A0A087XDN4_POEFO Loading...

Transient receptor potential melastatin 4b3

AlphaFold DB , UniProt , Accession A0A087XDN4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,260 aa.

						>A0A087XDN4_POEFO|A0A087XDN4
MKDTGEVRGSTDKLSKSEKDQTWIAKIYKKRVCTTFVEDSFSNGALCQCGGARDAHSSVALGDYFSTAIVNRWDSAQHSSEYPTDAFGEVQFAGASKRHSQFLRLSWDTQPSMVYNLMRTHWHLPVPNLVVSVVGGEGRTKVKTWVREVLRQGLVKAAQRAGAWIITTGLREGVGRCVGEAVRDHATAASSDSLNKVVAVGVAPWGIVHNREQLVNPKGSFPAKYYVQNPVRDSCCLDNNYQSFLLVDDGSVGRRGGDTVFRAKLEDYISHQRTGIWGSGTIDIPVLCMLISGDTSSLERMDLSLKNSMPWLVLAGSGGLADFVADLLENVSAAPGFQSSSEGDGEPGPSVDLKEKVAERVKKHFPAESASDKLVERALSIYQCRDLISIHYGEQESPTDFDTVLLKALVGASKQRTSVEASPYNEELKLAVAWNRVDIAKSELFNGDIQWRYEDLKDSMTDVLINDKPQFVQLFTENGLNITEYLTYGRLEQLYRSVPDSTLLYQLLQRRLVVRTGTAATVPAATSESKSPFTGPEEDFQSRSQTDITLFEISGVLDLLLGDTCQPFYYDILGISQISSRRKAVKHVSRLLCENRSYQNQRCFYPWASLFIWAVLQNRTEMATFFWEMAGESVLTALSGCKMLRELSKLESETEIKLSMKELAQTFENLAHDIFSSCYRSDESRSFDLLIRKSPVWGSTTCLQMGMGADARIFFSHDGVQSFLSQIWWGDMQRDTAVWKLLLTFFCPFLCYTNFISFRENGNRQEEEEGSSSDEDPSRDSDNHYGTTIFSFSDIKHIEVDGQLSSPRSPSIKGVPEPYRPPQRPFILSRWRQFWFAPVTAFLGNVLMYFLFLILYAFVLLLDFKKPPPSNLAVSECLLYFWVFTIVCEEIREGFFSDVMTWRQRLRVYIQDVWNKFDILAITLFLLGLICRMFEWSYEYGRELLCVDFMVFTLRLIHIFAIHKRLGPKIIIVGKMMKDVFFFLFFLGVWIMAYGVANQALLYRHDPNFDRIFRRVFYRPYLHIYGQIPVEEVDVKKVWDVECTDNQTLVDGGAEQCRNLNGNWLVVILLMIYLLVTNILLINLLIAMFSNTFTEVQANSESYWKFQRYNLIVEYHSKPSLAPPFIIFSHINLIIKRKIRKVPSVKVQHFVLQLSKKAANRLMTWETIQKEDFLTAQNKIQKSSDSERLKRMSAKMDSVVKHMTENRDLDQRLRALENEMENCSNALRWIVDTLAEGGAFKPPRPPPTFRDGVPSSSGSS
					

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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	34.1	Very low	29.1	Very low	242 Å²	242	151.1 Å²	151.1	100%	1.192	85%	0.846	S	S	*	*				0	135	0	-87.1	162.3	146.2	0	0	107.3
2	K	26.6	Very low	29.1	Very low	204 Å²	204	149.8 Å²	149.8	89%	0.887	84%	0.836	S	S	*	*			trans	-74.9	119	-176.5	-84.4	173.7	169.4	177.1	0	109.5
3	D	29.3	Very low	29.3	Very low	164 Å²	164	152.7 Å²	152.7	88%	0.877	83%	0.834	S	S	*	*			trans	-93.9	103.3	168.4	-79.5	-30.4	0	0	0	109.8
4	T	27.8	Very low	29.6	Very low	134 Å²	134	149.4 Å²	149.4	82%	0.822	81%	0.814	S	S	*	*			trans	-111.4	94.3	159.7	46.2	0	0	0	0	106.9
5	G	26.1	Very low	29.7	Very low	74 Å²	74	143.4 Å²	143.4	76%	0.763	79%	0.788	S	S	*	*			trans	-85	110.1	172.3	0	0	0	0	0	110.3
6	E	26.2	Very low	30	Very low	176 Å²	176	144.8 Å²	144.8	82%	0.822	78%	0.784	S	S	*	*			trans	-61.8	127.5	171	-74.7	-179.4	135.6	0	0	111.4	R8	E6-R8 PolarHBondContact O-N 3.49Å; E6-R8 VanDerWaalsContact O-N 3.08Å
7	V	31.4	Very low	31.1	Very low	152 Å²	152	139.1 Å²	139.1	92%	0.921	76%	0.757	S	S	*	*			trans	-73.3	91.9	164.8	178	0	0	0	0	107.9
8	R	30.8	Very low	31.9	Very low	232 Å²	232	138 Å²	138	88%	0.875	75%	0.746	S	S	*	*			trans	-137.8	91.4	169.7	-141.8	177.5	-167.5	-171.1	2.9	109.7	E6	E6-R8 PolarHBondContact O-N 3.49Å; E6-R8 VanDerWaalsContact O-N 3.08Å
9	G	29.3	Very low	32.6	Very low	77 Å²	77	139.7 Å²	139.7	79%	0.794	75%	0.746	S	S	*	*			trans	167.9	57.9	178.6	0	0	0	0	0	114.8
10	S	28.9	Very low	33.8	Very low	96 Å²	96	138.7 Å²	138.7	67%	0.671	74%	0.741	S	S	*	*	S	Bend	trans	-137.3	-14.4	164.5	77.1	0	0	0	0	114.3
11	T	30.1	Very low	35.4	Very low	111 Å²	111	134.5 Å²	134.5	68%	0.681	72%	0.717	S	S	*	*	S	Bend	trans	-83.1	-24.9	-179.3	39.6	0	0	0	0	114.6
12	D	28.6	Very low	37.1	Very low	135 Å²	135	127 Å²	127	72%	0.722	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-10.4	-175.9	-80.3	-16.2	0	0	0	115.2
13	K	32.1	Very low	39.9	Very low	188 Å²	188	120.3 Å²	120.3	82%	0.817	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-22.6	171.5	-80.8	-173.8	177.2	-179	0	113
14	L	32.9	Very low	42.5	Very low	106 Å²	106	113 Å²	113	56%	0.555	61%	0.614	S	S	*	*	H	α-helix	trans	-70.8	-40.2	-178.7	-131	77.2	0	0	0	111.8	K16 S17	L14-K16 VanDerWaalsContact C-N 3.35Å; L14-K16 PolarHBondContact O-N 3.46Å; L14-S17 PolarHBondContact O-N 3.47Å; L14-S17 PolarHBondContact O-OG 3.38Å; L14-S17 VanDerWaalsContact O-OG 3.09Å
15	S	30.8	Very low	45.2	Very low	60 Å²	60	107.6 Å²	107.6	42%	0.42	58%	0.584	S	S	.	*	H	α-helix	trans	-73	-18.7	-174	66.4	0	0	0	0	115.2
16	K	35.4	Very low	47.9	Very low	165 Å²	165	112.2 Å²	112.2	72%	0.717	58%	0.583	S	S	*	*	H	α-helix	trans	-78.4	-33.2	172.9	-90.9	-177.6	175.1	179	0	112.7	L14	L14-K16 VanDerWaalsContact C-N 3.35Å; L14-K16 PolarHBondContact O-N 3.46Å
17	S	48.7	Very low	50.8	Low	48 Å²	48	107.6 Å²	107.6	34%	0.336	56%	0.563	S	S	.	*	H	α-helix	trans	-71.2	-30	179.2	80.1	0	0	0	0	113.3	L14 K19 D20	L14-S17 PolarHBondContact O-N 3.47Å; L14-S17 PolarHBondContact O-OG 3.38Å; L14-S17 VanDerWaalsContact O-OG 3.09Å; S17-K19 VanDerWaalsContact C-N 3.33Å; S17-K19 PolarHBondContact O-N 3.26Å; S17-D20 PolarHBondContact O-N 3.34Å
18	E	45	Very low	53.6	Low	120 Å²	120	100.5 Å²	100.5	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-66.7	-30	-179.8	-72.1	-178.4	157.6	0	0	113.2
19	K	46.2	Very low	56.4	Low	171 Å²	171	94.1 Å²	94.1	74%	0.743	50%	0.498	S	S	*	.	H	α-helix	trans	-78	-26.7	178.1	-78.3	-177.1	176.9	177.9	0	113.1	S17	S17-K19 VanDerWaalsContact C-N 3.33Å; S17-K19 PolarHBondContact O-N 3.26Å
20	D	56.1	Low	59.4	Low	119 Å²	119	92 Å²	92	64%	0.636	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.5	-172.9	-74.4	-14.7	0	0	0	114.3	S17 W23	S17-D20 PolarHBondContact O-N 3.34Å; D20-W23 PolarHBondContact O-NE1 3.35Å
21	Q	66.8	Low	62.2	Low	51 Å²	51	88.5 Å²	88.5	24%	0.238	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	3.3	-175.6	-62.2	-166.1	20.3	0	0	115.5	W23 I24 F221	Q21-W23 PolarHBondContact O-N 3.14Å; Q21-I24 HydrophobicContact CB-CD1 4.04Å; Q21-I24 HydrophobicContact CG-CD1 4.38Å; Q21-I24 WeakPolarHBondContact O-CB 3.49Å; Q21-I24 WeakPolarHBondContact O-CG1 3.45Å; Q21-I24 PolarHBondContact O-N 3.28Å; Q21-F221 VanDerWaalsContact OE1-CE1 3.22Å
22	T	70.5	Confident	64.9	Low	85 Å²	85	85.8 Å²	85.8	52%	0.521	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-16.4	177.3	58.8	0	0	0	0	114.1	I24	T22-I24 VanDerWaalsContact C-N 3.33Å
23	W	84.5	Confident	67.5	Low	62 Å²	62	79.9 Å²	79.9	24%	0.235	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-24.1	175.1	66.1	-91.3	0	0	0	112.7	D20 Q21 A25 K26 I27 Y28 L117 H121	D20-W23 PolarHBondContact O-NE1 3.35Å; Q21-W23 PolarHBondContact O-N 3.14Å; W23-A25 PolarHBondContact O-N 3.32Å; W23-K26 WeakPolarHBondContact O-CB 3.38Å; W23-K26 PolarHBondContact O-N 3.01Å; W23-I27 HydrophobicContact CE3-CB 4.44Å; W23-I27 HydrophobicContact CE3-CD1 3.54Å; W23-I27 HydrophobicContact CE3-CG1 4.1Å; W23-I27 HydrophobicContact CZ3-CD1 3.96Å; W23-I27 WeakPolarHBondContact O-CG1 3.35Å; W23-I27 PolarHBondContact O-N 3.48Å; W23-Y28 HydrophobicContact CH2-CE2 4.39Å; W23-Y28 AromaticContact CZ3-CE2 3.93Å; W23-Y28 HydrophobicContact CZ3-CE2 3.93Å; W23-L117 HydrophobicContact CH2-CD1 3.57Å; W23-L117 HydrophobicContact CZ2-CD1 4.1Å; W23-H121 AromaticContact CE2-CE1 3.84Å; W23-H121 AromaticContact CE2-NE2 3.89Å; W23-H121 AromaticContact CH2-CD2 3.5Å; W23-H121 AromaticContact CH2-NE2 3.47Å; W23-H121 WeakPolarHBondContact CH2-NE2 3.29Å; W23-H121 AromaticContact CZ2-CD2 3.35Å; W23-H121 WeakPolarHBondContact CZ2-CD2 3.49Å; W23-H121 AromaticContact CZ2-CE1 3.29Å; W23-H121 WeakPolarHBondContact CZ2-CE1 3.34Å; W23-H121 AromaticContact CZ2-CG 3.71Å; W23-H121 AromaticContact CZ2-ND1 3.67Å; W23-H121 AromaticContact CZ2-NE2 3.08Å; W23-H121 WeakPolarHBondContact CZ2-NE2 3.28Å; W23-H121 AromaticContact NE1-CE1 4Å
24	I	85.1	Confident	69.9	Low	10 Å²	10	72.6 Å²	72.6	5%	0.051	36%	0.363	C	S	.	.	H	α-helix	trans	-60.3	-48.2	-179.8	-63.5	178.9	0	0	0	109.9	Q21 T22 K26 I27 Y28 F87 L103	Q21-I24 HydrophobicContact CB-CD1 4.04Å; Q21-I24 HydrophobicContact CG-CD1 4.38Å; Q21-I24 WeakPolarHBondContact O-CB 3.49Å; Q21-I24 WeakPolarHBondContact O-CG1 3.45Å; Q21-I24 PolarHBondContact O-N 3.28Å; T22-I24 VanDerWaalsContact C-N 3.33Å; I24-K26 PolarHBondContact O-N 3.47Å; I24-I27 PolarHBondContact O-N 3.16Å; I24-Y28 HydrophobicContact CB-CD2 4.36Å; I24-Y28 HydrophobicContact CG2-CD2 3.68Å; I24-Y28 HydrophobicContact CG2-CE2 4.3Å; I24-Y28 WeakPolarHBondContact O-CB 3.24Å; I24-Y28 WeakPolarHBondContact O-CD2 3.18Å; I24-Y28 PolarHBondContact O-N 2.97Å; I24-F87 HydrophobicContact CB-CD2 4.18Å; I24-F87 HydrophobicContact CB-CE2 4.26Å; I24-F87 HydrophobicContact CB-CG 4.5Å; I24-F87 HydrophobicContact CD1-CD2 4.04Å; I24-F87 HydrophobicContact CD1-CE2 4.42Å; I24-F87 HydrophobicContact CG2-CB 4.07Å; I24-F87 HydrophobicContact CG2-CD1 4.26Å; I24-F87 HydrophobicContact CG2-CD2 3.94Å; I24-F87 HydrophobicContact CG2-CE2 4.46Å; I24-F87 HydrophobicContact CG2-CG 3.83Å; I24-L103 HydrophobicContact CG2-CD1 3.8Å
25	A	82.9	Confident	72.1	Confident	22 Å²	22	69.9 Å²	69.9	18%	0.182	35%	0.351	C	S	.	.	H	α-helix	trans	-65.9	-19.1	176.7	0	0	0	0	0	113.7	W23 P83 F87	W23-A25 PolarHBondContact O-N 3.32Å; A25-P83 WeakPolarHBondContact O-CB 3.41Å; A25-F87 HydrophobicContact CB-CE1 4.05Å; A25-F87 HydrophobicContact CB-CZ 4.44Å
26	K	83.3	Confident	74.3	Confident	170 Å²	170	68.3 Å²	68.3	74%	0.739	34%	0.337	S	S	*	.	H	α-helix	trans	-84.8	-34.6	176.6	-64.9	-179.5	-178.2	177.4	0	112.6	W23 I24	W23-K26 WeakPolarHBondContact O-CB 3.38Å; W23-K26 PolarHBondContact O-N 3.01Å; I24-K26 PolarHBondContact O-N 3.47Å
27	I	86.5	Confident	76.4	Confident	80 Å²	80	61.2 Å²	61.2	41%	0.41	31%	0.307	S	S	.	.	H	α-helix	trans	-90.6	-45.4	-175.9	-62.3	-169.7	0	0	0	111	W23 I24 M113	W23-I27 HydrophobicContact CE3-CB 4.44Å; W23-I27 HydrophobicContact CE3-CD1 3.54Å; W23-I27 HydrophobicContact CE3-CG1 4.1Å; W23-I27 HydrophobicContact CZ3-CD1 3.96Å; W23-I27 WeakPolarHBondContact O-CG1 3.35Å; W23-I27 PolarHBondContact O-N 3.48Å; I24-I27 PolarHBondContact O-N 3.16Å; I27-M113 HydrophobicContact CG2-SD 3.67Å
28	Y	90.8	Very high	77.8	Confident	3 Å²	3	64.2 Å²	64.2	1%	0.012	32%	0.316	C	S	.	.			trans	-89.3	139.2	-177.3	-62.2	-77.5	0	0	0	111.5	W23 I24 T84 L103 T109 M113 V114 L117	W23-Y28 HydrophobicContact CH2-CE2 4.39Å; W23-Y28 AromaticContact CZ3-CE2 3.93Å; W23-Y28 HydrophobicContact CZ3-CE2 3.93Å; I24-Y28 HydrophobicContact CB-CD2 4.36Å; I24-Y28 HydrophobicContact CG2-CD2 3.68Å; I24-Y28 HydrophobicContact CG2-CE2 4.3Å; I24-Y28 WeakPolarHBondContact O-CB 3.24Å; I24-Y28 WeakPolarHBondContact O-CD2 3.18Å; I24-Y28 PolarHBondContact O-N 2.97Å; Y28-T84 PolarHBondContact O-N 3.14Å; Y28-T84 VanDerWaalsContact O-N 3.1Å; Y28-T84 PolarHBondContact O-OG1 3.33Å; Y28-L103 HydrophobicContact CD1-CD2 3.88Å; Y28-L103 HydrophobicContact CD2-CD1 4.37Å; Y28-L103 HydrophobicContact CD2-CD2 4.17Å; Y28-L103 HydrophobicContact CE1-CD2 3.94Å; Y28-L103 HydrophobicContact CE2-CD2 4.21Å; Y28-L103 HydrophobicContact CG-CD1 4.29Å; Y28-L103 HydrophobicContact CG-CD2 4Å; Y28-T109 HydrophobicContact CD1-CG2 4.08Å; Y28-T109 HydrophobicContact CE1-CG2 4.26Å; Y28-M113 HydrophobicContact CE1-CB 4.25Å; Y28-M113 PolarHBondContact OH-O 3.31Å; Y28-V114 HydrophobicContact CE1-CG2 4Å; Y28-L117 HydrophobicContact CE2-CD1 4.35Å; Y28-L117 HydrophobicContact CE2-CD2 4.31Å; Y28-L117 WeakPolarHBondContact OH-CB 3.41Å
29	K	90.8	Very high	79.3	Confident	97 Å²	97	60.1 Å²	60.1	42%	0.422	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	156.8	-178.5	-58.1	178.3	-179.1	174.8	0	110.3	E81 Y82 T84 L105 S106	K29-E81 HydrophobicContact CB-CB 4.43Å; K29-E81 HydrophobicContact CD-CB 4.04Å; K29-E81 HydrophobicContact CD-CG 4.37Å; K29-E81 WeakPolarHBondContact CD-OE2 3.32Å; K29-E81 WeakPolarHBondContact CE-OE2 3.29Å; K29-E81 IonicContact NZ-OE2 3.41Å; K29-E81 PolarHBondContact NZ-OE2 3.37Å; K29-Y82 CarbonylContact C-O 3.56Å; K29-Y82 WeakPolarHBondContact CA-O 3.21Å; K29-Y82 WeakPolarHBondContact CB-O 3.24Å; K29-T84 VanDerWaalsContact C-OG1 3.25Å; K29-T84 PolarHBondContact N-OG1 3.42Å; K29-T84 PolarHBondContact O-OG1 2.97Å; K29-L105 CarbonylContact O-C 3.59Å; K29-L105 WeakPolarHBondContact O-CA 3.39Å; K29-S106 WeakPolarHBondContact O-CB 3.49Å; K29-S106 PolarHBondContact O-N 3.14Å
30	K	90.5	Very high	80.5	Confident	32 Å²	32	57 Å²	57	14%	0.139	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	163.8	170.1	61.9	168.9	177.7	167.6	0	109.8	E81 Y82 P83 D85 R104	K30-E81 CarbonylContact O-C 3.59Å; K30-E81 VanDerWaalsContact O-CA 3.28Å; K30-E81 WeakPolarHBondContact O-CA 3.39Å; K30-Y82 WeakPolarHBondContact CG-O 3.35Å; K30-Y82 PolarHBondContact N-O 2.88Å; K30-Y82 PolarHBondContact O-N 2.94Å; K30-P83 VanDerWaalsContact CE-O 3.29Å; K30-P83 WeakPolarHBondContact CE-O 3.2Å; K30-D85 WeakPolarHBondContact CD-OD1 3.38Å; K30-D85 VanDerWaalsContact NZ-CG 3.31Å; K30-D85 IonicContact NZ-OD1 2.97Å; K30-D85 IonicContact NZ-OD2 3.37Å; K30-D85 PolarHBondContact NZ-OD2 3.24Å; K30-R104 HydrophobicContact CB-CG 4.45Å
31	R	88.4	Confident	81	Confident	23 Å²	23	60.5 Å²	60.5	9%	0.087	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	146.2	173.6	-86.4	174.6	179.8	-108.6	-0.4	111.6	S75 S79 S80 E81 S106 D108 D248	R31-S75 PolarHBondContact NH1-O 3.47Å; R31-S75 VanDerWaalsContact NH1-O 3.07Å; R31-S79 WeakPolarHBondContact CD-OG 3.45Å; R31-S79 PolarHBondContact NH1-OG 3.26Å; R31-S80 WeakPolarHBondContact CA-O 3.33Å; R31-E81 HydrophobicContact CG-CG 4.14Å; R31-E81 IonicContact NH2-OE1 2.77Å; R31-S106 WeakPolarHBondContact CD-OG 3.42Å; R31-S106 VanDerWaalsContact CG-OG 3.25Å; R31-S106 WeakPolarHBondContact CG-OG 3.44Å; R31-S106 PolarHBondContact NE-OG 3.13Å; R31-D108 IonicContact CZ-OD2 3.58Å; R31-D108 IonicContact NE-OD2 3.39Å; R31-D108 PolarHBondContact NE-OD2 2.8Å; R31-D108 IonicContact NH2-OD2 3.89Å; R31-D108 PolarHBondContact NH2-OD2 3.45Å; R31-D248 VanDerWaalsContact O-OD2 3.08Å
32	V	85.9	Confident	80.9	Confident	55 Å²	55	59.5 Å²	59.5	33%	0.333	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	136.3	174.9	-175.5	0	0	0	0	108.4	T34 S79 S80 Y82	V32-T34 PolarHBondContact O-N 2.98Å; V32-S79 CarbonylContact O-C 3.55Å; V32-S79 VanDerWaalsContact O-CA 3.24Å; V32-S79 WeakPolarHBondContact O-CA 3.09Å; V32-S79 WeakPolarHBondContact O-CB 3.07Å; V32-S80 PolarHBondContact N-O 3.18Å; V32-S80 PolarHBondContact O-N 3.35Å; V32-Y82 HydrophobicContact CB-CD2 4.07Å; V32-Y82 HydrophobicContact CB-CE2 4.13Å; V32-Y82 HydrophobicContact CG2-CD2 3.83Å; V32-Y82 HydrophobicContact CG2-CE2 4.32Å
33	C	85.2	Confident	80.6	Confident	10 Å²	10	63.3 Å²	63.3	7%	0.068	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	120	176.2	-174.1	0	0	0	0	110.4	T35 C49 W73	C33-T35 PolarHBondContact SG-O 3.48Å; C33-T35 VanDerWaalsContact SG-O 3.34Å; C33-C49 HydrophobicContact CB-CB 4.1Å; C33-C49 VanDerWaalsContact SG-SG 3.66Å; C33-W73 PolarHBondContact SG-NE1 3.41Å
34	T	81.1	Confident	79.8	Confident	36 Å²	36	61.2 Å²	61.2	22%	0.221	32%	0.321	C	S	.	.			trans	-109.7	-5.3	-177.1	47	0	0	0	0	113.9	V32 A60 H78 S80	V32-T34 PolarHBondContact O-N 2.98Å; T34-A60 VanDerWaalsContact C-CB 3.43Å; T34-A60 WeakPolarHBondContact O-CA 3.46Å; T34-A60 WeakPolarHBondContact O-CB 3.44Å; T34-H78 PolarHBondContact N-O 3.29Å; T34-H78 PolarHBondContact OG1-O 3.11Å; T34-S80 WeakPolarHBondContact CG2-OG 3.42Å
35	T	79.5	Confident	79.2	Confident	49 Å²	49	63.8 Å²	63.8	30%	0.301	34%	0.343	S	S	.	.	S	Bend	trans	-127.9	124.2	177.1	56.8	0	0	0	0	109.6	C33 V37 H78	C33-T35 PolarHBondContact SG-O 3.48Å; C33-T35 VanDerWaalsContact SG-O 3.34Å; T35-V37 PolarHBondContact O-N 2.79Å; T35-H78 PolarHBondContact N-O 3.35Å; T35-H78 WeakPolarHBondContact OG1-CA 3.47Å; T35-H78 WeakPolarHBondContact OG1-CB 3.31Å; T35-H78 PolarHBondContact OG1-CD2 2.97Å; T35-H78 PolarHBondContact OG1-O 3.44Å
36	F	78.1	Confident	79.1	Confident	27 Å²	27	65.9 Å²	65.9	12%	0.118	35%	0.351	C	S	.	.			trans	-80.9	115.1	176.2	-173.8	-100.5	0	0	0	110.2	E38 C47 R53 A60 L61	F36-E38 HydrophobicContact CD1-CG 4.12Å; F36-E38 HydrophobicContact CE1-CG 3.44Å; F36-E38 VanDerWaalsContact CE1-CG 3.44Å; F36-E38 HydrophobicContact CZ-CG 4.22Å; F36-C47 HydrophobicContact CD2-CB 3.58Å; F36-C47 HydrophobicContact CE2-CB 3.59Å; F36-R53 HydrophobicContact CE2-CB 3.96Å; F36-R53 HydrophobicContact CE2-CG 3.97Å; F36-R53 HydrophobicContact CZ-CB 4.14Å; F36-R53 HydrophobicContact CZ-CG 3.97Å; F36-A60 PolarHBondContact N-O 3.11Å; F36-L61 HydrophobicContact CB-CD2 4.39Å; F36-L61 HydrophobicContact CG-CD2 4.35Å
37	V	79.4	Confident	79.1	Confident	15 Å²	15	57.9 Å²	57.9	9%	0.091	32%	0.316	C	S	.	.			trans	-113.4	121	174	-176.6	0	0	0	0	107.1	T35 C47 Q48 W73	T35-V37 PolarHBondContact O-N 2.79Å; V37-C47 PolarHBondContact N-SG 3.29Å; V37-C47 CarbonylContact O-C 3.55Å; V37-C47 VanDerWaalsContact O-CA 3.24Å; V37-C47 WeakPolarHBondContact O-CA 3.41Å; V37-C47 PolarHBondContact O-SG 3.28Å; V37-C47 VanDerWaalsContact O-SG 3.4Å; V37-Q48 HydrophobicContact CB-CB 4.28Å; V37-Q48 HydrophobicContact CB-CG 4.32Å; V37-Q48 HydrophobicContact CG1-CB 4.36Å; V37-Q48 VanDerWaalsContact CG1-CD 3.45Å; V37-Q48 HydrophobicContact CG1-CG 3.95Å; V37-Q48 PolarHBondContact O-N 3.26Å; V37-W73 HydrophobicContact CB-CB 4.34Å; V37-W73 HydrophobicContact CG2-CB 4.38Å
38	E	77.4	Confident	78.7	Confident	111 Å²	111	55.1 Å²	55.1	52%	0.519	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-68.3	133.3	-174.9	-74.5	-178.2	178.3	0	0	112.5	F36 Q48	F36-E38 HydrophobicContact CD1-CG 4.12Å; F36-E38 HydrophobicContact CE1-CG 3.44Å; F36-E38 VanDerWaalsContact CE1-CG 3.44Å; F36-E38 HydrophobicContact CZ-CG 4.22Å; E38-Q48 WeakPolarHBondContact O-CG 3.48Å; E38-Q48 PolarHBondContact O-NE2 3.39Å
39	D	76.6	Confident	78.2	Confident	35 Å²	35	55 Å²	55	19%	0.187	30%	0.302	C	S	.	.			trans	-84.6	123.2	172.9	-177.4	31	0	0	0	111.1	F41 S42 L46 Q48	D39-F41 PolarHBondContact O-N 3.5Å; D39-S42 PolarHBondContact O-N 3.39Å; D39-S42 PolarHBondContact OD2-OG 3.36Å; D39-L46 WeakPolarHBondContact CB-O 3.44Å; D39-L46 PolarHBondContact N-O 3.06Å; D39-L46 VanDerWaalsContact N-O 3.16Å; D39-Q48 HydrophobicContact CB-CG 4.09Å
40	S	70.5	Confident	77.6	Confident	104 Å²	104	51.7 Å²	51.7	73%	0.727	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-23.6	-174.5	-44	0	0	0	0	113
41	F	67.4	Low	77.1	Confident	194 Å²	194	50.5 Å²	50.5	85%	0.851	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-12.3	-179.8	-63.7	-79.1	0	0	0	113.7	D39	D39-F41 PolarHBondContact O-N 3.5Å
42	S	63.8	Low	76.7	Confident	30 Å²	30	51.6 Å²	51.6	21%	0.21	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112	12	-166.2	-60.4	0	0	0	0	114	D39 G44 A45	D39-S42 PolarHBondContact O-N 3.39Å; D39-S42 PolarHBondContact OD2-OG 3.36Å; S42-G44 PolarHBondContact O-N 3.14Å; S42-G44 VanDerWaalsContact O-N 3.1Å; S42-A45 WeakPolarHBondContact O-CB 3.22Å; S42-A45 PolarHBondContact O-N 3.3Å
43	N	64.4	Low	76.2	Confident	165 Å²	165	54.9 Å²	54.9	88%	0.882	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	39.6	-176.1	-73.4	-14.5	0	0	0	113.6	A45	N43-A45 VanDerWaalsContact C-N 3.32Å; N43-A45 PolarHBondContact O-N 2.99Å
44	G	67.6	Low	75.6	Confident	18 Å²	18	62 Å²	62	19%	0.186	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	4.5	177.2	0	0	0	0	0	116.4	S42	S42-G44 PolarHBondContact O-N 3.14Å; S42-G44 VanDerWaalsContact O-N 3.1Å
45	A	73.8	Confident	75.2	Confident	63 Å²	63	64 Å²	64	52%	0.521	37%	0.369	S	S	.	.	S	Bend	trans	-81.2	-27.9	179.8	0	0	0	0	0	113.9	S42 N43 R53	S42-A45 WeakPolarHBondContact O-CB 3.22Å; S42-A45 PolarHBondContact O-N 3.3Å; N43-A45 VanDerWaalsContact C-N 3.32Å; N43-A45 PolarHBondContact O-N 2.99Å; A45-R53 PolarHBondContact O-N 3.5Å
46	L	80.1	Confident	75	Confident	67 Å²	67	62.6 Å²	62.6	35%	0.351	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-118.7	143	-178.6	-66.2	167.8	0	0	0	110.1	D39	D39-L46 WeakPolarHBondContact CB-O 3.44Å; D39-L46 PolarHBondContact N-O 3.06Å; D39-L46 VanDerWaalsContact N-O 3.16Å
47	C	83	Confident	74.5	Confident	1 Å²	1	64 Å²	64	1%	0.007	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-72.4	154.4	165	-175.3	0	0	0	0	109.2	F36 V37 C49 G50 G51 H56	F36-C47 HydrophobicContact CD2-CB 3.58Å; F36-C47 HydrophobicContact CE2-CB 3.59Å; V37-C47 PolarHBondContact N-SG 3.29Å; V37-C47 CarbonylContact O-C 3.55Å; V37-C47 VanDerWaalsContact O-CA 3.24Å; V37-C47 WeakPolarHBondContact O-CA 3.41Å; V37-C47 PolarHBondContact O-SG 3.28Å; V37-C47 VanDerWaalsContact O-SG 3.4Å; C47-C49 VanDerWaalsContact CB-SG 3.52Å; C47-C49 PolarHBondContact O-N 2.99Å; C47-C49 VanDerWaalsContact O-N 3.07Å; C47-C49 PolarHBondContact SG-N 3.43Å; C47-C49 VanDerWaalsContact SG-N 3.44Å; C47-G50 WeakPolarHBondContact O-CA 3.4Å; C47-G50 PolarHBondContact O-N 3.48Å; C47-G51 PolarHBondContact N-O 3.47Å; C47-H56 VanDerWaalsContact CB-CE1 3.47Å; C47-H56 WeakPolarHBondContact CB-CE1 3.38Å
48	Q	79.6	Confident	73.6	Confident	22 Å²	22	68.2 Å²	68.2	10%	0.103	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-14	167.7	-69	-172.1	11.9	0	0	112.4	V37 E38 D39 G50 N71 W73 R254	V37-Q48 HydrophobicContact CB-CB 4.28Å; V37-Q48 HydrophobicContact CB-CG 4.32Å; V37-Q48 HydrophobicContact CG1-CB 4.36Å; V37-Q48 VanDerWaalsContact CG1-CD 3.45Å; V37-Q48 HydrophobicContact CG1-CG 3.95Å; V37-Q48 PolarHBondContact O-N 3.26Å; E38-Q48 WeakPolarHBondContact O-CG 3.48Å; E38-Q48 PolarHBondContact O-NE2 3.39Å; D39-Q48 HydrophobicContact CB-CG 4.09Å; Q48-G50 PolarHBondContact O-N 3.05Å; Q48-N71 PolarHBondContact NE2-O 3.43Å; Q48-W73 HydrophobicContact CB-CB 3.52Å; Q48-W73 HydrophobicContact CB-CG 4.27Å; Q48-R254 PolarHBondContact O-NE 3.42Å; Q48-R254 PolarHBondContact O-NH1 3.2Å; Q48-R254 VanDerWaalsContact O-NH1 3.16Å; Q48-R254 PolarHBondContact O-NH2 2.98Å
49	C	78.4	Confident	72.7	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.014	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-9.8	167.8	76.1	0	0	0	0	113.4	C33 C47 G51 H56 W73 S251 V252	C33-C49 HydrophobicContact CB-CB 4.1Å; C33-C49 VanDerWaalsContact SG-SG 3.66Å; C47-C49 VanDerWaalsContact CB-SG 3.52Å; C47-C49 PolarHBondContact O-N 2.99Å; C47-C49 VanDerWaalsContact O-N 3.07Å; C47-C49 PolarHBondContact SG-N 3.43Å; C47-C49 VanDerWaalsContact SG-N 3.44Å; C49-G51 PolarHBondContact SG-N 2.91Å; C49-G51 VanDerWaalsContact SG-N 3.36Å; C49-H56 PolarHBondContact SG-NE2 3.05Å; C49-H56 VanDerWaalsContact SG-NE2 3.35Å; C49-W73 HydrophobicContact CB-CD2 4.12Å; C49-W73 HydrophobicContact CB-CH2 4.32Å; C49-W73 HydrophobicContact CB-CZ2 3.65Å; C49-S251 CarbonylContact O-C 3.01Å; C49-S251 VanDerWaalsContact O-CA 3.32Å; C49-S251 WeakPolarHBondContact O-CA 3.1Å; C49-V252 PolarHBondContact O-N 2.9Å
50	G	78.7	Confident	71.9	Confident	26 Å²	26	67.5 Å²	67.5	27%	0.268	41%	0.408	S	S	.	.	S	Bend	trans	87.3	-3.4	-175.4	0	0	0	0	0	114.7	C47 Q48 V252	C47-G50 WeakPolarHBondContact O-CA 3.4Å; C47-G50 PolarHBondContact O-N 3.48Å; Q48-G50 PolarHBondContact O-N 3.05Å; G50-V252 WeakPolarHBondContact CA-O 3.44Å
51	G	80.5	Confident	71.4	Confident	8 Å²	8	66 Å²	66	8%	0.082	39%	0.392	C	S	.	.			trans	-80.8	143.5	175	0	0	0	0	0	112.8	C47 C49	C47-G51 PolarHBondContact N-O 3.47Å; C49-G51 PolarHBondContact SG-N 2.91Å; C49-G51 VanDerWaalsContact SG-N 3.36Å
52	A	79.8	Confident	70.9	Confident	45 Å²	45	58.8 Å²	58.8	37%	0.372	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-62.4	151.5	169.8	0	0	0	0	0	111.4	D54 A55 H56	A52-D54 PolarHBondContact O-N 2.61Å; A52-A55 WeakPolarHBondContact O-CB 3.32Å; A52-A55 PolarHBondContact O-N 2.81Å; A52-H56 PolarHBondContact O-ND1 3.29Å
53	R	75.1	Confident	70.3	Confident	125 Å²	125	63.7 Å²	63.7	47%	0.472	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-55.6	-39	178.3	-166.5	173.4	-176.9	164.8	2.7	112.5	F36 A45 A55 H56 L61	F36-R53 HydrophobicContact CE2-CB 3.96Å; F36-R53 HydrophobicContact CE2-CG 3.97Å; F36-R53 HydrophobicContact CZ-CB 4.14Å; F36-R53 HydrophobicContact CZ-CG 3.97Å; A45-R53 PolarHBondContact O-N 3.5Å; R53-A55 VanDerWaalsContact C-N 3.27Å; R53-A55 PolarHBondContact O-N 3.39Å; R53-H56 PolarHBondContact O-N 3.1Å; R53-L61 HydrophobicContact CG-CD2 3.84Å
