolarHBondContact N-O 3.47Å; C727-W825 VanDerWaalsContact SG-CZ3 3.56Å; H731-W825 HydrophobicContact CB-CH2 3.32Å; H731-W825 HydrophobicContact CB-CZ2 3.9Å; H731-W825 HydrophobicContact CB-CZ3 3.88Å; F732-W825 HydrophobicContact CB-CB 4.12Å; F732-W825 HydrophobicContact CB-CD2 3.86Å; F732-W825 HydrophobicContact CB-CE3 4.27Å; F732-W825 HydrophobicContact CB-CG 3.78Å; F732-W825 HydrophobicContact CD2-CB 3.93Å; F732-W825 AromaticContact CD2-CD1 3.76Å; F732-W825 AromaticContact CD2-CG 3.91Å; F732-W825 HydrophobicContact CD2-CG 3.91Å; F732-W825 HydrophobicContact CG-CB 4.34Å; F732-W825 HydrophobicContact CG-CG 4.3Å; E735-W825 WeakPolarHBondContact OE2-CZ2 3.47Å; E735-W825 PolarHBondContact OE2-NE1 3.32Å; V821-W825 VanDerWaalsContact O-CD1 3.26Å; V821-W825 PolarHBondContact O-N 3Å; V821-W825 VanDerWaalsContact O-N 3.08Å; V822-W825 PolarHBondContact O-N 3.4Å
826	Y	92	Very high	89	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-122.4	146.6	-170.1	-69	-92.6	0	0	0	114.9	F712 G715 L716 K717 F732 V822 S830 L832 R833	F712-Y826 WeakPolarHBondContact O-CE1 3.49Å; F712-Y826 PolarHBondContact O-OH 3.11Å; G715-Y826 CarbonylContact O-C 3.37Å; G715-Y826 WeakPolarHBondContact O-CA 3.26Å; L716-Y826 HydrophobicContact CB-CD1 4.42Å; L716-Y826 HydrophobicContact CB-CE1 4.06Å; L716-Y826 HydrophobicContact CD1-CD1 4.45Å; L716-Y826 HydrophobicContact CD1-CE1 3.93Å; L716-Y826 HydrophobicContact CD1-CE2 4.07Å; K717-Y826 VanDerWaalsContact CE-C 3.42Å; K717-Y826 WeakPolarHBondContact CE-O 3.47Å; F732-Y826 HydrophobicContact CB-CE2 4.18Å; F732-Y826 AromaticContact CD1-CE2 3.71Å; F732-Y826 HydrophobicContact CD1-CE2 3.71Å; F732-Y826 HydrophobicContact CD2-CD2 4.3Å; F732-Y826 AromaticContact CD2-CE2 3.77Å; F732-Y826 HydrophobicContact CD2-CE2 3.77Å; F732-Y826 HydrophobicContact CE1-CE2 4.02Å; F732-Y826 HydrophobicContact CE2-CD2 4.43Å; F732-Y826 HydrophobicContact CE2-CE2 4.07Å; F732-Y826 AromaticContact CG-CE2 3.59Å; F732-Y826 HydrophobicContact CG-CE2 3.59Å; F732-Y826 HydrophobicContact CZ-CE2 4.18Å; V822-Y826 WeakPolarHBondContact O-CB 3.4Å; V822-Y826 PolarHBondContact O-N 3.31Å; Y826-S830 WeakPolarHBondContact CB-OG 3.46Å; Y826-L832 HydrophobicContact CD2-CB 4.37Å; Y826-L832 HydrophobicContact CD2-CD2 4.33Å; Y826-L832 HydrophobicContact CE1-CD1 4.14Å; Y826-L832 HydrophobicContact CE1-CD2 4.28Å; Y826-L832 HydrophobicContact CE2-CD2 3.68Å; Y826-L832 HydrophobicContact CG-CB 4.4Å; Y826-R833 WeakPolarHBondContact O-CD 3.29Å; Y826-R833 PolarHBondContact O-NH1 3.44Å
827	H	88.9	Confident	88.9	Confident	70 Å²	70	51.8 Å²	51.8	32%	0.324	27%	0.268	S	S	.	.			trans	-69.8	153.6	170.2	-71.9	-74.5	0	0	0	111.6	G715 W829 S830	G715-H827 PolarHBondContact O-CD2 3.24Å; G715-H827 PolarHBondContact O-N 3.06Å; H827-W829 HydrophobicContact CB-CD2 3.92Å; H827-W829 HydrophobicContact CB-CG 4.19Å; H827-W829 HydrophobicContact CB-CZ2 3.76Å; H827-W829 AromaticContact CD2-CZ2 3.61Å; H827-W829 AromaticContact CG-CE2 3.81Å; H827-W829 AromaticContact CG-CZ2 3.78Å; H827-W829 AromaticContact CG-NE1 3.75Å; H827-W829 PolarHBondContact O-N 3.45Å; H827-W829 VanDerWaalsContact O-N 3.12Å; H827-S830 VanDerWaalsContact O-CB 3.31Å; H827-S830 WeakPolarHBondContact O-CB 3.44Å; H827-S830 PolarHBondContact O-N 2.58Å; H827-S830 PolarHBondContact O-OG 3.08Å
828	P	85.9	Confident	89	Confident	79 Å²	79	51.4 Å²	51.4	51%	0.513	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.8	-179.8	-23.4	31.9	0	0	0	114.9	S830	P828-S830 VanDerWaalsContact C-N 3.34Å
829	W	82.3	Confident	89.3	Confident	83 Å²	83	54.7 Å²	54.7	31%	0.314	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	1.8	178.7	51.7	-103.5	0	0	0	113.3	K563 Q567 H714 H827	K563-W829 HydrophobicContact CD-CD2 4.14Å; K563-W829 HydrophobicContact CD-CG 4.22Å; Q567-W829 PolarHBondContact NE2-O 3.31Å; H714-W829 AromaticContact CE1-CE3 3.59Å; H714-W829 AromaticContact CE1-CZ3 3.74Å; H714-W829 PolarHBondContact CE1-O 3.49Å; H714-W829 AromaticContact NE2-CE3 3.93Å; H714-W829 AromaticContact NE2-CZ3 3.73Å; H827-W829 HydrophobicContact CB-CD2 3.92Å; H827-W829 HydrophobicContact CB-CG 4.19Å; H827-W829 HydrophobicContact CB-CZ2 3.76Å; H827-W829 AromaticContact CD2-CZ2 3.61Å; H827-W829 AromaticContact CG-CE2 3.81Å; H827-W829 AromaticContact CG-CZ2 3.78Å; H827-W829 AromaticContact CG-NE1 3.75Å; H827-W829 PolarHBondContact O-N 3.45Å; H827-W829 VanDerWaalsContact O-N 3.12Å
830	S	89.4	Confident	89.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.249	C	C	.	.	S	Bend	trans	-68.6	161.5	172	63.4	0	0	0	0	111.6	H714 Y826 H827 P828 R833 S834	H714-S830 WeakPolarHBondContact O-CB 3.24Å; Y826-S830 WeakPolarHBondContact CB-OG 3.46Å; H827-S830 VanDerWaalsContact O-CB 3.31Å; H827-S830 WeakPolarHBondContact O-CB 3.44Å; H827-S830 PolarHBondContact O-N 2.58Å; H827-S830 PolarHBondContact O-OG 3.08Å; P828-S830 VanDerWaalsContact C-N 3.34Å; S830-R833 WeakPolarHBondContact OG-CB 3.48Å; S830-R833 PolarHBondContact OG-N 3.49Å; S830-R833 VanDerWaalsContact OG-N 3.09Å; S830-S834 WeakPolarHBondContact O-CB 3.23Å; S830-S834 PolarHBondContact O-N 3.26Å; S830-S834 PolarHBondContact O-OG 2.8Å
831	Y	89.4	Confident	89.8	Confident	11 Å²	11	41.5 Å²	41.5	4%	0.043	21%	0.212	C	C	.	.	S	Bend	trans	-62	-48.8	170.2	-84.7	-66	0	0	0	111.6	Q567 I570 V711 H714 R833 S834 I840	Q567-Y831 WeakPolarHBondContact CA-OH 3.45Å; Q567-Y831 HydrophobicContact CB-CE2 3.98Å; Q567-Y831 VanDerWaalsContact CB-OH 3.23Å; Q567-Y831 WeakPolarHBondContact CB-OH 3.03Å; Q567-Y831 HydrophobicContact CG-CE2 3.88Å; Q567-Y831 PolarHBondContact O-OH 3.46Å; I570-Y831 HydrophobicContact CB-CE2 4.34Å; I570-Y831 HydrophobicContact CG2-CE2 4.16Å; V711-Y831 HydrophobicContact CG1-CD2 4.39Å; V711-Y831 HydrophobicContact CG1-CG 4.44Å; H714-Y831 HydrophobicContact CB-CD2 4.34Å; H714-Y831 AromaticContact ND1-CD2 3.85Å; Y831-R833 PolarHBondContact O-N 2.92Å; Y831-R833 VanDerWaalsContact O-N 3.12Å; Y831-S834 PolarHBondContact O-N 3.48Å; Y831-S834 VanDerWaalsContact O-N 3.12Å; Y831-S834 PolarHBondContact O-OG 3.08Å; Y831-I840 HydrophobicContact CD1-CD1 3.44Å; Y831-I840 VanDerWaalsContact CD1-CD1 3.44Å; Y831-I840 HydrophobicContact CD2-CD1 4.28Å; Y831-I840 HydrophobicContact CE1-CD1 4.04Å; Y831-I840 HydrophobicContact CG-CD1 3.58Å
832	L	92.3	Very high	90	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.5	-175	-73.8	78.7	0	0	0	113.1	V711 F712 F732 V822 Y826	V711-L832 HydrophobicContact CG1-CD1 4.18Å; F712-L832 HydrophobicContact CD1-CD2 4.02Å; F712-L832 HydrophobicContact CE1-CD2 4Å; F732-L832 HydrophobicContact CD1-CD2 4.13Å; F732-L832 HydrophobicContact CE1-CD2 3.34Å; F732-L832 HydrophobicContact CZ-CD2 3.68Å; V822-L832 HydrophobicContact CG1-CB 4.24Å; V822-L832 WeakPolarHBondContact CG1-O 3.48Å; Y826-L832 HydrophobicContact CD2-CB 4.37Å; Y826-L832 HydrophobicContact CD2-CD2 4.33Å; Y826-L832 HydrophobicContact CE1-CD1 4.14Å; Y826-L832 HydrophobicContact CE1-CD2 4.28Å; Y826-L832 HydrophobicContact CE2-CD2 3.68Å; Y826-L832 HydrophobicContact CG-CB 4.4Å