54	D	74	Confident	69.5	Low	158 Å²	158	65.8 Å²	65.8	85%	0.845	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-71	-18.5	179.8	-56.1	-28.5	0	0	0	114	A52 H56	A52-D54 PolarHBondContact O-N 2.61Å; D54-H56 VanDerWaalsContact C-N 3.31Å
55	A	72	Confident	68.5	Low	79 Å²	79	74 Å²	74	65%	0.653	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-83.5	-7.1	179.8	0	0	0	0	0	113.1	A52 R53	A52-A55 WeakPolarHBondContact O-CB 3.32Å; A52-A55 PolarHBondContact O-N 2.81Å; R53-A55 VanDerWaalsContact C-N 3.27Å; R53-A55 PolarHBondContact O-N 3.39Å
56	H	75.1	Confident	67.2	Low	19 Å²	19	75.4 Å²	75.4	9%	0.088	43%	0.43	C	S	.	.	S	Bend	trans	-89.7	140.7	178.9	-70	76.3	0	0	0	110.7	C47 C49 A52 R53 D54 A60	C47-H56 VanDerWaalsContact CB-CE1 3.47Å; C47-H56 WeakPolarHBondContact CB-CE1 3.38Å; C49-H56 PolarHBondContact SG-NE2 3.05Å; C49-H56 VanDerWaalsContact SG-NE2 3.35Å; A52-H56 PolarHBondContact O-ND1 3.29Å; R53-H56 PolarHBondContact O-N 3.1Å; D54-H56 VanDerWaalsContact C-N 3.31Å; H56-A60 HydrophobicContact CB-CB 4.11Å
57	S	66.9	Low	65.7	Low	57 Å²	57	77.1 Å²	77.1	40%	0.399	44%	0.443	S	S	.	.			trans	-60.4	150.3	174.9	66.9	0	0	0	0	111.1	V59 A60	S57-V59 PolarHBondContact O-N 3.45Å; S57-A60 WeakPolarHBondContact O-CA 3.37Å; S57-A60 VanDerWaalsContact O-CB 3.29Å; S57-A60 WeakPolarHBondContact O-CB 3.44Å; S57-A60 PolarHBondContact O-N 3.35Å
58	S	60.6	Low	64	Low	104 Å²	104	81.7 Å²	81.7	73%	0.727	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-55.1	-27.3	178.6	53.5	0	0	0	0	113.8	A60 L61 G62	S58-A60 VanDerWaalsContact C-N 3.3Å; S58-A60 PolarHBondContact O-N 3.25Å; S58-L61 PolarHBondContact O-N 3.35Å; S58-G62 PolarHBondContact O-N 2.85Å
59	V	59.5	Low	62.7	Low	121 Å²	121	88 Å²	88	73%	0.733	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-64.8	-32.4	174.1	-177.7	0	0	0	0	112.1	S57 L61	S57-V59 PolarHBondContact O-N 3.45Å; V59-L61 VanDerWaalsContact C-N 3.33Å
60	A	58.5	Low	61.8	Low	10 Å²	10	90.4 Å²	90.4	8%	0.083	53%	0.529	C	S	.	.	G	3₁₀ helix	trans	-80.4	-14.8	-179.6	0	0	0	0	0	114.2	T34 F36 H56 S57 S58	T34-A60 VanDerWaalsContact C-CB 3.43Å; T34-A60 WeakPolarHBondContact O-CA 3.46Å; T34-A60 WeakPolarHBondContact O-CB 3.44Å; F36-A60 PolarHBondContact N-O 3.11Å; H56-A60 HydrophobicContact CB-CB 4.11Å; S57-A60 WeakPolarHBondContact O-CA 3.37Å; S57-A60 VanDerWaalsContact O-CB 3.29Å; S57-A60 WeakPolarHBondContact O-CB 3.44Å; S57-A60 PolarHBondContact O-N 3.35Å; S58-A60 VanDerWaalsContact C-N 3.3Å; S58-A60 PolarHBondContact O-N 3.25Å
61	L	61	Low	61.2	Low	72 Å²	72	96.4 Å²	96.4	38%	0.377	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-99.5	-2.1	177.3	-66.2	166.8	0	0	0	112.1	F36 R53 S58 V59	F36-L61 HydrophobicContact CB-CD2 4.39Å; F36-L61 HydrophobicContact CG-CD2 4.35Å; R53-L61 HydrophobicContact CG-CD2 3.84Å; S58-L61 PolarHBondContact O-N 3.35Å; V59-L61 VanDerWaalsContact C-N 3.33Å
62	G	57.2	Low	61	Low	43 Å²	43	105.8 Å²	105.8	44%	0.443	59%	0.587	S	S	.	*			trans	-77.6	122.7	-179.2	0	0	0	0	0	112.3	S58 Y64	S58-G62 PolarHBondContact O-N 2.85Å; G62-Y64 PolarHBondContact O-N 3.07Å
63	D	49.7	Very low	61	Low	133 Å²	133	104.6 Å²	104.6	71%	0.711	57%	0.573	S	S	*	*			trans	-67.5	16.6	-179.7	-83.3	-33.9	0	0	0	115.7	F65	D63-F65 PolarHBondContact O-N 3.44Å; D63-F65 VanDerWaalsContact O-N 3.11Å
64	Y	48.7	Very low	61.3	Low	209 Å²	209	102.2 Å²	102.2	82%	0.82	57%	0.57	S	S	*	*	S	Bend	trans	-86.6	93	-178.9	-81.5	-87.3	0	0	0	110.9	G62	G62-Y64 PolarHBondContact O-N 3.07Å
65	F	46.5	Very low	61.7	Low	189 Å²	189	95.2 Å²	95.2	83%	0.829	53%	0.534	S	S	*	.	S	Bend	trans	61.9	88.3	167.8	-73.2	-92.9	0	0	0	115.5	D63	D63-F65 PolarHBondContact O-N 3.44Å; D63-F65 VanDerWaalsContact O-N 3.11Å
66	S	46.2	Very low	62.1	Low	94 Å²	94	94 Å²	94	66%	0.657	52%	0.523	S	S	*	.			trans	164.7	-3.2	141.4	-73	0	0	0	0	115.2	A68	S66-A68 PolarHBondContact O-N 3.24Å; S66-A68 VanDerWaalsContact O-N 3.08Å
67	T	48.1	Very low	62.5	Low	102 Å²	102	100 Å²	100	63%	0.626	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-12.8	-174.2	47.4	0	0	0	0	115.4
68	A	47.3	Very low	63.2	Low	97 Å²	97	97.9 Å²	97.9	80%	0.802	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-2.9	-173.4	0	0	0	0	0	116.3	S66	S66-A68 PolarHBondContact O-N 3.24Å; S66-A68 VanDerWaalsContact O-N 3.08Å
69	I	53.6	Low	64.4	Low	154 Å²	154	93.4 Å²	93.4	79%	0.79	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.9	-13.2	-172	-65.8	172.3	0	0	0	114.1
70	V	58.3	Low	65.7	Low	54 Å²	54	89.3 Å²	89.3	33%	0.327	48%	0.481	S	S	.	.			trans	-106.4	102.7	-172.5	-170.7	0	0	0	0	112.1	R72	V70-R72 WeakPolarHBondContact CG1-O 3.37Å
71	N	67.4	Low	67.1	Low	152 Å²	152	92.5 Å²	92.5	81%	0.813	49%	0.494	S	S	*	.			trans	-82.8	-11.6	175.9	-70.5	-20.3	0	0	0	113.8	Q48	Q48-N71 PolarHBondContact NE2-O 3.43Å
72	R	75.1	Confident	68.4	Low	204 Å²	204	94.2 Å²	94.2	77%	0.77	50%	0.496	S	S	*	.	S	Bend	trans	-136.6	123.9	-174	-171.7	177.2	179.6	175.1	0.9	112.1	V70	V70-R72 WeakPolarHBondContact CG1-O 3.37Å
73	W	80.8	Confident	69.9	Low	21 Å²	21	96.3 Å²	96.3	8%	0.08	50%	0.502	C	S	.	.			trans	-73	135.8	174.1	-175.6	90.5	0	0	0	111.8	C33 V37 Q48 C49 H78	C33-W73 PolarHBondContact SG-NE1 3.41Å; V37-W73 HydrophobicContact CB-CB 4.34Å; V37-W73 HydrophobicContact CG2-CB 4.38Å; Q48-W73 HydrophobicContact CB-CB 3.52Å; Q48-W73 HydrophobicContact CB-CG 4.27Å; C49-W73 HydrophobicContact CB-CD2 4.12Å; C49-W73 HydrophobicContact CB-CH2 4.32Å; C49-W73 HydrophobicContact CB-CZ2 3.65Å; W73-H78 HydrophobicContact CG-CB 4.37Å
74	D	81.4	Confident	71.9	Confident	75 Å²	75	90.2 Å²	90.2	40%	0.401	47%	0.469	S	S	.	.			trans	-136.2	124.7	176.9	179.9	12.9	0	0	0	109.6	A76 Q77 H78	D74-A76 PolarHBondContact O-N 3.07Å; D74-A76 PolarHBondContact OD1-N 3.2Å; D74-Q77 PolarHBondContact O-N 3.3Å; D74-H78 PolarHBondContact N-ND1 2.73Å; D74-H78 WeakPolarHBondContact O-CB 3.4Å; D74-H78 PolarHBondContact O-N 3.12Å; D74-H78 PolarHBondContact O-ND1 3.12Å
75	S	81.2	Confident	73.8	Confident	11 Å²	11	81.5 Å²	81.5	8%	0.077	44%	0.437	C	S	.	.	H	α-helix	trans	-55.3	-39.6	-177.4	179	0	0	0	0	112	R31 Q77 S79 W107 D249	R31-S75 PolarHBondContact NH1-O 3.47Å; R31-S75 VanDerWaalsContact NH1-O 3.07Å; S75-Q77 VanDerWaalsContact C-N 3.32Å; S75-Q77 PolarHBondContact O-N 3.4Å; S75-S79 WeakPolarHBondContact O-CB 3.49Å; S75-S79 PolarHBondContact O-N 3.15Å; S75-S79 PolarHBondContact O-OG 3.08Å; S75-S79 PolarHBondContact OG-OG 3.42Å; S75-W107 PolarHBondContact OG-NE1 3.4Å; S75-D249 WeakPolarHBondContact CB-O 3.25Å; S75-D249 PolarHBondContact OG-O 3.01Å
76	A	82.1	Confident	75.9	Confident	52 Å²	52	72.5 Å²	72.5	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-62.6	-37.3	-176.4	0	0	0	0	0	113.3	D74 W107	D74-A76 PolarHBondContact O-N 3.07Å; D74-A76 PolarHBondContact OD1-N 3.2Å; A76-W107 HydrophobicContact CB-CZ2 4.35Å
77	Q	81.6	Confident	78.1	Confident	145 Å²	145	68.3 Å²	68.3	68%	0.678	37%	0.367	S	S	*	.	H	α-helix	trans	-98.2	-27.7	-174.5	-60.7	-178.6	-0.2	0	0	113.4	D74 S75	D74-Q77 PolarHBondContact O-N 3.3Å; S75-Q77 VanDerWaalsContact C-N 3.32Å; S75-Q77 PolarHBondContact O-N 3.4Å
78	H	83.4	Confident	80.1	Confident	13 Å²	13	63.8 Å²	63.8	6%	0.06	34%	0.341	C	S	.	.	H	α-helix	trans	-109.5	3.7	-167.6	-60.5	103.7	0	0	0	113.8	T34 T35 W73 D74	T34-H78 PolarHBondContact N-O 3.29Å; T34-H78 PolarHBondContact OG1-O 3.11Å; T35-H78 PolarHBondContact N-O 3.35Å; T35-H78 WeakPolarHBondContact OG1-CA 3.47Å; T35-H78 WeakPolarHBondContact OG1-CB 3.31Å; T35-H78 PolarHBondContact OG1-CD2 2.97Å; T35-H78 PolarHBondContact OG1-O 3.44Å; W73-H78 HydrophobicContact CG-CB 4.37Å; D74-H78 PolarHBondContact N-ND1 2.73Å; D74-H78 WeakPolarHBondContact O-CB 3.4Å; D74-H78 PolarHBondContact O-N 3.12Å; D74-H78 PolarHBondContact O-ND1 3.12Å
79	S	85.6	Confident	82.2	Confident	11 Å²	11	61.8 Å²	61.8	8%	0.077	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	150	173.5	73.3	0	0	0	0	111.5	R31 V32 S75	R31-S79 WeakPolarHBondContact CD-OG 3.45Å; R31-S79 PolarHBondContact NH1-OG 3.26Å; V32-S79 CarbonylContact O-C 3.55Å; V32-S79 VanDerWaalsContact O-CA 3.24Å; V32-S79 WeakPolarHBondContact O-CA 3.09Å; V32-S79 WeakPolarHBondContact O-CB 3.07Å; S75-S79 WeakPolarHBondContact O-CB 3.49Å; S75-S79 PolarHBondContact O-N 3.15Å; S75-S79 PolarHBondContact O-OG 3.08Å; S75-S79 PolarHBondContact OG-OG 3.42Å
80	S	86.1	Confident	83.9	Confident	35 Å²	35	54.4 Å²	54.4	25%	0.245	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	153.6	175.6	72.1	0	0	0	0	112	R31 V32 T34 Y82	R31-S80 WeakPolarHBondContact CA-O 3.33Å; V32-S80 PolarHBondContact N-O 3.18Å; V32-S80 PolarHBondContact O-N 3.35Å; T34-S80 WeakPolarHBondContact CG2-OG 3.42Å; S80-Y82 WeakPolarHBondContact OG-CE2 3.21Å
81	E	88.2	Confident	85.4	Confident	76 Å²	76	54.4 Å²	54.4	36%	0.355	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	136.4	-179.6	-69.1	170.1	-155.9	0	0	112.2	K29 K30 R31	K29-E81 HydrophobicContact CB-CB 4.43Å; K29-E81 HydrophobicContact CD-CB 4.04Å; K29-E81 HydrophobicContact CD-CG 4.37Å; K29-E81 WeakPolarHBondContact CD-OE2 3.32Å; K29-E81 WeakPolarHBondContact CE-OE2 3.29Å; K29-E81 IonicContact NZ-OE2 3.41Å; K29-E81 PolarHBondContact NZ-OE2 3.37Å; K30-E81 CarbonylContact O-C 3.59Å; K30-E81 VanDerWaalsContact O-CA 3.28Å; K30-E81 WeakPolarHBondContact O-CA 3.39Å; R31-E81 HydrophobicContact CG-CG 4.14Å; R31-E81 IonicContact NH2-OE1 2.77Å
82	Y	87.7	Confident	86.4	Confident	109 Å²	109	47.3 Å²	47.3	43%	0.427	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	160.5	173.6	-72.4	-84.2	0	0	0	110.9	K29 K30 V32 S80	K29-Y82 CarbonylContact C-O 3.56Å; K29-Y82 WeakPolarHBondContact CA-O 3.21Å; K29-Y82 WeakPolarHBondContact CB-O 3.24Å; K30-Y82 WeakPolarHBondContact CG-O 3.35Å; K30-Y82 PolarHBondContact N-O 2.88Å; K30-Y82 PolarHBondContact O-N 2.94Å; V32-Y82 HydrophobicContact CB-CD2 4.07Å; V32-Y82 HydrophobicContact CB-CE2 4.13Å; V32-Y82 HydrophobicContact CG2-CD2 3.83Å; V32-Y82 HydrophobicContact CG2-CE2 4.32Å; S80-Y82 WeakPolarHBondContact OG-CE2 3.21Å
83	P	89.8	Confident	86.6	Confident	87 Å²	87	39.6 Å²	39.6	57%	0.565	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-54.6	139.2	170.2	-27.1	36.6	0	0	0	112.5	A25 K30	A25-P83 WeakPolarHBondContact O-CB 3.41Å; K30-P83 VanDerWaalsContact CE-O 3.29Å; K30-P83 WeakPolarHBondContact CE-O 3.2Å
84	T	90.7	Very high	86.1	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.025	26%	0.258	C	S	.	.			trans	-64.9	134.7	177.1	-70.5	0	0	0	0	111.5	Y28 K29 F87 L103 R104	Y28-T84 PolarHBondContact O-N 3.14Å; Y28-T84 VanDerWaalsContact O-N 3.1Å; Y28-T84 PolarHBondContact O-OG1 3.33Å; K29-T84 VanDerWaalsContact C-OG1 3.25Å; K29-T84 PolarHBondContact N-OG1 3.42Å; K29-T84 PolarHBondContact O-OG1 2.97Å; T84-F87 HydrophobicContact CG2-CD1 4.28Å; T84-L103 HydrophobicContact CG2-CD1 4.25Å; T84-R104 HydrophobicContact CG2-CB 4.09Å; T84-R104 WeakPolarHBondContact CG2-O 3.44Å; T84-R104 PolarHBondContact OG1-O 3.31Å
85	D	89.9	Confident	85.1	Confident	27 Å²	27	42.7 Å²	42.7	14%	0.144	27%	0.265	C	S	.	.			trans	-115.1	1.6	-179.4	59.8	-9.6	0	0	0	113.7	K30 R104 V215 N216	K30-D85 WeakPolarHBondContact CD-OD1 3.38Å; K30-D85 VanDerWaalsContact NZ-CG 3.31Å; K30-D85 IonicContact NZ-OD1 2.97Å; K30-D85 IonicContact NZ-OD2 3.37Å; K30-D85 PolarHBondContact NZ-OD2 3.24Å; D85-R104 IonicContact OD1-CZ 3.6Å; D85-R104 IonicContact OD1-NH1 2.74Å; D85-R104 PolarHBondContact OD1-NH1 2.91Å; D85-R104 IonicContact OD2-NH1 3.89Å; D85-V215 HydrophobicContact CB-CG1 4.27Å; D85-N216 CarbonylContact O-C 3.58Å; D85-N216 WeakPolarHBondContact O-CA 3.34Å; D85-N216 PolarHBondContact O-N 3.41Å
86	A	90.4	Very high	84.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.274	C	S	.	.			trans	-133.8	100	-177.6	0	0	0	0	0	109.9	F102 R104 W205 L214	A86-F102 HydrophobicContact CB-CE2 4.25Å; A86-R104 HydrophobicContact CB-CB 3.85Å; A86-R104 WeakPolarHBondContact O-CB 3.49Å; A86-R104 PolarHBondContact O-N 2.89Å; A86-W205 HydrophobicContact CB-CH2 4.04Å; A86-W205 HydrophobicContact CB-CZ3 4.42Å; A86-L214 WeakPolarHBondContact CB-O 3.38Å
87	F	91.6	Very high	83.4	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.026	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	152.8	176.4	63.5	-85.1	0	0	0	110.6	I24 A25 T84 F102 L103 G219 S220 F221	I24-F87 HydrophobicContact CB-CD2 4.18Å; I24-F87 HydrophobicContact CB-CE2 4.26Å; I24-F87 HydrophobicContact CB-CG 4.5Å; I24-F87 HydrophobicContact CD1-CD2 4.04Å; I24-F87 HydrophobicContact CD1-CE2 4.42Å; I24-F87 HydrophobicContact CG2-CB 4.07Å; I24-F87 HydrophobicContact CG2-CD1 4.26Å; I24-F87 HydrophobicContact CG2-CD2 3.94Å; I24-F87 HydrophobicContact CG2-CE2 4.46Å; I24-F87 HydrophobicContact CG2-CG 3.83Å; A25-F87 HydrophobicContact CB-CE1 4.05Å; A25-F87 HydrophobicContact CB-CZ 4.44Å; T84-F87 HydrophobicContact CG2-CD1 4.28Å; F87-F102 WeakPolarHBondContact CA-O 3.25Å; F87-L103 HydrophobicContact CB-CD1 3.84Å; F87-G219 WeakPolarHBondContact O-CA 3.49Å; F87-S220 PolarHBondContact O-N 3.34Å; F87-F221 HydrophobicContact CD2-CZ 4.33Å; F87-F221 HydrophobicContact CE2-CZ 4.36Å
88	G	90.2	Very high	83	Confident	7 Å²	7	49.9 Å²	49.9	7%	0.072	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.3	-142.1	172.5	0	0	0	0	0	113	Q101 F102 S220 F221	G88-Q101 CarbonylContact O-C 3.51Å; G88-Q101 WeakPolarHBondContact O-CA 2.88Å; G88-F102 PolarHBondContact N-O 3.35Å; G88-F102 WeakPolarHBondContact O-CD1 3.41Å; G88-F102 PolarHBondContact O-N 3.31Å; G88-S220 CarbonylContact C-O 3.41Å; G88-S220 WeakPolarHBondContact CA-O 3.29Å; G88-F221 VanDerWaalsContact CA-CE1 3.45Å
89	E	90.4	Very high	83.1	Confident	54 Å²	54	53.7 Å²	53.7	25%	0.252	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	132	178.9	-68.1	-178.9	-175.8	0	0	110.4	H99 S100 Q101 S220 F221 P222 A223	E89-H99 HydrophobicContact CB-CB 4.4Å; E89-H99 IonicContact OE2-CE1 3.28Å; E89-H99 IonicContact OE2-CG 3.22Å; E89-H99 IonicContact OE2-ND1 2.88Å; E89-H99 PolarHBondContact OE2-ND1 3.14Å; E89-S100 CarbonylContact C-O 3.52Å; E89-S100 WeakPolarHBondContact CA-O 3.35Å; E89-Q101 HydrophobicContact CG-CG 4.21Å; E89-S220 PolarHBondContact N-O 3.13Å; E89-F221 HydrophobicContact CG-CD1 4.17Å; E89-P222 HydrophobicContact CB-CB 4.48Å; E89-P222 CarbonylContact O-C 3.52Å; E89-P222 VanDerWaalsContact O-CA 3.24Å; E89-P222 WeakPolarHBondContact O-CA 3.28Å; E89-A223 PolarHBondContact O-N 3.1Å
90	V	89.9	Confident	83.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.5	174	66.1	0	0	0	0	110.7	F92 S100 F102 L214 A223 Y225 F244	V90-F92 HydrophobicContact CG1-CE2 3.98Å; V90-F92 HydrophobicContact CG1-CZ 4.31Å; V90-S100 WeakPolarHBondContact CG1-O 2.88Å; V90-S100 PolarHBondContact N-O 2.82Å; V90-S100 PolarHBondContact O-N 3.11Å; V90-F102 HydrophobicContact CB-CD1 3.83Å; V90-F102 HydrophobicContact CB-CE1 4.15Å; V90-F102 HydrophobicContact CG1-CD1 4.23Å; V90-L214 HydrophobicContact CB-CD2 4.32Å; V90-L214 HydrophobicContact CG2-CD2 3.84Å; V90-A223 WeakPolarHBondContact CA-O 3.28Å; V90-Y225 VanDerWaalsContact CG2-CB 3.49Å; V90-Y225 HydrophobicContact CG2-CG 4.37Å; V90-F244 HydrophobicContact CG1-CD2 4.32Å; V90-F244 HydrophobicContact CG1-CE2 4.37Å
91	Q	89.8	Confident	83.6	Confident	53 Å²	53	53.8 Å²	53.8	25%	0.248	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.1	172.3	-174.7	179	47.3	0	0	109.3	P222 A223 K224 Y225	Q91-P222 HydrophobicContact CB-CB 4.11Å; Q91-A223 PolarHBondContact N-O 3.11Å; Q91-K224 WeakPolarHBondContact O-CA 3.16Å; Q91-Y225 PolarHBondContact O-N 3.4Å
92	F	88.4	Confident	83.8	Confident	3 Å²	3	50.3 Å²	50.3	1%	0.013	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	122.5	178.3	-66.7	-89.8	0	0	0	110.9	V90 G94 Y225 V227 L237 D238 N239 F244	V90-F92 HydrophobicContact CG1-CE2 3.98Å; V90-F92 HydrophobicContact CG1-CZ 4.31Å; F92-G94 PolarHBondContact O-N 3.23Å; F92-Y225 AromaticContact CD1-CD1 3.69Å; F92-Y225 HydrophobicContact CD1-CD1 3.69Å; F92-Y225 HydrophobicContact CD1-CE1 4.45Å; F92-Y225 AromaticContact CE1-CD1 3.52Å; F92-Y225 HydrophobicContact CE1-CD1 3.52Å; F92-Y225 HydrophobicContact CE1-CE1 4.02Å; F92-Y225 HydrophobicContact CE1-CG 4.48Å; F92-V227 HydrophobicContact CD1-CG2 3.82Å; F92-V227 HydrophobicContact CE1-CG2 4.4Å; F92-L237 HydrophobicContact CE1-CB 4.07Å; F92-L237 HydrophobicContact CZ-CB 4.09Å; F92-D238 WeakPolarHBondContact CZ-O 3.4Å; F92-N239 HydrophobicContact CB-CB 4.14Å; F92-N239 HydrophobicContact CD1-CB 3.98Å; F92-N239 HydrophobicContact CD2-CB 3.83Å; F92-N239 HydrophobicContact CE1-CB 4.35Å; F92-N239 HydrophobicContact CE2-CB 4.22Å; F92-N239 HydrophobicContact CG-CB 3.71Å; F92-N239 HydrophobicContact CZ-CB 4.46Å; F92-F244 HydrophobicContact CE2-CE2 4.15Å; F92-F244 HydrophobicContact CZ-CE2 4.05Å; F92-F244 HydrophobicContact CZ-CZ 4.16Å
93	A	79.7	Confident	84.1	Confident	42 Å²	42	45.2 Å²	45.2	35%	0.347	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	128	-179.7	0	0	0	0	0	111.8	A95 Y225 Y226	A93-A95 PolarHBondContact O-N 3.39Å; A93-Y225 PolarHBondContact N-O 3.49Å; A93-Y226 HydrophobicContact CB-CD1 3.41Å; A93-Y226 VanDerWaalsContact CB-CD1 3.41Å; A93-Y226 HydrophobicContact CB-CE1 3.44Å; A93-Y226 VanDerWaalsContact CB-CE1 3.44Å; A93-Y226 HydrophobicContact CB-CG 4.23Å
94	G	69.8	Low	84.3	Confident	95 Å²	95	42 Å²	42	98%	0.979	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.3	-10.3	168.8	0	0	0	0	0	117.6	F92	F92-G94 PolarHBondContact O-N 3.23Å
95	A	60.3	Low	84.4	Confident	67 Å²	67	41.8 Å²	41.8	55%	0.554	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-25.9	-172.2	0	0	0	0	0	115.7	A93 N239	A93-A95 PolarHBondContact O-N 3.39Å; A95-N239 VanDerWaalsContact CB-ND2 3.3Å; A95-N239 WeakPolarHBondContact CB-ND2 3.24Å
96	S	63.2	Low	84.5	Confident	36 Å²	36	40.5 Å²	40.5	25%	0.252	23%	0.23	S	C	.	.			trans	-159.5	140.1	-177	176.2	0	0	0	0	112.2	R98	S96-R98 VanDerWaalsContact C-N 3.28Å; S96-R98 WeakPolarHBondContact OG-CB 3.43Å; S96-R98 PolarHBondContact OG-N 3.05Å
97	K	65.4	Low	84.4	Confident	194 Å²	194	43.3 Å²	43.3	84%	0.843	24%	0.24	S	C	*	.	S	Bend	trans	-82.2	-2.6	168.8	-70.5	-173.3	-178.7	179.7	0	113	H99	K97-H99 PolarHBondContact O-CD2 2.95Å
98	R	73.2	Confident	84.2	Confident	129 Å²	129	45.3 Å²	45.3	49%	0.487	25%	0.251	S	S	.	.			trans	-73.3	134.9	179.9	-65.8	-178.5	175.4	170.9	1.8	110.2	S96	S96-R98 VanDerWaalsContact C-N 3.28Å; S96-R98 WeakPolarHBondContact OG-CB 3.43Å; S96-R98 PolarHBondContact OG-N 3.05Å
99	H	85.1	Confident	84.2	Confident	93 Å²	93	45.6 Å²	45.6	43%	0.431	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132.4	171.5	-63.8	-163.2	0	0	0	107.8	E89 K97	E89-H99 HydrophobicContact CB-CB 4.4Å; E89-H99 IonicContact OE2-CE1 3.28Å; E89-H99 IonicContact OE2-CG 3.22Å; E89-H99 IonicContact OE2-ND1 2.88Å; E89-H99 PolarHBondContact OE2-ND1 3.14Å; K97-H99 PolarHBondContact O-CD2 2.95Å
100	S	89.4	Confident	84.3	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.6	174.6	-44.4	0	0	0	0	108.7	E89 V90 Y241 Q242	E89-S100 CarbonylContact C-O 3.52Å; E89-S100 WeakPolarHBondContact CA-O 3.35Å; V90-S100 WeakPolarHBondContact CG1-O 2.88Å; V90-S100 PolarHBondContact N-O 2.82Å; V90-S100 PolarHBondContact O-N 3.11Å; S100-Y241 PolarHBondContact OG-O 3.3Å; S100-Q242 CarbonylContact C-O 3.59Å; S100-Q242 VanDerWaalsContact CA-O 3.25Å; S100-Q242 WeakPolarHBondContact CA-O 3.3Å; S100-Q242 WeakPolarHBondContact CB-O 3.47Å
101	Q	91.7	Very high	84.4	Confident	44 Å²	44	49.8 Å²	49.8	21%	0.206	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	142.8	178.5	-72.5	167.4	-19.7	0	0	110	G88 E89 W122 Q242 S243 F244	G88-Q101 CarbonylContact O-C 3.51Å; G88-Q101 WeakPolarHBondContact O-CA 2.88Å; E89-Q101 HydrophobicContact CG-CG 4.21Å; Q101-W122 HydrophobicContact CB-CD2 4.08Å; Q101-W122 HydrophobicContact CB-CG 4.38Å; Q101-W122 HydrophobicContact CB-CZ2 4.12Å; Q101-W122 VanDerWaalsContact CD-CD1 3.42Å; Q101-W122 VanDerWaalsContact OE1-CA 3.28Å; Q101-Q242 PolarHBondContact N-O 2.95Å; Q101-S243 CarbonylContact O-C 3.6Å; Q101-S243 WeakPolarHBondContact O-CA 3.42Å; Q101-F244 PolarHBondContact O-N 3.46Å
102	F	93.3	Very high	84.5	Confident	3 Å²	3	48.7 Å²	48.7	1%	0.013	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	147.4	176.1	76.7	-80.7	0	0	0	112	A86 F87 G88 V90 L214 A223 F244 L246	A86-F102 HydrophobicContact CB-CE2 4.25Å; F87-F102 WeakPolarHBondContact CA-O 3.25Å; G88-F102 PolarHBondContact N-O 3.35Å; G88-F102 WeakPolarHBondContact O-CD1 3.41Å; G88-F102 PolarHBondContact O-N 3.31Å; V90-F102 HydrophobicContact CB-CD1 3.83Å; V90-F102 HydrophobicContact CB-CE1 4.15Å; V90-F102 HydrophobicContact CG1-CD1 4.23Å; F102-L214 HydrophobicContact CE1-CD2 4.31Å; F102-L214 HydrophobicContact CE2-CB 3.87Å; F102-L214 HydrophobicContact CE2-CD2 4.29Å; F102-L214 HydrophobicContact CE2-CG 4.49Å; F102-L214 HydrophobicContact CZ-CB 4.14Å; F102-L214 HydrophobicContact CZ-CD2 4.07Å; F102-A223 HydrophobicContact CE1-CB 4.2Å; F102-A223 HydrophobicContact CZ-CB 4.38Å; F102-F244 CarbonylContact C-O 3.55Å; F102-F244 VanDerWaalsContact CA-O 3.26Å; F102-F244 WeakPolarHBondContact CA-O 3.36Å; F102-F244 HydrophobicContact CB-CB 3.94Å; F102-L246 HydrophobicContact CD2-CD1 4.19Å
103	L	93.6	Very high	84.6	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	128.4	175.3	174.5	65.5	0	0	0	110.3	I24 Y28 T84 F87 L105 L117 W122 F244 L246	I24-L103 HydrophobicContact CG2-CD1 3.8Å; Y28-L103 HydrophobicContact CD1-CD2 3.88Å; Y28-L103 HydrophobicContact CD2-CD1 4.37Å; Y28-L103 HydrophobicContact CD2-CD2 4.17Å; Y28-L103 HydrophobicContact CE1-CD2 3.94Å; Y28-L103 HydrophobicContact CE2-CD2 4.21Å; Y28-L103 HydrophobicContact CG-CD1 4.29Å; Y28-L103 HydrophobicContact CG-CD2 4Å; T84-L103 HydrophobicContact CG2-CD1 4.25Å; F87-L103 HydrophobicContact CB-CD1 3.84Å; L103-L105 HydrophobicContact CD2-CD2 4.27Å; L103-L117 HydrophobicContact CD2-CD2 3.46Å; L103-L117 VanDerWaalsContact CD2-CD2 3.46Å; L103-W122 HydrophobicContact CB-CH2 4.31Å; L103-W122 HydrophobicContact CB-CZ2 4Å; L103-F244 PolarHBondContact N-O 3.43Å; L103-L246 PolarHBondContact O-N 2.97Å
104	R	93.3	Very high	85.2	Confident	19 Å²	19	49.3 Å²	49.3	7%	0.072	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	125.4	165.4	-179.6	-175.9	178.3	-179.4	9.4	110.3	K30 T84 D85 A86 W205 L246 D248	K30-R104 HydrophobicContact CB-CG 4.45Å; T84-R104 HydrophobicContact CG2-CB 4.09Å; T84-R104 WeakPolarHBondContact CG2-O 3.44Å; T84-R104 PolarHBondContact OG1-O 3.31Å; D85-R104 IonicContact OD1-CZ 3.6Å; D85-R104 IonicContact OD1-NH1 2.74Å; D85-R104 PolarHBondContact OD1-NH1 2.91Å; D85-R104 IonicContact OD2-NH1 3.89Å; A86-R104 HydrophobicContact CB-CB 3.85Å; A86-R104 WeakPolarHBondContact O-CB 3.49Å; A86-R104 PolarHBondContact O-N 2.89Å; R104-W205 HydrophobicContact CG-CD2 4.28Å; R104-W205 HydrophobicContact CG-CE3 4.39Å; R104-L246 WeakPolarHBondContact CA-O 3.49Å; R104-D248 HydrophobicContact CG-CB 4.48Å; R104-D248 IonicContact CZ-OD2 3.6Å; R104-D248 IonicContact NE-OD2 3.86Å; R104-D248 PolarHBondContact NE-OD2 2.79Å; R104-D248 IonicContact NH2-OD2 2.64Å; R104-D248 PolarHBondContact NH2-OD2 2.87Å
105	L	93.6	Very high	86.2	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	154.5	-177.7	63.8	91	0	0	0	111.1	K29 L103 V114 L245 L246 V247 D248 F261	K29-L105 CarbonylContact O-C 3.59Å; K29-L105 WeakPolarHBondContact O-CA 3.39Å; L103-L105 HydrophobicContact CD2-CD2 4.27Å; L105-V114 HydrophobicContact CD2-CG1 4.46Å; L105-V114 HydrophobicContact CD2-CG2 4.18Å; L105-L245 HydrophobicContact CD2-CB 4.23Å; L105-L245 HydrophobicContact CD2-CD2 3.8Å; L105-L246 PolarHBondContact N-O 3.42Å; L105-V247 HydrophobicContact CD1-CG1 4.41Å; L105-V247 HydrophobicContact CD1-CG2 4.14Å; L105-V247 CarbonylContact O-C 3.59Å; L105-V247 WeakPolarHBondContact O-CA 3.3Å; L105-D248 WeakPolarHBondContact O-CB 3.44Å; L105-D248 PolarHBondContact O-N 3.18Å; L105-F261 HydrophobicContact CD1-CD1 4.19Å; L105-F261 HydrophobicContact CD1-CD2 4.03Å; L105-F261 HydrophobicContact CD1-CE1 3.88Å; L105-F261 HydrophobicContact CD1-CE2 3.72Å; L105-F261 HydrophobicContact CD1-CG 4.26Å; L105-F261 HydrophobicContact CD1-CZ 3.64Å; L105-F261 HydrophobicContact CD2-CE1 4.33Å; L105-F261 HydrophobicContact CD2-CZ 4.08Å