833	R	89.7	Confident	90.1	Very high	94 Å²	94	41.6 Å²	41.6	36%	0.355	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	2.7	179.4	-157.8	170.3	173.2	-145.2	-10.8	114.4	V822 S823 Y826 S830 Y831	V822-R833 HydrophobicContact CG1-CB 3.73Å; V822-R833 HydrophobicContact CG1-CG 3.94Å; S823-R833 PolarHBondContact OG-NE 2.93Å; S823-R833 VanDerWaalsContact OG-NE 3.1Å; Y826-R833 WeakPolarHBondContact O-CD 3.29Å; Y826-R833 PolarHBondContact O-NH1 3.44Å; S830-R833 WeakPolarHBondContact OG-CB 3.48Å; S830-R833 PolarHBondContact OG-N 3.49Å; S830-R833 VanDerWaalsContact OG-N 3.09Å; Y831-R833 PolarHBondContact O-N 2.92Å; Y831-R833 VanDerWaalsContact O-N 3.12Å
834	S	85.6	Confident	90.4	Very high	25 Å²	25	40.1 Å²	40.1	18%	0.175	20%	0.202	C	C	.	.	S	Bend	trans	-116.4	162.5	177.6	68.3	0	0	0	0	110.7	S830 Y831 G836 W837	S830-S834 WeakPolarHBondContact O-CB 3.23Å; S830-S834 PolarHBondContact O-N 3.26Å; S830-S834 PolarHBondContact O-OG 2.8Å; Y831-S834 PolarHBondContact O-N 3.48Å; Y831-S834 VanDerWaalsContact O-N 3.12Å; Y831-S834 PolarHBondContact O-OG 3.08Å; S834-G836 PolarHBondContact O-N 3.18Å; S834-G836 PolarHBondContact OG-N 2.9Å; S834-W837 PolarHBondContact O-N 2.59Å
835	P	83.2	Confident	90.6	Very high	114 Å²	114	36 Å²	36	74%	0.74	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-13.1	174.5	-25.3	35.1	0	0	0	114.6	W837 V838	P835-W837 PolarHBondContact O-N 2.74Å; P835-V838 WeakPolarHBondContact O-CB 3.26Å; P835-V838 PolarHBondContact O-N 3.07Å; P835-V838 VanDerWaalsContact O-N 3.12Å
836	G	85	Confident	90.7	Very high	18 Å²	18	34.4 Å²	34.4	19%	0.186	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-21.5	177.4	0	0	0	0	0	114.4	S834 V838 Q839 I840	S834-G836 PolarHBondContact O-N 3.18Å; S834-G836 PolarHBondContact OG-N 2.9Å; G836-V838 PolarHBondContact O-N 3.42Å; G836-Q839 WeakPolarHBondContact O-CB 3.3Å; G836-Q839 PolarHBondContact O-N 3.08Å; G836-I840 PolarHBondContact O-N 3.47Å
837	W	91.7	Very high	90.9	Very high	51 Å²	51	34.6 Å²	34.6	19%	0.193	18%	0.179	C	C	.	.	H	α-helix	trans	-61.6	-29.8	174.1	76.5	-107.5	0	0	0	112.5	F812 E813 C816 S834 P835 Q839 I840 K841	F812-W837 HydrophobicContact CE1-CB 3.74Å; F812-W837 WeakPolarHBondContact CE1-O 2.79Å; F812-W837 HydrophobicContact CZ-CB 4.3Å; E813-W837 HydrophobicContact CB-CZ3 3.98Å; E813-W837 HydrophobicContact CG-CH2 3.93Å; E813-W837 HydrophobicContact CG-CZ3 3.85Å; C816-W837 HydrophobicContact CB-CB 4.27Å; C816-W837 HydrophobicContact CB-CD2 3.81Å; C816-W837 HydrophobicContact CB-CE3 4.11Å; C816-W837 HydrophobicContact CB-CG 3.85Å; S834-W837 PolarHBondContact O-N 2.59Å; P835-W837 PolarHBondContact O-N 2.74Å; W837-Q839 VanDerWaalsContact C-N 3.31Å; W837-Q839 PolarHBondContact O-N 2.83Å; W837-I840 PolarHBondContact O-N 3.35Å; W837-K841 HydrophobicContact CE3-CB 4.31Å; W837-K841 HydrophobicContact CZ3-CB 4.31Å; W837-K841 HydrophobicContact CZ3-CD 3.97Å; W837-K841 PolarHBondContact O-N 3.12Å
838	V	91.5	Very high	91	Very high	51 Å²	51	32.7 Å²	32.7	31%	0.309	17%	0.174	S	C	.	.	H	α-helix	trans	-64.4	-39.9	177.8	-178.3	0	0	0	0	110.5	P835 G836 K841 C842	P835-V838 WeakPolarHBondContact O-CB 3.26Å; P835-V838 PolarHBondContact O-N 3.07Å; P835-V838 VanDerWaalsContact O-N 3.12Å; G836-V838 PolarHBondContact O-N 3.42Å; V838-K841 WeakPolarHBondContact O-CB 3.23Å; V838-K841 PolarHBondContact O-N 3.45Å; V838-C842 PolarHBondContact O-N 3.15Å; V838-C842 VanDerWaalsContact O-N 3.09Å; V838-C842 PolarHBondContact O-SG 3.27Å
839	Q	91.2	Very high	91.3	Very high	75 Å²	75	31.1 Å²	31.1	35%	0.35	16%	0.159	S	C	.	.	H	α-helix	trans	-62.1	-46.9	175.3	-171.6	173.7	10	0	0	110.9	L571 Y602 G836 W837 K841 C842 E843	L571-Q839 HydrophobicContact CD1-CG 4.48Å; L571-Q839 HydrophobicContact CD2-CG 4.42Å; Y602-Q839 HydrophobicContact CE1-CG 3.85Å; G836-Q839 WeakPolarHBondContact O-CB 3.3Å; G836-Q839 PolarHBondContact O-N 3.08Å; W837-Q839 VanDerWaalsContact C-N 3.31Å; W837-Q839 PolarHBondContact O-N 2.83Å; Q839-K841 VanDerWaalsContact C-N 3.35Å; Q839-K841 PolarHBondContact O-N 3.06Å; Q839-C842 WeakPolarHBondContact O-CB 3.19Å; Q839-C842 PolarHBondContact O-N 2.96Å; Q839-E843 WeakPolarHBondContact O-CG 3.49Å; Q839-E843 PolarHBondContact O-N 3.24Å
840	I	94.1	Very high	91.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.5	-41.7	177.5	-67.6	160.3	0	0	0	111.4	L571 L574 V711 F812 Y831 G836 W837 C842 E843 L844	L571-I840 HydrophobicContact CD1-CG1 4.04Å; L574-I840 HydrophobicContact CD2-CB 4.44Å; L574-I840 HydrophobicContact CD2-CG1 4.16Å; L574-I840 HydrophobicContact CD2-CG2 3.86Å; V711-I840 HydrophobicContact CG1-CD1 3.69Å; V711-I840 HydrophobicContact CG2-CD1 4.22Å; F812-I840 HydrophobicContact CD1-CB 4.47Å; F812-I840 HydrophobicContact CD1-CG2 3.98Å; F812-I840 HydrophobicContact CE1-CB 3.71Å; F812-I840 HydrophobicContact CE1-CG2 3.46Å; F812-I840 VanDerWaalsContact CE1-CG2 3.46Å; F812-I840 HydrophobicContact CE2-CG2 4.1Å; F812-I840 HydrophobicContact CG-CG2 4.49Å; F812-I840 HydrophobicContact CZ-CB 4.03Å; F812-I840 HydrophobicContact CZ-CD1 4.14Å; F812-I840 HydrophobicContact CZ-CG2 3.53Å; Y831-I840 HydrophobicContact CD1-CD1 3.44Å; Y831-I840 VanDerWaalsContact CD1-CD1 3.44Å; Y831-I840 HydrophobicContact CD2-CD1 4.28Å; Y831-I840 HydrophobicContact CE1-CD1 4.04Å; Y831-I840 HydrophobicContact CG-CD1 3.58Å; G836-I840 PolarHBondContact O-N 3.47Å; W837-I840 PolarHBondContact O-N 3.35Å; I840-C842 VanDerWaalsContact C-N 3.32Å; I840-C842 PolarHBondContact O-N 3.35Å; I840-E843 PolarHBondContact O-N 3.5Å; I840-L844 HydrophobicContact CG2-CD1 3.89Å; I840-L844 HydrophobicContact CG2-CG 4.27Å; I840-L844 WeakPolarHBondContact O-CG 3.47Å; I840-L844 PolarHBondContact O-N 3.49Å
841	K	95.1	Very high	91.6	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.009	15%	0.147	C	C	.	.	H	α-helix	trans	-54.9	-47.7	173.5	173.9	-174.4	169.5	172	0	111	H607 D610 H809 E813 W837 V838 Q839 L844 R845	H607-K841 PolarHBondContact ND1-NZ 3.28Å; D610-K841 WeakPolarHBondContact OD2-CE 3.45Å; D610-K841 IonicContact OD2-NZ 3.68Å; D610-K841 PolarHBondContact OD2-NZ 3.03Å; H809-K841 HydrophobicContact CB-CG 4.47Å; E813-K841 HydrophobicContact CB-CD 4.14Å; E813-K841 HydrophobicContact CG-CD 4.49Å; E813-K841 IonicContact OE1-NZ 3.02Å; E813-K841 PolarHBondContact OE1-NZ 3.02Å; E813-K841 WeakPolarHBondContact OE2-CE 3.38Å; E813-K841 IonicContact OE2-NZ 2.74Å; E813-K841 PolarHBondContact OE2-NZ 2.81Å; W837-K841 HydrophobicContact CE3-CB 4.31Å; W837-K841 HydrophobicContact CZ3-CB 4.31Å; W837-K841 HydrophobicContact CZ3-CD 3.97Å; W837-K841 PolarHBondContact O-N 3.12Å; V838-K841 WeakPolarHBondContact O-CB 3.23Å; V838-K841 PolarHBondContact O-N 3.45Å; Q839-K841 VanDerWaalsContact C-N 3.35Å; Q839-K841 PolarHBondContact O-N 3.06Å; K841-L844 PolarHBondContact O-N 3.47Å; K841-R845 WeakPolarHBondContact O-CB 3.47Å; K841-R845 PolarHBondContact O-N 3.29Å
842	C	94.7	Very high	91.7	Very high	2 Å²	2	27 Å²	27	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-63	-41.5	178.1	-68.8	0	0	0	0	112.5	A600 D601 Y602 V838 Q839 I840 R845	A600-C842 HydrophobicContact CB-CB 4.17Å; A600-C842 WeakPolarHBondContact CB-O 3.5Å; D601-C842 PolarHBondContact O-SG 3.49Å; Y602-C842 HydrophobicContact CD1-CB 3.49Å; Y602-C842 VanDerWaalsContact CD1-CB 3.49Å; Y602-C842 HydrophobicContact CE1-CB 3.66Å; Y602-C842 HydrophobicContact CG-CB 4.44Å; V838-C842 PolarHBondContact O-N 3.15Å; V838-C842 VanDerWaalsContact O-N 3.09Å; V838-C842 PolarHBondContact O-SG 3.27Å; Q839-C842 WeakPolarHBondContact O-CB 3.19Å; Q839-C842 PolarHBondContact O-N 2.96Å; I840-C842 VanDerWaalsContact C-N 3.32Å; I840-C842 PolarHBondContact O-N 3.35Å; C842-R845 WeakPolarHBondContact O-CB 3.36Å; C842-R845 PolarHBondContact O-N 2.95Å; C842-R845 PolarHBondContact SG-NH2 3.37Å
843	E	95.2	Very high	91.3	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.037	15%	0.151	C	C	.	.	H	α-helix	trans	-59.5	-50.4	174.2	-57.9	-54.2	158	0	0	111.4	L571 K575 I578 Y602 Q839 I840 R845 V846	L571-E843 HydrophobicContact CD1-CG 4.45Å; K575-E843 WeakPolarHBondContact CE-OE1 3.41Å; K575-E843 HydrophobicContact CG-CG 4.18Å; K575-E843 IonicContact NZ-OE1 2.8Å; K575-E843 PolarHBondContact NZ-OE1 2.78Å; K575-E843 IonicContact NZ-OE2 3.42Å; I578-E843 HydrophobicContact CD1-CB 3.61Å; Y602-E843 PolarHBondContact OH-OE1 3.13Å; Q839-E843 WeakPolarHBondContact O-CG 3.49Å; Q839-E843 PolarHBondContact O-N 3.24Å; I840-E843 PolarHBondContact O-N 3.5Å; E843-R845 PolarHBondContact O-N 2.97Å; E843-V846 VanDerWaalsContact O-CB 3.28Å; E843-V846 WeakPolarHBondContact O-CB 3.23Å; E843-V846 WeakPolarHBondContact O-CG2 3.39Å; E843-V846 PolarHBondContact O-N 3.41Å; E843-V846 VanDerWaalsContact O-N 3.15Å
844	L	97	Very high	91.2	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-63.6	-30.3	-177.5	-69.5	174.3	0	0	0	112.8	L574 I578 L704 L708 L808 H809 F812 I840 K841 V846 L847	L574-L844 HydrophobicContact CD1-CD2 4.34Å; I578-L844 HydrophobicContact CD1-CD2 4.41Å; L704-L844 HydrophobicContact CD1-CD2 4.44Å; L708-L844 HydrophobicContact CD1-CD2 4.12Å; L708-L844 HydrophobicContact CD2-CD1 4.18Å; L708-L844 HydrophobicContact CD2-CD2 4.12Å; L808-L844 HydrophobicContact CD2-CD2 4Å; L808-L844 HydrophobicContact CG-CD1 4.43Å; L808-L844 HydrophobicContact CG-CD2 4.46Å; H809-L844 HydrophobicContact CB-CB 3.9Å; F812-L844 HydrophobicContact CB-CD1 4.04Å; F812-L844 HydrophobicContact CD2-CD1 4.36Å; F812-L844 HydrophobicContact CG-CD1 4.06Å; I840-L844 HydrophobicContact CG2-CD1 3.89Å; I840-L844 HydrophobicContact CG2-CG 4.27Å; I840-L844 WeakPolarHBondContact O-CG 3.47Å; I840-L844 PolarHBondContact O-N 3.49Å; K841-L844 PolarHBondContact O-N 3.47Å; L844-V846 PolarHBondContact O-N 3.4Å; L844-L847 WeakPolarHBondContact O-CB 3.48Å; L844-L847 PolarHBondContact O-N 3.15Å; L844-L847 VanDerWaalsContact O-N 3.11Å
845	R	95.3	Very high	91.2	Very high	28 Å²	28	24.7 Å²	24.7	11%	0.106	14%	0.139	C	C	.	.	H	α-helix	trans	-62	-28.2	177.9	-166.9	-175.6	-42.1	177.7	20.8	112.6	S606 H607 D610 H809 K841 C842 E843 L847 S848	S606-R845 PolarHBondContact O-NH1 3.33Å; S606-R845 PolarHBondContact OG-NH1 3.21Å; H607-R845 PolarHBondContact CE1-NH2 3.32Å; H607-R845 PolarHBondContact ND1-NH2 2.99Å; H607-R845 VanDerWaalsContact ND1-NH2 3.19Å; D610-R845 WeakPolarHBondContact OD1-CD 3.26Å; D610-R845 IonicContact OD1-CZ 2.64Å; D610-R845 IonicContact OD1-NE 2.98Å; D610-R845 PolarHBondContact OD1-NE 3.18Å; D610-R845 VanDerWaalsContact OD1-NE 3.09Å; D610-R845 IonicContact OD1-NH1 3.09Å; D610-R845 PolarHBondContact OD1-NH1 3.41Å; D610-R845 IonicContact OD2-CZ 2.64Å; D610-R845 VanDerWaalsContact OD2-CZ 3.29Å; D610-R845 IonicContact OD2-NE 3.99Å; D610-R845 IonicContact OD2-NH1 2.68Å; D610-R845 PolarHBondContact OD2-NH1 2.8Å; D610-R845 IonicContact OD2-NH2 3.12Å; H809-R845 HydrophobicContact CB-CB 4.17Å; K841-R845 WeakPolarHBondContact O-CB 3.47Å; K841-R845 PolarHBondContact O-N 3.29Å; C842-R845 WeakPolarHBondContact O-CB 3.36Å; C842-R845 PolarHBondContact O-N 2.95Å; C842-R845 PolarHBondContact SG-NH2 3.37Å; E843-R845 PolarHBondContact O-N 2.97Å; R845-L847 PolarHBondContact O-N 2.85Å; R845-L847 VanDerWaalsContact O-N 3.13Å; R845-S848 WeakPolarHBondContact O-CB 3.37Å; R845-S848 PolarHBondContact O-N 2.94Å; R845-S848 PolarHBondContact O-OG 3.42Å
846	V	95.6	Very high	91.2	Very high	7 Å²	7	21.4 Å²	21.4	4%	0.042	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-53.5	-35.4	174.7	177.7	0	0	0	0	111.1	I578 V582 T597 A600 E843 L844 S848 Q849	I578-V846 HydrophobicContact CG2-CB 4.03Å; I578-V846 HydrophobicContact CG2-CG1 3.99Å; V582-V846 HydrophobicContact CG2-CG1 3.73Å; T597-V846 VanDerWaalsContact O-CG1 3.25Å; T597-V846 WeakPolarHBondContact O-CG1 3.32Å; A600-V846 HydrophobicContact CB-CG2 3.92Å; E843-V846 VanDerWaalsContact O-CB 3.28Å; E843-V846 WeakPolarHBondContact O-CB 3.23Å; E843-V846 WeakPolarHBondContact O-CG2 3.39Å; E843-V846 PolarHBondContact O-N 3.41Å; E843-V846 VanDerWaalsContact O-N 3.15Å; L844-V846 PolarHBondContact O-N 3.4Å; V846-S848 VanDerWaalsContact C-N 3.3Å; V846-S848 PolarHBondContact O-N 2.81Å; V846-Q849 WeakPolarHBondContact O-CB 3.32Å; V846-Q849 WeakPolarHBondContact O-CG 3.23Å; V846-Q849 PolarHBondContact O-N 2.67Å; V846-Q849 PolarHBondContact O-NE2 3.46Å
847	L	95.4	Very high	91.2	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.021	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-73.7	-16.4	-179.3	-59.9	179.1	0	0	0	113.8	I578 I581 L704 L803 L844 R845 Q849 F850 F852	I578-L847 HydrophobicContact CG1-CD1 4.17Å; I578-L847 HydrophobicContact CG1-CG 4.34Å; I578-L847 HydrophobicContact CG2-CD2 3.99Å; I578-L847 HydrophobicContact CG2-CG 4.27Å; I581-L847 HydrophobicContact CB-CD2 4.03Å; I581-L847 HydrophobicContact CD1-CD1 4.43Å; I581-L847 HydrophobicContact CD1-CD2 4.26Å; I581-L847 HydrophobicContact CG2-CD2 3.78Å; L704-L847 HydrophobicContact CD1-CD1 4.23Å; L704-L847 HydrophobicContact CD2-CD1 3.6Å; L803-L847 HydrophobicContact CD2-CB 4.01Å; L803-L847 HydrophobicContact CD2-CD1 3.72Å; L844-L847 WeakPolarHBondContact O-CB 3.48Å; L844-L847 PolarHBondContact O-N 3.15Å; L844-L847 VanDerWaalsContact O-N 3.11Å; R845-L847 PolarHBondContact O-N 2.85Å; R845-L847 VanDerWaalsContact O-N 3.13Å; L847-Q849 PolarHBondContact O-N 3.13Å; L847-Q849 VanDerWaalsContact O-N 3.09Å; L847-F850 HydrophobicContact CD2-CD2 4.45Å; L847-F850 HydrophobicContact CD2-CE2 4.45Å; L847-F850 PolarHBondContact O-N 2.72Å; L847-F852 HydrophobicContact CB-CE2 4.44Å
848	S	92.2	Very high	90.9	Very high	31 Å²	31	25 Å²	25	22%	0.217	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-67.7	-7.8	174.7	77.4	0	0	0	0	112.5	K682 R845 V846 F850	K682-S848 VanDerWaalsContact CE-O 3.28Å; K682-S848 WeakPolarHBondContact CE-O 3.47Å; K682-S848 PolarHBondContact NZ-O 3.12Å; R845-S848 WeakPolarHBondContact O-CB 3.37Å; R845-S848 PolarHBondContact O-N 2.94Å; R845-S848 PolarHBondContact O-OG 3.42Å; V846-S848 VanDerWaalsContact C-N 3.3Å; V846-S848 PolarHBondContact O-N 2.81Å; S848-F850 VanDerWaalsContact C-N 3.26Å; S848-F850 PolarHBondContact O-N 2.98Å