106	S	92.1	Very high	87.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	148	175.1	-169.2	0	0	0	0	111.6	K29 R31 D108 T109 D248	K29-S106 WeakPolarHBondContact O-CB 3.49Å; K29-S106 PolarHBondContact O-N 3.14Å; R31-S106 WeakPolarHBondContact CD-OG 3.42Å; R31-S106 VanDerWaalsContact CG-OG 3.25Å; R31-S106 WeakPolarHBondContact CG-OG 3.44Å; R31-S106 PolarHBondContact NE-OG 3.13Å; S106-D108 WeakPolarHBondContact CB-OD1 3.35Å; S106-D108 PolarHBondContact O-N 3.13Å; S106-D108 VanDerWaalsContact O-N 3.09Å; S106-D108 PolarHBondContact OG-OD1 3.44Å; S106-D108 VanDerWaalsContact OG-OD1 3.08Å; S106-T109 PolarHBondContact N-OG1 2.95Å; S106-T109 WeakPolarHBondContact O-CB 3.43Å; S106-T109 PolarHBondContact O-N 2.64Å; S106-T109 VanDerWaalsContact O-N 3.08Å; S106-T109 PolarHBondContact O-OG1 3.36Å; S106-D248 WeakPolarHBondContact CA-O 3.21Å
107	W	88.2	Confident	88.8	Confident	59 Å²	59	44.9 Å²	44.9	22%	0.223	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-17.8	-178.9	73.2	-88.3	0	0	0	115.1	S75 A76 V247 D248	S75-W107 PolarHBondContact OG-NE1 3.4Å; A76-W107 HydrophobicContact CB-CZ2 4.35Å; W107-V247 HydrophobicContact CB-CG1 3.71Å; W107-D248 PolarHBondContact N-O 3.5Å
108	D	88.2	Confident	90	Very high	48 Å²	48	35.8 Å²	35.8	26%	0.257	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-3.8	178.9	59.6	8.1	0	0	0	114.5	R31 S106 Q110	R31-D108 IonicContact CZ-OD2 3.58Å; R31-D108 IonicContact NE-OD2 3.39Å; R31-D108 PolarHBondContact NE-OD2 2.8Å; R31-D108 IonicContact NH2-OD2 3.89Å; R31-D108 PolarHBondContact NH2-OD2 3.45Å; S106-D108 WeakPolarHBondContact CB-OD1 3.35Å; S106-D108 PolarHBondContact O-N 3.13Å; S106-D108 VanDerWaalsContact O-N 3.09Å; S106-D108 PolarHBondContact OG-OD1 3.44Å; S106-D108 VanDerWaalsContact OG-OD1 3.08Å; D108-Q110 PolarHBondContact O-N 3.08Å
109	T	90.6	Very high	90.7	Very high	13 Å²	13	33.5 Å²	33.5	8%	0.08	16%	0.161	C	C	.	.	S	Bend	trans	-56.6	136.3	-179.6	-53.7	0	0	0	0	110.5	Y28 S106 P111 M113 V114	Y28-T109 HydrophobicContact CD1-CG2 4.08Å; Y28-T109 HydrophobicContact CE1-CG2 4.26Å; S106-T109 PolarHBondContact N-OG1 2.95Å; S106-T109 WeakPolarHBondContact O-CB 3.43Å; S106-T109 PolarHBondContact O-N 2.64Å; S106-T109 VanDerWaalsContact O-N 3.08Å; S106-T109 PolarHBondContact O-OG1 3.36Å; T109-P111 WeakPolarHBondContact O-CD 3.44Å; T109-M113 HydrophobicContact CG2-CE 3.9Å; T109-V114 HydrophobicContact CG2-CG2 4.14Å
110	Q	91.6	Very high	90.6	Very high	122 Å²	122	32.9 Å²	32.9	57%	0.57	16%	0.164	S	C	*	.			trans	-65.4	129.5	177.9	-61.4	-179.9	-1.9	0	0	111.1	D108 S112 M113	D108-Q110 PolarHBondContact O-N 3.08Å; Q110-S112 PolarHBondContact O-N 3.5Å; Q110-M113 HydrophobicContact CB-CE 3.65Å; Q110-M113 HydrophobicContact CG-CE 4.08Å; Q110-M113 PolarHBondContact O-N 3.38Å
111	P	92.2	Very high	90.4	Very high	20 Å²	20	36.4 Å²	36.4	13%	0.13	18%	0.179	C	C	.	.	H	α-helix	trans	-59.8	-28.7	-179.5	-28.1	35.6	0	0	0	115.4	T109 M113 V114 Y115 K264 L265 Y268	T109-P111 WeakPolarHBondContact O-CD 3.44Å; P111-M113 VanDerWaalsContact C-N 3.32Å; P111-M113 PolarHBondContact O-N 3.11Å; P111-V114 PolarHBondContact O-N 3.41Å; P111-Y115 PolarHBondContact O-N 3.31Å; P111-K264 HydrophobicContact CG-CB 3.87Å; P111-L265 HydrophobicContact CB-CD1 4.01Å; P111-Y268 HydrophobicContact CB-CD1 4.26Å; P111-Y268 HydrophobicContact CB-CG 3.87Å
112	S	91.5	Very high	90.2	Very high	31 Å²	31	35.6 Å²	35.6	22%	0.217	18%	0.175	C	C	.	.	H	α-helix	trans	-59.1	-40.8	179.6	57.5	0	0	0	0	113	Q110 N116 Y268	Q110-S112 PolarHBondContact O-N 3.5Å; S112-N116 WeakPolarHBondContact O-CB 3.4Å; S112-N116 VanDerWaalsContact O-CG 3.25Å; S112-N116 PolarHBondContact O-N 3.49Å; S112-N116 PolarHBondContact O-ND2 2.97Å; S112-Y268 VanDerWaalsContact CA-CZ 3.42Å; S112-Y268 VanDerWaalsContact CB-CZ 3.48Å; S112-Y268 WeakPolarHBondContact CB-OH 3.31Å
113	M	90.8	Very high	89.8	Confident	58 Å²	58	42.7 Å²	42.7	29%	0.286	21%	0.207	S	C	.	.	H	α-helix	trans	-63.9	-44.6	176.9	-63.8	-173.2	-81.5	0	0	110.9	I27 Y28 T109 Q110 P111 N116 L117	I27-M113 HydrophobicContact CG2-SD 3.67Å; Y28-M113 HydrophobicContact CE1-CB 4.25Å; Y28-M113 PolarHBondContact OH-O 3.31Å; T109-M113 HydrophobicContact CG2-CE 3.9Å; Q110-M113 HydrophobicContact CB-CE 3.65Å; Q110-M113 HydrophobicContact CG-CE 4.08Å; Q110-M113 PolarHBondContact O-N 3.38Å; P111-M113 VanDerWaalsContact C-N 3.32Å; P111-M113 PolarHBondContact O-N 3.11Å; M113-N116 PolarHBondContact O-N 2.96Å; M113-L117 PolarHBondContact O-N 2.9Å
114	V	91.8	Very high	89.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.3	-42.1	-178.8	-175.6	0	0	0	0	111.1	Y28 L105 T109 P111 N116 L117 M118 L245 F261	Y28-V114 HydrophobicContact CE1-CG2 4Å; L105-V114 HydrophobicContact CD2-CG1 4.46Å; L105-V114 HydrophobicContact CD2-CG2 4.18Å; T109-V114 HydrophobicContact CG2-CG2 4.14Å; P111-V114 PolarHBondContact O-N 3.41Å; V114-N116 PolarHBondContact O-N 3.34Å; V114-L117 WeakPolarHBondContact O-CB 3.4Å; V114-L117 PolarHBondContact O-N 3.39Å; V114-M118 HydrophobicContact CG1-CE 3.99Å; V114-M118 WeakPolarHBondContact O-CG 3.29Å; V114-M118 PolarHBondContact O-N 2.76Å; V114-L245 HydrophobicContact CG1-CD1 3.87Å; V114-L245 HydrophobicContact CG1-CD2 3.7Å; V114-L245 HydrophobicContact CG1-CG 4.48Å; V114-F261 HydrophobicContact CG2-CZ 4.08Å
115	Y	90.6	Very high	89	Confident	15 Å²	15	46 Å²	46	6%	0.059	23%	0.231	C	C	.	.	H	α-helix	trans	-61.6	-43.9	174.4	-174.9	-104.5	0	0	0	111.8	P111 L117 M118 R119 W164 Y268 I269 Q272	P111-Y115 PolarHBondContact O-N 3.31Å; Y115-L117 PolarHBondContact O-N 2.86Å; Y115-M118 HydrophobicContact CD2-CE 4.42Å; Y115-M118 PolarHBondContact O-N 2.9Å; Y115-R119 HydrophobicContact CD1-CG 4.2Å; Y115-R119 HydrophobicContact CE1-CG 3.91Å; Y115-R119 HydrophobicContact CE2-CG 4.27Å; Y115-R119 WeakPolarHBondContact O-CB 3.44Å; Y115-R119 WeakPolarHBondContact O-CG 3.33Å; Y115-R119 PolarHBondContact O-N 2.49Å; Y115-W164 HydrophobicContact CE2-CH2 4.17Å; Y115-W164 HydrophobicContact CE2-CZ3 4.3Å; Y115-Y268 AromaticContact CD1-CE1 3.92Å; Y115-Y268 HydrophobicContact CD1-CE1 3.92Å; Y115-Y268 HydrophobicContact CG-CD1 4.33Å; Y115-Y268 AromaticContact CG-CE1 3.88Å; Y115-Y268 HydrophobicContact CG-CE1 3.88Å; Y115-I269 HydrophobicContact CD2-CG1 3.91Å; Y115-I269 HydrophobicContact CE2-CG1 4.16Å; Y115-Q272 HydrophobicContact CD1-CG 4.36Å; Y115-Q272 HydrophobicContact CE1-CG 3.91Å
116	N	88.8	Confident	88.6	Confident	87 Å²	87	47.5 Å²	47.5	47%	0.465	24%	0.24	S	C	.	.	H	α-helix	trans	-60.9	-43.8	175.2	-74.3	-19.7	0	0	0	111.6	S112 M113 V114 M118 R119 T120	S112-N116 WeakPolarHBondContact O-CB 3.4Å; S112-N116 VanDerWaalsContact O-CG 3.25Å; S112-N116 PolarHBondContact O-N 3.49Å; S112-N116 PolarHBondContact O-ND2 2.97Å; M113-N116 PolarHBondContact O-N 2.96Å; V114-N116 PolarHBondContact O-N 3.34Å; N116-M118 PolarHBondContact O-N 3.49Å; N116-R119 PolarHBondContact O-N 3.29Å; N116-T120 PolarHBondContact O-N 3.23Å; N116-T120 PolarHBondContact O-OG1 2.79Å
117	L	90.4	Very high	88.3	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-57.5	-48.1	174.3	178.1	82.7	0	0	0	112.3	W23 Y28 L103 M113 V114 Y115 R119 H121 W122	W23-L117 HydrophobicContact CH2-CD1 3.57Å; W23-L117 HydrophobicContact CZ2-CD1 4.1Å; Y28-L117 HydrophobicContact CE2-CD1 4.35Å; Y28-L117 HydrophobicContact CE2-CD2 4.31Å; Y28-L117 WeakPolarHBondContact OH-CB 3.41Å; L103-L117 HydrophobicContact CD2-CD2 3.46Å; L103-L117 VanDerWaalsContact CD2-CD2 3.46Å; M113-L117 PolarHBondContact O-N 2.9Å; V114-L117 WeakPolarHBondContact O-CB 3.4Å; V114-L117 PolarHBondContact O-N 3.39Å; Y115-L117 PolarHBondContact O-N 2.86Å; L117-R119 PolarHBondContact O-N 3.24Å; L117-H121 HydrophobicContact CD1-CB 3.91Å; L117-H121 WeakPolarHBondContact O-CB 3.39Å; L117-H121 PolarHBondContact O-N 3.07Å; L117-W122 HydrophobicContact CD2-CZ2 3.97Å; L117-W122 PolarHBondContact O-N 2.83Å
118	M	90.3	Very high	88	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-57.8	-35.3	178.2	-75.2	-170.2	-73	0	0	112.1	V114 Y115 N116 W122 L124 W164 L245 L265	V114-M118 HydrophobicContact CG1-CE 3.99Å; V114-M118 WeakPolarHBondContact O-CG 3.29Å; V114-M118 PolarHBondContact O-N 2.76Å; Y115-M118 HydrophobicContact CD2-CE 4.42Å; Y115-M118 PolarHBondContact O-N 2.9Å; N116-M118 PolarHBondContact O-N 3.49Å; M118-W122 HydrophobicContact CB-CE3 4.34Å; M118-W122 HydrophobicContact CG-CD2 4.46Å; M118-W122 HydrophobicContact CG-CE3 3.58Å; M118-W122 HydrophobicContact CG-CZ3 3.79Å; M118-W122 WeakPolarHBondContact O-CB 3.17Å; M118-W122 HydrophobicContact SD-CZ3 4.43Å; M118-L124 HydrophobicContact CB-CD1 4.17Å; M118-L124 HydrophobicContact CG-CD1 4.36Å; M118-L124 WeakPolarHBondContact O-CB 3.37Å; M118-L124 PolarHBondContact O-N 2.83Å; M118-W164 HydrophobicContact CB-CH2 4.31Å; M118-W164 HydrophobicContact CE-CZ3 4.27Å; M118-W164 HydrophobicContact SD-CZ3 4.2Å; M118-L245 HydrophobicContact SD-CD1 4.25Å; M118-L265 HydrophobicContact CE-CD1 4.1Å; M118-L265 HydrophobicContact CE-CD2 4.39Å
119	R	87.1	Confident	88	Confident	82 Å²	82	44.2 Å²	44.2	31%	0.309	23%	0.226	S	C	.	.	H	α-helix	trans	-84	-51.9	-177	-67.9	-72.7	-61.2	145.7	4.6	113.1	Y115 N116 L117 H123 L124 V126	Y115-R119 HydrophobicContact CD1-CG 4.2Å; Y115-R119 HydrophobicContact CE1-CG 3.91Å; Y115-R119 HydrophobicContact CE2-CG 4.27Å; Y115-R119 WeakPolarHBondContact O-CB 3.44Å; Y115-R119 WeakPolarHBondContact O-CG 3.33Å; Y115-R119 PolarHBondContact O-N 2.49Å; N116-R119 PolarHBondContact O-N 3.29Å; L117-R119 PolarHBondContact O-N 3.24Å; R119-H123 WeakPolarHBondContact O-CA 3.2Å; R119-L124 PolarHBondContact NH1-O 2.96Å; R119-V126 VanDerWaalsContact NH1-CG2 3.26Å
120	T	84.6	Confident	88.1	Confident	80 Å²	80	43.6 Å²	43.6	49%	0.491	22%	0.223	S	C	.	.	H	α-helix	trans	-86.8	-38.5	-170.5	59.8	0	0	0	0	113.1	N116 H123	N116-T120 PolarHBondContact O-N 3.23Å; N116-T120 PolarHBondContact O-OG1 2.79Å; T120-H123 PolarHBondContact O-CE1 3.45Å; T120-H123 PolarHBondContact O-ND1 3.43Å
121	H	84.5	Confident	88.1	Confident	76 Å²	76	37.8 Å²	37.8	35%	0.352	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-38.7	-174.5	-69.3	-74.8	0	0	0	112.9	W23 L117 H123	W23-H121 AromaticContact CE2-CE1 3.84Å; W23-H121 AromaticContact CE2-NE2 3.89Å; W23-H121 AromaticContact CH2-CD2 3.5Å; W23-H121 AromaticContact CH2-NE2 3.47Å; W23-H121 WeakPolarHBondContact CH2-NE2 3.29Å; W23-H121 AromaticContact CZ2-CD2 3.35Å; W23-H121 WeakPolarHBondContact CZ2-CD2 3.49Å; W23-H121 AromaticContact CZ2-CE1 3.29Å; W23-H121 WeakPolarHBondContact CZ2-CE1 3.34Å; W23-H121 AromaticContact CZ2-CG 3.71Å; W23-H121 AromaticContact CZ2-ND1 3.67Å; W23-H121 AromaticContact CZ2-NE2 3.08Å; W23-H121 WeakPolarHBondContact CZ2-NE2 3.28Å; W23-H121 AromaticContact NE1-CE1 4Å; L117-H121 HydrophobicContact CD1-CB 3.91Å; L117-H121 WeakPolarHBondContact O-CB 3.39Å; L117-H121 PolarHBondContact O-N 3.07Å; H121-H123 VanDerWaalsContact C-N 3.31Å
122	W	87.4	Confident	88.2	Confident	28 Å²	28	36.9 Å²	36.9	11%	0.106	19%	0.19	C	C	.	.	S	Bend	trans	-85.7	-8.7	177.2	-67.2	-1.7	0	0	0	112.8	Q101 L103 L117 M118 L124 S243 L245	Q101-W122 HydrophobicContact CB-CD2 4.08Å; Q101-W122 HydrophobicContact CB-CG 4.38Å; Q101-W122 HydrophobicContact CB-CZ2 4.12Å; Q101-W122 VanDerWaalsContact CD-CD1 3.42Å; Q101-W122 VanDerWaalsContact OE1-CA 3.28Å; L103-W122 HydrophobicContact CB-CH2 4.31Å; L103-W122 HydrophobicContact CB-CZ2 4Å; L117-W122 HydrophobicContact CD2-CZ2 3.97Å; L117-W122 PolarHBondContact O-N 2.83Å; M118-W122 HydrophobicContact CB-CE3 4.34Å; M118-W122 HydrophobicContact CG-CD2 4.46Å; M118-W122 HydrophobicContact CG-CE3 3.58Å; M118-W122 HydrophobicContact CG-CZ3 3.79Å; M118-W122 WeakPolarHBondContact O-CB 3.17Å; M118-W122 HydrophobicContact SD-CZ3 4.43Å; W122-L124 HydrophobicContact CB-CG 4.15Å; W122-L124 HydrophobicContact CE3-CD1 4.28Å; W122-L124 PolarHBondContact O-N 2.85Å; W122-S243 VanDerWaalsContact CZ3-CB 3.48Å; W122-L245 HydrophobicContact CH2-CD2 3.64Å; W122-L245 HydrophobicContact CH2-CG 4.42Å; W122-L245 HydrophobicContact CZ3-CD2 4.01Å
123	H	85.9	Confident	88.2	Confident	152 Å²	152	35.6 Å²	35.6	70%	0.704	18%	0.181	S	C	*	.			trans	53.8	32.8	178.9	-58.1	-60.6	0	0	0	113.8	R119 T120 H121	R119-H123 WeakPolarHBondContact O-CA 3.2Å; T120-H123 PolarHBondContact O-CE1 3.45Å; T120-H123 PolarHBondContact O-ND1 3.43Å; H121-H123 VanDerWaalsContact C-N 3.31Å
124	L	86.6	Confident	88.1	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.063	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-74	132.7	176.1	-60.9	-179.6	0	0	0	110.3	M118 R119 W122 W164 V198	M118-L124 HydrophobicContact CB-CD1 4.17Å; M118-L124 HydrophobicContact CG-CD1 4.36Å; M118-L124 WeakPolarHBondContact O-CB 3.37Å; M118-L124 PolarHBondContact O-N 2.83Å; R119-L124 PolarHBondContact NH1-O 2.96Å; W122-L124 HydrophobicContact CB-CG 4.15Å; W122-L124 HydrophobicContact CE3-CD1 4.28Å; W122-L124 PolarHBondContact O-N 2.85Å; L124-W164 HydrophobicContact CB-CH2 4.41Å; L124-W164 HydrophobicContact CB-CZ2 3.7Å; L124-W164 HydrophobicContact CD1-CZ2 4.31Å; L124-V198 HydrophobicContact CD1-CG1 4.38Å; L124-V198 HydrophobicContact CD2-CG1 4.07Å
125	P	83.6	Confident	87.7	Confident	79 Å²	79	34 Å²	34	51%	0.513	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-64.7	155.9	177.5	28.3	-35.1	0	0	0	111.7	W164 V198	P125-W164 WeakPolarHBondContact O-CZ2 3.3Å; P125-W164 PolarHBondContact O-NE1 3.36Å; P125-W164 VanDerWaalsContact O-NE1 3.1Å; P125-V198 HydrophobicContact CG-CG2 4.33Å
126	V	83.7	Confident	86.8	Confident	30 Å²	30	33.5 Å²	33.5	18%	0.182	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-69.1	128	-178.8	-172.4	0	0	0	0	106.2	R119 I284	R119-V126 VanDerWaalsContact NH1-CG2 3.26Å; V126-I284 HydrophobicContact CG1-CD1 3.77Å
127	P	86.5	Confident	85.6	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-70.6	136	174	25.3	-27.2	0	0	0	110.1	L129 V130 W164 I284	P127-L129 VanDerWaalsContact C-N 3.25Å; P127-L129 WeakPolarHBondContact CB-O 3.41Å; P127-V130 HydrophobicContact CB-CG2 3.92Å; P127-V130 HydrophobicContact CG-CG2 3.75Å; P127-W164 HydrophobicContact CB-CB 4.19Å; P127-W164 HydrophobicContact CB-CD2 3.92Å; P127-W164 HydrophobicContact CB-CG 3.67Å; P127-W164 HydrophobicContact CG-CD2 3.61Å; P127-W164 HydrophobicContact CG-CE3 3.92Å; P127-W164 HydrophobicContact CG-CG 3.93Å; P127-W164 HydrophobicContact CG-CH2 4.46Å; P127-W164 HydrophobicContact CG-CZ2 4.19Å; P127-W164 HydrophobicContact CG-CZ3 4.33Å; P127-I284 HydrophobicContact CG-CD1 4.28Å; P127-I284 HydrophobicContact CG-CG2 4.37Å
128	N	82.7	Confident	84.4	Confident	38 Å²	38	32 Å²	32	20%	0.203	17%	0.174	C	C	.	.	S	Bend	trans	-80.1	-14.1	166	-60.6	-37.6	0	0	0	112	A161 G162 P285	N128-A161 WeakPolarHBondContact CB-O 3.34Å; N128-A161 PolarHBondContact ND2-O 2.88Å; N128-G162 PolarHBondContact N-O 3.4Å; N128-P285 WeakPolarHBondContact O-CD 3.46Å
129	L	87.1	Confident	83.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.203	C	C	.	.			trans	-156.8	143.6	178.5	167.4	70	0	0	0	108.4	P127 V131 A161 A163 W164 P285 L405 L409 W434	P127-L129 VanDerWaalsContact C-N 3.25Å; P127-L129 WeakPolarHBondContact CB-O 3.41Å; L129-V131 HydrophobicContact CD2-CG2 3.83Å; L129-V131 HydrophobicContact CG-CG2 4.02Å; L129-A161 HydrophobicContact CD2-CB 4.47Å; L129-A163 HydrophobicContact CB-CB 3.94Å; L129-A163 HydrophobicContact CD2-CB 4.19Å; L129-A163 HydrophobicContact CG-CB 4.12Å; L129-A163 CarbonylContact O-C 3.59Å; L129-A163 WeakPolarHBondContact O-CA 3.42Å; L129-A163 WeakPolarHBondContact O-CB 3.26Å; L129-W164 PolarHBondContact O-N 2.81Å; L129-P285 HydrophobicContact CB-CG 4.38Å; L129-P285 HydrophobicContact CD1-CB 4.1Å; L129-P285 HydrophobicContact CD1-CG 3.89Å; L129-P285 WeakPolarHBondContact CD1-O 3.46Å; L129-L405 HydrophobicContact CD2-CD2 3.49Å; L129-L405 VanDerWaalsContact CD2-CD2 3.49Å; L129-L405 HydrophobicContact CD2-CG 4.29Å; L129-L409 HydrophobicContact CD1-CD1 3.63Å; L129-L409 HydrophobicContact CD1-CD2 4.45Å; L129-W434 HydrophobicContact CB-CZ2 4.24Å; L129-W434 HydrophobicContact CD1-CZ2 4.18Å; L129-W434 HydrophobicContact CD2-CH2 4Å; L129-W434 HydrophobicContact CD2-CZ2 3.66Å; L129-W434 HydrophobicContact CG-CZ2 4.24Å
130	V	91.8	Very high	82.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.1	168.2	-179	0	0	0	0	109.3	P127 W164 I166 I269 I284 P285 V286 L287	P127-V130 HydrophobicContact CB-CG2 3.92Å; P127-V130 HydrophobicContact CG-CG2 3.75Å; V130-W164 WeakPolarHBondContact CA-O 3.4Å; V130-W164 HydrophobicContact CG1-CB 4.47Å; V130-W164 HydrophobicContact CG2-CB 4.29Å; V130-I166 HydrophobicContact CG1-CD1 3.53Å; V130-I166 HydrophobicContact CG1-CG1 3.85Å; V130-I269 HydrophobicContact CG2-CG2 3.82Å; V130-I284 HydrophobicContact CG2-CG2 4.04Å; V130-P285 PolarHBondContact N-O 3.17Å; V130-V286 HydrophobicContact CB-CB 4.4Å; V130-V286 HydrophobicContact CB-CG1 4.16Å; V130-V286 HydrophobicContact CB-CG2 4.06Å; V130-V286 HydrophobicContact CG1-CG1 4.26Å; V130-V286 HydrophobicContact CG2-CG2 4.43Å; V130-V286 CarbonylContact O-C 3.57Å; V130-V286 WeakPolarHBondContact O-CA 3.35Å; V130-L287 PolarHBondContact O-N 3.37Å
131	V	93	Very high	81.4	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.4	172.3	-173.4	0	0	0	0	108.8	L129 V133 L154 W164 I165 I166 L287 M289 L405	L129-V131 HydrophobicContact CD2-CG2 3.83Å; L129-V131 HydrophobicContact CG-CG2 4.02Å; V131-V133 HydrophobicContact CG1-CG2 4.39Å; V131-L154 HydrophobicContact CB-CD1 4.22Å; V131-L154 HydrophobicContact CG1-CD1 3.78Å; V131-L154 HydrophobicContact CG2-CD1 4.3Å; V131-W164 PolarHBondContact N-O 3.06Å; V131-I165 WeakPolarHBondContact O-CA 3.44Å; V131-I166 PolarHBondContact O-N 3.39Å; V131-L287 CarbonylContact C-O 3.41Å; V131-L287 WeakPolarHBondContact CA-O 3.22Å; V131-M289 HydrophobicContact CG1-CB 4.31Å; V131-L405 HydrophobicContact CG2-CD1 4.43Å
132	S	93.5	Very high	81.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	105.7	177.6	-174.7	0	0	0	0	109.7	I166 R262 E266 L287 C288 M289	S132-I166 WeakPolarHBondContact CA-O 3.39Å; S132-R262 PolarHBondContact OG-NE 3.22Å; S132-R262 PolarHBondContact OG-NH2 3.31Å; S132-E266 VanDerWaalsContact CB-OE1 3.26Å; S132-E266 WeakPolarHBondContact CB-OE1 2.98Å; S132-E266 VanDerWaalsContact OG-CD 3.31Å; S132-E266 PolarHBondContact OG-OE1 3.25Å; S132-L287 PolarHBondContact N-O 3Å; S132-C288 CarbonylContact O-C 3.51Å; S132-C288 WeakPolarHBondContact O-CA 3.46Å; S132-M289 PolarHBondContact O-N 3.05Å
133	V	91.8	Very high	81	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.03	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	120.5	179.8	-174.3	0	0	0	0	109	V131 L154 I165 I166 T167 V174 V178 R262 I291	V131-V133 HydrophobicContact CG1-CG2 4.39Å; V133-L154 HydrophobicContact CG2-CD2 3.73Å; V133-I165 HydrophobicContact CG2-CG2 4.12Å; V133-I166 PolarHBondContact N-O 3.41Å; V133-T167 HydrophobicContact CB-CG2 4.17Å; V133-T167 HydrophobicContact CG2-CG2 4.48Å; V133-V174 HydrophobicContact CG1-CG1 3.64Å; V133-V178 HydrophobicContact CG1-CG2 4.36Å; V133-R262 PolarHBondContact O-NH2 3.01Å; V133-I291 HydrophobicContact CG1-CD1 3.76Å; V133-I291 HydrophobicContact CG1-CG1 4.26Å
134	V	88.3	Confident	80.9	Confident	8 Å²	8	46.1 Å²	46.1	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.2	176.8	-175.4	0	0	0	0	107.3	M289 L290 I291 W311	V134-M289 PolarHBondContact N-O 3.39Å; V134-M289 VanDerWaalsContact O-O 3.12Å; V134-L290 HydrophobicContact CG1-CD1 4.37Å; V134-L290 WeakPolarHBondContact O-CA 3.49Å; V134-I291 PolarHBondContact O-N 3.03Å; V134-W311 HydrophobicContact CB-CH2 4.37Å; V134-W311 HydrophobicContact CB-CZ3 4.32Å; V134-W311 HydrophobicContact CG2-CH2 4.03Å; V134-W311 HydrophobicContact CG2-CZ3 4.34Å
135	G	83.1	Confident	80.8	Confident	15 Å²	15	47.9 Å²	47.9	16%	0.155	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	166.7	178.8	0	0	0	0	0	112.2	I291 S292	G135-I291 WeakPolarHBondContact CA-O 3.39Å; G135-S292 WeakPolarHBondContact CA-O 3.27Å
136	G	72	Confident	80.9	Confident	6 Å²	6	44.1 Å²	44.1	6%	0.062	23%	0.226	C	C	.	.			trans	-57	138.5	-178.7	0	0	0	0	0	112.6	G138	G136-G138 VanDerWaalsContact C-N 3.28Å; G136-G138 PolarHBondContact O-N 3.48Å
137	E	65	Low	81	Confident	35 Å²	35	48.7 Å²	48.7	16%	0.164	24%	0.239	C	C	.	.			trans	-90.7	13.7	-170.2	-67.1	-173.2	-176.8	0	0	113	R255 D294	E137-R255 PolarHBondContact O-NH1 3.4Å; E137-R255 WeakPolarHBondContact OE2-CB 3.39Å; E137-R255 WeakPolarHBondContact OE2-CD 3.41Å; E137-R255 WeakPolarHBondContact OE2-CG 3.24Å; E137-R255 IonicContact OE2-NH1 2.76Å; E137-D294 PolarHBondContact N-OD2 2.7Å
138	G	63.8	Low	80.9	Confident	24 Å²	24	51.2 Å²	51.2	25%	0.247	25%	0.251	C	S	.	.	S	Bend	trans	-97.5	168.9	-178.5	0	0	0	0	0	115.7	G136 T140	G136-G138 VanDerWaalsContact C-N 3.28Å; G136-G138 PolarHBondContact O-N 3.48Å; G138-T140 PolarHBondContact O-N 3.35Å; G138-T140 VanDerWaalsContact O-N 3.12Å
139	R	63.8	Low	81.1	Confident	167 Å²	167	49.7 Å²	49.7	63%	0.63	24%	0.244	S	C	*	.	S	Bend	trans	-72.7	10	170.1	-61.2	-172.7	-179.1	-171.9	0.1	114	K141 E172	R139-K141 PolarHBondContact O-N 3.27Å; R139-E172 WeakPolarHBondContact CG-OE1 3.18Å; R139-E172 IonicContact NE-OE1 3.18Å
140	T	65.2	Low	81.1	Confident	93 Å²	93	49.8 Å²	49.8	57%	0.571	24%	0.244	S	C	*	.	P	Polyproline II helix	trans	-60.3	126.4	177.9	47.5	0	0	0	0	109.4	G138 V142	G138-T140 PolarHBondContact O-N 3.35Å; G138-T140 VanDerWaalsContact O-N 3.12Å; T140-V142 PolarHBondContact O-N 3.17Å; T140-V142 VanDerWaalsContact O-N 3.17Å
141	K	69.4	Low	80.8	Confident	205 Å²	205	55.2 Å²	55.2	89%	0.891	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-65.5	118.5	179.3	-70.8	-176.4	179.7	178.1	0	109.1	R139	R139-K141 PolarHBondContact O-N 3.27Å
142	V	80.3	Confident	80.3	Confident	43 Å²	43	59.5 Å²	59.5	26%	0.261	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-60	137.8	171.1	-178.4	0	0	0	0	108.8	T140 V146 V174	T140-V142 PolarHBondContact O-N 3.17Å; T140-V142 VanDerWaalsContact O-N 3.17Å; V142-V146 HydrophobicContact CG1-CB 3.74Å; V142-V146 HydrophobicContact CG1-CG1 3.56Å; V142-V174 HydrophobicContact CG2-CG2 4.15Å
143	K	83.9	Confident	79.9	Confident	98 Å²	98	59.6 Å²	59.6	43%	0.426	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-58.2	148.4	177.4	-66.5	-175.6	179.8	-179.4	0	110.6	W145 V146 R147 G316	K143-W145 PolarHBondContact O-N 3.4Å; K143-V146 HydrophobicContact CB-CG2 4.1Å; K143-V146 PolarHBondContact O-N 3.21Å; K143-R147 PolarHBondContact O-N 3.32Å; K143-G316 WeakPolarHBondContact CE-O 3.42Å; K143-G316 PolarHBondContact NZ-O 2.95Å
144	T	84.3	Confident	79.7	Confident	110 Å²	110	59.4 Å²	59.4	68%	0.675	28%	0.284	S	S	*	.	H	α-helix	trans	-63	-40.7	-174.9	45.5	0	0	0	0	113.1	R147 E148	T144-R147 WeakPolarHBondContact O-CB 3.29Å; T144-R147 PolarHBondContact O-N 3.45Å; T144-E148 PolarHBondContact O-N 3.28Å
145	W	83.9	Confident	79.7	Confident	48 Å²	48	59 Å²	59	18%	0.182	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-37.5	178.2	70.8	-102.8	0	0	0	112.3	K143 R147 E148 V149	K143-W145 PolarHBondContact O-N 3.4Å; W145-R147 VanDerWaalsContact C-N 3.29Å; W145-R147 PolarHBondContact O-N 3.38Å; W145-E148 WeakPolarHBondContact O-CA 3.05Å; W145-E148 WeakPolarHBondContact O-CB 3.34Å; W145-E148 PolarHBondContact O-N 3.02Å; W145-V149 HydrophobicContact CE3-CG2 3.94Å; W145-V149 HydrophobicContact CZ3-CG2 4.15Å; W145-V149 PolarHBondContact O-N 2.99Å
146	V	85.1	Confident	79.7	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-62.3	-39.6	175.8	176.1	0	0	0	0	110.7	V142 K143 E148 V149 L150 I291 L314	V142-V146 HydrophobicContact CG1-CB 3.74Å; V142-V146 HydrophobicContact CG1-CG1 3.56Å; K143-V146 HydrophobicContact CB-CG2 4.1Å; K143-V146 PolarHBondContact O-N 3.21Å; V146-E148 VanDerWaalsContact C-N 3.25Å; V146-E148 PolarHBondContact O-N 2.9Å; V146-V149 PolarHBondContact O-N 2.94Å; V146-L150 HydrophobicContact CG1-CD1 4.49Å; V146-L150 WeakPolarHBondContact O-CG 3.37Å; V146-L150 PolarHBondContact O-N 3.31Å; V146-I291 HydrophobicContact CG1-CG2 3.4Å; V146-L314 HydrophobicContact CG1-CD1 4.11Å
147	R	86.1	Confident	80.3	Confident	125 Å²	125	62.2 Å²	62.2	47%	0.472	29%	0.291	S	S	.	.	H	α-helix	trans	-62.2	-36.1	173.8	-171.7	178.7	66.5	170.1	0.5	111.5	K143 T144 W145 L150 R151	K143-R147 PolarHBondContact O-N 3.32Å; T144-R147 WeakPolarHBondContact O-CB 3.29Å; T144-R147 PolarHBondContact O-N 3.45Å; W145-R147 VanDerWaalsContact C-N 3.29Å; W145-R147 PolarHBondContact O-N 3.38Å; R147-L150 PolarHBondContact O-N 2.73Å; R147-R151 VanDerWaalsContact O-CB 3.27Å; R147-R151 WeakPolarHBondContact O-CB 3.39Å; R147-R151 PolarHBondContact O-N 3.3Å
148	E	84.3	Confident	81.3	Confident	54 Å²	54	60.6 Å²	60.6	25%	0.252	28%	0.284	S	S	.	.	H	α-helix	trans	-70.6	-40.7	176.9	-157.1	60.8	-156.6	0	0	112.2	T144 W145 V146 L150 R151 Q152	T144-E148 PolarHBondContact O-N 3.28Å; W145-E148 WeakPolarHBondContact O-CA 3.05Å; W145-E148 WeakPolarHBondContact O-CB 3.34Å; W145-E148 PolarHBondContact O-N 3.02Å; V146-E148 VanDerWaalsContact C-N 3.25Å; V146-E148 PolarHBondContact O-N 2.9Å; E148-L150 VanDerWaalsContact C-N 3.32Å; E148-L150 PolarHBondContact O-N 3.2Å; E148-R151 PolarHBondContact O-N 3.28Å; E148-Q152 HydrophobicContact CG-CG 4.36Å; E148-Q152 PolarHBondContact O-N 3.44Å; E148-Q152 WeakPolarHBondContact OE1-CG 3.33Å; E148-Q152 PolarHBondContact OE1-NE2 3.2Å
149	V	87.3	Confident	82.3	Confident	6 Å²	6	61.2 Å²	61.2	4%	0.036	28%	0.28	C	S	.	.	I	π-helix	trans	-59.5	-43	172.6	173.5	0	0	0	0	111	W145 V146 G153 L154 M289 P398 F401	W145-V149 HydrophobicContact CE3-CG2 3.94Å; W145-V149 HydrophobicContact CZ3-CG2 4.15Å; W145-V149 PolarHBondContact O-N 2.99Å; V146-V149 PolarHBondContact O-N 2.94Å; V149-G153 CarbonylContact O-C 3.37Å; V149-G153 WeakPolarHBondContact O-CA 3.27Å; V149-G153 PolarHBondContact O-N 3.42Å; V149-L154 PolarHBondContact O-N 2.77Å; V149-M289 HydrophobicContact CG1-CE 4.48Å; V149-P398 HydrophobicContact CG2-CB 4.4Å; V149-F401 HydrophobicContact CG1-CD2 3.91Å; V149-F401 HydrophobicContact CG1-CE2 3.82Å; V149-F401 HydrophobicContact CG1-CZ 4.4Å
150	L	88.3	Confident	83	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	27%	0.269	C	S	.	.	I	π-helix	trans	-64.1	-41.7	174.9	-74.1	174.7	0	0	0	112.3	V146 R147 E148 L154 V155 V174 C177 V178 I291	V146-L150 HydrophobicContact CG1-CD1 4.49Å; V146-L150 WeakPolarHBondContact O-CG 3.37Å; V146-L150 PolarHBondContact O-N 3.31Å; R147-L150 PolarHBondContact O-N 2.73Å; E148-L150 VanDerWaalsContact C-N 3.32Å; E148-L150 PolarHBondContact O-N 3.2Å; L150-L154 HydrophobicContact CD2-CB 4.36Å; L150-L154 HydrophobicContact CD2-CD2 3.58Å; L150-V155 WeakPolarHBondContact O-CG2 3.31Å; L150-V155 PolarHBondContact O-N 2.97Å; L150-V174 HydrophobicContact CD1-CG1 4.24Å; L150-C177 HydrophobicContact CD1-CB 4.06Å; L150-V178 HydrophobicContact CD1-CG2 4.18Å; L150-V178 HydrophobicContact CD2-CG2 4.03Å; L150-I291 HydrophobicContact CD1-CD1 4.08Å; L150-I291 HydrophobicContact CD2-CD1 3.53Å; L150-I291 HydrophobicContact CG-CD1 4.04Å
151	R	85.1	Confident	83.6	Confident	115 Å²	115	54.2 Å²	54.2	43%	0.434	24%	0.244	S	C	.	.	I	π-helix	trans	-75.4	-50.7	-175.4	-171.9	-177.6	-176.4	-160.4	1.7	113.5	R147 E148 A181 D184	R147-R151 VanDerWaalsContact O-CB 3.27Å; R147-R151 WeakPolarHBondContact O-CB 3.39Å; R147-R151 PolarHBondContact O-N 3.3Å; E148-R151 PolarHBondContact O-N 3.28Å; R151-A181 HydrophobicContact CB-CB 4.18Å; R151-A181 HydrophobicContact CG-CB 4.45Å; R151-D184 IonicContact CZ-OD2 3.69Å; R151-D184 IonicContact NE-OD2 2.87Å; R151-D184 PolarHBondContact NE-OD2 2.92Å; R151-D184 IonicContact NH2-OD2 3.18Å
152	Q	82.1	Confident	84.2	Confident	90 Å²	90	45.5 Å²	45.5	42%	0.421	21%	0.213	S	C	.	.	I	π-helix	trans	-93.5	-34.5	-175.7	-68.5	-167	5.3	0	0	113.5	E148 K156	E148-Q152 HydrophobicContact CG-CG 4.36Å; E148-Q152 PolarHBondContact O-N 3.44Å; E148-Q152 WeakPolarHBondContact OE1-CG 3.33Å; E148-Q152 PolarHBondContact OE1-NE2 3.2Å; Q152-K156 WeakPolarHBondContact O-CB 3.24Å
153	G	84	Confident	84.6	Confident	2 Å²	2	43.6 Å²	43.6	2%	0.021	20%	0.202	C	C	.	.	I	π-helix	trans	-83.1	-74.6	179.9	0	0	0	0	0	111.2	V149 V155 K156 A157	V149-G153 CarbonylContact O-C 3.37Å; V149-G153 WeakPolarHBondContact O-CA 3.27Å; V149-G153 PolarHBondContact O-N 3.42Å; G153-V155 PolarHBondContact O-N 3.43Å; G153-K156 PolarHBondContact O-N 3.06Å; G153-A157 WeakPolarHBondContact O-CB 3.37Å; G153-A157 PolarHBondContact O-N 2.99Å
154	L	88	Confident	84.9	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	18%	0.182	C	C	.	.	I	π-helix	trans	-59.5	-49.7	-169.5	179.1	65	0	0	0	113.8	V131 V133 V149 L150 K156 A157 A158 I165 M289 F401	V131-L154 HydrophobicContact CB-CD1 4.22Å; V131-L154 HydrophobicContact CG1-CD1 3.78Å; V131-L154 HydrophobicContact CG2-CD1 4.3Å; V133-L154 HydrophobicContact CG2-CD2 3.73Å; V149-L154 PolarHBondContact O-N 2.77Å; L150-L154 HydrophobicContact CD2-CB 4.36Å; L150-L154 HydrophobicContact CD2-CD2 3.58Å; L154-K156 VanDerWaalsContact C-N 3.33Å; L154-K156 PolarHBondContact O-N 3.44Å; L154-A157 WeakPolarHBondContact O-CB 3.45Å; L154-A157 PolarHBondContact O-N 3.2Å; L154-A158 VanDerWaalsContact O-CB 3.27Å; L154-A158 WeakPolarHBondContact O-CB 3.5Å; L154-A158 PolarHBondContact O-N 3.44Å; L154-I165 HydrophobicContact CG-CD1 4.43Å; L154-M289 HydrophobicContact CD2-SD 4.44Å; L154-F401 HydrophobicContact CB-CE1 4.24Å; L154-F401 HydrophobicContact CD1-CE1 4.26Å
155	V	87.7	Confident	85.4	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-66.7	-37.3	-176.3	175.1	0	0	0	0	111.6	L150 G153 A158 Q159 I165 A181 V182 H185 V197	L150-V155 WeakPolarHBondContact O-CG2 3.31Å; L150-V155 PolarHBondContact O-N 2.97Å; G153-V155 PolarHBondContact O-N 3.43Å; V155-A158 PolarHBondContact O-N 2.76Å; V155-Q159 WeakPolarHBondContact O-CB 3.43Å; V155-Q159 PolarHBondContact O-N 2.97Å; V155-I165 HydrophobicContact CG2-CD1 4.5Å; V155-A181 HydrophobicContact CG2-CB 3.81Å; V155-V182 HydrophobicContact CG2-CG2 4.02Å; V155-H185 HydrophobicContact CG1-CB 3.48Å; V155-H185 VanDerWaalsContact CG1-CB 3.48Å; V155-V197 HydrophobicContact CG1-CG2 4.16Å
156	K	83.9	Confident	85.9	Confident	82 Å²	82	31.8 Å²	31.8	36%	0.357	14%	0.142	S	C	.	.	H	α-helix	trans	-68.3	-42.8	176.1	-167.6	179.1	-177.8	-178.5	0	111.3	Q152 G153 L154 A158 Q159 R160	Q152-K156 WeakPolarHBondContact O-CB 3.24Å; G153-K156 PolarHBondContact O-N 3.06Å; L154-K156 VanDerWaalsContact C-N 3.33Å; L154-K156 PolarHBondContact O-N 3.44Å; K156-A158 VanDerWaalsContact C-N 3.34Å; K156-Q159 PolarHBondContact O-N 3.38Å; K156-R160 VanDerWaalsContact O-CG 3.32Å; K156-R160 WeakPolarHBondContact O-CG 2.91Å; K156-R160 PolarHBondContact O-N 3.48Å; K156-R160 VanDerWaalsContact O-N 3.11Å
157	A	84.3	Confident	86.2	Confident	5 Å²	5	31.9 Å²	31.9	4%	0.041	14%	0.143	C	C	.	.	H	α-helix	trans	-57.1	-48.9	172.8	0	0	0	0	0	111.1	G153 L154 Q159 R160 A161 D402 L405	G153-A157 WeakPolarHBondContact O-CB 3.37Å; G153-A157 PolarHBondContact O-N 2.99Å; L154-A157 WeakPolarHBondContact O-CB 3.45Å; L154-A157 PolarHBondContact O-N 3.2Å; A157-Q159 PolarHBondContact O-N 3.3Å; A157-R160 PolarHBondContact O-N 2.58Å; A157-A161 WeakPolarHBondContact O-CB 3.29Å; A157-A161 PolarHBondContact O-N 2.66Å; A157-D402 WeakPolarHBondContact CA-OD1 3.4Å; A157-D402 WeakPolarHBondContact CB-OD1 3.36Å; A157-L405 HydrophobicContact CB-CD2 4.28Å
158	A	85.8	Confident	86.2	Confident	2 Å²	2	27.3 Å²	27.3	2%	0.017	13%	0.129	C	C	.	.	H	α-helix	trans	-66	-38.5	-177.1	0	0	0	0	0	112.2	L154 V155 K156 G162 A163 I165 V197	L154-A158 VanDerWaalsContact O-CB 3.27Å; L154-A158 WeakPolarHBondContact O-CB 3.5Å; L154-A158 PolarHBondContact O-N 3.44Å; V155-A158 PolarHBondContact O-N 2.76Å; K156-A158 VanDerWaalsContact C-N 3.34Å; A158-G162 WeakPolarHBondContact O-CA 3.12Å; A158-G162 PolarHBondContact O-N 3.03Å; A158-A163 HydrophobicContact CB-CB 4.07Å; A158-A163 PolarHBondContact O-N 2.82Å; A158-I165 HydrophobicContact CB-CD1 3.79Å; A158-I165 HydrophobicContact CB-CG1 3.93Å; A158-V197 HydrophobicContact CB-CG1 4.39Å
159	Q	84.6	Confident	86.3	Confident	37 Å²	37	24.7 Å²	24.7	17%	0.173	12%	0.117	C	C	.	.	H	α-helix	trans	-62.9	-46.2	174.8	-166	-165.4	15.6	0	0	111.6	V155 K156 A157 G162 H185 S193 N195 V197	V155-Q159 WeakPolarHBondContact O-CB 3.43Å; V155-Q159 PolarHBondContact O-N 2.97Å; K156-Q159 PolarHBondContact O-N 3.38Å; A157-Q159 PolarHBondContact O-N 3.3Å; Q159-G162 PolarHBondContact O-N 3.15Å; Q159-H185 VanDerWaalsContact CD-CE1 3.41Å; Q159-H185 PolarHBondContact OE1-CE1 2.83Å; Q159-H185 PolarHBondContact OE1-NE2 3.38Å; Q159-S193 PolarHBondContact NE2-OG 3.44Å; Q159-N195 WeakPolarHBondContact CG-O 3.43Å; Q159-N195 WeakPolarHBondContact O-CB 3.33Å; Q159-V197 HydrophobicContact CB-CG2 3.66Å; Q159-V197 HydrophobicContact CG-CG2 4.06Å
160	R	79.1	Confident	86.4	Confident	107 Å²	107	24.9 Å²	24.9	40%	0.404	12%	0.117	S	C	.	.	H	α-helix	trans	-65.3	-45.9	-178.6	-73.5	172.8	168.7	-176.3	-11.8	111.9	K156 A157 G162 D402	K156-R160 VanDerWaalsContact O-CG 3.32Å; K156-R160 WeakPolarHBondContact O-CG 2.91Å; K156-R160 PolarHBondContact O-N 3.48Å; K156-R160 VanDerWaalsContact O-N 3.11Å; A157-R160 PolarHBondContact O-N 2.58Å; R160-G162 VanDerWaalsContact C-N 3.29Å; R160-G162 PolarHBondContact O-N 3.37Å; R160-D402 IonicContact CZ-OD2 3.42Å; R160-D402 IonicContact NH1-OD2 2.73Å; R160-D402 PolarHBondContact NH1-OD2 3.47Å
161	A	78.4	Confident	86.3	Confident	5 Å²	5	30.4 Å²	30.4	4%	0.041	14%	0.138	C	C	.	.	H	α-helix	trans	-72.5	-22.1	178.4	0	0	0	0	0	112.9	N128 L129 A157 A163 W434	N128-A161 WeakPolarHBondContact CB-O 3.34Å; N128-A161 PolarHBondContact ND2-O 2.88Å; L129-A161 HydrophobicContact CD2-CB 4.47Å; A157-A161 WeakPolarHBondContact O-CB 3.29Å; A157-A161 PolarHBondContact O-N 2.66Å; A161-A163 HydrophobicContact CB-CB 4.31Å; A161-W434 HydrophobicContact CB-CD2 4.32Å; A161-W434 HydrophobicContact CB-CG 4.24Å
162	G	82	Confident	86.3	Confident	23 Å²	23	26.1 Å²	26.1	24%	0.237	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	45.1	-167	0	0	0	0	0	111.1	N128 A158 Q159 R160	N128-G162 PolarHBondContact N-O 3.4Å; A158-G162 WeakPolarHBondContact O-CA 3.12Å; A158-G162 PolarHBondContact O-N 3.03Å; Q159-G162 PolarHBondContact O-N 3.15Å; R160-G162 VanDerWaalsContact C-N 3.29Å; R160-G162 PolarHBondContact O-N 3.37Å
163	A	87.4	Confident	86.3	Confident	3 Å²	3	22.6 Å²	22.6	3%	0.025	11%	0.111	C	C	.	.			trans	-91.1	153.3	-175	0	0	0	0	0	113.2	L129 A158 A161	L129-A163 HydrophobicContact CB-CB 3.94Å; L129-A163 HydrophobicContact CD2-CB 4.19Å; L129-A163 HydrophobicContact CG-CB 4.12Å; L129-A163 CarbonylContact O-C 3.59Å; L129-A163 WeakPolarHBondContact O-CA 3.42Å; L129-A163 WeakPolarHBondContact O-CB 3.26Å; A158-A163 HydrophobicContact CB-CB 4.07Å; A158-A163 PolarHBondContact O-N 2.82Å; A161-A163 HydrophobicContact CB-CB 4.31Å
164	W	92.2	Very high	86.4	Confident	4 Å²	4	23 Å²	23	2%	0.015	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135	165.8	-69.8	4.7	0	0	0	110	Y115 M118 L124 P125 P127 L129 V130 V131 V198 I269	Y115-W164 HydrophobicContact CE2-CH2 4.17Å; Y115-W164 HydrophobicContact CE2-CZ3 4.3Å; M118-W164 HydrophobicContact CB-CH2 4.31Å; M118-W164 HydrophobicContact CE-CZ3 4.27Å; M118-W164 HydrophobicContact SD-CZ3 4.2Å; L124-W164 HydrophobicContact CB-CH2 4.41Å; L124-W164 HydrophobicContact CB-CZ2 3.7Å; L124-W164 HydrophobicContact CD1-CZ2 4.31Å; P125-W164 WeakPolarHBondContact O-CZ2 3.3Å; P125-W164 PolarHBondContact O-NE1 3.36Å; P125-W164 VanDerWaalsContact O-NE1 3.1Å; P127-W164 HydrophobicContact CB-CB 4.19Å; P127-W164 HydrophobicContact CB-CD2 3.92Å; P127-W164 HydrophobicContact CB-CG 3.67Å; P127-W164 HydrophobicContact CG-CD2 3.61Å; P127-W164 HydrophobicContact CG-CE3 3.92Å; P127-W164 HydrophobicContact CG-CG 3.93Å; P127-W164 HydrophobicContact CG-CH2 4.46Å; P127-W164 HydrophobicContact CG-CZ2 4.19Å; P127-W164 HydrophobicContact CG-CZ3 4.33Å; L129-W164 PolarHBondContact O-N 2.81Å; V130-W164 WeakPolarHBondContact CA-O 3.4Å; V130-W164 HydrophobicContact CG1-CB 4.47Å; V130-W164 HydrophobicContact CG2-CB 4.29Å; V131-W164 PolarHBondContact N-O 3.06Å; W164-V198 HydrophobicContact CG-CB 4.41Å; W164-V198 HydrophobicContact CG-CG1 4.32Å; W164-I269 HydrophobicContact CZ3-CD1 4.5Å
165	I	94	Very high	86.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	112.5	171	-54.3	177.2	0	0	0	107.7	V131 V133 L154 V155 A158 T167 V178 V182 V197 V198 A199 V200	V131-I165 WeakPolarHBondContact O-CA 3.44Å; V133-I165 HydrophobicContact CG2-CG2 4.12Å; L154-I165 HydrophobicContact CG-CD1 4.43Å; V155-I165 HydrophobicContact CG2-CD1 4.5Å; A158-I165 HydrophobicContact CB-CD1 3.79Å; A158-I165 HydrophobicContact CB-CG1 3.93Å; I165-T167 HydrophobicContact CG2-CG2 3.77Å; I165-V178 HydrophobicContact CG2-CG1 3.93Å; I165-V182 HydrophobicContact CD1-CG2 4.46Å; I165-V197 HydrophobicContact CD1-CG1 3.74Å; I165-V197 HydrophobicContact CG1-CG1 4.34Å; I165-V198 PolarHBondContact N-O 3.45Å; I165-A199 WeakPolarHBondContact O-CA 3.21Å; I165-V200 PolarHBondContact O-N 3.18Å
166	I	93.6	Very high	86.4	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.015	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.7	175.7	-56.8	-178	0	0	0	108.4	V130 V131 S132 V133 V200 V202 R262 I269	V130-I166 HydrophobicContact CG1-CD1 3.53Å; V130-I166 HydrophobicContact CG1-CG1 3.85Å; V131-I166 PolarHBondContact O-N 3.39Å; S132-I166 WeakPolarHBondContact CA-O 3.39Å; V133-I166 PolarHBondContact N-O 3.41Å; I166-V200 WeakPolarHBondContact CA-O 3.26Å; I166-V200 HydrophobicContact CG1-CB 4.46Å; I166-V202 HydrophobicContact CG2-CG2 3.83Å; I166-R262 HydrophobicContact CG2-CG 4.44Å; I166-R262 PolarHBondContact O-NH2 3.48Å; I166-I269 HydrophobicContact CD1-CD1 4.43Å
167	T	92.1	Very high	86.7	Confident	3 Å²	3	25.1 Å²	25.1	2%	0.018	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	-176.5	175.9	87.2	0	0	0	0	110.5	V133 I165 G169 V178 V200 G201 V202 Y241	V133-T167 HydrophobicContact CB-CG2 4.17Å; V133-T167 HydrophobicContact CG2-CG2 4.48Å; I165-T167 HydrophobicContact CG2-CG2 3.77Å; T167-G169 PolarHBondContact O-N 3.16Å; T167-G169 PolarHBondContact OG1-N 3.02Å; T167-V178 HydrophobicContact CG2-CB 4.26Å; T167-V178 HydrophobicContact CG2-CG1 3.88Å; T167-V178 HydrophobicContact CG2-CG2 4.37Å; T167-V200 PolarHBondContact N-O 3.11Å; T167-G201 CarbonylContact O-C 3.58Å; T167-V202 PolarHBondContact O-N 3.23Å; T167-Y241 HydrophobicContact CG2-CE1 4.04Å; T167-Y241 WeakPolarHBondContact OG1-CE1 3.42Å; T167-Y241 PolarHBondContact OG1-OH 3.35Å
168	T	86.4	Confident	86.9	Confident	29 Å²	29	24.9 Å²	24.9	18%	0.178	12%	0.12	C	C	.	.			trans	-69.2	-17.6	174	56.1	0	0	0	0	114	L170 V202 A203	T168-L170 PolarHBondContact O-N 3.23Å; T168-V202 CarbonylContact C-O 3.51Å; T168-V202 VanDerWaalsContact CA-O 3.26Å; T168-V202 WeakPolarHBondContact CA-O 3.39Å; T168-V202 CarbonylContact O-C 3.56Å; T168-A203 VanDerWaalsContact O-CB 3.3Å; T168-A203 WeakPolarHBondContact O-CB 3.16Å
169	G	86.9	Confident	87.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.12	C	C	.	.			trans	64.7	6	179.7	0	0	0	0	0	115.9	T167 D238	T167-G169 PolarHBondContact O-N 3.16Å; T167-G169 PolarHBondContact OG1-N 3.02Å; G169-D238 PolarHBondContact O-N 3.37Å
170	L	88.2	Confident	87.3	Confident	9 Å²	9	24.9 Å²	24.9	5%	0.047	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-87.4	149.3	177.1	-63.2	177.6	0	0	0	110.7	T168 E172 A203 I207 C235 L237	T168-L170 PolarHBondContact O-N 3.23Å; L170-E172 PolarHBondContact O-N 3.05Å; L170-A203 HydrophobicContact CD2-CB 3.93Å; L170-A203 HydrophobicContact CG-CB 4.22Å; L170-I207 HydrophobicContact CD1-CG2 4.36Å; L170-C235 HydrophobicContact CB-CB 4.45Å; L170-C235 HydrophobicContact CD1-CB 4.29Å; L170-C235 HydrophobicContact CD2-CB 4.2Å; L170-L237 HydrophobicContact CD2-CD2 4.26Å
171	R	86.3	Confident	87.8	Confident	117 Å²	117	20 Å²	20	44%	0.442	10%	0.102	S	C	.	.	S	Bend	trans	-79.1	42.9	177.1	-158.7	-176.5	178	-169.1	-0.3	112.8	R176 V227 C236 D238	R171-R176 HydrophobicContact CG-CG 4.36Å; R171-V227 VanDerWaalsContact NH1-CG1 3.32Å; R171-C236 WeakPolarHBondContact CB-O 3.19Å; R171-C236 PolarHBondContact N-O 2.98Å; R171-D238 HydrophobicContact CB-CB 4.4Å
172	E	84.8	Confident	88.3	Confident	26 Å²	26	20.3 Å²	20.3	12%	0.121	10%	0.104	C	C	.	.	S	Bend	trans	-136.8	155.2	178.9	-175.7	168.2	-136.9	0	0	110.9	R139 L170 V174 G175 R176 C235 R255	R139-E172 WeakPolarHBondContact CG-OE1 3.18Å; R139-E172 IonicContact NE-OE1 3.18Å; L170-E172 PolarHBondContact O-N 3.05Å; E172-V174 PolarHBondContact O-N 2.73Å; E172-G175 PolarHBondContact O-N 3.26Å; E172-R176 PolarHBondContact O-N 3.16Å; E172-C235 PolarHBondContact OE2-SG 3.44Å; E172-R255 IonicContact OE1-NH2 2.68Å; E172-R255 IonicContact OE2-CZ 3.96Å; E172-R255 IonicContact OE2-NH1 3.98Å; E172-R255 PolarHBondContact OE2-NH1 2.97Å; E172-R255 IonicContact OE2-NH2 3.18Å; E172-R255 PolarHBondContact OE2-NH2 2.84Å
173	G	83.6	Confident	88.5	Confident	16 Å²	16	23.8 Å²	23.8	17%	0.165	11%	0.11	C	C	.	.	H	α-helix	trans	53.5	-135.5	172.3	0	0	0	0	0	114
174	V	86.3	Confident	88.4	Confident	10 Å²	10	25.6 Å²	25.6	6%	0.061	12%	0.119	C	C	.	.	H	α-helix	trans	-67.2	-34.4	-179.5	179.8	0	0	0	0	112.2	V133 V142 L150 E172 R176 C177 V178 I291	V133-V174 HydrophobicContact CG1-CG1 3.64Å; V142-V174 HydrophobicContact CG2-CG2 4.15Å; L150-V174 HydrophobicContact CD1-CG1 4.24Å; E172-V174 PolarHBondContact O-N 2.73Å; V174-R176 VanDerWaalsContact C-N 3.27Å; V174-R176 PolarHBondContact O-N 3.4Å; V174-C177 PolarHBondContact O-N 3.35Å; V174-V178 HydrophobicContact CG1-CG2 4.2Å; V174-V178 WeakPolarHBondContact O-CG2 3.15Å; V174-V178 PolarHBondContact O-N 2.66Å; V174-I291 HydrophobicContact CG1-CB 4.36Å; V174-I291 HydrophobicContact CG1-CD1 4.12Å; V174-I291 HydrophobicContact CG2-CB 4.24Å; V174-I291 HydrophobicContact CG2-CG2 4.05Å
175	G	87.4	Confident	87.9	Confident	4 Å²	4	27.3 Å²	27.3	4%	0.041	13%	0.127	C	C	.	.	H	α-helix	trans	-58.1	-39.3	179.8	0	0	0	0	0	112.8	E172 G179 Y241	E172-G175 PolarHBondContact O-N 3.26Å; G175-G179 PolarHBondContact O-N 2.89Å; G175-Y241 PolarHBondContact O-OH 3.33Å
176	R	87.7	Confident	87.2	Confident	107 Å²	107	29.1 Å²	29.1	40%	0.404	14%	0.142	S	C	.	.	H	α-helix	trans	-65.9	-44.1	173	-179.5	-179.5	170.4	177.9	-3.7	112.6	R171 E172 V174 V178 G179 E180	R171-R176 HydrophobicContact CG-CG 4.36Å; E172-R176 PolarHBondContact O-N 3.16Å; V174-R176 VanDerWaalsContact C-N 3.27Å; V174-R176 PolarHBondContact O-N 3.4Å; R176-V178 VanDerWaalsContact C-N 3.32Å; R176-V178 PolarHBondContact O-N 2.56Å; R176-G179 PolarHBondContact O-N 3.14Å; R176-E180 HydrophobicContact CG-CG 4.42Å; R176-E180 IonicContact CZ-OE1 3.49Å; R176-E180 IonicContact NE-OE1 3.01Å; R176-E180 PolarHBondContact NE-OE1 3.35Å; R176-E180 IonicContact NH2-OE1 3Å; R176-E180 PolarHBondContact NH2-OE1 3.32Å; R176-E180 VanDerWaalsContact NH2-OE1 3.09Å; R176-E180 WeakPolarHBondContact O-CG 3.32Å; R176-E180 PolarHBondContact O-N 3.23Å
177	C	88.8	Confident	86.6	Confident	18 Å²	18	34.2 Å²	34.2	12%	0.122	17%	0.174	C	C	.	.	H	α-helix	trans	-63.1	-39.8	179.3	-66.9	0	0	0	0	111.8	L150 V174 A181	L150-C177 HydrophobicContact CD1-CB 4.06Å; V174-C177 PolarHBondContact O-N 3.35Å; C177-A181 VanDerWaalsContact O-CB 3.31Å; C177-A181 WeakPolarHBondContact O-CB 3.4Å; C177-A181 PolarHBondContact O-N 3.07Å
178	V	90.3	Very high	85.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.2	-42.8	173.8	177.1	0	0	0	0	111	V133 L150 I165 T167 V174 R176 A181 V182	V133-V178 HydrophobicContact CG1-CG2 4.36Å; L150-V178 HydrophobicContact CD1-CG2 4.18Å; L150-V178 HydrophobicContact CD2-CG2 4.03Å; I165-V178 HydrophobicContact CG2-CG1 3.93Å; T167-V178 HydrophobicContact CG2-CB 4.26Å; T167-V178 HydrophobicContact CG2-CG1 3.88Å; T167-V178 HydrophobicContact CG2-CG2 4.37Å; V174-V178 HydrophobicContact CG1-CG2 4.2Å; V174-V178 WeakPolarHBondContact O-CG2 3.15Å; V174-V178 PolarHBondContact O-N 2.66Å; R176-V178 VanDerWaalsContact C-N 3.32Å; R176-V178 PolarHBondContact O-N 2.56Å; V178-A181 PolarHBondContact O-N 3.46Å; V178-V182 HydrophobicContact CG1-CG2 4.39Å; V178-V182 WeakPolarHBondContact O-CG2 3.34Å; V178-V182 PolarHBondContact O-N 2.95Å
179	G	88.8	Confident	84.9	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-60.1	-46.2	175.7	0	0	0	0	0	112.8	G175 R176 V182 R183 N240	G175-G179 PolarHBondContact O-N 2.89Å; R176-G179 PolarHBondContact O-N 3.14Å; G179-V182 PolarHBondContact O-N 2.85Å; G179-R183 WeakPolarHBondContact O-CB 3.27Å; G179-R183 PolarHBondContact O-N 2.85Å; G179-N240 VanDerWaalsContact O-CB 3.25Å; G179-N240 WeakPolarHBondContact O-CB 3.38Å
180	E	88.8	Confident	83.6	Confident	38 Å²	38	42.4 Å²	42.4	18%	0.178	24%	0.239	C	C	.	.	H	α-helix	trans	-62.2	-42.4	174.9	-71.6	177.4	178.7	0	0	111.4	R176 R183 D184	R176-E180 HydrophobicContact CG-CG 4.42Å; R176-E180 IonicContact CZ-OE1 3.49Å; R176-E180 IonicContact NE-OE1 3.01Å; R176-E180 PolarHBondContact NE-OE1 3.35Å; R176-E180 IonicContact NH2-OE1 3Å; R176-E180 PolarHBondContact NH2-OE1 3.32Å; R176-E180 VanDerWaalsContact NH2-OE1 3.09Å; R176-E180 WeakPolarHBondContact O-CG 3.32Å; R176-E180 PolarHBondContact O-N 3.23Å; E180-R183 WeakPolarHBondContact O-CB 2.99Å; E180-R183 PolarHBondContact O-N 2.95Å; E180-D184 WeakPolarHBondContact O-CB 3.43Å; E180-D184 PolarHBondContact O-N 3.49Å; E180-D184 VanDerWaalsContact O-OD1 3.13Å
181	A	89.4	Confident	82	Confident	3 Å²	3	47.8 Å²	47.8	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-61.4	-45.6	175.8	0	0	0	0	0	112.8	R151 V155 C177 V178 R183 D184 H185	R151-A181 HydrophobicContact CB-CB 4.18Å; R151-A181 HydrophobicContact CG-CB 4.45Å; V155-A181 HydrophobicContact CG2-CB 3.81Å; C177-A181 VanDerWaalsContact O-CB 3.31Å; C177-A181 WeakPolarHBondContact O-CB 3.4Å; C177-A181 PolarHBondContact O-N 3.07Å; V178-A181 PolarHBondContact O-N 3.46Å; A181-R183 VanDerWaalsContact C-N 3.32Å; A181-R183 PolarHBondContact O-N 2.91Å; A181-D184 PolarHBondContact O-N 3.41Å; A181-H185 WeakPolarHBondContact O-CB 3.38Å; A181-H185 PolarHBondContact O-N 2.93Å
182	V	88.8	Confident	80.1	Confident	12 Å²	12	49 Å²	49	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-63.6	-38.8	176.8	171	0	0	0	0	111.1	V155 I165 V178 G179 A186 V197 A199	V155-V182 HydrophobicContact CG2-CG2 4.02Å; I165-V182 HydrophobicContact CD1-CG2 4.46Å; V178-V182 HydrophobicContact CG1-CG2 4.39Å; V178-V182 WeakPolarHBondContact O-CG2 3.34Å; V178-V182 PolarHBondContact O-N 2.95Å; G179-V182 PolarHBondContact O-N 2.85Å; V182-A186 VanDerWaalsContact O-CB 3.22Å; V182-A186 WeakPolarHBondContact O-CB 3.23Å; V182-A186 PolarHBondContact O-N 3.49Å; V182-V197 HydrophobicContact CG2-CG1 4.33Å; V182-A199 HydrophobicContact CG2-CB 4.42Å
183	R	86.4	Confident	78.7	Confident	97 Å²	97	49.7 Å²	49.7	37%	0.366	30%	0.301	S	S	.	.	H	α-helix	trans	-65.8	-49	175.7	-177.4	-165.4	64.3	-151	-8.1	112.1	G179 E180 A181 H185 A186 T187 N240	G179-R183 WeakPolarHBondContact O-CB 3.27Å; G179-R183 PolarHBondContact O-N 2.85Å; E180-R183 WeakPolarHBondContact O-CB 2.99Å; E180-R183 PolarHBondContact O-N 2.95Å; A181-R183 VanDerWaalsContact C-N 3.32Å; A181-R183 PolarHBondContact O-N 2.91Å; R183-H185 PolarHBondContact O-N 3.28Å; R183-A186 CarbonylContact O-C 3.22Å; R183-A186 PolarHBondContact O-N 2.83Å; R183-A186 VanDerWaalsContact O-N 3.13Å; R183-T187 WeakPolarHBondContact O-CG2 3.47Å; R183-T187 PolarHBondContact O-N 3.41Å; R183-T187 PolarHBondContact O-OG1 2.84Å; R183-T187 VanDerWaalsContact O-OG1 3.06Å; R183-N240 HydrophobicContact CB-CB 4.44Å; R183-N240 WeakPolarHBondContact CB-OD1 3.43Å