849	Q	91	Very high	90.6	Very high	46 Å²	46	24.2 Å²	24.2	22%	0.215	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-65.8	-25.9	172.8	-71.2	176.9	92.6	0	0	113.4	T597 K682 V846 L847	T597-Q849 PolarHBondContact O-NE2 2.77Å; K682-Q849 VanDerWaalsContact CD-O 3.31Å; K682-Q849 WeakPolarHBondContact CD-O 3.46Å; K682-Q849 PolarHBondContact NZ-O 3.04Å; V846-Q849 WeakPolarHBondContact O-CB 3.32Å; V846-Q849 WeakPolarHBondContact O-CG 3.23Å; V846-Q849 PolarHBondContact O-N 2.67Å; V846-Q849 PolarHBondContact O-NE2 3.46Å; L847-Q849 PolarHBondContact O-N 3.13Å; L847-Q849 VanDerWaalsContact O-N 3.09Å
850	F	91.8	Very high	90.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	S	Bend	trans	-109.7	156.3	-168.1	-49.2	-71.2	0	0	0	112.9	V582 F585 H593 A596 Q806 L847 S848 F852	V582-F850 HydrophobicContact CB-CE2 4.44Å; V582-F850 HydrophobicContact CB-CZ 4.12Å; V582-F850 HydrophobicContact CG1-CZ 4.09Å; V582-F850 HydrophobicContact CG2-CE2 3.74Å; V582-F850 HydrophobicContact CG2-CZ 3.84Å; F585-F850 HydrophobicContact CB-CD1 3.5Å; F585-F850 VanDerWaalsContact CB-CD1 3.5Å; F585-F850 HydrophobicContact CB-CE1 3.45Å; F585-F850 VanDerWaalsContact CB-CE1 3.45Å; F585-F850 HydrophobicContact CB-CG 4.36Å; F585-F850 HydrophobicContact CB-CZ 4.3Å; F585-F850 HydrophobicContact CD1-CB 4.03Å; F585-F850 AromaticContact CD1-CD1 3.63Å; F585-F850 HydrophobicContact CD1-CD1 3.63Å; F585-F850 HydrophobicContact CD1-CE1 4.47Å; F585-F850 HydrophobicContact CD1-CG 4.07Å; F585-F850 HydrophobicContact CD2-CB 4.06Å; F585-F850 AromaticContact CD2-CD1 3.7Å; F585-F850 HydrophobicContact CD2-CD1 3.7Å; F585-F850 HydrophobicContact CD2-CD2 4.14Å; F585-F850 HydrophobicContact CD2-CE1 4.18Å; F585-F850 AromaticContact CD2-CG 3.68Å; F585-F850 HydrophobicContact CD2-CG 3.68Å; F585-F850 HydrophobicContact CE1-CB 3.72Å; F585-F850 HydrophobicContact CE1-CD1 4.23Å; F585-F850 HydrophobicContact CE1-CG 4.24Å; F585-F850 HydrophobicContact CE2-CB 3.78Å; F585-F850 HydrophobicContact CE2-CD1 4.3Å; F585-F850 HydrophobicContact CE2-CD2 4.36Å; F585-F850 AromaticContact CE2-CG 3.89Å; F585-F850 HydrophobicContact CE2-CG 3.89Å; F585-F850 HydrophobicContact CG-CB 4.18Å; F585-F850 AromaticContact CG-CD1 3.32Å; F585-F850 HydrophobicContact CG-CD1 3.32Å; F585-F850 AromaticContact CG-CE1 3.81Å; F585-F850 HydrophobicContact CG-CE1 3.81Å; F585-F850 AromaticContact CG-CG 3.77Å; F585-F850 HydrophobicContact CG-CG 3.77Å; F585-F850 HydrophobicContact CZ-CB 3.59Å; F585-F850 HydrophobicContact CZ-CG 4.15Å; H593-F850 HydrophobicContact CB-CE1 4.27Å; H593-F850 AromaticContact CG-CD1 3.97Å; H593-F850 AromaticContact ND1-CD1 3.92Å; A596-F850 HydrophobicContact CB-CE1 3.57Å; A596-F850 HydrophobicContact CB-CZ 3.78Å; Q806-F850 PolarHBondContact NE2-O 2.93Å; L847-F850 HydrophobicContact CD2-CD2 4.45Å; L847-F850 HydrophobicContact CD2-CE2 4.45Å; L847-F850 PolarHBondContact O-N 2.72Å; S848-F850 VanDerWaalsContact C-N 3.26Å; S848-F850 PolarHBondContact O-N 2.98Å; F850-F852 HydrophobicContact CB-CD2 4.39Å; F850-F852 HydrophobicContact CB-CE2 3.8Å; F850-F852 HydrophobicContact CB-CZ 4.17Å; F850-F852 HydrophobicContact CD2-CZ 4.48Å
851	A	87.3	Confident	88.7	Confident	6 Å²	6	25 Å²	25	5%	0.05	13%	0.132	C	C	.	.			trans	-95.4	125.2	169.2	0	0	0	0	0	109.7	K682 N683	K682-A851 HydrophobicContact CB-CB 4.14Å; N683-A851 WeakPolarHBondContact O-CB 3.26Å
852	F	89.9	Confident	87.1	Confident	2 Å²	2	28 Å²	28	1%	0.009	15%	0.154	C	C	.	.			trans	-111.2	144.3	177.5	-68.5	-88.6	0	0	0	110.4	I581 F585 I696 V700 L803 N804 L847 F850 L854	I581-F852 HydrophobicContact CG2-CE1 4.08Å; I581-F852 HydrophobicContact CG2-CZ 3.87Å; F585-F852 HydrophobicContact CE2-CD1 4.35Å; F585-F852 AromaticContact CE2-CE1 3.63Å; F585-F852 HydrophobicContact CE2-CE1 3.63Å; F585-F852 AromaticContact CE2-CZ 3.74Å; F585-F852 HydrophobicContact CE2-CZ 3.74Å; F585-F852 HydrophobicContact CZ-CD1 4.12Å; F585-F852 AromaticContact CZ-CE1 3.85Å; F585-F852 HydrophobicContact CZ-CE1 3.85Å; F585-F852 HydrophobicContact CZ-CZ 4.09Å; I696-F852 HydrophobicContact CD1-CE1 4.19Å; V700-F852 HydrophobicContact CG2-CE1 4.26Å; L803-F852 HydrophobicContact CB-CB 4.14Å; L803-F852 HydrophobicContact CB-CD1 4.4Å; L803-F852 HydrophobicContact CB-CD2 3.82Å; L803-F852 HydrophobicContact CB-CE2 4.29Å; L803-F852 HydrophobicContact CB-CG 3.87Å; L803-F852 HydrophobicContact CD1-CD1 4.44Å; L803-F852 HydrophobicContact CD1-CE1 4.34Å; L803-F852 HydrophobicContact CD2-CD2 4.37Å; L803-F852 HydrophobicContact CD2-CE2 4Å; L803-F852 HydrophobicContact CD2-CZ 4.26Å; N804-F852 WeakPolarHBondContact OD1-CB 3.4Å; N804-F852 PolarHBondContact OD1-O 3.5Å; L847-F852 HydrophobicContact CB-CE2 4.44Å; F850-F852 HydrophobicContact CB-CD2 4.39Å; F850-F852 HydrophobicContact CB-CE2 3.8Å; F850-F852 HydrophobicContact CB-CZ 4.17Å; F850-F852 HydrophobicContact CD2-CZ 4.48Å; F852-L854 HydrophobicContact CB-CD1 4.22Å; F852-L854 HydrophobicContact CB-CG 4.17Å; F852-L854 HydrophobicContact CD1-CD1 3.97Å; F852-L854 HydrophobicContact CD1-CG 4.32Å; F852-L854 HydrophobicContact CG-CD1 4.39Å
853	H	84.3	Confident	85.5	Confident	31 Å²	31	30.5 Å²	30.5	14%	0.144	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-131.8	77.8	170.7	-102.4	70.4	0	0	0	108.4	D678 E679 G688 D689 D690	D678-H853 PolarHBondContact O-NE2 3.26Å; E679-H853 WeakPolarHBondContact CG-CE1 3.13Å; E679-H853 IonicContact OE1-CE1 2.68Å; G688-H853 PolarHBondContact O-N 2.94Å; D689-H853 WeakPolarHBondContact CA-O 3.49Å; D689-H853 HydrophobicContact CB-CB 3.84Å; D690-H853 PolarHBondContact N-O 3.45Å
854	L	88.3	Confident	83.4	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.016	19%	0.189	C	C	.	.			trans	-107.9	123.3	-175.9	-57.2	170.6	0	0	0	110.3	D690 I696 V700 C800 L803 N804 F852 P856	D690-L854 HydrophobicContact CB-CD2 3.99Å; D690-L854 WeakPolarHBondContact OD2-CA 3.22Å; I696-L854 HydrophobicContact CG1-CD2 4.24Å; I696-L854 HydrophobicContact CG2-CD2 3.95Å; V700-L854 HydrophobicContact CB-CD1 4.32Å; V700-L854 HydrophobicContact CG1-CD1 3.83Å; V700-L854 HydrophobicContact CG2-CD1 4.11Å; C800-L854 HydrophobicContact CB-CB 3.89Å; C800-L854 HydrophobicContact CB-CD1 4.15Å; L803-L854 HydrophobicContact CB-CD1 4.18Å; L803-L854 HydrophobicContact CD1-CD1 3.82Å; N804-L854 PolarHBondContact ND2-N 2.92Å; N804-L854 PolarHBondContact ND2-O 3.24Å; N804-L854 WeakPolarHBondContact OD1-CB 3.43Å; N804-L854 PolarHBondContact OD1-N 3.15Å; F852-L854 HydrophobicContact CB-CD1 4.22Å; F852-L854 HydrophobicContact CB-CG 4.17Å; F852-L854 HydrophobicContact CD1-CD1 3.97Å; F852-L854 HydrophobicContact CD1-CG 4.32Å; F852-L854 HydrophobicContact CG-CD1 4.39Å; L854-P856 WeakPolarHBondContact O-CD 3.44Å
855	S	85.5	Confident	80.9	Confident	37 Å²	37	40.1 Å²	40.1	26%	0.259	22%	0.215	S	C	.	.			trans	-64.9	112.6	179	175.4	0	0	0	0	112.5	D690 R701 T857 Y858	D690-S855 PolarHBondContact OD1-N 3.45Å; D690-S855 VanDerWaalsContact OD1-N 3.12Å; D690-S855 PolarHBondContact OD2-N 3.42Å; R701-S855 PolarHBondContact NH2-O 3.37Å; S855-T857 PolarHBondContact O-N 3.16Å; S855-T857 VanDerWaalsContact O-N 3.07Å; S855-T857 PolarHBondContact OG-OG1 3.12Å; S855-Y858 WeakPolarHBondContact O-CB 3.46Å; S855-Y858 PolarHBondContact O-N 3.34Å; S855-Y858 PolarHBondContact OG-N 3.04Å