184	D	85.6	Confident	77.2	Confident	40 Å²	40	57.2 Å²	57.2	21%	0.214	34%	0.336	C	S	.	.	H	α-helix	trans	-62.1	-39	-178.9	-69.5	6.3	0	0	0	110.1	R151 E180 A181 T187 A188	R151-D184 IonicContact CZ-OD2 3.69Å; R151-D184 IonicContact NE-OD2 2.87Å; R151-D184 PolarHBondContact NE-OD2 2.92Å; R151-D184 IonicContact NH2-OD2 3.18Å; E180-D184 WeakPolarHBondContact O-CB 3.43Å; E180-D184 PolarHBondContact O-N 3.49Å; E180-D184 VanDerWaalsContact O-OD1 3.13Å; A181-D184 PolarHBondContact O-N 3.41Å; D184-T187 WeakPolarHBondContact CA-OG1 3.45Å; D184-T187 PolarHBondContact O-N 3.24Å; D184-T187 PolarHBondContact O-OG1 2.86Å; D184-A188 WeakPolarHBondContact O-CB 3.48Å; D184-A188 PolarHBondContact O-N 3.13Å
185	H	82.1	Confident	76.1	Confident	40 Å²	40	60.6 Å²	60.6	19%	0.185	35%	0.354	C	S	.	.	H	α-helix	trans	-68	-41.8	172.6	-167.2	-71.3	0	0	0	112.5	V155 Q159 A181 R183 T187 A188 A189	V155-H185 HydrophobicContact CG1-CB 3.48Å; V155-H185 VanDerWaalsContact CG1-CB 3.48Å; Q159-H185 VanDerWaalsContact CD-CE1 3.41Å; Q159-H185 PolarHBondContact OE1-CE1 2.83Å; Q159-H185 PolarHBondContact OE1-NE2 3.38Å; A181-H185 WeakPolarHBondContact O-CB 3.38Å; A181-H185 PolarHBondContact O-N 2.93Å; R183-H185 PolarHBondContact O-N 3.28Å; H185-T187 PolarHBondContact O-N 2.91Å; H185-A188 PolarHBondContact O-N 3.37Å; H185-A189 WeakPolarHBondContact O-CB 3.38Å; H185-A189 PolarHBondContact O-N 3.14Å
186	A	79.9	Confident	75.5	Confident	39 Å²	39	66.2 Å²	66.2	32%	0.322	38%	0.377	S	S	.	.	H	α-helix	trans	-67.6	-19.4	178	0	0	0	0	0	113.7	V182 R183	V182-A186 VanDerWaalsContact O-CB 3.22Å; V182-A186 WeakPolarHBondContact O-CB 3.23Å; V182-A186 PolarHBondContact O-N 3.49Å; R183-A186 CarbonylContact O-C 3.22Å; R183-A186 PolarHBondContact O-N 2.83Å; R183-A186 VanDerWaalsContact O-N 3.13Å
187	T	80.3	Confident	75.3	Confident	110 Å²	110	61.8 Å²	61.8	68%	0.675	36%	0.362	S	S	*	.	H	α-helix	trans	-90.2	-31	173.2	50.6	0	0	0	0	112.4	R183 D184 H185	R183-T187 WeakPolarHBondContact O-CG2 3.47Å; R183-T187 PolarHBondContact O-N 3.41Å; R183-T187 PolarHBondContact O-OG1 2.84Å; R183-T187 VanDerWaalsContact O-OG1 3.06Å; D184-T187 WeakPolarHBondContact CA-OG1 3.45Å; D184-T187 PolarHBondContact O-N 3.24Å; D184-T187 PolarHBondContact O-OG1 2.86Å; H185-T187 PolarHBondContact O-N 2.91Å
188	A	76.9	Confident	75.3	Confident	87 Å²	87	61.2 Å²	61.2	72%	0.719	36%	0.358	S	S	*	.	H	α-helix	trans	-80.3	-30.2	175.3	0	0	0	0	0	113.6	D184 H185	D184-A188 WeakPolarHBondContact O-CB 3.48Å; D184-A188 PolarHBondContact O-N 3.13Å; H185-A188 PolarHBondContact O-N 3.37Å
189	A	66.5	Low	75.3	Confident	32 Å²	32	61.3 Å²	61.3	26%	0.264	36%	0.359	S	S	.	.	S	Bend	trans	-75.8	138.9	-179.9	0	0	0	0	0	111.8	H185	H185-A189 WeakPolarHBondContact O-CB 3.38Å; H185-A189 PolarHBondContact O-N 3.14Å
190	S	59.1	Low	75.6	Confident	84 Å²	84	61.3 Å²	61.3	59%	0.587	36%	0.359	S	S	*	.			trans	-63	146.9	170.8	53	0	0	0	0	111.1	D192 S193	S190-D192 PolarHBondContact O-N 2.67Å; S190-S193 PolarHBondContact O-N 3.14Å
191	S	54.4	Low	75.8	Confident	123 Å²	123	59.5 Å²	59.5	86%	0.86	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-18.4	178.3	48.9	0	0	0	0	114.9
192	D	46.7	Very low	76	Confident	141 Å²	141	59.4 Å²	59.4	75%	0.754	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	5.4	-175	-72.6	-11.4	0	0	0	115.2	S190 L194	S190-D192 PolarHBondContact O-N 2.67Å; D192-L194 PolarHBondContact O-N 3.41Å; D192-L194 VanDerWaalsContact O-N 3.13Å
193	S	54.7	Low	76.1	Confident	42 Å²	42	58.8 Å²	58.8	29%	0.294	35%	0.346	S	S	.	.			trans	-71.6	112.2	176.3	69.7	0	0	0	0	110.8	Q159 S190 N195	Q159-S193 PolarHBondContact NE2-OG 3.44Å; S190-S193 PolarHBondContact O-N 3.14Å; S193-N195 PolarHBondContact O-N 3.35Å; S193-N195 VanDerWaalsContact O-N 3.08Å
194	L	51.6	Low	76.3	Confident	174 Å²	174	54.5 Å²	54.5	91%	0.911	33%	0.33	S	S	*	.	S	Bend	trans	-49.9	-32.6	-178.6	-77.2	155.5	0	0	0	114.3	D192	D192-L194 PolarHBondContact O-N 3.41Å; D192-L194 VanDerWaalsContact O-N 3.13Å
195	N	64.8	Low	76.6	Confident	81 Å²	81	53 Å²	53	43%	0.433	32%	0.322	S	S	.	.			trans	-108.7	100.3	-177.3	-66	-11.6	0	0	0	110.9	Q159 S193	Q159-N195 WeakPolarHBondContact CG-O 3.43Å; Q159-N195 WeakPolarHBondContact O-CB 3.33Å; S193-N195 PolarHBondContact O-N 3.35Å; S193-N195 VanDerWaalsContact O-N 3.08Å
196	K	73.4	Confident	76.8	Confident	122 Å²	122	51.4 Å²	51.4	53%	0.53	32%	0.316	S	S	.	.			trans	-80.9	130.6	171.8	-171.5	-179.1	177.6	-168.5	0	109.8	V198	K196-V198 PolarHBondContact O-N 3.49Å
197	V	83.9	Confident	77.1	Confident	14 Å²	14	49.8 Å²	49.8	9%	0.085	30%	0.302	C	S	.	.			trans	-62.2	123.7	176	-177.4	0	0	0	0	109.9	V155 A158 Q159 I165 V182 Q242	V155-V197 HydrophobicContact CG1-CG2 4.16Å; A158-V197 HydrophobicContact CB-CG1 4.39Å; Q159-V197 HydrophobicContact CB-CG2 3.66Å; Q159-V197 HydrophobicContact CG-CG2 4.06Å; I165-V197 HydrophobicContact CD1-CG1 3.74Å; I165-V197 HydrophobicContact CG1-CG1 4.34Å; V182-V197 HydrophobicContact CG2-CG1 4.33Å; V197-Q242 PolarHBondContact O-NE2 3.43Å
198	V	88.7	Confident	77.6	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.03	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	114.4	177.6	-179.4	0	0	0	0	108.3	L124 P125 W164 I165 K196 V200	L124-V198 HydrophobicContact CD1-CG1 4.38Å; L124-V198 HydrophobicContact CD2-CG1 4.07Å; P125-V198 HydrophobicContact CG-CG2 4.33Å; W164-V198 HydrophobicContact CG-CB 4.41Å; W164-V198 HydrophobicContact CG-CG1 4.32Å; I165-V198 PolarHBondContact N-O 3.45Å; K196-V198 PolarHBondContact O-N 3.49Å; V198-V200 HydrophobicContact CG1-CG2 4.13Å
199	A	91.6	Very high	78.1	Confident	2 Å²	2	42.3 Å²	42.3	2%	0.017	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122	175.1	0	0	0	0	0	109.5	I165 V182 Y241 Q242	I165-A199 WeakPolarHBondContact O-CA 3.21Å; V182-A199 HydrophobicContact CG2-CB 4.42Å; A199-Y241 HydrophobicContact CB-CD1 3.62Å; A199-Y241 HydrophobicContact CB-CE1 3.92Å; A199-Y241 HydrophobicContact CB-CG 4.3Å; A199-Q242 PolarHBondContact O-N 3.04Å
200	V	93.6	Very high	79.1	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.9	-179.2	-176.2	0	0	0	0	108.9	I165 I166 T167 V198 L245	I165-V200 PolarHBondContact O-N 3.18Å; I166-V200 WeakPolarHBondContact CA-O 3.26Å; I166-V200 HydrophobicContact CG1-CB 4.46Å; T167-V200 PolarHBondContact N-O 3.11Å; V198-V200 HydrophobicContact CG1-CG2 4.13Å; V200-L245 HydrophobicContact CG1-CD1 4.4Å
201	G	93.6	Very high	80.4	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.8	175.6	0	0	0	0	0	111.3	T167 S243 F244 L245	T167-G201 CarbonylContact O-C 3.58Å; G201-S243 PolarHBondContact N-O 2.98Å; G201-F244 CarbonylContact O-C 3.6Å; G201-F244 VanDerWaalsContact O-CA 3.31Å; G201-F244 WeakPolarHBondContact O-CA 3.35Å; G201-L245 PolarHBondContact O-N 2.79Å
202	V	93.3	Very high	82	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	105.2	171.3	-175.1	0	0	0	0	107.7	I166 T167 T168 L245 V247 D258 F261 R262	I166-V202 HydrophobicContact CG2-CG2 3.83Å; T167-V202 PolarHBondContact O-N 3.23Å; T168-V202 CarbonylContact C-O 3.51Å; T168-V202 VanDerWaalsContact CA-O 3.26Å; T168-V202 WeakPolarHBondContact CA-O 3.39Å; T168-V202 CarbonylContact O-C 3.56Å; V202-L245 CarbonylContact C-O 3.45Å; V202-L245 WeakPolarHBondContact CA-O 3.36Å; V202-L245 HydrophobicContact CG2-CB 4.31Å; V202-L245 HydrophobicContact CG2-CD1 4.24Å; V202-V247 HydrophobicContact CG1-CG2 3.75Å; V202-D258 HydrophobicContact CG1-CB 4.32Å; V202-F261 HydrophobicContact CG1-CD1 4.41Å; V202-R262 HydrophobicContact CG1-CB 4.28Å; V202-R262 HydrophobicContact CG1-CG 4.44Å; V202-R262 HydrophobicContact CG2-CG 4.46Å
203	A	91.2	Very high	83.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.9	-173	0	0	0	0	0	111.5	T168 L170 W205 L237 L245 L246 V247	T168-A203 VanDerWaalsContact O-CB 3.3Å; T168-A203 WeakPolarHBondContact O-CB 3.16Å; L170-A203 HydrophobicContact CD2-CB 3.93Å; L170-A203 HydrophobicContact CG-CB 4.22Å; A203-W205 PolarHBondContact O-N 3.02Å; A203-L237 HydrophobicContact CB-CD2 4.45Å; A203-L245 PolarHBondContact N-O 3.49Å; A203-L246 HydrophobicContact CB-CD2 3.97Å; A203-L246 CarbonylContact O-C 3.54Å; A203-L246 VanDerWaalsContact O-CA 3.31Å; A203-L246 WeakPolarHBondContact O-CA 3.46Å; A203-V247 PolarHBondContact O-N 3.5Å
204	P	90.9	Very high	85.6	Confident	6 Å²	6	38.8 Å²	38.8	4%	0.039	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	125.8	169.9	28.7	-33	0	0	0	110.9	G206 I207 V247	P204-G206 PolarHBondContact O-N 2.98Å; P204-I207 HydrophobicContact CG-CB 4.26Å; P204-I207 HydrophobicContact CG-CD1 3.76Å; P204-I207 HydrophobicContact CG-CG1 4.06Å; P204-I207 PolarHBondContact O-N 2.77Å; P204-V247 CarbonylContact C-O 3.51Å; P204-V247 WeakPolarHBondContact CA-O 3.43Å
205	W	90.8	Very high	87.4	Confident	9 Å²	9	33.3 Å²	33.3	3%	0.034	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.7	179	176.9	-105	0	0	0	113.1	A86 R104 A203 I207 R211 L214 V215 L246 V247 D248	A86-W205 HydrophobicContact CB-CH2 4.04Å; A86-W205 HydrophobicContact CB-CZ3 4.42Å; R104-W205 HydrophobicContact CG-CD2 4.28Å; R104-W205 HydrophobicContact CG-CE3 4.39Å; A203-W205 PolarHBondContact O-N 3.02Å; W205-I207 PolarHBondContact O-N 2.63Å; W205-R211 HydrophobicContact CH2-CB 3.71Å; W205-R211 HydrophobicContact CZ2-CB 3.75Å; W205-R211 HydrophobicContact CZ2-CG 4.1Å; W205-R211 HydrophobicContact CZ3-CB 4.12Å; W205-R211 PolarHBondContact O-NH1 3.24Å; W205-L214 HydrophobicContact CH2-CB 4.25Å; W205-L214 HydrophobicContact CZ3-CB 4.43Å; W205-L214 HydrophobicContact CZ3-CD1 4.23Å; W205-V215 HydrophobicContact CH2-CG2 3.98Å; W205-V215 HydrophobicContact CZ2-CG2 3.86Å; W205-L246 HydrophobicContact CE3-CB 3.95Å; W205-L246 HydrophobicContact CE3-CD1 3.63Å; W205-L246 HydrophobicContact CE3-CG 4.37Å; W205-L246 HydrophobicContact CZ3-CD1 3.59Å; W205-V247 WeakPolarHBondContact CB-O 3.48Å; W205-V247 PolarHBondContact N-O 2.95Å; W205-D248 HydrophobicContact CB-CB 4.16Å
206	G	87	Confident	88.5	Confident	6 Å²	6	32.2 Å²	32.2	6%	0.062	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.8	177.7	0	0	0	0	0	115	P204 S251 G253	P204-G206 PolarHBondContact O-N 2.98Å; G206-S251 VanDerWaalsContact CA-O 3.24Å; G206-S251 WeakPolarHBondContact CA-O 3.4Å; G206-G253 PolarHBondContact O-N 2.91Å
207	I	87.3	Confident	89	Confident	5 Å²	5	31.1 Å²	31.1	3%	0.026	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-19.3	-172.3	-62	-174.8	0	0	0	112.6	L170 P204 W205 H209 S234 C235 R254 R255	L170-I207 HydrophobicContact CD1-CG2 4.36Å; P204-I207 HydrophobicContact CG-CB 4.26Å; P204-I207 HydrophobicContact CG-CD1 3.76Å; P204-I207 HydrophobicContact CG-CG1 4.06Å; P204-I207 PolarHBondContact O-N 2.77Å; W205-I207 PolarHBondContact O-N 2.63Å; I207-H209 PolarHBondContact O-N 3.15Å; I207-H209 VanDerWaalsContact O-N 3.14Å; I207-S234 WeakPolarHBondContact O-CA 3.26Å; I207-C235 HydrophobicContact CG2-CB 3.87Å; I207-C235 PolarHBondContact O-N 3.24Å; I207-R254 WeakPolarHBondContact CD1-O 3.41Å; I207-R255 HydrophobicContact CD1-CB 4.11Å; I207-R255 HydrophobicContact CD1-CG 3.3Å
208	V	89.3	Confident	88.8	Confident	5 Å²	5	39.1 Å²	39.1	3%	0.03	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-63.5	117.2	-175.4	179.4	0	0	0	0	110.8	R211 C235 L237 L246	V208-R211 HydrophobicContact CB-CB 4.4Å; V208-R211 HydrophobicContact CG1-CB 4.31Å; V208-C235 WeakPolarHBondContact CA-O 3.38Å; V208-L237 HydrophobicContact CG1-CD1 4.2Å; V208-L237 HydrophobicContact CG1-CD2 4.25Å; V208-L237 HydrophobicContact CG1-CG 3.93Å; V208-L237 HydrophobicContact CG2-CD2 3.96Å; V208-L246 HydrophobicContact CG2-CD2 4.23Å
209	H	87.4	Confident	88.5	Confident	36 Å²	36	39.3 Å²	39.3	17%	0.167	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	147.9	176.7	-171	38.8	0	0	0	111	I207 R211 Y225 C235	I207-H209 PolarHBondContact O-N 3.15Å; I207-H209 VanDerWaalsContact O-N 3.14Å; H209-R211 PolarHBondContact O-N 3.13Å; H209-R211 VanDerWaalsContact O-N 3.14Å; H209-Y225 VanDerWaalsContact O-CE2 3.26Å; H209-Y225 WeakPolarHBondContact O-CE2 3.4Å; H209-Y225 PolarHBondContact O-OH 3.1Å; H209-C235 PolarHBondContact N-O 3.12Å
210	N	87.5	Confident	87.9	Confident	42 Å²	42	39.9 Å²	39.9	23%	0.225	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	30.1	-177.8	-67.6	-18.2	0	0	0	115	E212 Q213 Y225	N210-E212 PolarHBondContact O-N 3.36Å; N210-Q213 HydrophobicContact CB-CG 4.45Å; N210-Q213 WeakPolarHBondContact O-CB 3.41Å; N210-Q213 PolarHBondContact O-N 2.91Å; N210-Y225 HydrophobicContact CB-CE2 4.1Å
211	R	87.1	Confident	87.4	Confident	67 Å²	67	42.1 Å²	42.1	25%	0.253	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-56.3	-23.6	-179.2	63.1	-174.2	172.9	-174.4	-2.7	114.7	W205 V208 H209 Q213 L214 V252	W205-R211 HydrophobicContact CH2-CB 3.71Å; W205-R211 HydrophobicContact CZ2-CB 3.75Å; W205-R211 HydrophobicContact CZ2-CG 4.1Å; W205-R211 HydrophobicContact CZ3-CB 4.12Å; W205-R211 PolarHBondContact O-NH1 3.24Å; V208-R211 HydrophobicContact CB-CB 4.4Å; V208-R211 HydrophobicContact CG1-CB 4.31Å; H209-R211 PolarHBondContact O-N 3.13Å; H209-R211 VanDerWaalsContact O-N 3.14Å; R211-Q213 PolarHBondContact O-N 2.91Å; R211-L214 WeakPolarHBondContact O-CB 3.47Å; R211-L214 PolarHBondContact O-N 3.23Å; R211-V252 VanDerWaalsContact NH2-CG1 3.34Å
212	E	87.1	Confident	86.9	Confident	168 Å²	168	44.7 Å²	44.7	79%	0.785	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-58.8	-29.5	175.3	-61.6	-174.9	-167.4	0	0	113.1	N210 L214 V215	N210-E212 PolarHBondContact O-N 3.36Å; E212-L214 PolarHBondContact O-N 3.36Å; E212-V215 PolarHBondContact O-N 3.47Å
213	Q	88.4	Confident	86.6	Confident	71 Å²	71	45 Å²	45	33%	0.332	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-67.8	-17.3	177.3	-62.8	175.9	2.3	0	0	113.2	N210 R211	N210-Q213 HydrophobicContact CB-CG 4.45Å; N210-Q213 WeakPolarHBondContact O-CB 3.41Å; N210-Q213 PolarHBondContact O-N 2.91Å; R211-Q213 PolarHBondContact O-N 2.91Å
214	L	88.6	Confident	86.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-98	-11.6	-178.6	-58.9	175.8	0	0	0	112.7	A86 V90 F102 W205 R211 E212 N216 A223 Y225 L237 L246	A86-L214 WeakPolarHBondContact CB-O 3.38Å; V90-L214 HydrophobicContact CB-CD2 4.32Å; V90-L214 HydrophobicContact CG2-CD2 3.84Å; F102-L214 HydrophobicContact CE1-CD2 4.31Å; F102-L214 HydrophobicContact CE2-CB 3.87Å; F102-L214 HydrophobicContact CE2-CD2 4.29Å; F102-L214 HydrophobicContact CE2-CG 4.49Å; F102-L214 HydrophobicContact CZ-CB 4.14Å; F102-L214 HydrophobicContact CZ-CD2 4.07Å; W205-L214 HydrophobicContact CH2-CB 4.25Å; W205-L214 HydrophobicContact CZ3-CB 4.43Å; W205-L214 HydrophobicContact CZ3-CD1 4.23Å; R211-L214 WeakPolarHBondContact O-CB 3.47Å; R211-L214 PolarHBondContact O-N 3.23Å; E212-L214 PolarHBondContact O-N 3.36Å; L214-N216 PolarHBondContact O-N 2.86Å; L214-A223 HydrophobicContact CD2-CB 4.05Å; L214-Y225 HydrophobicContact CD1-CD2 4.45Å; L214-Y225 HydrophobicContact CD2-CD2 4.2Å; L214-Y225 HydrophobicContact CG-CD2 4.25Å; L214-L237 HydrophobicContact CD1-CD1 4.04Å; L214-L246 HydrophobicContact CD1-CD1 4.23Å
215	V	90.4	Very high	86.3	Confident	59 Å²	59	50.9 Å²	50.9	36%	0.358	26%	0.256	S	S	.	.			trans	-84.5	115.6	-176.2	179.7	0	0	0	0	109.9	D85 W205 E212	D85-V215 HydrophobicContact CB-CG1 4.27Å; W205-V215 HydrophobicContact CH2-CG2 3.98Å; W205-V215 HydrophobicContact CZ2-CG2 3.86Å; E212-V215 PolarHBondContact O-N 3.47Å
216	N	87.7	Confident	86.1	Confident	57 Å²	57	56 Å²	56	31%	0.305	28%	0.276	S	S	.	.			trans	-153	115.2	171.4	-177.9	-6.3	0	0	0	109.7	D85 L214 K218 G219 S220	D85-N216 CarbonylContact O-C 3.58Å; D85-N216 WeakPolarHBondContact O-CA 3.34Å; D85-N216 PolarHBondContact O-N 3.41Å; L214-N216 PolarHBondContact O-N 2.86Å; N216-K218 PolarHBondContact O-N 2.9Å; N216-K218 PolarHBondContact OD1-N 3.31Å; N216-K218 VanDerWaalsContact OD1-N 3.15Å; N216-G219 PolarHBondContact ND2-O 2.71Å; N216-G219 PolarHBondContact O-N 3.24Å; N216-S220 WeakPolarHBondContact CB-OG 3.46Å; N216-S220 PolarHBondContact ND2-OG 3.11Å
217	P	82.9	Confident	85.8	Confident	99 Å²	99	58.1 Å²	58.1	64%	0.643	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.8	-175.2	26.5	-35.7	0	0	0	114.1
218	K	81.2	Confident	85.3	Confident	183 Å²	183	63.7 Å²	63.7	80%	0.796	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-2.2	175.3	-66.4	-177.4	179.2	179.1	0	113.5	N216	N216-K218 PolarHBondContact O-N 2.9Å; N216-K218 PolarHBondContact OD1-N 3.31Å; N216-K218 VanDerWaalsContact OD1-N 3.15Å
219	G	81.2	Confident	84.2	Confident	8 Å²	8	70.9 Å²	70.9	8%	0.082	35%	0.352	C	S	.	.			trans	81.9	155.5	-168.6	0	0	0	0	0	112.4	F87 N216	F87-G219 WeakPolarHBondContact O-CA 3.49Å; N216-G219 PolarHBondContact ND2-O 2.71Å; N216-G219 PolarHBondContact O-N 3.24Å
220	S	79.3	Confident	83	Confident	14 Å²	14	71.5 Å²	71.5	10%	0.098	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	117.6	-176.3	-68.7	0	0	0	0	112	F87 G88 E89 N216	F87-S220 PolarHBondContact O-N 3.34Å; G88-S220 CarbonylContact C-O 3.41Å; G88-S220 WeakPolarHBondContact CA-O 3.29Å; E89-S220 PolarHBondContact N-O 3.13Å; N216-S220 WeakPolarHBondContact CB-OG 3.46Å; N216-S220 PolarHBondContact ND2-OG 3.11Å
221	F	82.4	Confident	81.7	Confident	49 Å²	49	74.6 Å²	74.6	22%	0.215	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	81.5	-177.9	-53.7	-83.8	0	0	0	111.1	Q21 F87 G88 E89	Q21-F221 VanDerWaalsContact OE1-CE1 3.22Å; F87-F221 HydrophobicContact CD2-CZ 4.33Å; F87-F221 HydrophobicContact CE2-CZ 4.36Å; G88-F221 VanDerWaalsContact CA-CE1 3.45Å; E89-F221 HydrophobicContact CG-CD1 4.17Å
222	P	83.9	Confident	80.4	Confident	55 Å²	55	82.1 Å²	82.1	36%	0.357	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-105.8	147.8	1.1	36.7	-30.1	0	0	0	114.3	E89 Q91	E89-P222 HydrophobicContact CB-CB 4.48Å; E89-P222 CarbonylContact O-C 3.52Å; E89-P222 VanDerWaalsContact O-CA 3.24Å; E89-P222 WeakPolarHBondContact O-CA 3.28Å; Q91-P222 HydrophobicContact CB-CB 4.11Å
223	A	86.1	Confident	79.6	Confident	7 Å²	7	80 Å²	80	6%	0.058	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	124.6	166.1	0	0	0	0	0	110.6	E89 V90 Q91 F102 L214	E89-A223 PolarHBondContact O-N 3.1Å; V90-A223 WeakPolarHBondContact CA-O 3.28Å; Q91-A223 PolarHBondContact N-O 3.11Å; F102-A223 HydrophobicContact CE1-CB 4.2Å; F102-A223 HydrophobicContact CZ-CB 4.38Å; L214-A223 HydrophobicContact CD2-CB 4.05Å
224	K	87.5	Confident	79.1	Confident	129 Å²	129	77.8 Å²	77.8	56%	0.561	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	117.1	173.2	-68.1	-176.5	-178.9	178	0	109.9	Q91 Y226	Q91-K224 WeakPolarHBondContact O-CA 3.16Å; K224-Y226 HydrophobicContact CB-CE2 4.37Å
225	Y	89.2	Confident	78.9	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.7	179	-174.6	-102.5	0	0	0	111	V90 Q91 F92 A93 H209 N210 L214 V227 L237	V90-Y225 VanDerWaalsContact CG2-CB 3.49Å; V90-Y225 HydrophobicContact CG2-CG 4.37Å; Q91-Y225 PolarHBondContact O-N 3.4Å; F92-Y225 AromaticContact CD1-CD1 3.69Å; F92-Y225 HydrophobicContact CD1-CD1 3.69Å; F92-Y225 HydrophobicContact CD1-CE1 4.45Å; F92-Y225 AromaticContact CE1-CD1 3.52Å; F92-Y225 HydrophobicContact CE1-CD1 3.52Å; F92-Y225 HydrophobicContact CE1-CE1 4.02Å; F92-Y225 HydrophobicContact CE1-CG 4.48Å; A93-Y225 PolarHBondContact N-O 3.49Å; H209-Y225 VanDerWaalsContact O-CE2 3.26Å; H209-Y225 WeakPolarHBondContact O-CE2 3.4Å; H209-Y225 PolarHBondContact O-OH 3.1Å; N210-Y225 HydrophobicContact CB-CE2 4.1Å; L214-Y225 HydrophobicContact CD1-CD2 4.45Å; L214-Y225 HydrophobicContact CD2-CD2 4.2Å; L214-Y225 HydrophobicContact CG-CD2 4.25Å; Y225-V227 HydrophobicContact CD1-CG2 4.14Å; Y225-V227 HydrophobicContact CE1-CG2 4.15Å; Y225-L237 HydrophobicContact CE1-CB 4.23Å
226	Y	86.1	Confident	78.8	Confident	116 Å²	116	75.6 Å²	75.6	46%	0.455	38%	0.382	S	S	.	.			trans	-101.1	120.6	-179.5	-63.7	-87	0	0	0	111	A93 K224	A93-Y226 HydrophobicContact CB-CD1 3.41Å; A93-Y226 VanDerWaalsContact CB-CD1 3.41Å; A93-Y226 HydrophobicContact CB-CE1 3.44Å; A93-Y226 VanDerWaalsContact CB-CE1 3.44Å; A93-Y226 HydrophobicContact CB-CG 4.23Å; K224-Y226 HydrophobicContact CB-CE2 4.37Å
227	V	81.3	Confident	78.8	Confident	50 Å²	50	73 Å²	73	30%	0.303	37%	0.367	S	S	.	.			trans	-87	116.1	178.7	-173.4	0	0	0	0	109.2	F92 R171 Y225 C236	F92-V227 HydrophobicContact CD1-CG2 3.82Å; F92-V227 HydrophobicContact CE1-CG2 4.4Å; R171-V227 VanDerWaalsContact NH1-CG1 3.32Å; Y225-V227 HydrophobicContact CD1-CG2 4.14Å; Y225-V227 HydrophobicContact CE1-CG2 4.15Å; V227-C236 HydrophobicContact CG1-CB 4.04Å
228	Q	75.8	Confident	79.1	Confident	122 Å²	122	68.3 Å²	68.3	57%	0.57	34%	0.337	S	S	*	.			trans	-120.1	166.9	175.3	-67.7	-176.8	-6.3	0	0	110.4	C236	Q228-C236 PolarHBondContact O-SG 3.06Å
229	N	66.6	Low	79.5	Confident	156 Å²	156	61.4 Å²	61.4	83%	0.834	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-69.8	125.4	176.6	-78.2	-22	0	0	0	110.2
230	P	63.8	Low	79.8	Confident	50 Å²	50	62.1 Å²	62.1	33%	0.325	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-74.4	147.3	-171.4	26.5	-33.3	0	0	0	114.2	S234	P230-S234 WeakPolarHBondContact CB-O 3.26Å
231	V	59.2	Low	80.3	Confident	106 Å²	106	61.6 Å²	61.6	64%	0.642	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-71.1	154.6	163.3	-176.4	0	0	0	0	109.5	D233 S234	V231-D233 PolarHBondContact O-N 3.3Å; V231-S234 PolarHBondContact O-N 3.42Å
232	R	60	Low	80.6	Confident	225 Å²	225	61.5 Å²	61.5	85%	0.849	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-20.5	-166.4	-85.7	-176.6	175	-177.8	-2	117
233	D	69.5	Low	81	Confident	125 Å²	125	58.9 Å²	58.9	67%	0.668	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	9	-173.3	-53	-36.4	0	0	0	115.7	V231	V231-D233 PolarHBondContact O-N 3.3Å
234	S	78.9	Confident	81.4	Confident	24 Å²	24	58.5 Å²	58.5	17%	0.168	29%	0.287	C	S	.	.			trans	-131.8	157.3	179.1	63.7	0	0	0	0	112.5	I207 P230 V231	I207-S234 WeakPolarHBondContact O-CA 3.26Å; P230-S234 WeakPolarHBondContact CB-O 3.26Å; V231-S234 PolarHBondContact O-N 3.42Å
235	C	83.3	Confident	81.7	Confident	8 Å²	8	52.4 Å²	52.4	5%	0.054	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-132.5	143.6	-179.6	-65.5	0	0	0	0	111.8	L170 E172 I207 V208 H209	L170-C235 HydrophobicContact CB-CB 4.45Å; L170-C235 HydrophobicContact CD1-CB 4.29Å; L170-C235 HydrophobicContact CD2-CB 4.2Å; E172-C235 PolarHBondContact OE2-SG 3.44Å; I207-C235 HydrophobicContact CG2-CB 3.87Å; I207-C235 PolarHBondContact O-N 3.24Å; V208-C235 WeakPolarHBondContact CA-O 3.38Å; H209-C235 PolarHBondContact N-O 3.12Å
236	C	88.1	Confident	82	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.034	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-80.9	150.4	173	-65.2	0	0	0	0	111.3	R171 V227 Q228	R171-C236 WeakPolarHBondContact CB-O 3.19Å; R171-C236 PolarHBondContact N-O 2.98Å; V227-C236 HydrophobicContact CG1-CB 4.04Å; Q228-C236 PolarHBondContact O-SG 3.06Å
237	L	89.7	Confident	82.3	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-64.8	141.6	166.1	-61.7	176	0	0	0	110.1	F92 L170 A203 V208 L214 Y225 F244 L246	F92-L237 HydrophobicContact CE1-CB 4.07Å; F92-L237 HydrophobicContact CZ-CB 4.09Å; L170-L237 HydrophobicContact CD2-CD2 4.26Å; A203-L237 HydrophobicContact CB-CD2 4.45Å; V208-L237 HydrophobicContact CG1-CD1 4.2Å; V208-L237 HydrophobicContact CG1-CD2 4.25Å; V208-L237 HydrophobicContact CG1-CG 3.93Å; V208-L237 HydrophobicContact CG2-CD2 3.96Å; L214-L237 HydrophobicContact CD1-CD1 4.04Å; Y225-L237 HydrophobicContact CE1-CB 4.23Å; L237-F244 HydrophobicContact CB-CE1 4.38Å; L237-F244 HydrophobicContact CD2-CD1 4.14Å; L237-F244 HydrophobicContact CD2-CE1 4.39Å; L237-L246 HydrophobicContact CD2-CD2 3.99Å