856	P	84.1	Confident	78.3	Confident	46 Å²	46	45.6 Å²	45.6	30%	0.299	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.9	179.9	-21.9	35.7	0	0	0	113.5	S797 L854	S797-P856 VanDerWaalsContact CB-O 3.22Å; S797-P856 WeakPolarHBondContact CB-O 3.42Å; S797-P856 PolarHBondContact OG-O 3.02Å; L854-P856 WeakPolarHBondContact O-CD 3.44Å
857	T	84.7	Confident	75.5	Confident	56 Å²	56	49.6 Å²	49.6	34%	0.344	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	8.2	-178.6	55	0	0	0	0	113.2	S855 E859 L860	S855-T857 PolarHBondContact O-N 3.16Å; S855-T857 VanDerWaalsContact O-N 3.07Å; S855-T857 PolarHBondContact OG-OG1 3.12Å; T857-E859 PolarHBondContact O-N 2.92Å; T857-L860 HydrophobicContact CG2-CD1 4Å; T857-L860 WeakPolarHBondContact O-CB 3.37Å; T857-L860 PolarHBondContact O-N 2.7Å
858	Y	85.2	Confident	72.7	Confident	87 Å²	87	55.1 Å²	55.1	34%	0.341	29%	0.287	S	S	.	.	H	α-helix	trans	-45.7	-44.2	-176.8	-176	-92.1	0	0	0	113.7	I697 S855	I697-Y858 HydrophobicContact CD1-CE2 3.77Å; I697-Y858 HydrophobicContact CG2-CE1 4.04Å; S855-Y858 WeakPolarHBondContact O-CB 3.46Å; S855-Y858 PolarHBondContact O-N 3.34Å; S855-Y858 PolarHBondContact OG-N 3.04Å
859	E	84.5	Confident	70.1	Confident	35 Å²	35	59.1 Å²	59.1	16%	0.164	30%	0.304	C	S	.	.	H	α-helix	trans	-83.1	-18.6	-176.8	-63.9	-174.6	68.9	0	0	114.2	I793 R796 T857 N861 S862 L863	I793-E859 HydrophobicContact CG2-CB 3.88Å; R796-E859 VanDerWaalsContact CZ-CD 3.42Å; R796-E859 IonicContact CZ-OE1 3.51Å; R796-E859 IonicContact CZ-OE2 3.09Å; R796-E859 IonicContact NE-OE2 2.71Å; R796-E859 IonicContact NH1-OE1 2.9Å; R796-E859 PolarHBondContact NH1-OE1 2.66Å; R796-E859 IonicContact NH1-OE2 2.78Å; R796-E859 PolarHBondContact NH1-OE2 2.75Å; R796-E859 IonicContact NH2-OE1 3.49Å; R796-E859 PolarHBondContact NH2-OE1 3.36Å; R796-E859 IonicContact NH2-OE2 3.79Å; R796-E859 PolarHBondContact NH2-OE2 2.54Å; T857-E859 PolarHBondContact O-N 2.92Å; E859-N861 VanDerWaalsContact C-N 3.31Å; E859-S862 WeakPolarHBondContact O-CB 3.37Å; E859-S862 PolarHBondContact O-N 3.19Å; E859-L863 PolarHBondContact O-N 3.2Å
860	L	79.9	Confident	67.4	Low	8 Å²	8	66.3 Å²	66.3	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-67.9	-35.6	175.4	-59.9	-171.7	0	0	0	111.2	A787 A789 I793 T857 S862 L863 Q864	A787-L860 HydrophobicContact CB-CD1 4.46Å; A787-L860 HydrophobicContact CB-CD2 3.83Å; A789-L860 HydrophobicContact CB-CD2 3.63Å; I793-L860 HydrophobicContact CG2-CD2 4.33Å; T857-L860 HydrophobicContact CG2-CD1 4Å; T857-L860 WeakPolarHBondContact O-CB 3.37Å; T857-L860 PolarHBondContact O-N 2.7Å; L860-S862 PolarHBondContact O-N 3.42Å; L860-L863 HydrophobicContact CD2-CD1 4.19Å; L860-L863 WeakPolarHBondContact O-CB 3.29Å; L860-L863 PolarHBondContact O-N 3.49Å; L860-Q864 PolarHBondContact O-N 3.48Å
861	N	66.7	Low	64.7	Low	83 Å²	83	73.4 Å²	73.4	44%	0.444	36%	0.363	S	S	.	.	H	α-helix	trans	-59.1	-34	176.2	-64.3	-18.8	0	0	0	111.6	E859 N865	E859-N861 VanDerWaalsContact C-N 3.31Å; N861-N865 PolarHBondContact O-N 3.03Å; N861-N865 PolarHBondContact O-ND2 3.03Å
862	S	61.5	Low	62.1	Low	66 Å²	66	79.5 Å²	79.5	46%	0.462	40%	0.395	S	S	.	.	H	α-helix	trans	-71	-37.7	176.4	-62.4	0	0	0	0	112	E859 L860 N865 F866	E859-S862 WeakPolarHBondContact O-CB 3.37Å; E859-S862 PolarHBondContact O-N 3.19Å; L860-S862 PolarHBondContact O-N 3.42Å; S862-N865 PolarHBondContact O-N 2.98Å; S862-F866 WeakPolarHBondContact O-CD2 3.41Å; S862-F866 PolarHBondContact O-N 3.38Å
863	L	59.8	Low	59.3	Low	55 Å²	55	83 Å²	83	29%	0.288	42%	0.419	S	S	.	.	H	α-helix	trans	-68.3	-38.1	177.4	-67.8	172.8	0	0	0	112.4	A789 I793 E859 L860 F866 N867	A789-L863 HydrophobicContact CB-CD1 3.97Å; I793-L863 HydrophobicContact CD1-CD1 3.75Å; E859-L863 PolarHBondContact O-N 3.2Å; L860-L863 HydrophobicContact CD2-CD1 4.19Å; L860-L863 WeakPolarHBondContact O-CB 3.29Å; L860-L863 PolarHBondContact O-N 3.49Å; L863-F866 PolarHBondContact O-N 2.97Å; L863-N867 PolarHBondContact O-N 3.38Å; L863-N867 VanDerWaalsContact O-N 3.11Å; L863-N867 PolarHBondContact O-ND2 2.89Å
864	Q	52.1	Low	56.6	Low	107 Å²	107	90.6 Å²	90.6	50%	0.5	45%	0.452	S	S	.	.	H	α-helix	trans	-64.5	-40.1	177	-70.6	178	-8.5	0	0	111.7	L860 F866 N867 H868	L860-Q864 PolarHBondContact O-N 3.48Å; Q864-F866 PolarHBondContact O-N 3.34Å; Q864-N867 PolarHBondContact O-N 2.96Å; Q864-H868 PolarHBondContact O-CD2 3.45Å; Q864-H868 PolarHBondContact O-N 3.45Å; Q864-H868 VanDerWaalsContact O-N 3.16Å
865	N	43.2	Very low	53.8	Low	105 Å²	105	96.4 Å²	96.4	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-65.2	-37.2	175.5	-75.9	-26.8	0	0	0	113	N861 S862 I869	N861-N865 PolarHBondContact O-N 3.03Å; N861-N865 PolarHBondContact O-ND2 3.03Å; S862-N865 PolarHBondContact O-N 2.98Å; N865-I869 WeakPolarHBondContact O-CD1 3.22Å; N865-I869 VanDerWaalsContact O-CG1 3.31Å; N865-I869 WeakPolarHBondContact O-CG1 3.42Å; N865-I869 PolarHBondContact O-N 3.44Å
866	F	40.4	Very low	50.9	Low	143 Å²	143	101.3 Å²	101.3	63%	0.627	52%	0.516	S	S	*	.	H	α-helix	trans	-70.6	-33.7	176.4	-93.5	-81.1	0	0	0	113.5	S862 L863 Q864 I869 R870	S862-F866 WeakPolarHBondContact O-CD2 3.41Å; S862-F866 PolarHBondContact O-N 3.38Å; L863-F866 PolarHBondContact O-N 2.97Å; Q864-F866 PolarHBondContact O-N 3.34Å; F866-I869 PolarHBondContact O-N 2.66Å; F866-R870 PolarHBondContact O-N 3.31Å; F866-R870 VanDerWaalsContact O-N 3.1Å
867	N	38	Very low	48.4	Very low	90 Å²	90	104.7 Å²	104.7	48%	0.481	54%	0.538	S	S	.	.	H	α-helix	trans	-71.1	-35.3	176.6	-74.5	-26.8	0	0	0	112.1	L863 Q864 Q871	L863-N867 PolarHBondContact O-N 3.38Å; L863-N867 VanDerWaalsContact O-N 3.11Å; L863-N867 PolarHBondContact O-ND2 2.89Å; Q864-N867 PolarHBondContact O-N 2.96Å; N867-Q871 WeakPolarHBondContact O-CB 3.41Å; N867-Q871 WeakPolarHBondContact O-CG 3.33Å; N867-Q871 PolarHBondContact O-N 3.19Å; N867-Q871 VanDerWaalsContact O-N 3.15Å
868	H	37.1	Very low	45.7	Very low	121 Å²	121	111.5 Å²	111.5	56%	0.56	56%	0.563	S	S	*	*	H	α-helix	trans	-69.2	-33.8	172.9	-82.7	-64.6	0	0	0	113.5	Q864 N872	Q864-H868 PolarHBondContact O-CD2 3.45Å; Q864-H868 PolarHBondContact O-N 3.45Å; Q864-H868 VanDerWaalsContact O-N 3.16Å; H868-N872 WeakPolarHBondContact O-CB 3.42Å; H868-N872 PolarHBondContact O-N 3.35Å
869	I	37.6	Very low	43	Very low	115 Å²	115	114.7 Å²	114.7	59%	0.59	59%	0.585	S	S	*	*	H	α-helix	trans	-76	-33.4	178.3	-65.8	166.7	0	0	0	112	N865 F866 S873	N865-I869 WeakPolarHBondContact O-CD1 3.22Å; N865-I869 VanDerWaalsContact O-CG1 3.31Å; N865-I869 WeakPolarHBondContact O-CG1 3.42Å; N865-I869 PolarHBondContact O-N 3.44Å; F866-I869 PolarHBondContact O-N 2.66Å; I869-S873 PolarHBondContact O-OG 3.37Å
870	R	32.8	Very low	40.4	Very low	196 Å²	196	121.6 Å²	121.6	74%	0.74	62%	0.615	S	S	*	*	H	α-helix	trans	-75.7	-27	174.6	-84.5	-172.1	174.6	-174.1	0.9	113.9	F866	F866-R870 PolarHBondContact O-N 3.31Å; F866-R870 VanDerWaalsContact O-N 3.1Å
871	Q	36.2	Very low	38	Very low	150 Å²	150	126.8 Å²	126.8	70%	0.701	65%	0.647	S	S	*	*	H	α-helix	trans	-82.2	-20.9	176.2	-73.4	-178.3	-4.6	0	0	113.4	N867	N867-Q871 WeakPolarHBondContact O-CB 3.41Å; N867-Q871 WeakPolarHBondContact O-CG 3.33Å; N867-Q871 PolarHBondContact O-N 3.19Å; N867-Q871 VanDerWaalsContact O-N 3.15Å