238	D	88.8	Confident	82.8	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.011	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-75.1	150.6	173.1	-164.1	-51.5	0	0	0	109.9	F92 G169 R171 N240 Y241 F244	F92-D238 WeakPolarHBondContact CZ-O 3.4Å; G169-D238 PolarHBondContact O-N 3.37Å; R171-D238 HydrophobicContact CB-CB 4.4Å; D238-N240 WeakPolarHBondContact OD1-CB 3.5Å; D238-N240 PolarHBondContact OD1-N 2.9Å; D238-N240 PolarHBondContact OD1-ND2 3.47Å; D238-Y241 HydrophobicContact CB-CD2 3.79Å; D238-Y241 HydrophobicContact CB-CE2 3.84Å; D238-F244 WeakPolarHBondContact O-CZ 3.39Å
239	N	88.3	Confident	83.4	Confident	37 Å²	37	39.8 Å²	39.8	20%	0.198	20%	0.203	C	C	.	.	S	Bend	trans	-94.1	-4.3	-178	66.1	-23.4	0	0	0	114	F92 A95	F92-N239 HydrophobicContact CB-CB 4.14Å; F92-N239 HydrophobicContact CD1-CB 3.98Å; F92-N239 HydrophobicContact CD2-CB 3.83Å; F92-N239 HydrophobicContact CE1-CB 4.35Å; F92-N239 HydrophobicContact CE2-CB 4.22Å; F92-N239 HydrophobicContact CG-CB 3.71Å; F92-N239 HydrophobicContact CZ-CB 4.46Å; A95-N239 VanDerWaalsContact CB-ND2 3.3Å; A95-N239 WeakPolarHBondContact CB-ND2 3.24Å
240	N	88.6	Confident	84.2	Confident	23 Å²	23	32.7 Å²	32.7	12%	0.123	17%	0.167	C	C	.	.	S	Bend	trans	-93.8	-7.1	-172.3	-58.7	-57.7	0	0	0	114.2	G179 R183 D238	G179-N240 VanDerWaalsContact O-CB 3.25Å; G179-N240 WeakPolarHBondContact O-CB 3.38Å; R183-N240 HydrophobicContact CB-CB 4.44Å; R183-N240 WeakPolarHBondContact CB-OD1 3.43Å; D238-N240 WeakPolarHBondContact OD1-CB 3.5Å; D238-N240 PolarHBondContact OD1-N 2.9Å; D238-N240 PolarHBondContact OD1-ND2 3.47Å
241	Y	89.6	Confident	85.2	Confident	4 Å²	4	30.4 Å²	30.4	2%	0.016	15%	0.152	C	C	.	.			trans	-86.8	154.4	-179.8	-69.3	-103.3	0	0	0	111.6	S100 T167 G175 A199 D238 F244	S100-Y241 PolarHBondContact OG-O 3.3Å; T167-Y241 HydrophobicContact CG2-CE1 4.04Å; T167-Y241 WeakPolarHBondContact OG1-CE1 3.42Å; T167-Y241 PolarHBondContact OG1-OH 3.35Å; G175-Y241 PolarHBondContact O-OH 3.33Å; A199-Y241 HydrophobicContact CB-CD1 3.62Å; A199-Y241 HydrophobicContact CB-CE1 3.92Å; A199-Y241 HydrophobicContact CB-CG 4.3Å; D238-Y241 HydrophobicContact CB-CD2 3.79Å; D238-Y241 HydrophobicContact CB-CE2 3.84Å; Y241-F244 HydrophobicContact CD2-CE1 4.49Å; Y241-F244 HydrophobicContact CG-CE1 4.25Å; Y241-F244 HydrophobicContact CG-CZ 4.38Å
242	Q	88.6	Confident	86.4	Confident	46 Å²	46	27.6 Å²	27.6	22%	0.215	14%	0.135	C	C	.	.	S	Bend	trans	-88.5	-34.2	-179.8	-64.2	-173.1	4.7	0	0	112.2	S100 Q101 V197 A199	S100-Q242 CarbonylContact C-O 3.59Å; S100-Q242 VanDerWaalsContact CA-O 3.25Å; S100-Q242 WeakPolarHBondContact CA-O 3.3Å; S100-Q242 WeakPolarHBondContact CB-O 3.47Å; Q101-Q242 PolarHBondContact N-O 2.95Å; V197-Q242 PolarHBondContact O-NE2 3.43Å; A199-Q242 PolarHBondContact O-N 3.04Å
243	S	92.4	Very high	87.3	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	150	-178.6	58.2	0	0	0	0	112.7	Q101 W122 G201	Q101-S243 CarbonylContact O-C 3.6Å; Q101-S243 WeakPolarHBondContact O-CA 3.42Å; W122-S243 VanDerWaalsContact CZ3-CB 3.48Å; G201-S243 PolarHBondContact N-O 2.98Å
244	F	94.3	Very high	87.7	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	124.4	179.4	-62.3	-80.5	0	0	0	111.7	V90 F92 Q101 F102 L103 G201 L237 D238 Y241 L246	V90-F244 HydrophobicContact CG1-CD2 4.32Å; V90-F244 HydrophobicContact CG1-CE2 4.37Å; F92-F244 HydrophobicContact CE2-CE2 4.15Å; F92-F244 HydrophobicContact CZ-CE2 4.05Å; F92-F244 HydrophobicContact CZ-CZ 4.16Å; Q101-F244 PolarHBondContact O-N 3.46Å; F102-F244 CarbonylContact C-O 3.55Å; F102-F244 VanDerWaalsContact CA-O 3.26Å; F102-F244 WeakPolarHBondContact CA-O 3.36Å; F102-F244 HydrophobicContact CB-CB 3.94Å; L103-F244 PolarHBondContact N-O 3.43Å; G201-F244 CarbonylContact O-C 3.6Å; G201-F244 VanDerWaalsContact O-CA 3.31Å; G201-F244 WeakPolarHBondContact O-CA 3.35Å; L237-F244 HydrophobicContact CB-CE1 4.38Å; L237-F244 HydrophobicContact CD2-CD1 4.14Å; L237-F244 HydrophobicContact CD2-CE1 4.39Å; D238-F244 WeakPolarHBondContact O-CZ 3.39Å; Y241-F244 HydrophobicContact CD2-CE1 4.49Å; Y241-F244 HydrophobicContact CG-CE1 4.25Å; Y241-F244 HydrophobicContact CG-CZ 4.38Å; F244-L246 HydrophobicContact CB-CD2 4.2Å; F244-L246 HydrophobicContact CB-CG 4.48Å
245	L	94.9	Very high	87.6	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	112	167	-63.7	173.7	0	0	0	107.7	L105 V114 M118 W122 V200 G201 V202 A203 L265	L105-L245 HydrophobicContact CD2-CB 4.23Å; L105-L245 HydrophobicContact CD2-CD2 3.8Å; V114-L245 HydrophobicContact CG1-CD1 3.87Å; V114-L245 HydrophobicContact CG1-CD2 3.7Å; V114-L245 HydrophobicContact CG1-CG 4.48Å; M118-L245 HydrophobicContact SD-CD1 4.25Å; W122-L245 HydrophobicContact CH2-CD2 3.64Å; W122-L245 HydrophobicContact CH2-CG 4.42Å; W122-L245 HydrophobicContact CZ3-CD2 4.01Å; V200-L245 HydrophobicContact CG1-CD1 4.4Å; G201-L245 PolarHBondContact O-N 2.79Å; V202-L245 CarbonylContact C-O 3.45Å; V202-L245 WeakPolarHBondContact CA-O 3.36Å; V202-L245 HydrophobicContact CG2-CB 4.31Å; V202-L245 HydrophobicContact CG2-CD1 4.24Å; A203-L245 PolarHBondContact N-O 3.49Å; L245-L265 HydrophobicContact CD1-CD2 3.91Å
246	L	94.1	Very high	87.2	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	100.9	-176.9	-54.4	178.7	0	0	0	108.9	F102 L103 R104 L105 A203 W205 V208 L214 L237 F244	F102-L246 HydrophobicContact CD2-CD1 4.19Å; L103-L246 PolarHBondContact O-N 2.97Å; R104-L246 WeakPolarHBondContact CA-O 3.49Å; L105-L246 PolarHBondContact N-O 3.42Å; A203-L246 HydrophobicContact CB-CD2 3.97Å; A203-L246 CarbonylContact O-C 3.54Å; A203-L246 VanDerWaalsContact O-CA 3.31Å; A203-L246 WeakPolarHBondContact O-CA 3.46Å; W205-L246 HydrophobicContact CE3-CB 3.95Å; W205-L246 HydrophobicContact CE3-CD1 3.63Å; W205-L246 HydrophobicContact CE3-CG 4.37Å; W205-L246 HydrophobicContact CZ3-CD1 3.59Å; V208-L246 HydrophobicContact CG2-CD2 4.23Å; L214-L246 HydrophobicContact CD1-CD1 4.23Å; L237-L246 HydrophobicContact CD2-CD2 3.99Å; F244-L246 HydrophobicContact CB-CD2 4.2Å; F244-L246 HydrophobicContact CB-CG 4.48Å
247	V	93.3	Very high	86.7	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	130.4	-174.1	-172.7	0	0	0	0	110.2	L105 W107 V202 A203 P204 W205 D258 F261	L105-V247 HydrophobicContact CD1-CG1 4.41Å; L105-V247 HydrophobicContact CD1-CG2 4.14Å; L105-V247 CarbonylContact O-C 3.59Å; L105-V247 WeakPolarHBondContact O-CA 3.3Å; W107-V247 HydrophobicContact CB-CG1 3.71Å; V202-V247 HydrophobicContact CG1-CG2 3.75Å; A203-V247 PolarHBondContact O-N 3.5Å; P204-V247 CarbonylContact C-O 3.51Å; P204-V247 WeakPolarHBondContact CA-O 3.43Å; W205-V247 WeakPolarHBondContact CB-O 3.48Å; W205-V247 PolarHBondContact N-O 2.95Å; V247-D258 HydrophobicContact CB-CB 4.14Å; V247-D258 HydrophobicContact CG2-CB 4.13Å; V247-F261 HydrophobicContact CG1-CB 4.05Å; V247-F261 HydrophobicContact CG1-CG 4.36Å; V247-F261 HydrophobicContact CG2-CB 4.41Å; V247-F261 HydrophobicContact CG2-CD1 3.57Å; V247-F261 HydrophobicContact CG2-CE1 4.19Å; V247-F261 HydrophobicContact CG2-CG 4.18Å
248	D	91.7	Very high	86.5	Confident	3 Å²	3	23 Å²	23	2%	0.016	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	114.1	-174.9	-163.8	4.1	0	0	0	111.6	R31 R104 L105 S106 W107 W205 G250	R31-D248 VanDerWaalsContact O-OD2 3.08Å; R104-D248 HydrophobicContact CG-CB 4.48Å; R104-D248 IonicContact CZ-OD2 3.6Å; R104-D248 IonicContact NE-OD2 3.86Å; R104-D248 PolarHBondContact NE-OD2 2.79Å; R104-D248 IonicContact NH2-OD2 2.64Å; R104-D248 PolarHBondContact NH2-OD2 2.87Å; L105-D248 WeakPolarHBondContact O-CB 3.44Å; L105-D248 PolarHBondContact O-N 3.18Å; S106-D248 WeakPolarHBondContact CA-O 3.21Å; W107-D248 PolarHBondContact N-O 3.5Å; W205-D248 HydrophobicContact CB-CB 4.16Å; D248-G250 PolarHBondContact OD1-N 2.73Å
249	D	87.5	Confident	86.3	Confident	20 Å²	20	24.2 Å²	24.2	11%	0.107	13%	0.133	C	C	.	.			trans	-102.2	3.3	173.7	68	-11.7	0	0	0	112.8	S75 S251	S75-D249 WeakPolarHBondContact CB-O 3.25Å; S75-D249 PolarHBondContact OG-O 3.01Å; D249-S251 PolarHBondContact O-N 3.43Å; D249-S251 VanDerWaalsContact OD1-CB 3.3Å; D249-S251 WeakPolarHBondContact OD1-CB 3.25Å; D249-S251 PolarHBondContact OD1-N 3.23Å; D249-S251 PolarHBondContact OD1-OG 3.28Å; D249-S251 PolarHBondContact OD2-OG 3.2Å
250	G	84.4	Confident	86.2	Confident	8 Å²	8	25.2 Å²	25.2	8%	0.082	14%	0.141	C	C	.	.	S	Bend	trans	77	4.6	-176	0	0	0	0	0	114.1	D248	D248-G250 PolarHBondContact OD1-N 2.73Å
251	S	85.1	Confident	86.3	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.014	14%	0.135	C	C	.	.			trans	-90.6	158.1	174.2	79.7	0	0	0	0	112.3	C49 G206 D249	C49-S251 CarbonylContact O-C 3.01Å; C49-S251 VanDerWaalsContact O-CA 3.32Å; C49-S251 WeakPolarHBondContact O-CA 3.1Å; G206-S251 VanDerWaalsContact CA-O 3.24Å; G206-S251 WeakPolarHBondContact CA-O 3.4Å; D249-S251 PolarHBondContact O-N 3.43Å; D249-S251 VanDerWaalsContact OD1-CB 3.3Å; D249-S251 WeakPolarHBondContact OD1-CB 3.25Å; D249-S251 PolarHBondContact OD1-N 3.23Å; D249-S251 PolarHBondContact OD1-OG 3.28Å; D249-S251 PolarHBondContact OD2-OG 3.2Å
252	V	83.7	Confident	86.3	Confident	47 Å²	47	24.1 Å²	24.1	29%	0.285	14%	0.135	S	C	.	.	S	Bend	trans	-127.7	129.3	176.6	-177.5	0	0	0	0	108.7	C49 G50 R211 R254	C49-V252 PolarHBondContact O-N 2.9Å; G50-V252 WeakPolarHBondContact CA-O 3.44Å; R211-V252 VanDerWaalsContact NH2-CG1 3.34Å; V252-R254 PolarHBondContact O-N 3.29Å
253	G	78.8	Confident	86.3	Confident	39 Å²	39	22 Å²	22	40%	0.402	13%	0.125	S	C	.	.	S	Bend	trans	70.7	4.4	178.8	0	0	0	0	0	115.7	G206	G206-G253 PolarHBondContact O-N 2.91Å
254	R	78.3	Confident	86.2	Confident	107 Å²	107	26.3 Å²	26.3	40%	0.404	14%	0.144	S	C	.	.			trans	-96.4	138.3	175.4	-68.8	-171.3	170.2	-168.1	-5.2	111.8	Q48 I207 V252	Q48-R254 PolarHBondContact O-NE 3.42Å; Q48-R254 PolarHBondContact O-NH1 3.2Å; Q48-R254 VanDerWaalsContact O-NH1 3.16Å; Q48-R254 PolarHBondContact O-NH2 2.98Å; I207-R254 WeakPolarHBondContact CD1-O 3.41Å; V252-R254 PolarHBondContact O-N 3.29Å
255	R	77.3	Confident	86.1	Confident	110 Å²	110	26.4 Å²	26.4	42%	0.415	14%	0.144	S	C	.	.	S	Bend	trans	-88.8	152.7	176.1	-75.2	176.6	-169.8	-98.7	7	111.3	E137 E172 I207	E137-R255 PolarHBondContact O-NH1 3.4Å; E137-R255 WeakPolarHBondContact OE2-CB 3.39Å; E137-R255 WeakPolarHBondContact OE2-CD 3.41Å; E137-R255 WeakPolarHBondContact OE2-CG 3.24Å; E137-R255 IonicContact OE2-NH1 2.76Å; E172-R255 IonicContact OE1-NH2 2.68Å; E172-R255 IonicContact OE2-CZ 3.96Å; E172-R255 IonicContact OE2-NH1 3.98Å; E172-R255 PolarHBondContact OE2-NH1 2.97Å; E172-R255 IonicContact OE2-NH2 3.18Å; E172-R255 PolarHBondContact OE2-NH2 2.84Å; I207-R255 HydrophobicContact CD1-CB 4.11Å; I207-R255 HydrophobicContact CD1-CG 3.3Å
256	G	74.9	Confident	85.9	Confident	17 Å²	17	26.5 Å²	26.5	18%	0.175	15%	0.145	C	C	.	.			trans	94.7	-4	172	0	0	0	0	0	117.4	D258 T259	G256-D258 PolarHBondContact O-N 2.87Å; G256-T259 WeakPolarHBondContact O-CG2 3.36Å; G256-T259 PolarHBondContact O-N 2.91Å; G256-T259 PolarHBondContact O-OG1 3.09Å
257	G	77.4	Confident	85.7	Confident	16 Å²	16	28.8 Å²	28.8	17%	0.165	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.9	-179.2	0	0	0	0	0	115.2
258	D	84.3	Confident	85.6	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.011	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-17.8	180	63.4	-59.6	0	0	0	114	V202 V247 G256 V260 F261 R262	V202-D258 HydrophobicContact CG1-CB 4.32Å; V247-D258 HydrophobicContact CB-CB 4.14Å; V247-D258 HydrophobicContact CG2-CB 4.13Å; G256-D258 PolarHBondContact O-N 2.87Å; D258-V260 PolarHBondContact O-N 3.31Å; D258-F261 PolarHBondContact O-N 2.82Å; D258-R262 VanDerWaalsContact O-CB 3.3Å; D258-R262 WeakPolarHBondContact O-CB 3.24Å; D258-R262 PolarHBondContact O-N 2.97Å
259	T	84.7	Confident	85.6	Confident	28 Å²	28	31.7 Å²	31.7	17%	0.172	17%	0.168	C	C	.	.	H	α-helix	trans	-58.8	-46.9	-170.2	55.3	0	0	0	0	113.4	G256 R262 A263	G256-T259 WeakPolarHBondContact O-CG2 3.36Å; G256-T259 PolarHBondContact O-N 2.91Å; G256-T259 PolarHBondContact O-OG1 3.09Å; T259-R262 PolarHBondContact O-N 3.35Å; T259-A263 PolarHBondContact O-N 2.95Å
260	V	86.6	Confident	85.6	Confident	58 Å²	58	31 Å²	31	35%	0.352	17%	0.165	S	C	.	.	H	α-helix	trans	-66.2	-46.8	-178.9	178.2	0	0	0	0	111.4	D258 R262 A263 K264	D258-V260 PolarHBondContact O-N 3.31Å; V260-R262 VanDerWaalsContact C-N 3.33Å; V260-R262 PolarHBondContact O-N 3.31Å; V260-A263 PolarHBondContact O-N 3.13Å; V260-K264 WeakPolarHBondContact O-CG 3.47Å; V260-K264 PolarHBondContact O-N 2.89Å; V260-K264 VanDerWaalsContact O-N 3.15Å
261	F	89.6	Confident	85.6	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.6	-43.7	178.2	173.4	-97.7	0	0	0	110.9	L105 V114 V202 V247 D258 A263 K264 L265	L105-F261 HydrophobicContact CD1-CD1 4.19Å; L105-F261 HydrophobicContact CD1-CD2 4.03Å; L105-F261 HydrophobicContact CD1-CE1 3.88Å; L105-F261 HydrophobicContact CD1-CE2 3.72Å; L105-F261 HydrophobicContact CD1-CG 4.26Å; L105-F261 HydrophobicContact CD1-CZ 3.64Å; L105-F261 HydrophobicContact CD2-CE1 4.33Å; L105-F261 HydrophobicContact CD2-CZ 4.08Å; V114-F261 HydrophobicContact CG2-CZ 4.08Å; V202-F261 HydrophobicContact CG1-CD1 4.41Å; V247-F261 HydrophobicContact CG1-CB 4.05Å; V247-F261 HydrophobicContact CG1-CG 4.36Å; V247-F261 HydrophobicContact CG2-CB 4.41Å; V247-F261 HydrophobicContact CG2-CD1 3.57Å; V247-F261 HydrophobicContact CG2-CE1 4.19Å; V247-F261 HydrophobicContact CG2-CG 4.18Å; D258-F261 PolarHBondContact O-N 2.82Å; F261-A263 PolarHBondContact O-N 3.11Å; F261-K264 PolarHBondContact O-N 2.83Å; F261-L265 HydrophobicContact CE1-CD2 4.17Å; F261-L265 WeakPolarHBondContact O-CB 3.43Å; F261-L265 PolarHBondContact O-N 2.78Å
262	R	90.1	Very high	85.7	Confident	3 Å²	3	38.5 Å²	38.5	1%	0.011	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-40.5	-179.1	-170	172.7	150.8	-170.5	3.5	112	S132 V133 I166 V202 D258 T259 V260 L265 E266 R300	S132-R262 PolarHBondContact OG-NE 3.22Å; S132-R262 PolarHBondContact OG-NH2 3.31Å; V133-R262 PolarHBondContact O-NH2 3.01Å; I166-R262 HydrophobicContact CG2-CG 4.44Å; I166-R262 PolarHBondContact O-NH2 3.48Å; V202-R262 HydrophobicContact CG1-CB 4.28Å; V202-R262 HydrophobicContact CG1-CG 4.44Å; V202-R262 HydrophobicContact CG2-CG 4.46Å; D258-R262 VanDerWaalsContact O-CB 3.3Å; D258-R262 WeakPolarHBondContact O-CB 3.24Å; D258-R262 PolarHBondContact O-N 2.97Å; T259-R262 PolarHBondContact O-N 3.35Å; V260-R262 VanDerWaalsContact C-N 3.33Å; V260-R262 PolarHBondContact O-N 3.31Å; R262-L265 PolarHBondContact O-N 3.04Å; R262-E266 VanDerWaalsContact CG-OE1 3.26Å; R262-E266 WeakPolarHBondContact CG-OE1 3.07Å; R262-E266 IonicContact CZ-OE1 3.91Å; R262-E266 IonicContact NE-OE1 2.91Å; R262-E266 PolarHBondContact NE-OE1 2.98Å; R262-E266 WeakPolarHBondContact O-CB 3.07Å; R262-E266 VanDerWaalsContact O-CG 3.29Å; R262-E266 WeakPolarHBondContact O-CG 3.06Å; R262-E266 PolarHBondContact O-N 2.79Å; R262-R300 VanDerWaalsContact CD-NH1 3.27Å; R262-R300 VanDerWaalsContact CG-NH2 3.33Å
263	A	88.9	Confident	85.3	Confident	2 Å²	2	44.1 Å²	44.1	2%	0.017	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-39.3	175.1	0	0	0	0	0	112.8	T259 V260 F261 L265 E266 D267 L303	T259-A263 PolarHBondContact O-N 2.95Å; V260-A263 PolarHBondContact O-N 3.13Å; F261-A263 PolarHBondContact O-N 3.11Å; A263-L265 VanDerWaalsContact C-N 3.32Å; A263-L265 PolarHBondContact O-N 2.51Å; A263-E266 PolarHBondContact O-N 2.98Å; A263-D267 WeakPolarHBondContact O-CB 3.29Å; A263-D267 PolarHBondContact O-N 3.31Å; A263-L303 HydrophobicContact CB-CD2 3.41Å; A263-L303 VanDerWaalsContact CB-CD2 3.41Å
264	K	90.1	Very high	84.9	Confident	90 Å²	90	42.7 Å²	42.7	39%	0.391	20%	0.197	S	C	.	.	H	α-helix	trans	-63.7	-37.2	172.9	-70.4	177.1	-179	177.4	0	112.4	P111 V260 F261 Y268	P111-K264 HydrophobicContact CG-CB 3.87Å; V260-K264 WeakPolarHBondContact O-CG 3.47Å; V260-K264 PolarHBondContact O-N 2.89Å; V260-K264 VanDerWaalsContact O-N 3.15Å; F261-K264 PolarHBondContact O-N 2.83Å; K264-Y268 WeakPolarHBondContact O-CB 3.48Å; K264-Y268 PolarHBondContact O-N 2.98Å
265	L	91.6	Very high	83.8	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-68.1	-44.3	176.8	-179.5	63.7	0	0	0	111.6	P111 M118 L245 F261 R262 A263 Y268 I269	P111-L265 HydrophobicContact CB-CD1 4.01Å; M118-L265 HydrophobicContact CE-CD1 4.1Å; M118-L265 HydrophobicContact CE-CD2 4.39Å; L245-L265 HydrophobicContact CD1-CD2 3.91Å; F261-L265 HydrophobicContact CE1-CD2 4.17Å; F261-L265 WeakPolarHBondContact O-CB 3.43Å; F261-L265 PolarHBondContact O-N 2.78Å; R262-L265 PolarHBondContact O-N 3.04Å; A263-L265 VanDerWaalsContact C-N 3.32Å; A263-L265 PolarHBondContact O-N 2.51Å; L265-Y268 PolarHBondContact O-N 3.33Å; L265-I269 HydrophobicContact CD1-CD1 4.14Å; L265-I269 HydrophobicContact CD1-CG1 4.46Å; L265-I269 HydrophobicContact CG-CD1 3.97Å; L265-I269 VanDerWaalsContact O-CG1 3.24Å; L265-I269 WeakPolarHBondContact O-CG1 2.96Å; L265-I269 PolarHBondContact O-N 3.42Å
266	E	91.4	Very high	82.6	Confident	3 Å²	3	36.4 Å²	36.4	1%	0.014	19%	0.194	C	C	.	.	H	α-helix	trans	-61.3	-44.4	176.4	-75.4	162	-170.8	0	0	111.7	S132 R262 A263 I269 S270 V286 R300 M309	S132-E266 VanDerWaalsContact CB-OE1 3.26Å; S132-E266 WeakPolarHBondContact CB-OE1 2.98Å; S132-E266 VanDerWaalsContact OG-CD 3.31Å; S132-E266 PolarHBondContact OG-OE1 3.25Å; R262-E266 VanDerWaalsContact CG-OE1 3.26Å; R262-E266 WeakPolarHBondContact CG-OE1 3.07Å; R262-E266 IonicContact CZ-OE1 3.91Å; R262-E266 IonicContact NE-OE1 2.91Å; R262-E266 PolarHBondContact NE-OE1 2.98Å; R262-E266 WeakPolarHBondContact O-CB 3.07Å; R262-E266 VanDerWaalsContact O-CG 3.29Å; R262-E266 WeakPolarHBondContact O-CG 3.06Å; R262-E266 PolarHBondContact O-N 2.79Å; A263-E266 PolarHBondContact O-N 2.98Å; E266-I269 PolarHBondContact O-N 2.93Å; E266-S270 PolarHBondContact O-N 3.48Å; E266-V286 HydrophobicContact CB-CG1 4.18Å; E266-V286 HydrophobicContact CG-CG1 4.31Å; E266-R300 IonicContact OE1-NH2 3.77Å; E266-R300 PolarHBondContact OE1-NH2 2.8Å; E266-R300 IonicContact OE2-CZ 3.58Å; E266-R300 IonicContact OE2-NH2 2.79Å; E266-R300 PolarHBondContact OE2-NH2 3.46Å; E266-M309 HydrophobicContact CB-CE 4.21Å
267	D	90.6	Very high	81.3	Confident	47 Å²	47	43.1 Å²	43.1	25%	0.251	21%	0.214	S	C	.	.	H	α-helix	trans	-64.6	-39.7	175.1	-176.1	55.3	0	0	0	112.7	A263 I269 S270 H271	A263-D267 WeakPolarHBondContact O-CB 3.29Å; A263-D267 PolarHBondContact O-N 3.31Å; D267-I269 VanDerWaalsContact C-N 3.33Å; D267-I269 PolarHBondContact O-N 2.99Å; D267-S270 PolarHBondContact O-N 3.19Å; D267-S270 PolarHBondContact O-OG 2.91Å; D267-H271 PolarHBondContact O-ND1 3.24Å; D267-H271 IonicContact OD1-CE1 2.64Å; D267-H271 PolarHBondContact OD1-CE1 3.15Å; D267-H271 IonicContact OD1-ND1 2.79Å
268	Y	91	Very high	79.9	Confident	65 Å²	65	43.4 Å²	43.4	26%	0.255	22%	0.217	S	C	.	.	H	α-helix	trans	-64.8	-38.9	174.9	-179.8	-95	0	0	0	112.3	P111 S112 Y115 K264 L265 Q272	P111-Y268 HydrophobicContact CB-CD1 4.26Å; P111-Y268 HydrophobicContact CB-CG 3.87Å; S112-Y268 VanDerWaalsContact CA-CZ 3.42Å; S112-Y268 VanDerWaalsContact CB-CZ 3.48Å; S112-Y268 WeakPolarHBondContact CB-OH 3.31Å; Y115-Y268 AromaticContact CD1-CE1 3.92Å; Y115-Y268 HydrophobicContact CD1-CE1 3.92Å; Y115-Y268 HydrophobicContact CG-CD1 4.33Å; Y115-Y268 AromaticContact CG-CE1 3.88Å; Y115-Y268 HydrophobicContact CG-CE1 3.88Å; K264-Y268 WeakPolarHBondContact O-CB 3.48Å; K264-Y268 PolarHBondContact O-N 2.98Å; L265-Y268 PolarHBondContact O-N 3.33Å; Y268-Q272 HydrophobicContact CD1-CG 4.43Å; Y268-Q272 HydrophobicContact CE1-CG 4.13Å; Y268-Q272 WeakPolarHBondContact O-CG 3.37Å; Y268-Q272 PolarHBondContact O-NE2 2.97Å; Y268-Q272 PolarHBondContact OH-NE2 3.45Å
269	I	90.5	Very high	77.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69	-35.8	178.5	-66.3	164.4	0	0	0	110.9	Y115 V130 W164 I166 L265 E266 D267 H271 Q272 I284 V286	Y115-I269 HydrophobicContact CD2-CG1 3.91Å; Y115-I269 HydrophobicContact CE2-CG1 4.16Å; V130-I269 HydrophobicContact CG2-CG2 3.82Å; W164-I269 HydrophobicContact CZ3-CD1 4.5Å; I166-I269 HydrophobicContact CD1-CD1 4.43Å; L265-I269 HydrophobicContact CD1-CD1 4.14Å; L265-I269 HydrophobicContact CD1-CG1 4.46Å; L265-I269 HydrophobicContact CG-CD1 3.97Å; L265-I269 VanDerWaalsContact O-CG1 3.24Å; L265-I269 WeakPolarHBondContact O-CG1 2.96Å; L265-I269 PolarHBondContact O-N 3.42Å; E266-I269 PolarHBondContact O-N 2.93Å; D267-I269 VanDerWaalsContact C-N 3.33Å; D267-I269 PolarHBondContact O-N 2.99Å; I269-H271 PolarHBondContact O-N 3.29Å; I269-Q272 WeakPolarHBondContact O-CB 3.34Å; I269-Q272 PolarHBondContact O-N 3.45Å; I269-I284 HydrophobicContact CG2-CB 4.44Å; I269-I284 HydrophobicContact CG2-CD1 4.39Å; I269-I284 HydrophobicContact CG2-CG2 4.14Å; I269-V286 HydrophobicContact CB-CG2 4.49Å; I269-V286 HydrophobicContact CG2-CG2 4.21Å
270	S	87.4	Confident	76.3	Confident	6 Å²	6	45.4 Å²	45.4	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-30.1	-178.9	74.5	0	0	0	0	112.9	E266 D267 Q272 D283 I284	E266-S270 PolarHBondContact O-N 3.48Å; D267-S270 PolarHBondContact O-N 3.19Å; D267-S270 PolarHBondContact O-OG 2.91Å; S270-Q272 VanDerWaalsContact C-N 3.35Å; S270-D283 WeakPolarHBondContact O-CB 3.48Å; S270-I284 WeakPolarHBondContact CA-O 3.43Å
271	H	86.1	Confident	74.9	Confident	120 Å²	120	45.6 Å²	45.6	56%	0.556	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	0.2	176.5	-63.4	90.8	0	0	0	113.7	D267 I269	D267-H271 PolarHBondContact O-ND1 3.24Å; D267-H271 IonicContact OD1-CE1 2.64Å; D267-H271 PolarHBondContact OD1-CE1 3.15Å; D267-H271 IonicContact OD1-ND1 2.79Å; I269-H271 PolarHBondContact O-N 3.29Å
272	Q	85.3	Confident	73.9	Confident	47 Å²	47	46.5 Å²	46.5	22%	0.22	24%	0.24	C	C	.	.	S	Bend	trans	-82.9	145.2	175.6	-61.2	-48.6	-43.8	0	0	110.9	Y115 Y268 I269 S270 D283 I284	Y115-Q272 HydrophobicContact CD1-CG 4.36Å; Y115-Q272 HydrophobicContact CE1-CG 3.91Å; Y268-Q272 HydrophobicContact CD1-CG 4.43Å; Y268-Q272 HydrophobicContact CE1-CG 4.13Å; Y268-Q272 WeakPolarHBondContact O-CG 3.37Å; Y268-Q272 PolarHBondContact O-NE2 2.97Å; Y268-Q272 PolarHBondContact OH-NE2 3.45Å; I269-Q272 WeakPolarHBondContact O-CB 3.34Å; I269-Q272 PolarHBondContact O-N 3.45Å; S270-Q272 VanDerWaalsContact C-N 3.35Å; Q272-D283 WeakPolarHBondContact O-CA 3.38Å; Q272-I284 HydrophobicContact CB-CD1 3.98Å; Q272-I284 WeakPolarHBondContact O-CG1 3.36Å; Q272-I284 PolarHBondContact O-N 3.37Å
273	R	77.3	Confident	73.4	Confident	164 Å²	164	50 Å²	50	62%	0.619	26%	0.259	S	S	*	.	B	Isolated β-bridge	trans	-81.7	138.6	177	-64.9	177.7	176	-173.6	0.4	110.5
274	T	68.4	Low	73.2	Confident	10 Å²	10	50 Å²	50	6%	0.061	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-56.7	145.1	168.8	52.3	0	0	0	0	110.2	I276 I282 I284	T274-I276 PolarHBondContact O-N 3.07Å; T274-I282 WeakPolarHBondContact CG2-O 3.47Å; T274-I282 PolarHBondContact N-O 2.78Å; T274-I282 VanDerWaalsContact N-O 3.11Å; T274-I282 PolarHBondContact OG1-O 3.26Å; T274-I282 VanDerWaalsContact OG1-O 3.13Å; T274-I284 HydrophobicContact CG2-CG1 3.76Å
275	G	56.5	Low	73.1	Confident	60 Å²	60	46.3 Å²	46.3	62%	0.619	24%	0.244	S	C	*	.	S	Bend	trans	-70.5	13.2	-179.8	0	0	0	0	0	114.6
276	I	52.7	Low	73	Confident	25 Å²	25	46.3 Å²	46.3	13%	0.128	24%	0.244	C	C	.	.			trans	-81	116.4	-178.7	-68	169.3	0	0	0	107.7	T274 G278 A433 N466	T274-I276 PolarHBondContact O-N 3.07Å; I276-G278 PolarHBondContact O-N 3.49Å; I276-A433 HydrophobicContact CD1-CB 4.15Å; I276-N466 WeakPolarHBondContact CG2-ND2 3.3Å; I276-N466 WeakPolarHBondContact CG2-OD1 3.33Å
277	W	47	Very low	73	Confident	157 Å²	157	46.2 Å²	46.2	60%	0.595	24%	0.243	S	C	*	.			trans	-73.2	123.7	173.9	-118	32.7	0	0	0	109.5	I465 R496	W277-I465 HydrophobicContact CB-CG2 4.24Å; W277-I465 WeakPolarHBondContact O-CD1 3.31Å; W277-I465 WeakPolarHBondContact O-CG2 3.47Å; W277-R496 WeakPolarHBondContact CH2-O 3.48Å; W277-R496 WeakPolarHBondContact CZ3-O 3.43Å