872	N	33.1	Very low	36.3	Very low	134 Å²	134	127.9 Å²	127.9	72%	0.717	66%	0.661	S	S	*	*	S	Bend	trans	-101.4	7.7	179.6	-78	-12.6	0	0	0	115.6	H868	H868-N872 WeakPolarHBondContact O-CB 3.42Å; H868-N872 PolarHBondContact O-N 3.35Å
873	S	29.8	Very low	34.9	Very low	75 Å²	75	129.7 Å²	129.7	52%	0.524	67%	0.674	S	S	.	*	S	Bend	trans	-113.5	13.6	-180	49.2	0	0	0	0	115.1	I869	I869-S873 PolarHBondContact O-OG 3.37Å
874	F	28.1	Very low	33.5	Very low	190 Å²	190	131.7 Å²	131.7	83%	0.833	69%	0.693	S	S	*	*	S	Bend	trans	-122.6	56.6	174.4	-91.2	-84.5	0	0	0	112.6
875	T	28.9	Very low	32.6	Very low	126 Å²	126	134.2 Å²	134.2	77%	0.773	71%	0.709	S	S	*	*			trans	-150.7	82.8	163	37.1	0	0	0	0	110.1
876	V	25.9	Very low	32.1	Very low	139 Å²	139	133.7 Å²	133.7	84%	0.842	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-84.9	121.4	161.4	178.7	0	0	0	0	108.1
877	P	31.9	Very low	31.8	Very low	118 Å²	118	135 Å²	135	77%	0.766	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-77.7	125.6	173.9	-8.8	25.9	0	0	0	110.8	L879	P877-L879 PolarHBondContact O-N 3.35Å
878	K	26.5	Very low	31.5	Very low	198 Å²	198	136 Å²	136	86%	0.861	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-59.6	126.3	167.7	-75.6	173.5	174.1	171.7	0	110.8
879	L	28.3	Very low	31.1	Very low	155 Å²	155	140.8 Å²	140.8	81%	0.812	75%	0.751	S	S	*	*			trans	-156.3	106.4	144.7	-107.9	121.2	0	0	0	112.7	P877	P877-L879 PolarHBondContact O-N 3.35Å
880	F	30	Very low	30.8	Very low	180 Å²	180	147.4 Å²	147.4	79%	0.789	77%	0.769	S	S	*	*			trans	66.7	128.7	141.5	-73.4	-90.9	0	0	0	124.8
881	T	30.4	Very low	30.7	Very low	117 Å²	117	142.6 Å²	142.6	72%	0.718	76%	0.761	S	S	*	*			trans	95	107.1	137.2	49	0	0	0	0	121.9
882	S	30.5	Very low	30.6	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	77%	0.771	S	S	*	*			trans	51.2	127.5	133.9	62.7	0	0	0	0	118.7
883	S	33	Very low	30.4	Very low	104 Å²	104	146.9 Å²	146.9	73%	0.727	78%	0.779	S	S	*	*			cis	-169.6	143.9	47	-38.6	0	0	0	0	110.3
884	S	31	Very low	30.7	Very low	98 Å²	98	149 Å²	149	69%	0.685	79%	0.794	S	S	*	*			trans	17.1	121.7	146.4	55.6	0	0	0	0	120.3
885	D	33.1	Very low	30.9	Very low	159 Å²	159	143.9 Å²	143.9	85%	0.85	79%	0.794	S	S	*	*				-168.6	154.6	87.7	-103.8	-23.8	0	0	0	113.8
886	S	32.7	Very low	31	Very low	95 Å²	95	142.8 Å²	142.8	66%	0.664	79%	0.792	S	S	*	*			trans	-81.8	151.3	-162.5	52.9	0	0	0	0	116.5
887	L	32.2	Very low	31.2	Very low	170 Å²	170	145.3 Å²	145.3	89%	0.89	79%	0.792	S	S	*	*				-171.6	148.5	121.1	-96.1	142.1	0	0	0	112.1
888	P	33.2	Very low	31.1	Very low	111 Å²	111	146.1 Å²	146.1	72%	0.721	79%	0.794	S	S	*	*			trans	-117.3	158.4	-149.2	41.2	-31.3	0	0	0	117.4
889	R	28	Very low	31.2	Very low	221 Å²	221	140.6 Å²	140.6	83%	0.834	79%	0.786	S	S	*	*			trans	19.3	131.8	139.2	-101	176.3	-179.6	176	2	120
890	R	32.4	Very low	31.1	Very low	255 Å²	255	138.3 Å²	138.3	96%	0.962	78%	0.782	S	S	*	*			trans	-138.5	109.6	131.7	-118.4	179.1	177.4	-179	-0.6	111.9
891	T	30.1	Very low	31	Very low	94 Å²	94	135.5 Å²	135.5	58%	0.577	78%	0.78	S	S	*	*			trans	-81.2	153.4	163	48	0	0	0	0	110
892	N	33.3	Very low	31	Very low	172 Å²	172	138.1 Å²	138.1	92%	0.92	79%	0.789	S	S	*	*			trans	-150.4	123.9	136.3	-100.3	-14.4	0	0	0	111.8
893	K	30.3	Very low	30.8	Very low	203 Å²	203	136 Å²	136	88%	0.883	78%	0.784	S	S	*	*			trans	-92.3	150.1	169.1	-75.5	175.6	170.9	178.6	0	109
894	S	35.1	Very low	30.5	Very low	120 Å²	120	139 Å²	139	84%	0.839	79%	0.792	S	S	*	*			trans	-168.5	111.3	140.6	51.4	0	0	0	0	106.5
895	G	31.7	Very low	30.4	Very low	81 Å²	81	138.9 Å²	138.9	84%	0.835	80%	0.797	S	S	*	*				89.9	140.7	73.3	0	0	0	0	0	108.6
896	S	32	Very low	30.3	Very low	104 Å²	104	139.7 Å²	139.7	73%	0.727	80%	0.8	S	S	*	*			cis	-173.5	145.5	1.8	162	0	0	0	0	106.8
897	K	28.8	Very low	30	Very low	192 Å²	192	141.7 Å²	141.7	84%	0.835	80%	0.804	S	S	*	*			trans	29.7	140.4	146.4	-64.7	172	172.5	178.3	0	119.7
898	V	30.7	Very low	29.9	Very low	134 Å²	134	144 Å²	144	81%	0.812	81%	0.807	S	S	*	*				-171.3	114.3	82	166.6	0	0	0	0	107
899	A	28.9	Very low	29.6	Very low	83 Å²	83	145.9 Å²	145.9	69%	0.686	81%	0.806	S	S	*	*				63.9	109.3	97.9	0	0	0	0	0	117.9
900	S	26.2	Very low	29.6	Very low	106 Å²	106	144.9 Å²	144.9	74%	0.741	81%	0.807	S	S	*	*			trans	46.8	125.4	134.3	61.1	0	0	0	0	121.5
901	T	27.2	Very low	29.6	Very low	122 Å²	122	138 Å²	138	75%	0.748	79%	0.794	S	S	*	*				159.3	148.7	104.3	-56.1	0	0	0	0	110.7
902	L	30.9	Very low	30	Very low	171 Å²	171	142.2 Å²	142.2	90%	0.895	80%	0.804	S	S	*	*			trans	102.7	103.1	173.2	-63.1	149.7	0	0	0	112.9
903	G	26.8	Very low	29.9	Very low	62 Å²	62	138.2 Å²	138.2	64%	0.639	79%	0.787	S	S	*	*			cis	106.3	97.6	19.3	0	0	0	0	0	110.9
904	N	27.1	Very low	30	Very low	167 Å²	167	134.4 Å²	134.4	89%	0.893	78%	0.776	S	S	*	*			trans	70.6	112.6	157.1	-58.2	-13.4	0	0	0	119.6
905	A	28.7	Very low	29.8	Very low	95 Å²	95	136.9 Å²	136.9	79%	0.785	77%	0.774	S	S	*	*				160.5	113.8	106.3	0	0	0	0	0	110.9
906	L	30	Very low	29.7	Very low	175 Å²	175	143.1 Å²	143.1	92%	0.916	77%	0.772	S	S	*	*			trans	-176	111.7	133.3	-95	162.6	0	0	0	108.7
907	D	26.6	Very low	29.7	Very low	138 Å²	138	144.1 Å²	144.1	74%	0.738	77%	0.769	S	S	*	*			trans	-60.1	128.8	-170.4	-73.9	-62.7	0	0	0	115.9
908	F	29.8	Very low	29.9	Very low	218 Å²	218	140.4 Å²	140.4	96%	0.956	76%	0.762	S	S	*	*			trans	-117.3	63.8	155.3	-89.2	-84.4	0	0	0	110	K910	F908-K910 PolarHBondContact O-N 2.99Å
909	H	26.4	Very low	29.9	Very low	150 Å²	150	139.3 Å²	139.3	69%	0.694	76%	0.756	S	S	*	*			trans	-86.2	99.9	164.7	-101.7	-75.3	0	0	0	109.3
910	K	28	Very low	30	Very low	200 Å²	200	138.3 Å²	138.3	87%	0.87	75%	0.748	S	S	*	*			trans	156.4	90.9	151.1	-88.6	165.4	-175.9	-175.5	0	110.5	F908	F908-K910 PolarHBondContact O-N 2.99Å
911	V	34.1	Very low	30.2	Very low	112 Å²	112	138 Å²	138	68%	0.679	75%	0.746	S	S	*	*			trans	-169.3	86.9	137.3	-178.4	0	0	0	0	106.8	P913 L914	V911-P913 VanDerWaalsContact C-CD 3.43Å; V911-L914 HydrophobicContact CG1-CD1 4.11Å
912	K	37	Very low	30.4	Very low	182 Å²	182	137.2 Å²	137.2	79%	0.791	75%	0.745	S	S	*	*			trans	-86.6	1.5	-177.9	-87	-177.8	174.8	-179.9	0	118.2
913	P	32.1	Very low	30.5	Very low	88 Å²	88	134.4 Å²	134.4	57%	0.571	74%	0.735	S	S	*	*	S	Bend	trans	-84.6	-25	175.9	-14.2	30.6	0	0	0	116.2	V911	V911-P913 VanDerWaalsContact C-CD 3.43Å
914	L	31.3	Very low	30.8	Very low	123 Å²	123	137 Å²	137	64%	0.644	74%	0.738	S	S	*	*	H	α-helix	trans	-82.5	-23.9	-166.1	-79.4	159.8	0	0	0	115.3	V911	V911-L914 HydrophobicContact CG1-CD1 4.11Å
915	Q	31.8	Very low	31	Very low	172 Å²	172	132.5 Å²	132.5	80%	0.804	71%	0.714	S	S	*	*	H	α-helix	trans	-81.8	-13.8	178.6	-102.8	173.2	-14.5	0	0	114.4	T919	Q915-T919 PolarHBondContact O-OG1 2.92Å; Q915-T919 VanDerWaalsContact O-OG1 3.07Å
916	R	29.8	Very low	31.3	Very low	211 Å²	211	134.1 Å²	134.1	80%	0.796	72%	0.716	S	S	*	*	H	α-helix	trans	-89.4	-21.1	174.5	-77	-178.4	176	165	-3.6	113.5	A920	R916-A920 PolarHBondContact O-N 3.45Å
917	L	31	Very low	31.3	Very low	126 Å²	126	128.3 Å²	128.3	66%	0.66	69%	0.685	S	S	*	*	H	α-helix	trans	-75.6	-35.5	173.5	-102.9	109.4	0	0	0	112.5	T919 A920 S921	L917-T919 PolarHBondContact O-N 3.16Å; L917-A920 PolarHBondContact O-N 3.46Å; L917-A920 VanDerWaalsContact O-N 3.13Å; L917-S921 PolarHBondContact O-N 3.21Å
918	V	32.9	Very low	31.7	Very low	113 Å²	113	125 Å²	125	69%	0.685	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-25.1	178.6	177.7	0	0	0	0	112.1	S921	V918-S921 PolarHBondContact O-OG 2.77Å
919	T	31.1	Very low	31.7	Very low	111 Å²	111	120.2 Å²	120.2	68%	0.681	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-7.4	174.9	3.6	0	0	0	0	114.3	Q915 L917	Q915-T919 PolarHBondContact O-OG1 2.92Å; Q915-T919 VanDerWaalsContact O-OG1 3.07Å; L917-T919 PolarHBondContact O-N 3.16Å
920	A	30.8	Very low	31.9	Very low	62 Å²	62	118 Å²	118	51%	0.512	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95	-9.4	173.9	0	0	0	0	0	113	R916 L917 S922 V923	R916-A920 PolarHBondContact O-N 3.45Å; L917-A920 PolarHBondContact O-N 3.46Å; L917-A920 VanDerWaalsContact O-N 3.13Å; A920-S922 PolarHBondContact O-N 3.04Å; A920-S922 VanDerWaalsContact O-N 3.08Å; A920-V923 PolarHBondContact O-N 3.3Å
921	S	30.1	Very low	31.9	Very low	100 Å²	100	114.2 Å²	114.2	70%	0.699	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	5.2	-179.8	68.2	0	0	0	0	115.6	L917 V918	L917-S921 PolarHBondContact O-N 3.21Å; V918-S921 PolarHBondContact O-OG 2.77Å
922	S	32.5	Very low	31.6	Very low	105 Å²	105	114.7 Å²	114.7	73%	0.734	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	15.5	177.4	70	0	0	0	0	113.8	A920	A920-S922 PolarHBondContact O-N 3.04Å; A920-S922 VanDerWaalsContact O-N 3.08Å
923	V	32.4	Very low	31.1	Very low	112 Å²	112	114 Å²	114	68%	0.679	66%	0.657	S	S	*	*	S	Bend	trans	-134	128.4	-179.9	-177.2	0	0	0	0	108.8	A920 D925	A920-V923 PolarHBondContact O-N 3.3Å; V923-D925 PolarHBondContact O-N 3.41Å
924	V	33.6	Very low	30.9	Very low	116 Å²	116	114 Å²	114	70%	0.703	66%	0.66	S	S	*	*			trans	-29.5	114.9	175.7	-178.6	0	0	0	0	112	P926	V924-P926 WeakPolarHBondContact O-CD 3.21Å
925	D	32	Very low	30.5	Very low	73 Å²	73	116.8 Å²	116.8	39%	0.39	67%	0.674	S	S	.	*			trans	-89.8	111	177.8	-174	-5.1	0	0	0	108.9	V923 M927 N928	V923-D925 PolarHBondContact O-N 3.41Å; D925-M927 PolarHBondContact O-N 3.42Å; D925-M927 VanDerWaalsContact OD1-CB 3.23Å; D925-M927 WeakPolarHBondContact OD1-CB 3.42Å; D925-M927 PolarHBondContact OD1-N 2.89Å; D925-M927 VanDerWaalsContact OD1-N 3.1Å; D925-N928 PolarHBondContact O-N 2.91Å
926	P	33.1	Very low	30.3	Very low	129 Å²	129	112.4 Å²	112.4	84%	0.838	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-2.4	-179.7	25.6	-33.7	0	0	0	113.7	V924	V924-P926 WeakPolarHBondContact O-CD 3.21Å
927	M	30.4	Very low	30.3	Very low	54 Å²	54	107.6 Å²	107.6	27%	0.266	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.6	-7.1	-178.7	-141.7	171	70.5	0	0	114.5	K756 H778 D925	K756-M927 WeakPolarHBondContact CE-O 3.49Å; K756-M927 PolarHBondContact NZ-O 3.26Å; H778-M927 VanDerWaalsContact CE1-CE 3.41Å; H778-M927 WeakPolarHBondContact CE1-CE 3.49Å; D925-M927 PolarHBondContact O-N 3.42Å; D925-M927 VanDerWaalsContact OD1-CB 3.23Å; D925-M927 WeakPolarHBondContact OD1-CB 3.42Å; D925-M927 PolarHBondContact OD1-N 2.89Å; D925-M927 VanDerWaalsContact OD1-N 3.1Å
928	N	35.8	Very low	30	Very low	68 Å²	68	109.5 Å²	109.5	36%	0.364	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-145.3	-2.2	-172.9	-86.3	-41.2	0	0	0	118.8	K756 D925 P930	K756-N928 PolarHBondContact NZ-OD1 3.1Å; D925-N928 PolarHBondContact O-N 2.91Å; N928-P930 WeakPolarHBondContact O-CD 3.16Å
929	D	30.5	Very low	29.7	Very low	118 Å²	118	111.7 Å²	111.7	63%	0.631	68%	0.678	S	S	*	*			trans	-97.2	106.7	-180	-71.9	-28.7	0	0	0	112.2
930	P	29.3	Very low	29.5	Very low	102 Å²	102	113.9 Å²	113.9	66%	0.662	68%	0.684	S	S	*	*			trans	-69	147.4	155.5	30.5	-30.7	0	0	0	108.7	N928 C932	N928-P930 WeakPolarHBondContact O-CD 3.16Å; P930-C932 PolarHBondContact O-N 3.09Å
931	P	29.1	Very low	29.6	Very low	121 Å²	121	115.6 Å²	115.6	79%	0.786	69%	0.689	S	S	*	*			trans	-59	118.1	172	23.9	-30.4	0	0	0	109	L933	P931-L933 PolarHBondContact O-N 3.38Å
932	C	27.6	Very low	29.5	Very low	122 Å²	122	117.7 Å²	117.7	82%	0.824	69%	0.693	S	S	*	*			trans	-60.3	103.1	170.1	-85.9	0	0	0	0	109.2	P930 S934	P930-C932 PolarHBondContact O-N 3.09Å; C932-S934 PolarHBondContact O-N 3.18Å; C932-S934 VanDerWaalsContact O-N 3.1Å
933	L	26	Very low	29.6	Very low	167 Å²	167	120.3 Å²	120.3	87%	0.874	70%	0.699	S	S	*	*			trans	-78.2	81.6	155.2	-71.7	174.8	0	0	0	107.5	P931 L935	P931-L933 PolarHBondContact O-N 3.38Å; L933-L935 PolarHBondContact O-N 3.3Å; L933-L935 VanDerWaalsContact O-N 3.1Å
934	S	27.1	Very low	29.4	Very low	89 Å²	89	122.8 Å²	122.8	62%	0.622	70%	0.703	S	S	*	*			trans	-62.1	109.8	168	57.1	0	0	0	0	109	C932 S936	C932-S934 PolarHBondContact O-N 3.18Å; C932-S934 VanDerWaalsContact O-N 3.1Å; S934-S936 PolarHBondContact O-N 3.42Å
935	L	24.4	Very low	29.3	Very low	181 Å²	181	124.2 Å²	124.2	95%	0.948	71%	0.706	S	S	*	*			trans	-64.3	80.7	161.5	-96.2	150.8	0	0	0	108.7	L933	L933-L935 PolarHBondContact O-N 3.3Å; L933-L935 VanDerWaalsContact O-N 3.1Å
936	S	27.1	Very low	29.2	Very low	80 Å²	80	128.9 Å²	128.9	56%	0.559	73%	0.73	S	S	*	*			trans	-128.1	120.6	163.4	43.7	0	0	0	0	108.4	S934	S934-S936 PolarHBondContact O-N 3.42Å
937	S	28.8	Very low	29	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	73%	0.731	S	S	*	*			trans	73.8	82.9	163.2	23.3	0	0	0	0	117.5	L939	S937-L939 PolarHBondContact O-N 2.89Å; S937-L939 VanDerWaalsContact O-N 3.15Å
938	I	25.3	Very low	29.1	Very low	165 Å²	165	136.5 Å²	136.5	85%	0.846	76%	0.759	S	S	*	*			trans	-64	101.8	142.4	-66.2	171.6	0	0	0	106.5
939	L	27.4	Very low	28.9	Very low	160 Å²	160	141.6 Å²	141.6	84%	0.838	79%	0.785	S	S	*	*			trans	-168.7	90.3	156.1	-99.1	158.1	0	0	0	107.4	S937	S937-L939 PolarHBondContact O-N 2.89Å; S937-L939 VanDerWaalsContact O-N 3.15Å
940	I	27.1	Very low	28.9	Very low	157 Å²	157	143.3 Å²	143.3	81%	0.805	79%	0.794	S	S	*	*			trans	-87.4	143.3	158.5	-60.9	173.3	0	0	0	104.5
941	P	31.5	Very low	28.9	Very low	97 Å²	97	143 Å²	143	63%	0.63	79%	0.794	S	S	*	*			cis	-147.5	173.3	42	16.1	13.2	0	0	0	118.7
942	N	29	Very low	29	Very low	144 Å²	144	144.3 Å²	144.3	77%	0.77	80%	0.795	S	S	*	*			trans	71.6	107.8	149.7	-58.8	-13.3	0	0	0	118.3
943	D	33.3	Very low	29.2	Very low	161 Å²	161	146 Å²	146	86%	0.861	79%	0.794	S	S	*	*				-168.8	154.2	97.7	-113.6	-27.7	0	0	0	112.8
944	E	29.9	Very low	29.4	Very low	164 Å²	164	143.6 Å²	143.6	77%	0.766	79%	0.786	S	S	*	*			trans	-68	160	-172.9	-57.5	178.6	148.1	0	0	114.3
945	N	30.9	Very low	29.6	Very low	145 Å²	145	143.9 Å²	143.9	78%	0.775	79%	0.785	S	S	*	*			trans	89	102	168.7	-59.1	-63.4	0	0	0	116.9
946	L	30.5	Very low	29.9	Very low	171 Å²	171	138.6 Å²	138.6	90%	0.895	77%	0.767	S	S	*	*				-175.1	98.3	113	-93.5	149.2	0	0	0	109.3
947	N	28.8	Very low	30.1	Very low	161 Å²	161	138 Å²	138	86%	0.861	77%	0.767	S	S	*	*			trans	-71.5	118	157.8	-71.4	-35.9	0	0	0	107.9
948	E	31.6	Very low	30.3	Very low	182 Å²	182	137.3 Å²	137.3	85%	0.85	76%	0.758	S	S	*	*			trans	169	142.9	141.9	-96.8	175	-178.9	0	0	108.3
949	I	32.3	Very low	30.7	Very low	176 Å²	176	136.4 Å²	136.4	90%	0.903	75%	0.75	S	S	*	*			trans	96.7	59.7	-178.4	-42.5	157.5	0	0	0	114.1
950	D	29.8	Very low	31.2	Very low	154 Å²	154	133.2 Å²	133.2	82%	0.824	74%	0.737	S	S	*	*			trans	-100.2	140.4	148.3	-107.2	-30	0	0	0	108.3