278	G	48.6	Very low	73.1	Confident	23 Å²	23	44 Å²	44	24%	0.237	23%	0.231	C	C	.	.	S	Bend	trans	167.7	163.4	-174	0	0	0	0	0	111.7	I276 G280 D462	I276-G278 PolarHBondContact O-N 3.49Å; G278-G280 VanDerWaalsContact C-N 3.26Å; G278-D462 VanDerWaalsContact CA-OD1 3.28Å; G278-D462 WeakPolarHBondContact CA-OD1 3.2Å
279	S	40.8	Very low	73.1	Confident	63 Å²	63	40.9 Å²	40.9	44%	0.441	22%	0.219	S	C	.	.	S	Bend	trans	-76	-16.9	177.1	60	0	0	0	0	112.6	T281 D462	S279-T281 PolarHBondContact O-N 2.93Å; S279-D462 PolarHBondContact N-OD1 3.46Å
280	G	51.3	Low	73.1	Confident	9 Å²	9	40.9 Å²	40.9	9%	0.093	22%	0.219	C	C	.	.			trans	-87.1	76.4	171.2	0	0	0	0	0	111.5	G278 I282	G278-G280 VanDerWaalsContact C-N 3.26Å; G280-I282 PolarHBondContact O-N 3.38Å
281	T	57.8	Low	73.2	Confident	61 Å²	61	40.7 Å²	40.7	37%	0.374	22%	0.218	S	C	.	.			trans	-72.6	93.2	171.4	55	0	0	0	0	109.1	S279	S279-T281 PolarHBondContact O-N 2.93Å
282	I	68.8	Low	73	Confident	19 Å²	19	36.3 Å²	36.3	10%	0.097	20%	0.2	C	C	.	.			trans	-77.1	129.5	172.1	-48.6	163.2	0	0	0	107.5	T274 G280 K429 L430 A433	T274-I282 WeakPolarHBondContact CG2-O 3.47Å; T274-I282 PolarHBondContact N-O 2.78Å; T274-I282 VanDerWaalsContact N-O 3.11Å; T274-I282 PolarHBondContact OG1-O 3.26Å; T274-I282 VanDerWaalsContact OG1-O 3.13Å; G280-I282 PolarHBondContact O-N 3.38Å; I282-K429 HydrophobicContact CD1-CB 3.61Å; I282-K429 HydrophobicContact CD1-CG 4.45Å; I282-K429 WeakPolarHBondContact CD1-O 3.27Å; I282-K429 HydrophobicContact CG1-CB 4.1Å; I282-K429 HydrophobicContact CG1-CD 4.22Å; I282-L430 HydrophobicContact CG2-CD2 4.16Å; I282-A433 HydrophobicContact CD1-CB 4.23Å
283	D	78.9	Confident	72.7	Confident	77 Å²	77	34.1 Å²	34.1	41%	0.412	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	-67.3	136.9	168.8	-73	-15.6	0	0	0	109.5	S270 Q272 P285	S270-D283 WeakPolarHBondContact O-CB 3.48Å; Q272-D283 WeakPolarHBondContact O-CA 3.38Å; D283-P285 WeakPolarHBondContact O-CD 3.37Å
284	I	85.5	Confident	72.7	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.005	18%	0.178	C	C	.	.			trans	-61.8	115.5	-174.6	-64.3	168.1	0	0	0	108.9	V126 P127 V130 I269 S270 Q272 T274 V286	V126-I284 HydrophobicContact CG1-CD1 3.77Å; P127-I284 HydrophobicContact CG-CD1 4.28Å; P127-I284 HydrophobicContact CG-CG2 4.37Å; V130-I284 HydrophobicContact CG2-CG2 4.04Å; I269-I284 HydrophobicContact CG2-CB 4.44Å; I269-I284 HydrophobicContact CG2-CD1 4.39Å; I269-I284 HydrophobicContact CG2-CG2 4.14Å; S270-I284 WeakPolarHBondContact CA-O 3.43Å; Q272-I284 HydrophobicContact CB-CD1 3.98Å; Q272-I284 WeakPolarHBondContact O-CG1 3.36Å; Q272-I284 PolarHBondContact O-N 3.37Å; T274-I284 HydrophobicContact CG2-CG1 3.76Å; I284-V286 PolarHBondContact O-N 2.83Å
285	P	86.9	Confident	73.1	Confident	14 Å²	14	30.5 Å²	30.5	9%	0.091	19%	0.185	C	C	.	.			trans	-66.3	135.7	176	27.4	-33.9	0	0	0	109.1	N128 L129 V130 D283 L409 L430	N128-P285 WeakPolarHBondContact O-CD 3.46Å; L129-P285 HydrophobicContact CB-CG 4.38Å; L129-P285 HydrophobicContact CD1-CB 4.1Å; L129-P285 HydrophobicContact CD1-CG 3.89Å; L129-P285 WeakPolarHBondContact CD1-O 3.46Å; V130-P285 PolarHBondContact N-O 3.17Å; D283-P285 WeakPolarHBondContact O-CD 3.37Å; P285-L409 HydrophobicContact CB-CD1 4.12Å; P285-L409 HydrophobicContact CB-CD2 3.86Å; P285-L409 HydrophobicContact CG-CD1 4.41Å; P285-L430 HydrophobicContact CG-CD2 3.87Å
286	V	89.9	Confident	74.1	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.9	175.4	-179.3	0	0	0	0	107.4	V130 E266 I269 I284 M309 P310	V130-V286 HydrophobicContact CB-CB 4.4Å; V130-V286 HydrophobicContact CB-CG1 4.16Å; V130-V286 HydrophobicContact CB-CG2 4.06Å; V130-V286 HydrophobicContact CG1-CG1 4.26Å; V130-V286 HydrophobicContact CG2-CG2 4.43Å; V130-V286 CarbonylContact O-C 3.57Å; V130-V286 WeakPolarHBondContact O-CA 3.35Å; E266-V286 HydrophobicContact CB-CG1 4.18Å; E266-V286 HydrophobicContact CG-CG1 4.31Å; I269-V286 HydrophobicContact CB-CG2 4.49Å; I269-V286 HydrophobicContact CG2-CG2 4.21Å; I284-V286 PolarHBondContact O-N 2.83Å; V286-M309 HydrophobicContact CB-CE 3.32Å; V286-M309 HydrophobicContact CG1-CE 3.32Å; V286-M309 HydrophobicContact CG2-CE 4.12Å; V286-P310 WeakPolarHBondContact O-CD 3.24Å; V286-P310 WeakPolarHBondContact O-CG 3.29Å
287	L	91.8	Very high	75.5	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128.4	179.7	-176.4	74.4	0	0	0	110.2	V130 V131 S132 P310 L312 L405 A408 L409	V130-L287 PolarHBondContact O-N 3.37Å; V131-L287 CarbonylContact C-O 3.41Å; V131-L287 WeakPolarHBondContact CA-O 3.22Å; S132-L287 PolarHBondContact N-O 3Å; L287-P310 HydrophobicContact CD1-CB 3.71Å; L287-P310 HydrophobicContact CD1-CG 3.86Å; L287-L312 HydrophobicContact CD1-CB 4.34Å; L287-L312 HydrophobicContact CD2-CB 4.07Å; L287-L312 HydrophobicContact CD2-CD2 4.29Å; L287-L312 HydrophobicContact CG-CB 4.36Å; L287-L405 HydrophobicContact CD2-CD1 3.18Å; L287-L405 HydrophobicContact CD2-CG 4.15Å; L287-A408 HydrophobicContact CD1-CB 4.38Å; L287-L409 HydrophobicContact CB-CD2 3.95Å; L287-L409 HydrophobicContact CD1-CD2 4.17Å
288	C	92.5	Very high	77.3	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	128.1	171.8	-65.4	0	0	0	0	109.9	S132 P310 W311 L312	S132-C288 CarbonylContact O-C 3.51Å; S132-C288 WeakPolarHBondContact O-CA 3.46Å; C288-P310 PolarHBondContact N-O 2.95Å; C288-W311 HydrophobicContact CB-CD2 3.54Å; C288-W311 VanDerWaalsContact CB-CE2 3.47Å; C288-W311 HydrophobicContact CB-CE3 3.84Å; C288-W311 HydrophobicContact CB-CG 4.03Å; C288-W311 HydrophobicContact CB-CH2 4.07Å; C288-W311 HydrophobicContact CB-CZ2 3.74Å; C288-W311 HydrophobicContact CB-CZ3 4.11Å; C288-W311 CarbonylContact O-C 3.53Å; C288-W311 VanDerWaalsContact O-CA 3.29Å; C288-W311 WeakPolarHBondContact O-CA 3.31Å; C288-L312 PolarHBondContact O-N 3.06Å
289	M	91.8	Very high	79	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	121.3	178.6	-175.5	177.6	-179.1	0	0	109.7	V131 S132 V134 V149 L154 I291 L312 L314 F401	V131-M289 HydrophobicContact CG1-CB 4.31Å; S132-M289 PolarHBondContact O-N 3.05Å; V134-M289 PolarHBondContact N-O 3.39Å; V134-M289 VanDerWaalsContact O-O 3.12Å; V149-M289 HydrophobicContact CG1-CE 4.48Å; L154-M289 HydrophobicContact CD2-SD 4.44Å; M289-I291 HydrophobicContact CE-CD1 3.77Å; M289-I291 HydrophobicContact CE-CG1 4.11Å; M289-I291 HydrophobicContact CG-CD1 4.3Å; M289-I291 HydrophobicContact CG-CG1 4.07Å; M289-I291 HydrophobicContact SD-CD1 4.1Å; M289-I291 HydrophobicContact SD-CG1 4.49Å; M289-L312 CarbonylContact C-O 3.56Å; M289-L312 WeakPolarHBondContact CA-O 3.4Å; M289-L314 HydrophobicContact CE-CD1 3.51Å; M289-L314 HydrophobicContact CE-CD2 3.78Å; M289-L314 HydrophobicContact CE-CG 3.65Å; M289-F401 HydrophobicContact CE-CE2 4.08Å; M289-F401 HydrophobicContact CE-CZ 3.62Å; M289-F401 HydrophobicContact SD-CZ 3.96Å
290	L	90.8	Very high	81.1	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	120.4	-179.5	-176.1	66	0	0	0	110.9	V134 S292 M301 W311 L312 V313 L314 L320 A321	V134-L290 HydrophobicContact CG1-CD1 4.37Å; V134-L290 WeakPolarHBondContact O-CA 3.49Å; L290-S292 WeakPolarHBondContact CD1-O 3.43Å; L290-M301 HydrophobicContact CD2-SD 4.49Å; L290-W311 HydrophobicContact CB-CE3 3.97Å; L290-W311 HydrophobicContact CB-CZ3 3.97Å; L290-W311 HydrophobicContact CD1-CZ3 4.18Å; L290-L312 PolarHBondContact N-O 3.35Å; L290-V313 HydrophobicContact CB-CG2 4.37Å; L290-V313 HydrophobicContact CD2-CG1 4.36Å; L290-V313 HydrophobicContact CD2-CG2 4.3Å; L290-L314 PolarHBondContact O-N 3.49Å; L290-L320 HydrophobicContact CD1-CD2 4.12Å; L290-L320 HydrophobicContact CD2-CD2 4.14Å; L290-L320 HydrophobicContact CD2-CG 3.95Å; L290-A321 HydrophobicContact CD2-CB 4.11Å; L290-A321 HydrophobicContact CG-CB 4.18Å
291	I	88.2	Confident	82.9	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.01	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	97.6	-177.9	-50.3	-173.3	0	0	0	109.7	V133 V134 G135 V146 L150 V174 M289 L314	V133-I291 HydrophobicContact CG1-CD1 3.76Å; V133-I291 HydrophobicContact CG1-CG1 4.26Å; V134-I291 PolarHBondContact O-N 3.03Å; G135-I291 WeakPolarHBondContact CA-O 3.39Å; V146-I291 HydrophobicContact CG1-CG2 3.4Å; L150-I291 HydrophobicContact CD1-CD1 4.08Å; L150-I291 HydrophobicContact CD2-CD1 3.53Å; L150-I291 HydrophobicContact CG-CD1 4.04Å; V174-I291 HydrophobicContact CG1-CB 4.36Å; V174-I291 HydrophobicContact CG1-CD1 4.12Å; V174-I291 HydrophobicContact CG2-CB 4.24Å; V174-I291 HydrophobicContact CG2-CG2 4.05Å; M289-I291 HydrophobicContact CE-CD1 3.77Å; M289-I291 HydrophobicContact CE-CG1 4.11Å; M289-I291 HydrophobicContact CG-CD1 4.3Å; M289-I291 HydrophobicContact CG-CG1 4.07Å; M289-I291 HydrophobicContact SD-CD1 4.1Å; M289-I291 HydrophobicContact SD-CG1 4.49Å; I291-L314 HydrophobicContact CB-CD1 4.47Å; I291-L314 HydrophobicContact CD1-CD1 4.06Å; I291-L314 HydrophobicContact CG1-CD1 3.81Å; I291-L314 HydrophobicContact CG1-CG 4.38Å; I291-L314 HydrophobicContact CG2-CD1 4.24Å
292	S	81.9	Confident	84.3	Confident	27 Å²	27	19.4 Å²	19.4	19%	0.189	11%	0.107	C	C	.	.	S	Bend	trans	53.3	169.3	-162.4	-171.5	0	0	0	0	111.5	G135 L290 S317 G318	G135-S292 WeakPolarHBondContact CA-O 3.27Å; L290-S292 WeakPolarHBondContact CD1-O 3.43Å; S292-S317 PolarHBondContact N-OG 3.31Å; S292-S317 VanDerWaalsContact N-OG 3.07Å; S292-G318 WeakPolarHBondContact CA-O 3.47Å
293	G	79.4	Confident	85	Confident	2 Å²	2	22 Å²	22	2%	0.021	12%	0.121	C	C	.	.			trans	177.9	151.3	177.6	0	0	0	0	0	113.6	L320	G293-L320 WeakPolarHBondContact O-CB 3.48Å; G293-L320 PolarHBondContact O-N 3.33Å
294	D	78.3	Confident	85.4	Confident	67 Å²	67	18.5 Å²	18.5	36%	0.358	10%	0.102	S	C	.	.			trans	-101.3	177.5	177.2	-52.2	-39.9	0	0	0	109.6	E137 S296 S297	E137-D294 PolarHBondContact N-OD2 2.7Å; D294-S296 VanDerWaalsContact C-N 3.27Å; D294-S296 PolarHBondContact O-N 2.77Å; D294-S297 VanDerWaalsContact O-CB 3.28Å; D294-S297 WeakPolarHBondContact O-CB 3.4Å; D294-S297 PolarHBondContact O-N 3.24Å
295	T	76.8	Confident	85.5	Confident	31 Å²	31	18.7 Å²	18.7	19%	0.19	10%	0.103	C	C	.	.	H	α-helix	trans	-65.6	-27.7	-177.3	53.1	0	0	0	0	113.6	S297 L298 E299 F365 E368	T295-S297 VanDerWaalsContact C-N 3.25Å; T295-S297 PolarHBondContact O-N 3.18Å; T295-L298 WeakPolarHBondContact O-CB 3.46Å; T295-L298 PolarHBondContact O-N 3.08Å; T295-E299 PolarHBondContact O-N 3.41Å; T295-F365 HydrophobicContact CG2-CD1 3.52Å; T295-F365 HydrophobicContact CG2-CE1 3.67Å; T295-F365 HydrophobicContact CG2-CG 4.06Å; T295-F365 HydrophobicContact CG2-CZ 4.33Å; T295-E368 WeakPolarHBondContact CB-OE1 3.41Å; T295-E368 HydrophobicContact CG2-CG 4.49Å; T295-E368 WeakPolarHBondContact CG2-OE1 3.49Å; T295-E368 WeakPolarHBondContact CG2-OE2 3.45Å; T295-E368 PolarHBondContact OG1-OE1 2.74Å
296	S	77.4	Confident	85.3	Confident	35 Å²	35	24.5 Å²	24.5	25%	0.245	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-32.4	169.7	59.3	0	0	0	0	112.9	D294 L298 E299 R300	D294-S296 VanDerWaalsContact C-N 3.27Å; D294-S296 PolarHBondContact O-N 2.77Å; S296-L298 VanDerWaalsContact C-N 3.32Å; S296-E299 PolarHBondContact O-N 3.44Å; S296-R300 PolarHBondContact O-N 3.33Å
297	S	81.4	Confident	85	Confident	4 Å²	4	27.4 Å²	27.4	3%	0.028	14%	0.143	C	C	.	.	H	α-helix	trans	-72.7	-26.8	178.1	-59.1	0	0	0	0	112	D294 T295 R300 M301	D294-S297 VanDerWaalsContact O-CB 3.28Å; D294-S297 WeakPolarHBondContact O-CB 3.4Å; D294-S297 PolarHBondContact O-N 3.24Å; T295-S297 VanDerWaalsContact C-N 3.25Å; T295-S297 PolarHBondContact O-N 3.18Å; S297-R300 WeakPolarHBondContact O-CB 3.26Å; S297-R300 PolarHBondContact O-N 2.93Å; S297-M301 PolarHBondContact O-N 3.12Å
298	L	84.9	Confident	84.6	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-67.6	-41.1	174.5	-174.3	77.2	0	0	0	111.1	T295 S296 R300 M301 D302 L320 F323 L374 R377 I381	T295-L298 WeakPolarHBondContact O-CB 3.46Å; T295-L298 PolarHBondContact O-N 3.08Å; S296-L298 VanDerWaalsContact C-N 3.32Å; L298-R300 VanDerWaalsContact C-N 3.29Å; L298-R300 PolarHBondContact O-N 3.19Å; L298-M301 PolarHBondContact O-N 3.19Å; L298-D302 PolarHBondContact O-N 3.27Å; L298-L320 HydrophobicContact CB-CD1 4.06Å; L298-L320 HydrophobicContact CB-CD2 4.11Å; L298-L320 HydrophobicContact CD1-CD1 3.45Å; L298-L320 VanDerWaalsContact CD1-CD1 3.45Å; L298-L320 HydrophobicContact CG-CD1 4.31Å; L298-F323 HydrophobicContact CD1-CE1 4.49Å; L298-L374 HydrophobicContact CD2-CB 4.43Å; L298-L374 HydrophobicContact CD2-CD2 3.76Å; L298-R377 HydrophobicContact CD2-CB 4.43Å; L298-I381 HydrophobicContact CD1-CD1 3.34Å; L298-I381 HydrophobicContact CG-CD1 4.13Å
299	E	84.2	Confident	84.3	Confident	94 Å²	94	30.3 Å²	30.3	44%	0.439	16%	0.163	S	C	.	.	H	α-helix	trans	-61.3	-41.6	176.2	-48.4	-160.2	138.5	0	0	111.4	T295 S296 M301 L303 R377	T295-E299 PolarHBondContact O-N 3.41Å; S296-E299 PolarHBondContact O-N 3.44Å; E299-M301 VanDerWaalsContact C-N 3.35Å; E299-L303 PolarHBondContact O-N 3.32Å; E299-L303 VanDerWaalsContact O-N 3.13Å; E299-R377 VanDerWaalsContact CD-NH2 3.3Å; E299-R377 VanDerWaalsContact CG-NH1 3.34Å; E299-R377 IonicContact OE1-CZ 3.83Å; E299-R377 IonicContact OE1-NH1 3.12Å; E299-R377 PolarHBondContact OE1-NH1 3.29Å; E299-R377 IonicContact OE1-NH2 3.4Å; E299-R377 PolarHBondContact OE1-NH2 3.39Å; E299-R377 IonicContact OE2-NH2 3.8Å
300	R	85.3	Confident	84.2	Confident	12 Å²	12	30.5 Å²	30.5	5%	0.045	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-41.2	175.5	-177.1	-169.9	177	103.7	13.6	111.9	R262 E266 S296 S297 L298 L303 S304	R262-R300 VanDerWaalsContact CD-NH1 3.27Å; R262-R300 VanDerWaalsContact CG-NH2 3.33Å; E266-R300 IonicContact OE1-NH2 3.77Å; E266-R300 PolarHBondContact OE1-NH2 2.8Å; E266-R300 IonicContact OE2-CZ 3.58Å; E266-R300 IonicContact OE2-NH2 2.79Å; E266-R300 PolarHBondContact OE2-NH2 3.46Å; S296-R300 PolarHBondContact O-N 3.33Å; S297-R300 WeakPolarHBondContact O-CB 3.26Å; S297-R300 PolarHBondContact O-N 2.93Å; L298-R300 VanDerWaalsContact C-N 3.29Å; L298-R300 PolarHBondContact O-N 3.19Å; R300-L303 PolarHBondContact O-N 3.45Å; R300-S304 WeakPolarHBondContact O-CB 3.29Å; R300-S304 PolarHBondContact O-N 3.08Å; R300-S304 PolarHBondContact O-OG 3.09Å
301	M	87.9	Confident	84.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.7	-47.4	179.4	-173.2	169.9	-176.2	0	0	111.5	L290 S297 L298 E299 L303 S304 L305 W311 V324 I381 I388	L290-M301 HydrophobicContact CD2-SD 4.49Å; S297-M301 PolarHBondContact O-N 3.12Å; L298-M301 PolarHBondContact O-N 3.19Å; E299-M301 VanDerWaalsContact C-N 3.35Å; M301-L303 PolarHBondContact O-N 3.43Å; M301-S304 PolarHBondContact O-N 2.93Å; M301-L305 HydrophobicContact CE-CD1 4.03Å; M301-L305 HydrophobicContact CG-CD1 3.77Å; M301-L305 HydrophobicContact CG-CG 4.37Å; M301-L305 WeakPolarHBondContact O-CB 3.42Å; M301-L305 VanDerWaalsContact O-CG 3.31Å; M301-L305 WeakPolarHBondContact O-CG 3.48Å; M301-L305 PolarHBondContact O-N 3.38Å; M301-W311 VanDerWaalsContact CA-CZ2 3.47Å; M301-W311 HydrophobicContact CB-CH2 3.98Å; M301-W311 HydrophobicContact CB-CZ2 3.91Å; M301-W311 HydrophobicContact CB-CZ3 4.39Å; M301-W311 HydrophobicContact CE-CB 4.14Å; M301-W311 HydrophobicContact CE-CD2 4.17Å; M301-W311 HydrophobicContact CE-CE3 4.37Å; M301-W311 HydrophobicContact CE-CG 4.06Å; M301-W311 HydrophobicContact CG-CD2 3.9Å; M301-W311 HydrophobicContact CG-CE3 4.18Å; M301-W311 HydrophobicContact CG-CG 4.43Å; M301-W311 HydrophobicContact CG-CH2 4.27Å; M301-W311 HydrophobicContact CG-CZ2 4.03Å; M301-W311 HydrophobicContact CG-CZ3 4.35Å; M301-W311 HydrophobicContact SD-CD2 4.36Å; M301-W311 HydrophobicContact SD-CE3 4.23Å; M301-V324 HydrophobicContact CE-CG1 4.14Å; M301-V324 HydrophobicContact CE-CG2 4.43Å; M301-V324 HydrophobicContact SD-CG2 4.11Å; M301-I381 HydrophobicContact CB-CD1 4.39Å; M301-I381 HydrophobicContact CE-CG2 3.98Å; M301-I381 HydrophobicContact CG-CD1 4.23Å; M301-I381 HydrophobicContact CG-CG1 4.48Å; M301-I381 HydrophobicContact SD-CD1 4.32Å; M301-I381 HydrophobicContact SD-CG2 4.45Å; M301-I388 HydrophobicContact CE-CD1 3.63Å; M301-I388 HydrophobicContact CE-CG1 4Å; M301-I388 HydrophobicContact CE-CG2 4.46Å
302	D	86.8	Confident	84.3	Confident	16 Å²	16	30.4 Å²	30.4	9%	0.086	16%	0.164	C	C	.	.	H	α-helix	trans	-58.9	-44.9	175.1	177.6	56.5	0	0	0	112.1	L298 S304 L305 K306 S380	L298-D302 PolarHBondContact O-N 3.27Å; D302-S304 VanDerWaalsContact C-N 3.35Å; D302-S304 PolarHBondContact O-N 3.21Å; D302-L305 PolarHBondContact O-N 3.25Å; D302-K306 WeakPolarHBondContact O-CG 3.39Å; D302-K306 PolarHBondContact O-N 3.26Å; D302-K306 VanDerWaalsContact O-N 3.13Å; D302-K306 WeakPolarHBondContact OD1-CE 3.47Å; D302-K306 IonicContact OD1-NZ 3.47Å; D302-K306 PolarHBondContact OD1-NZ 2.63Å; D302-K306 IonicContact OD2-NZ 2.73Å; D302-K306 PolarHBondContact OD2-NZ 3.44Å; D302-S380 WeakPolarHBondContact OD1-CB 3.45Å; D302-S380 PolarHBondContact OD1-OG 3.27Å
303	L	85.3	Confident	84.7	Confident	74 Å²	74	29.1 Å²	29.1	39%	0.387	16%	0.155	S	C	.	.	H	α-helix	trans	-64.2	-39	179	-162.4	109.9	0	0	0	112.5	A263 E299 R300 M301	A263-L303 HydrophobicContact CB-CD2 3.41Å; A263-L303 VanDerWaalsContact CB-CD2 3.41Å; E299-L303 PolarHBondContact O-N 3.32Å; E299-L303 VanDerWaalsContact O-N 3.13Å; R300-L303 PolarHBondContact O-N 3.45Å; M301-L303 PolarHBondContact O-N 3.43Å
304	S	86.9	Confident	85.1	Confident	3 Å²	3	29 Å²	29	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-75.3	-37.1	-178.7	-51.7	0	0	0	0	111.9	R300 M301 D302 K306 N307 M309	R300-S304 WeakPolarHBondContact O-CB 3.29Å; R300-S304 PolarHBondContact O-N 3.08Å; R300-S304 PolarHBondContact O-OG 3.09Å; M301-S304 PolarHBondContact O-N 2.93Å; D302-S304 VanDerWaalsContact C-N 3.35Å; D302-S304 PolarHBondContact O-N 3.21Å; S304-K306 VanDerWaalsContact C-N 3.34Å; S304-N307 CarbonylContact O-C 3.52Å; S304-N307 PolarHBondContact O-N 3.5Å; S304-N307 VanDerWaalsContact O-N 3.14Å; S304-M309 VanDerWaalsContact O-CB 3.3Å; S304-M309 WeakPolarHBondContact O-CB 3.11Å; S304-M309 WeakPolarHBondContact O-CG 3.39Å; S304-M309 PolarHBondContact O-N 3.07Å
305	L	86.4	Confident	85.4	Confident	5 Å²	5	26.5 Å²	26.5	3%	0.026	14%	0.142	C	C	.	.	H	α-helix	trans	-66.9	-34.3	176.3	-75	167.9	0	0	0	112.2	M301 D302 N307 S308 W311 I381 C384 L387 I388	M301-L305 HydrophobicContact CE-CD1 4.03Å; M301-L305 HydrophobicContact CG-CD1 3.77Å; M301-L305 HydrophobicContact CG-CG 4.37Å; M301-L305 WeakPolarHBondContact O-CB 3.42Å; M301-L305 VanDerWaalsContact O-CG 3.31Å; M301-L305 WeakPolarHBondContact O-CG 3.48Å; M301-L305 PolarHBondContact O-N 3.38Å; D302-L305 PolarHBondContact O-N 3.25Å; L305-N307 PolarHBondContact O-N 3.43Å; L305-S308 WeakPolarHBondContact O-CA 3.06Å; L305-S308 PolarHBondContact O-N 2.8Å; L305-W311 HydrophobicContact CD2-CG 4.49Å; L305-I381 HydrophobicContact CD1-CB 4.22Å; L305-I381 HydrophobicContact CD1-CG1 3.85Å; L305-I381 HydrophobicContact CD1-CG2 3.99Å; L305-C384 HydrophobicContact CB-CB 4.43Å; L305-C384 HydrophobicContact CD1-CB 4.48Å; L305-C384 HydrophobicContact CD2-CB 4.25Å; L305-L387 HydrophobicContact CD2-CB 3.95Å; L305-L387 HydrophobicContact CD2-CD1 4.28Å; L305-I388 HydrophobicContact CD1-CD1 4.25Å; L305-I388 HydrophobicContact CD2-CG1 4.18Å
306	K	84.6	Confident	85.6	Confident	137 Å²	137	26.3 Å²	26.3	60%	0.596	15%	0.146	S	C	*	.	H	α-helix	trans	-59.7	-31.3	170.9	-77.2	168.1	177.8	161.3	0	112.7	D302 S304 S308	D302-K306 WeakPolarHBondContact O-CG 3.39Å; D302-K306 PolarHBondContact O-N 3.26Å; D302-K306 VanDerWaalsContact O-N 3.13Å; D302-K306 WeakPolarHBondContact OD1-CE 3.47Å; D302-K306 IonicContact OD1-NZ 3.47Å; D302-K306 PolarHBondContact OD1-NZ 2.63Å; D302-K306 IonicContact OD2-NZ 2.73Å; D302-K306 PolarHBondContact OD2-NZ 3.44Å; S304-K306 VanDerWaalsContact C-N 3.34Å; K306-S308 PolarHBondContact O-N 3.36Å
307	N	82.7	Confident	85.8	Confident	62 Å²	62	25.3 Å²	25.3	33%	0.332	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	14.3	173.1	-62.9	-6.7	0	0	0	112.7	S304 L305 M309	S304-N307 CarbonylContact O-C 3.52Å; S304-N307 PolarHBondContact O-N 3.5Å; S304-N307 VanDerWaalsContact O-N 3.14Å; L305-N307 PolarHBondContact O-N 3.43Å; N307-M309 VanDerWaalsContact C-N 3.28Å; N307-M309 HydrophobicContact CB-CG 4.05Å; N307-M309 PolarHBondContact O-N 3.44Å
308	S	83.8	Confident	85.8	Confident	58 Å²	58	25.9 Å²	25.9	41%	0.406	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	31.7	-179.9	-55.7	0	0	0	0	114.5	L305 K306 R416	L305-S308 WeakPolarHBondContact O-CA 3.06Å; L305-S308 PolarHBondContact O-N 2.8Å; K306-S308 PolarHBondContact O-N 3.36Å; S308-R416 PolarHBondContact O-NE 2.83Å; S308-R416 PolarHBondContact O-NH2 3.35Å
309	M	85.6	Confident	85.7	Confident	4 Å²	4	27.4 Å²	27.4	2%	0.02	16%	0.162	C	C	.	.			trans	-88.1	131.5	-177.9	-59.6	-70.8	-79.4	0	0	111.5	E266 V286 S304 N307 W311	E266-M309 HydrophobicContact CB-CE 4.21Å; V286-M309 HydrophobicContact CB-CE 3.32Å; V286-M309 HydrophobicContact CG1-CE 3.32Å; V286-M309 HydrophobicContact CG2-CE 4.12Å; S304-M309 VanDerWaalsContact O-CB 3.3Å; S304-M309 WeakPolarHBondContact O-CB 3.11Å; S304-M309 WeakPolarHBondContact O-CG 3.39Å; S304-M309 PolarHBondContact O-N 3.07Å; N307-M309 VanDerWaalsContact C-N 3.28Å; N307-M309 HydrophobicContact CB-CG 4.05Å; N307-M309 PolarHBondContact O-N 3.44Å; M309-W311 VanDerWaalsContact O-CD1 3.32Å
310	P	89.9	Confident	85.8	Confident	5 Å²	5	23 Å²	23	3%	0.032	14%	0.141	C	C	.	.			trans	-72.1	144.2	-179.6	26.4	-32.5	0	0	0	113.4	V286 L287 C288 L387 L409 A412	V286-P310 WeakPolarHBondContact O-CD 3.24Å; V286-P310 WeakPolarHBondContact O-CG 3.29Å; L287-P310 HydrophobicContact CD1-CB 3.71Å; L287-P310 HydrophobicContact CD1-CG 3.86Å; C288-P310 PolarHBondContact N-O 2.95Å; P310-L387 WeakPolarHBondContact CA-O 3.34Å; P310-L409 HydrophobicContact CG-CD2 3.94Å; P310-A412 HydrophobicContact CB-CB 3.53Å; P310-A412 HydrophobicContact CG-CB 4.18Å
311	W	90.1	Very high	85.8	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	131.4	177.2	-78.3	74.7	0	0	0	111.9	V134 C288 L290 M301 L305 M309 L387 I388 S389	V134-W311 HydrophobicContact CB-CH2 4.37Å; V134-W311 HydrophobicContact CB-CZ3 4.32Å; V134-W311 HydrophobicContact CG2-CH2 4.03Å; V134-W311 HydrophobicContact CG2-CZ3 4.34Å; C288-W311 HydrophobicContact CB-CD2 3.54Å; C288-W311 VanDerWaalsContact CB-CE2 3.47Å; C288-W311 HydrophobicContact CB-CE3 3.84Å; C288-W311 HydrophobicContact CB-CG 4.03Å; C288-W311 HydrophobicContact CB-CH2 4.07Å; C288-W311 HydrophobicContact CB-CZ2 3.74Å; C288-W311 HydrophobicContact CB-CZ3 4.11Å; C288-W311 CarbonylContact O-C 3.53Å; C288-W311 VanDerWaalsContact O-CA 3.29Å; C288-W311 WeakPolarHBondContact O-CA 3.31Å; L290-W311 HydrophobicContact CB-CE3 3.97Å; L290-W311 HydrophobicContact CB-CZ3 3.97Å; L290-W311 HydrophobicContact CD1-CZ3 4.18Å; M301-W311 VanDerWaalsContact CA-CZ2 3.47Å; M301-W311 HydrophobicContact CB-CH2 3.98Å; M301-W311 HydrophobicContact CB-CZ2 3.91Å; M301-W311 HydrophobicContact CB-CZ3 4.39Å; M301-W311 HydrophobicContact CE-CB 4.14Å; M301-W311 HydrophobicContact CE-CD2 4.17Å; M301-W311 HydrophobicContact CE-CE3 4.37Å; M301-W311 HydrophobicContact CE-CG 4.06Å; M301-W311 HydrophobicContact CG-CD2 3.9Å; M301-W311 HydrophobicContact CG-CE3 4.18Å; M301-W311 HydrophobicContact CG-CG 4.43Å; M301-W311 HydrophobicContact CG-CH2 4.27Å; M301-W311 HydrophobicContact CG-CZ2 4.03Å; M301-W311 HydrophobicContact CG-CZ3 4.35Å; M301-W311 HydrophobicContact SD-CD2 4.36Å; M301-W311 HydrophobicContact SD-CE3 4.23Å; L305-W311 HydrophobicContact CD2-CG 4.49Å; M309-W311 VanDerWaalsContact O-CD1 3.32Å; W311-L387 PolarHBondContact N-O 3.42Å; W311-I388 HydrophobicContact CB-CG1 4.42Å; W311-I388 WeakPolarHBondContact O-CA 3.44Å; W311-S389 PolarHBondContact O-N 3.48Å