951	S	30.3	Very low	31.6	Very low	95 Å²	95	129.5 Å²	129.5	66%	0.664	72%	0.722	S	S	*	*	S	Bend	trans	150.1	2.9	141.5	59	0	0	0	0	119
952	N	31.1	Very low	31.9	Very low	148 Å²	148	126.4 Å²	126.4	79%	0.791	71%	0.708	S	S	*	*	S	Bend	trans	-124.9	5.8	-170.8	-80.7	-24.4	0	0	0	118.9
953	I	31.1	Very low	32.4	Very low	157 Å²	157	125 Å²	125	81%	0.805	70%	0.701	S	S	*	*	S	Bend	trans	-119.5	-15.6	-174.8	-63.9	177.6	0	0	0	113.6
954	T	30.4	Very low	32.6	Very low	118 Å²	118	123.6 Å²	123.6	72%	0.724	69%	0.69	S	S	*	*	S	Bend	trans	-95.9	-4.5	-170.8	-20.2	0	0	0	0	114.8
955	T	31.1	Very low	33.1	Very low	95 Å²	95	121 Å²	121	58%	0.583	68%	0.681	S	S	*	*	S	Bend	trans	-105.4	-10	-173.4	-15.9	0	0	0	0	114.6
956	A	30.8	Very low	33.6	Very low	69 Å²	69	118.1 Å²	118.1	57%	0.57	67%	0.668	S	S	*	*	H	α-helix	trans	-91.1	-17.3	-177.8	0	0	0	0	0	114.1
957	A	30.5	Very low	34.2	Very low	68 Å²	68	117.3 Å²	117.3	56%	0.562	66%	0.658	S	S	*	*	H	α-helix	trans	-84.1	-20.4	-178.6	0	0	0	0	0	113.3	T960 T961	A957-T960 PolarHBondContact O-OG1 2.83Å; A957-T961 PolarHBondContact O-OG1 3.05Å; A957-T961 VanDerWaalsContact O-OG1 3.11Å
958	T	33.7	Very low	34.7	Very low	96 Å²	96	116.8 Å²	116.8	59%	0.589	65%	0.645	S	S	*	*	H	α-helix	trans	-90.6	-24.7	-178.4	46.8	0	0	0	0	113.4	G962	T958-G962 PolarHBondContact O-N 3.28Å
959	E	33	Very low	35	Very low	146 Å²	146	115.1 Å²	115.1	68%	0.682	64%	0.637	S	S	*	*	H	α-helix	trans	-74.3	-29.2	178.2	-74.8	-174.4	156.4	0	0	113.2	D963	E959-D963 PolarHBondContact O-N 3.19Å
960	T	37.7	Very low	35.3	Very low	93 Å²	93	112.2 Å²	112.2	57%	0.571	62%	0.622	S	S	*	*	H	α-helix	trans	-79.3	-26.6	-179.1	47.3	0	0	0	0	113.6	A957	A957-T960 PolarHBondContact O-OG1 2.83Å
961	T	36.1	Very low	35.7	Very low	80 Å²	80	111.6 Å²	111.6	49%	0.491	61%	0.613	S	S	.	*	H	α-helix	trans	-78.3	-35.8	175	-20.6	0	0	0	0	111.7	A957 M964 L965	A957-T961 PolarHBondContact O-OG1 3.05Å; A957-T961 VanDerWaalsContact O-OG1 3.11Å; T961-M964 PolarHBondContact O-N 3.07Å; T961-L965 PolarHBondContact O-N 2.69Å
962	G	37	Very low	36.1	Very low	32 Å²	32	111 Å²	111	33%	0.33	61%	0.609	S	S	.	*	H	α-helix	trans	-64.2	-41.6	176	0	0	0	0	0	113.4	T958 M964 L965 V966	T958-G962 PolarHBondContact O-N 3.28Å; G962-M964 VanDerWaalsContact C-N 3.32Å; G962-M964 PolarHBondContact O-N 3.17Å; G962-L965 PolarHBondContact O-N 3.15Å; G962-V966 WeakPolarHBondContact O-CG2 3.25Å; G962-V966 PolarHBondContact O-N 3.2Å; G962-V966 VanDerWaalsContact O-N 3.14Å
963	D	40.3	Very low	36.2	Very low	115 Å²	115	115.1 Å²	115.1	62%	0.615	61%	0.613	S	S	*	*	H	α-helix	trans	-68.1	-28.2	178.4	-92.8	-3.8	0	0	0	113.6	E959 K967	E959-D963 PolarHBondContact O-N 3.19Å; D963-K967 PolarHBondContact O-N 2.89Å
964	M	38.6	Very low	36.4	Very low	130 Å²	130	115.9 Å²	115.9	64%	0.64	61%	0.613	S	S	*	*	H	α-helix	trans	-73.7	-36.6	174.2	-74.9	-145.5	-83	0	0	112.2	T961 G962 K967 Y968	T961-M964 PolarHBondContact O-N 3.07Å; G962-M964 VanDerWaalsContact C-N 3.32Å; G962-M964 PolarHBondContact O-N 3.17Å; M964-K967 PolarHBondContact O-N 3.39Å; M964-Y968 WeakPolarHBondContact O-CB 3.33Å; M964-Y968 PolarHBondContact O-N 3.3Å
965	L	39.1	Very low	36.5	Very low	111 Å²	111	119.2 Å²	119.2	58%	0.581	63%	0.625	S	S	*	*	H	α-helix	trans	-66.2	-37.4	174.2	-80.3	159	0	0	0	112.3	T961 G962 Y968 H969	T961-L965 PolarHBondContact O-N 2.69Å; G962-L965 PolarHBondContact O-N 3.15Å; L965-Y968 PolarHBondContact O-N 3.34Å; L965-H969 PolarHBondContact O-N 3.24Å; L965-H969 VanDerWaalsContact O-N 3.07Å
966	V	42.6	Very low	36.8	Very low	83 Å²	83	120.4 Å²	120.4	50%	0.503	63%	0.628	S	S	.	*	H	α-helix	trans	-68.4	-39.8	175.7	174.6	0	0	0	0	111.6	G962 Y968 H969 L970	G962-V966 WeakPolarHBondContact O-CG2 3.25Å; G962-V966 PolarHBondContact O-N 3.2Å; G962-V966 VanDerWaalsContact O-N 3.14Å; V966-Y968 VanDerWaalsContact C-N 3.33Å; V966-Y968 PolarHBondContact O-N 2.97Å; V966-H969 PolarHBondContact O-N 3.16Å; V966-L970 HydrophobicContact CG1-CD1 4.1Å; V966-L970 PolarHBondContact O-N 3.39Å; V966-L970 VanDerWaalsContact O-N 3.15Å
967	K	43.3	Very low	37.1	Very low	155 Å²	155	123.1 Å²	123.1	67%	0.674	63%	0.631	S	S	*	*	H	α-helix	trans	-65.6	-34.3	172.8	-83	176.2	178	168.2	0	112.7	D963 M964 L970 F971	D963-K967 PolarHBondContact O-N 2.89Å; M964-K967 PolarHBondContact O-N 3.39Å; K967-L970 PolarHBondContact O-N 3.34Å; K967-F971 WeakPolarHBondContact O-CB 3.41Å; K967-F971 PolarHBondContact O-N 3.37Å
968	Y	37.7	Very low	37.5	Very low	150 Å²	150	126.2 Å²	126.2	59%	0.588	63%	0.634	S	S	*	*	H	α-helix	trans	-67.6	-40	176.8	-143.8	-92.8	0	0	0	112.2	L754 M964 L965 V966 F971 S972	L754-Y968 HydrophobicContact CD1-CE2 4.32Å; M964-Y968 WeakPolarHBondContact O-CB 3.33Å; M964-Y968 PolarHBondContact O-N 3.3Å; L965-Y968 PolarHBondContact O-N 3.34Å; V966-Y968 VanDerWaalsContact C-N 3.33Å; V966-Y968 PolarHBondContact O-N 2.97Å; Y968-F971 PolarHBondContact O-N 3.01Å; Y968-S972 PolarHBondContact O-N 3.42Å; Y968-S972 VanDerWaalsContact O-N 3.16Å
969	H	38.7	Very low	37.7	Very low	147 Å²	147	127.9 Å²	127.9	68%	0.681	64%	0.637	S	S	*	*	H	α-helix	trans	-68.2	-32.2	174.6	-100	-56.4	0	0	0	113.5	L965 V966	L965-H969 PolarHBondContact O-N 3.24Å; L965-H969 VanDerWaalsContact O-N 3.07Å; V966-H969 PolarHBondContact O-N 3.16Å
970	L	39.3	Very low	38	Very low	114 Å²	114	126.8 Å²	126.8	60%	0.597	63%	0.634	S	S	*	*	H	α-helix	trans	-75.4	-35.7	175.5	-80.1	158.1	0	0	0	112.6	V966 K967 W973	V966-L970 HydrophobicContact CG1-CD1 4.1Å; V966-L970 PolarHBondContact O-N 3.39Å; V966-L970 VanDerWaalsContact O-N 3.15Å; K967-L970 PolarHBondContact O-N 3.34Å; L970-W973 PolarHBondContact O-N 3.37Å
971	F	37.7	Very low	38	Very low	142 Å²	142	129.1 Å²	129.1	62%	0.623	64%	0.638	S	S	*	*	H	α-helix	trans	-75.5	-29.9	-179.8	-138.2	-94.5	0	0	0	113.1	K967 Y968 W973 E974 L975	K967-F971 WeakPolarHBondContact O-CB 3.41Å; K967-F971 PolarHBondContact O-N 3.37Å; Y968-F971 PolarHBondContact O-N 3.01Å; F971-W973 PolarHBondContact O-N 3.46Å; F971-E974 PolarHBondContact O-N 3.45Å; F971-L975 HydrophobicContact CD1-CD1 4.01Å; F971-L975 HydrophobicContact CE1-CD1 4.11Å
972	S	39.5	Very low	38.2	Very low	83 Å²	83	132.6 Å²	132.6	58%	0.58	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-3.2	174.6	-168.8	0	0	0	0	114	Y968	Y968-S972 PolarHBondContact O-N 3.42Å; Y968-S972 VanDerWaalsContact O-N 3.16Å
973	W	32.9	Very low	38.2	Very low	234 Å²	234	140.3 Å²	140.3	89%	0.886	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-14	173.7	-103.5	49.4	0	0	0	113	L970 F971	L970-W973 PolarHBondContact O-N 3.37Å; F971-W973 PolarHBondContact O-N 3.46Å
974	E	34.7	Very low	38.1	Very low	173 Å²	173	142.4 Å²	142.4	81%	0.808	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-12.6	177.7	-78.1	-173	152.5	0	0	114	F971	F971-E974 PolarHBondContact O-N 3.45Å
975	L	32.8	Very low	38	Very low	187 Å²	187	143.5 Å²	143.5	98%	0.979	68%	0.682	S	S	*	*			trans	-100	0	168.9	-91.2	155.5	0	0	0	110	F971	F971-L975 HydrophobicContact CD1-CD1 4.01Å; F971-L975 HydrophobicContact CE1-CD1 4.11Å

Retrieved 975 of 975 residues in 2087.3 ms (Link to these results)

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