312	L	90.9	Very high	85.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.3	169.9	-178.9	66.1	0	0	0	109.2	L287 C288 M289 L290 S389 H391 F401 V404 A408	L287-L312 HydrophobicContact CD1-CB 4.34Å; L287-L312 HydrophobicContact CD2-CB 4.07Å; L287-L312 HydrophobicContact CD2-CD2 4.29Å; L287-L312 HydrophobicContact CG-CB 4.36Å; C288-L312 PolarHBondContact O-N 3.06Å; M289-L312 CarbonylContact C-O 3.56Å; M289-L312 WeakPolarHBondContact CA-O 3.4Å; L290-L312 PolarHBondContact N-O 3.35Å; L312-S389 WeakPolarHBondContact CA-O 3.38Å; L312-H391 HydrophobicContact CD1-CB 4.09Å; L312-F401 HydrophobicContact CD2-CE2 4.02Å; L312-F401 HydrophobicContact CD2-CZ 3.71Å; L312-V404 HydrophobicContact CD1-CG1 4.11Å; L312-A408 HydrophobicContact CD1-CB 4.31Å
313	V	90.4	Very high	85.7	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.7	-177.4	-179.4	0	0	0	0	109.9	L290 A315 A321 V324 I388 S389 H391	L290-V313 HydrophobicContact CB-CG2 4.37Å; L290-V313 HydrophobicContact CD2-CG1 4.36Å; L290-V313 HydrophobicContact CD2-CG2 4.3Å; V313-A315 PolarHBondContact O-N 3.1Å; V313-A321 HydrophobicContact CG1-CB 3.95Å; V313-A321 WeakPolarHBondContact CG1-O 3.39Å; V313-V324 HydrophobicContact CG2-CG1 4.13Å; V313-I388 HydrophobicContact CG2-CG2 3.74Å; V313-S389 PolarHBondContact N-O 3Å; V313-H391 PolarHBondContact O-N 3.28Å
314	L	88.1	Confident	85.8	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	98.3	171.6	-68.7	-170.8	0	0	0	110.4	V146 M289 L290 I291 S317 H391	V146-L314 HydrophobicContact CG1-CD1 4.11Å; M289-L314 HydrophobicContact CE-CD1 3.51Å; M289-L314 HydrophobicContact CE-CD2 3.78Å; M289-L314 HydrophobicContact CE-CG 3.65Å; L290-L314 PolarHBondContact O-N 3.49Å; I291-L314 HydrophobicContact CB-CD1 4.47Å; I291-L314 HydrophobicContact CD1-CD1 4.06Å; I291-L314 HydrophobicContact CG1-CD1 3.81Å; I291-L314 HydrophobicContact CG1-CG 4.38Å; I291-L314 HydrophobicContact CG2-CD1 4.24Å; L314-S317 WeakPolarHBondContact O-CB 3.34Å; L314-S317 PolarHBondContact O-N 3.08Å; L314-S317 PolarHBondContact O-OG 3.18Å; L314-H391 HydrophobicContact CD2-CB 4.22Å; L314-H391 VanDerWaalsContact CD2-CD2 3.49Å; L314-H391 WeakPolarHBondContact CD2-CD2 3.32Å
315	A	83.5	Confident	85.7	Confident	13 Å²	13	20.2 Å²	20.2	11%	0.107	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	138.9	176.1	0	0	0	0	0	111	V313 S317 A325 I390 H391 Y392	V313-A315 PolarHBondContact O-N 3.1Å; A315-S317 VanDerWaalsContact C-N 3.33Å; A315-A325 HydrophobicContact CB-CB 3.99Å; A315-I390 HydrophobicContact CB-CG2 3.75Å; A315-H391 PolarHBondContact N-O 2.97Å; A315-Y392 HydrophobicContact CB-CD1 3.92Å; A315-Y392 HydrophobicContact CB-CE1 4.07Å
316	G	80.9	Confident	85.5	Confident	27 Å²	27	22 Å²	22	28%	0.278	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	6.9	-176.4	0	0	0	0	0	113.9	K143 D322	K143-G316 WeakPolarHBondContact CE-O 3.42Å; K143-G316 PolarHBondContact NZ-O 2.95Å; G316-D322 VanDerWaalsContact C-OD1 3.32Å; G316-D322 WeakPolarHBondContact CA-OD1 3.49Å; G316-D322 PolarHBondContact N-OD1 3.22Å
317	S	81.5	Confident	85.4	Confident	14 Å²	14	15.8 Å²	15.8	10%	0.098	11%	0.111	C	C	.	.	S	Bend	trans	-83.4	-15.2	176.9	66.6	0	0	0	0	113.7	S292 L314 A315 A321 D322	S292-S317 PolarHBondContact N-OG 3.31Å; S292-S317 VanDerWaalsContact N-OG 3.07Å; L314-S317 WeakPolarHBondContact O-CB 3.34Å; L314-S317 PolarHBondContact O-N 3.08Å; L314-S317 PolarHBondContact O-OG 3.18Å; A315-S317 VanDerWaalsContact C-N 3.33Å; S317-A321 WeakPolarHBondContact OG-CB 3.36Å; S317-D322 PolarHBondContact N-OD1 3.34Å; S317-D322 VanDerWaalsContact N-OD1 3.11Å
318	G	81.2	Confident	85.3	Confident	17 Å²	17	13.8 Å²	13.8	18%	0.175	10%	0.1	C	C	.	.			trans	105.5	166.1	176.7	0	0	0	0	0	114.9	S292 L320 A321 D322	S292-G318 WeakPolarHBondContact CA-O 3.47Å; G318-L320 PolarHBondContact O-N 3.46Å; G318-A321 PolarHBondContact O-N 3.47Å; G318-D322 WeakPolarHBondContact CA-OD2 3.28Å; G318-D322 VanDerWaalsContact N-CG 3.34Å; G318-D322 PolarHBondContact N-OD1 2.68Å; G318-D322 VanDerWaalsContact N-OD1 3.11Å; G318-D322 PolarHBondContact N-OD2 3.41Å; G318-D322 VanDerWaalsContact N-OD2 3.13Å
319	G	83.4	Confident	84.8	Confident	35 Å²	35	14.5 Å²	14.5	36%	0.361	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	-127.5	170.1	0	0	0	0	0	113.9	A321 F323	G319-A321 VanDerWaalsContact C-N 3.32Å; G319-A321 PolarHBondContact O-N 3.01Å; G319-F323 PolarHBondContact O-N 3.09Å
320	L	85.6	Confident	83.7	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.5	-34.4	179.4	-179.8	61	0	0	0	114	L290 G293 L298 G318 F323 V324 F365	L290-L320 HydrophobicContact CD1-CD2 4.12Å; L290-L320 HydrophobicContact CD2-CD2 4.14Å; L290-L320 HydrophobicContact CD2-CG 3.95Å; G293-L320 WeakPolarHBondContact O-CB 3.48Å; G293-L320 PolarHBondContact O-N 3.33Å; L298-L320 HydrophobicContact CB-CD1 4.06Å; L298-L320 HydrophobicContact CB-CD2 4.11Å; L298-L320 HydrophobicContact CD1-CD1 3.45Å; L298-L320 VanDerWaalsContact CD1-CD1 3.45Å; L298-L320 HydrophobicContact CG-CD1 4.31Å; G318-L320 PolarHBondContact O-N 3.46Å; L320-F323 HydrophobicContact CD1-CD1 3.94Å; L320-F323 WeakPolarHBondContact O-CB 3.21Å; L320-F323 PolarHBondContact O-N 3.15Å; L320-V324 HydrophobicContact CD1-CG2 4.11Å; L320-V324 HydrophobicContact CG-CG2 4.42Å; L320-V324 WeakPolarHBondContact O-CG2 3.37Å; L320-V324 PolarHBondContact O-N 3.37Å; L320-F365 HydrophobicContact CB-CZ 4.39Å; L320-F365 HydrophobicContact CD1-CZ 4.27Å
321	A	86.6	Confident	82.2	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.1	-43	-176.6	0	0	0	0	0	111.8	L290 V313 S317 G318 G319 V324 A325	L290-A321 HydrophobicContact CD2-CB 4.11Å; L290-A321 HydrophobicContact CG-CB 4.18Å; V313-A321 HydrophobicContact CG1-CB 3.95Å; V313-A321 WeakPolarHBondContact CG1-O 3.39Å; S317-A321 WeakPolarHBondContact OG-CB 3.36Å; G318-A321 PolarHBondContact O-N 3.47Å; G319-A321 VanDerWaalsContact C-N 3.32Å; G319-A321 PolarHBondContact O-N 3.01Å; A321-V324 PolarHBondContact O-N 3.47Å; A321-A325 PolarHBondContact O-N 3.44Å
322	D	86.1	Confident	80.5	Confident	41 Å²	41	23.9 Å²	23.9	22%	0.219	16%	0.155	C	C	.	.	H	α-helix	trans	-70.1	-36	177	-64.4	-1.9	0	0	0	110.8	G316 S317 G318 V324 A325 D326	G316-D322 VanDerWaalsContact C-OD1 3.32Å; G316-D322 WeakPolarHBondContact CA-OD1 3.49Å; G316-D322 PolarHBondContact N-OD1 3.22Å; S317-D322 PolarHBondContact N-OD1 3.34Å; S317-D322 VanDerWaalsContact N-OD1 3.11Å; G318-D322 WeakPolarHBondContact CA-OD2 3.28Å; G318-D322 VanDerWaalsContact N-CG 3.34Å; G318-D322 PolarHBondContact N-OD1 2.68Å; G318-D322 VanDerWaalsContact N-OD1 3.11Å; G318-D322 PolarHBondContact N-OD2 3.41Å; G318-D322 VanDerWaalsContact N-OD2 3.13Å; D322-V324 PolarHBondContact O-N 2.82Å; D322-A325 PolarHBondContact O-N 3.32Å; D322-D326 WeakPolarHBondContact O-CB 3.37Å; D322-D326 PolarHBondContact O-N 3.5Å
323	F	86.2	Confident	78	Confident	1 Å²	1	27.5 Å²	27.5	0%	0.004	19%	0.185	C	C	.	.	H	α-helix	trans	-59.4	-45.1	173.2	169.5	-102.3	0	0	0	112.4	L298 G319 L320 L327 R360 V361 H364 F365 A378	L298-F323 HydrophobicContact CD1-CE1 4.49Å; G319-F323 PolarHBondContact O-N 3.09Å; L320-F323 HydrophobicContact CD1-CD1 3.94Å; L320-F323 WeakPolarHBondContact O-CB 3.21Å; L320-F323 PolarHBondContact O-N 3.15Å; F323-L327 HydrophobicContact CE1-CD2 4.44Å; F323-L327 VanDerWaalsContact O-CB 3.25Å; F323-L327 WeakPolarHBondContact O-CB 3.5Å; F323-L327 PolarHBondContact O-N 2.95Å; F323-R360 HydrophobicContact CE2-CB 4.07Å; F323-V361 HydrophobicContact CE2-CG2 3.77Å; F323-V361 HydrophobicContact CZ-CG2 3.63Å; F323-H364 HydrophobicContact CB-CB 4.21Å; F323-H364 HydrophobicContact CD2-CB 4.22Å; F323-H364 AromaticContact CD2-ND1 3.82Å; F323-F365 HydrophobicContact CB-CE2 4.47Å; F323-F365 HydrophobicContact CD1-CE2 4.37Å; F323-F365 HydrophobicContact CG-CE2 4.21Å; F323-A378 HydrophobicContact CE1-CB 4.1Å; F323-A378 HydrophobicContact CZ-CB 3.87Å
324	V	86.5	Confident	75.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-69.2	-39	179	174.3	0	0	0	0	111.5	M301 V313 L320 A321 D322 L327 L328 I388	M301-V324 HydrophobicContact CE-CG1 4.14Å; M301-V324 HydrophobicContact CE-CG2 4.43Å; M301-V324 HydrophobicContact SD-CG2 4.11Å; V313-V324 HydrophobicContact CG2-CG1 4.13Å; L320-V324 HydrophobicContact CD1-CG2 4.11Å; L320-V324 HydrophobicContact CG-CG2 4.42Å; L320-V324 WeakPolarHBondContact O-CG2 3.37Å; L320-V324 PolarHBondContact O-N 3.37Å; A321-V324 PolarHBondContact O-N 3.47Å; D322-V324 PolarHBondContact O-N 2.82Å; V324-L327 PolarHBondContact O-N 2.84Å; V324-L328 HydrophobicContact CG1-CD1 3.86Å; V324-L328 HydrophobicContact CG1-CG 4.49Å; V324-L328 WeakPolarHBondContact O-CG 3.46Å; V324-L328 PolarHBondContact O-N 3.47Å; V324-L328 VanDerWaalsContact O-N 3.11Å; V324-I388 HydrophobicContact CG1-CG2 4.3Å
325	A	85.3	Confident	73	Confident	5 Å²	5	37 Å²	37	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-49.1	174.2	0	0	0	0	0	111.3	A315 A321 D322 L327 L328 E329 I390	A315-A325 HydrophobicContact CB-CB 3.99Å; A321-A325 PolarHBondContact O-N 3.44Å; D322-A325 PolarHBondContact O-N 3.32Å; A325-L327 VanDerWaalsContact C-N 3.27Å; A325-L327 PolarHBondContact O-N 2.87Å; A325-L328 PolarHBondContact O-N 3.33Å; A325-E329 PolarHBondContact O-N 3.34Å; A325-E329 VanDerWaalsContact O-N 3.07Å; A325-I390 HydrophobicContact CB-CG2 4.45Å
326	D	82.7	Confident	70.6	Confident	42 Å²	42	40 Å²	40	23%	0.225	29%	0.285	C	S	.	.	H	α-helix	trans	-57.4	-38.7	175.7	-94.9	16.4	0	0	0	112.2	D322 N330 R360 K363 H364	D322-D326 WeakPolarHBondContact O-CB 3.37Å; D322-D326 PolarHBondContact O-N 3.5Å; D326-N330 PolarHBondContact O-N 3.31Å; D326-N330 PolarHBondContact O-ND2 2.84Å; D326-N330 VanDerWaalsContact O-ND2 3.08Å; D326-R360 IonicContact OD2-NH1 3.67Å; D326-K363 IonicContact OD2-NZ 2.95Å; D326-H364 IonicContact OD2-CE1 3.69Å; D326-H364 PolarHBondContact OD2-CE1 3.26Å; D326-H364 IonicContact OD2-NE2 3.72Å
327	L	82.1	Confident	68.1	Low	7 Å²	7	48.7 Å²	48.7	4%	0.037	32%	0.315	C	S	.	.	H	α-helix	trans	-67.2	-38.1	180	-179.3	68.6	0	0	0	112.2	F323 V324 A325 V331 V357 Y382	F323-L327 HydrophobicContact CE1-CD2 4.44Å; F323-L327 VanDerWaalsContact O-CB 3.25Å; F323-L327 WeakPolarHBondContact O-CB 3.5Å; F323-L327 PolarHBondContact O-N 2.95Å; V324-L327 PolarHBondContact O-N 2.84Å; A325-L327 VanDerWaalsContact C-N 3.27Å; A325-L327 PolarHBondContact O-N 2.87Å; L327-V331 WeakPolarHBondContact O-CG2 3.35Å; L327-V357 HydrophobicContact CD1-CG2 3.79Å; L327-Y382 HydrophobicContact CG-CD2 4.3Å
328	L	80.7	Confident	65.8	Low	20 Å²	20	56.5 Å²	56.5	11%	0.105	35%	0.35	C	S	.	.	H	α-helix	trans	-82.7	-39.2	-176.2	-71.5	169.9	0	0	0	112.8	V324 A325 S332 Y382 R385 I388 I390	V324-L328 HydrophobicContact CG1-CD1 3.86Å; V324-L328 HydrophobicContact CG1-CG 4.49Å; V324-L328 WeakPolarHBondContact O-CG 3.46Å; V324-L328 PolarHBondContact O-N 3.47Å; V324-L328 VanDerWaalsContact O-N 3.11Å; A325-L328 PolarHBondContact O-N 3.33Å; L328-S332 PolarHBondContact O-OG 3.14Å; L328-Y382 HydrophobicContact CD2-CD2 4.41Å; L328-R385 HydrophobicContact CD2-CB 3.53Å; L328-I388 HydrophobicContact CD1-CB 4.03Å; L328-I388 HydrophobicContact CD1-CD1 4.29Å; L328-I388 HydrophobicContact CD1-CG2 3.63Å; L328-I390 HydrophobicContact CB-CD1 3.88Å; L328-I390 HydrophobicContact CD1-CD1 3.87Å; L328-I390 HydrophobicContact CD1-CG1 4.16Å
329	E	74.5	Confident	63.5	Low	74 Å²	74	61.5 Å²	61.5	35%	0.346	38%	0.383	S	S	.	.	H	α-helix	trans	-71.4	-46.6	-178.6	-73.7	177.3	-159.4	0	0	113.4	A325 S332 Y392	A325-E329 PolarHBondContact O-N 3.34Å; A325-E329 VanDerWaalsContact O-N 3.07Å; E329-S332 PolarHBondContact O-OG 2.83Å; E329-Y392 WeakPolarHBondContact OE1-CE1 3.46Å; E329-Y392 PolarHBondContact OE1-OH 2.86Å
330	N	62.4	Low	61	Low	87 Å²	87	65 Å²	65	47%	0.465	40%	0.402	S	S	.	.	H	α-helix	trans	-85.5	-19.8	-168.4	-67.1	-65.2	0	0	0	113.9	D326	D326-N330 PolarHBondContact O-N 3.31Å; D326-N330 PolarHBondContact O-ND2 2.84Å; D326-N330 VanDerWaalsContact O-ND2 3.08Å
331	V	57.8	Low	58.3	Low	44 Å²	44	70.8 Å²	70.8	27%	0.267	44%	0.442	S	S	.	.	H	α-helix	trans	-85.7	-24.7	176.4	-172.9	0	0	0	0	111	L327 L353 Y382	L327-V331 WeakPolarHBondContact O-CG2 3.35Å; V331-L353 HydrophobicContact CG1-CD1 3.53Å; V331-Y382 HydrophobicContact CB-CE2 3.63Å; V331-Y382 HydrophobicContact CG1-CE1 4.04Å; V331-Y382 HydrophobicContact CG1-CE2 3.65Å; V331-Y382 WeakPolarHBondContact CG1-OH 3.5Å; V331-Y382 HydrophobicContact CG2-CE2 4.32Å
332	S	53	Low	56	Low	75 Å²	75	80.5 Å²	80.5	52%	0.524	49%	0.487	S	S	.	.	H	α-helix	trans	-77.1	-19.5	173.2	55.6	0	0	0	0	113.6	L328 E329 A334	L328-S332 PolarHBondContact O-OG 3.14Å; E329-S332 PolarHBondContact O-OG 2.83Å; S332-A334 VanDerWaalsContact C-N 3.31Å; S332-A334 PolarHBondContact O-N 2.89Å
333	A	39	Very low	53.3	Low	76 Å²	76	82.1 Å²	82.1	63%	0.628	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	17.7	-177.9	0	0	0	0	0	115.9
334	A	34.2	Very low	51.1	Low	76 Å²	76	90.6 Å²	90.6	63%	0.628	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-80.2	124.1	171.3	0	0	0	0	0	110.3	S332 G336	S332-A334 VanDerWaalsContact C-N 3.31Å; S332-A334 PolarHBondContact O-N 2.89Å; A334-G336 PolarHBondContact O-N 2.81Å
335	P	39	Very low	48.5	Very low	124 Å²	124	94 Å²	94	81%	0.805	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-67	126.7	175	-3.5	16.3	0	0	0	109.7	F337	P335-F337 PolarHBondContact O-N 3.36Å
336	G	34.1	Very low	46	Very low	75 Å²	75	102.8 Å²	102.8	77%	0.773	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-59.5	120.7	170.8	0	0	0	0	0	110.7	A334 Q338	A334-G336 PolarHBondContact O-N 2.81Å; G336-Q338 PolarHBondContact O-N 3.18Å
337	F	27.8	Very low	44	Very low	209 Å²	209	106.8 Å²	106.8	92%	0.917	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-73	122.8	161.5	-123.1	-93.6	0	0	0	107.7	P335	P335-F337 PolarHBondContact O-N 3.36Å
338	Q	33	Very low	42.2	Very low	179 Å²	179	109.8 Å²	109.8	84%	0.836	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-56.3	138.7	176.7	-75.1	175.2	-16.4	0	0	110.9	G336 S340	G336-Q338 PolarHBondContact O-N 3.18Å; Q338-S340 PolarHBondContact O-N 2.96Å
339	S	33.3	Very low	40.8	Very low	122 Å²	122	114.1 Å²	114.1	85%	0.853	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-56.3	125.7	174.3	43.7	0	0	0	0	112.9
340	S	31.2	Very low	39.6	Very low	109 Å²	109	114.5 Å²	114.5	76%	0.762	74%	0.735	S	S	*	*			trans	-152.3	136.3	144.5	60.8	0	0	0	0	111.4	Q338	Q338-S340 PolarHBondContact O-N 2.96Å
341	S	28.1	Very low	39.3	Very low	121 Å²	121	115.4 Å²	115.4	85%	0.846	74%	0.744	S	S	*	*			trans	91.5	112.9	171.2	72	0	0	0	0	118.1
342	E	39.4	Very low	39.6	Very low	203 Å²	203	118.3 Å²	118.3	95%	0.949	76%	0.758	S	S	*	*			trans	-56.6	146	158.2	-63.8	173.9	140.5	0	0	111
343	G	29.5	Very low	40.3	Very low	75 Å²	75	117.3 Å²	117.3	77%	0.773	75%	0.746	S	S	*	*			trans	161	112.2	167.6	0	0	0	0	0	112.3
344	D	38.6	Very low	41.8	Very low	180 Å²	180	118 Å²	118	96%	0.963	74%	0.735	S	S	*	*			trans	-45.1	139.5	171	-85.5	-39.8	0	0	0	113.9
345	G	32.7	Very low	43.6	Very low	70 Å²	70	120.2 Å²	120.2	72%	0.722	73%	0.732	S	S	*	*			trans	146.8	100.9	161.3	0	0	0	0	0	116.4
346	E	32.6	Very low	45.2	Very low	191 Å²	191	120.3 Å²	120.3	89%	0.893	72%	0.72	S	S	*	*			trans	73.6	138	160.7	-59.6	-132.1	151.6	0	0	121.3	G348	E346-G348 PolarHBondContact O-N 3.32Å
347	P	41.3	Very low	47.2	Very low	125 Å²	125	116.8 Å²	116.8	81%	0.812	68%	0.684	S	S	*	*			trans	-88.8	104.8	-179.3	35	-29.1	0	0	0	111.3
348	G	43.9	Very low	49.4	Very low	71 Å²	71	108.2 Å²	108.2	73%	0.732	65%	0.651	S	S	*	*			trans	-145.6	85.5	171.9	0	0	0	0	0	114.2	E346	E346-G348 PolarHBondContact O-N 3.32Å
349	P	51	Low	51.5	Low	110 Å²	110	105.9 Å²	105.9	71%	0.714	64%	0.64	S	S	*	*	S	Bend	trans	-137	6.4	147.1	30.3	-12	0	0	0	114.3
350	S	50.4	Low	53.5	Low	83 Å²	83	104.2 Å²	104.2	58%	0.58	62%	0.616	S	S	*	*	H	α-helix	trans	-83.4	-20	-172.9	62.3	0	0	0	0	115.1	K354	S350-K354 PolarHBondContact O-N 2.95Å
351	V	55.3	Low	55.8	Low	105 Å²	105	99.2 Å²	99.2	64%	0.636	58%	0.58	S	S	*	*	H	α-helix	trans	-72.9	-43.8	-175.6	-175.7	0	0	0	0	111.3	L353 K354 E355	V351-L353 VanDerWaalsContact C-N 3.33Å; V351-L353 PolarHBondContact O-N 3.46Å; V351-K354 PolarHBondContact O-N 3.14Å; V351-E355 PolarHBondContact O-N 3.42Å; V351-E355 VanDerWaalsContact O-N 3.14Å
352	D	64.9	Low	58.1	Low	106 Å²	106	100.2 Å²	100.2	57%	0.567	57%	0.569	S	S	*	*	H	α-helix	trans	-63.7	-35	178.2	-82.7	10.7	0	0	0	113.3	K356	D352-K356 WeakPolarHBondContact O-CB 3.33Å; D352-K356 VanDerWaalsContact O-CG 3.29Å; D352-K356 WeakPolarHBondContact O-CG 3.39Å; D352-K356 PolarHBondContact O-N 3.49Å; D352-K356 VanDerWaalsContact O-N 3.16Å
353	L	67.7	Low	60	Low	53 Å²	53	96.9 Å²	96.9	28%	0.277	55%	0.552	S	S	.	*	H	α-helix	trans	-70.4	-42.7	179	-171.7	70.1	0	0	0	110.8	V331 V351 E355 K356 V357 L379 Y382	V331-L353 HydrophobicContact CG1-CD1 3.53Å; V351-L353 VanDerWaalsContact C-N 3.33Å; V351-L353 PolarHBondContact O-N 3.46Å; L353-E355 VanDerWaalsContact C-N 3.34Å; L353-E355 PolarHBondContact O-N 3.25Å; L353-K356 PolarHBondContact O-N 3.13Å; L353-V357 VanDerWaalsContact O-CG2 3.24Å; L353-V357 WeakPolarHBondContact O-CG2 3.34Å; L353-V357 PolarHBondContact O-N 3.09Å; L353-L379 HydrophobicContact CD2-CD2 3.9Å; L353-L379 HydrophobicContact CG-CD2 4.02Å; L353-Y382 HydrophobicContact CD2-CD1 4.46Å
354	K	70.1	Confident	62.2	Low	92 Å²	92	95.6 Å²	95.6	40%	0.4	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-38.3	179.6	-168.9	170.1	-175.3	176.3	0	111.7	S350 V351 A358 V375 L379	S350-K354 PolarHBondContact O-N 2.95Å; V351-K354 PolarHBondContact O-N 3.14Å; K354-A358 WeakPolarHBondContact O-CB 3.5Å; K354-A358 PolarHBondContact O-N 3.3Å; K354-V375 HydrophobicContact CG-CG1 3.79Å; K354-L379 HydrophobicContact CB-CD1 4.28Å; K354-L379 HydrophobicContact CD-CD1 4.39Å; K354-L379 HydrophobicContact CG-CD1 4.02Å
355	E	71.8	Confident	64.1	Low	121 Å²	121	88.6 Å²	88.6	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-69.2	-44.3	177.9	-165.6	166.1	-160.9	0	0	112.1	V351 L353 V357 A358 E359	V351-E355 PolarHBondContact O-N 3.42Å; V351-E355 VanDerWaalsContact O-N 3.14Å; L353-E355 VanDerWaalsContact C-N 3.34Å; L353-E355 PolarHBondContact O-N 3.25Å; E355-V357 VanDerWaalsContact C-N 3.35Å; E355-V357 PolarHBondContact O-N 3.19Å; E355-A358 WeakPolarHBondContact O-CB 3.37Å; E355-A358 PolarHBondContact O-N 3.07Å; E355-A358 VanDerWaalsContact O-N 3.14Å; E355-E359 PolarHBondContact O-N 3.45Å
356	K	71.6	Confident	65.8	Low	126 Å²	126	90.7 Å²	90.7	55%	0.548	49%	0.488	S	S	.	.	H	α-helix	trans	-61.1	-40.6	174.1	-74.1	173.1	-176.6	172.1	0	112.6	D352 L353 R360	D352-K356 WeakPolarHBondContact O-CB 3.33Å; D352-K356 VanDerWaalsContact O-CG 3.29Å; D352-K356 WeakPolarHBondContact O-CG 3.39Å; D352-K356 PolarHBondContact O-N 3.49Å; D352-K356 VanDerWaalsContact O-N 3.16Å; L353-K356 PolarHBondContact O-N 3.13Å; K356-R360 VanDerWaalsContact O-CG 3.24Å; K356-R360 WeakPolarHBondContact O-CG 3.36Å; K356-R360 PolarHBondContact O-N 2.88Å
357	V	76.5	Confident	67.1	Low	2 Å²	2	86.4 Å²	86.4	1%	0.012	49%	0.485	C	S	.	.	H	α-helix	trans	-66.1	-40.5	175.1	173.8	0	0	0	0	110.5	L327 L353 E355 E359 R360 V361 V375 A378 L379	L327-V357 HydrophobicContact CD1-CG2 3.79Å; L353-V357 VanDerWaalsContact O-CG2 3.24Å; L353-V357 WeakPolarHBondContact O-CG2 3.34Å; L353-V357 PolarHBondContact O-N 3.09Å; E355-V357 VanDerWaalsContact C-N 3.35Å; E355-V357 PolarHBondContact O-N 3.19Å; V357-E359 PolarHBondContact O-N 3.37Å; V357-R360 PolarHBondContact O-N 3.38Å; V357-V361 HydrophobicContact CG1-CG2 4.33Å; V357-V361 WeakPolarHBondContact O-CG2 3.36Å; V357-V361 PolarHBondContact O-N 3.5Å; V357-V375 HydrophobicContact CB-CG1 4.45Å; V357-V375 HydrophobicContact CG1-CG1 4.1Å; V357-A378 HydrophobicContact CG1-CB 3.61Å; V357-L379 HydrophobicContact CG2-CD2 4.05Å
358	A	74.4	Confident	68.1	Low	29 Å²	29	84.3 Å²	84.3	24%	0.24	46%	0.464	C	S	.	.	H	α-helix	trans	-63	-40.1	177.5	0	0	0	0	0	113.3	K354 E355 R360 V361 K362 V375	K354-A358 WeakPolarHBondContact O-CB 3.5Å; K354-A358 PolarHBondContact O-N 3.3Å; E355-A358 WeakPolarHBondContact O-CB 3.37Å; E355-A358 PolarHBondContact O-N 3.07Å; E355-A358 VanDerWaalsContact O-N 3.14Å; A358-R360 VanDerWaalsContact C-N 3.31Å; A358-R360 PolarHBondContact O-N 3.01Å; A358-V361 PolarHBondContact O-N 2.8Å; A358-K362 WeakPolarHBondContact O-CG 3.33Å; A358-K362 PolarHBondContact O-N 2.83Å; A358-V375 HydrophobicContact CB-CG2 3.84Å
359	E	76.9	Confident	68.6	Low	129 Å²	129	87.2 Å²	87.2	60%	0.603	47%	0.473	S	S	*	.	H	α-helix	trans	-61.2	-39.9	173	-72.1	-171	156	0	0	112.1	E355 V357 K362 K363	E355-E359 PolarHBondContact O-N 3.45Å; V357-E359 PolarHBondContact O-N 3.37Å; E359-K362 PolarHBondContact O-N 3.37Å; E359-K363 PolarHBondContact O-N 2.86Å
360	R	75.5	Confident	69	Low	88 Å²	88	84.6 Å²	84.6	33%	0.332	46%	0.461	S	S	.	.	H	α-helix	trans	-73.9	-34.7	-178.9	-64.4	-67.9	176.7	148.7	-0.2	113	F323 D326 K356 V357 A358 K362 K363 H364	F323-R360 HydrophobicContact CE2-CB 4.07Å; D326-R360 IonicContact OD2-NH1 3.67Å; K356-R360 VanDerWaalsContact O-CG 3.24Å; K356-R360 WeakPolarHBondContact O-CG 3.36Å; K356-R360 PolarHBondContact O-N 2.88Å; V357-R360 PolarHBondContact O-N 3.38Å; A358-R360 VanDerWaalsContact C-N 3.31Å; A358-R360 PolarHBondContact O-N 3.01Å; R360-K362 VanDerWaalsContact C-N 3.35Å; R360-K363 PolarHBondContact O-N 2.92Å; R360-H364 PolarHBondContact O-N 3.1Å; R360-H364 VanDerWaalsContact O-N 3.15Å; R360-H364 PolarHBondContact O-ND1 2.91Å; R360-H364 VanDerWaalsContact O-ND1 3.12Å
361	V	78.9	Confident	69.7	Low	4 Å²	4	82.7 Å²	82.7	2%	0.024	45%	0.448	C	S	.	.	H	α-helix	trans	-62.3	-44.4	170.2	171.3	0	0	0	0	109.7	F323 V357 A358 K363 H364 F365 L374 V375	F323-V361 HydrophobicContact CE2-CG2 3.77Å; F323-V361 HydrophobicContact CZ-CG2 3.63Å; V357-V361 HydrophobicContact CG1-CG2 4.33Å; V357-V361 WeakPolarHBondContact O-CG2 3.36Å; V357-V361 PolarHBondContact O-N 3.5Å; A358-V361 PolarHBondContact O-N 2.8Å; V361-K363 VanDerWaalsContact C-N 3.33Å; V361-K363 PolarHBondContact O-N 2.66Å; V361-H364 PolarHBondContact O-N 3.34Å; V361-F365 HydrophobicContact CG1-CD2 4.45Å; V361-F365 WeakPolarHBondContact O-CA 3.31Å; V361-F365 WeakPolarHBondContact O-CB 3.46Å; V361-F365 PolarHBondContact O-N 3.3Å; V361-L374 HydrophobicContact CG1-CB 4.16Å; V361-L374 HydrophobicContact CG1-CD1 4.37Å; V361-V375 HydrophobicContact CB-CG2 4.33Å; V361-V375 HydrophobicContact CG2-CG2 4.07Å
362	K	76.9	Confident	70.5	Confident	142 Å²	142	83.5 Å²	83.5	62%	0.617	45%	0.448	S	S	*	.	H	α-helix	trans	-62.7	-36.3	175.3	-75.6	177.5	180	174.4	0	113.1	A358 E359 R360	A358-K362 WeakPolarHBondContact O-CG 3.33Å; A358-K362 PolarHBondContact O-N 2.83Å; E359-K362 PolarHBondContact O-N 3.37Å; R360-K362 VanDerWaalsContact C-N 3.35Å
363	K	80.2	Confident	71.1	Confident	133 Å²	133	85.2 Å²	85.2	58%	0.578	45%	0.451	S	S	*	.	H	α-helix	trans	-64.1	-43.7	177.2	-175.2	-172.4	174.1	-163.6	0	112.3	D326 E359 R360 V361	D326-K363 IonicContact OD2-NZ 2.95Å; E359-K363 PolarHBondContact O-N 2.86Å; R360-K363 PolarHBondContact O-N 2.92Å; V361-K363 VanDerWaalsContact C-N 3.33Å; V361-K363 PolarHBondContact O-N 2.66Å
364	H	75.1	Confident	71.5	Confident	48 Å²	48	83.3 Å²	83.3	22%	0.222	44%	0.441	C	S	.	.	H	α-helix	trans	-91.4	-28	-174.8	-70.7	87	0	0	0	113.6	F323 D326 R360 V361 P366	F323-H364 HydrophobicContact CB-CB 4.21Å; F323-H364 HydrophobicContact CD2-CB 4.22Å; F323-H364 AromaticContact CD2-ND1 3.82Å; D326-H364 IonicContact OD2-CE1 3.69Å; D326-H364 PolarHBondContact OD2-CE1 3.26Å; D326-H364 IonicContact OD2-NE2 3.72Å; R360-H364 PolarHBondContact O-N 3.1Å; R360-H364 VanDerWaalsContact O-N 3.15Å; R360-H364 PolarHBondContact O-ND1 2.91Å; R360-H364 VanDerWaalsContact O-ND1 3.12Å; V361-H364 PolarHBondContact O-N 3.34Å; H364-P366 VanDerWaalsContact C-CD 3.49Å; H364-P366 WeakPolarHBondContact O-CD 3.45Å
365	F	77.9	Confident	72	Confident	32 Å²	32	79.1 Å²	79.1	14%	0.14	42%	0.423	C	S	.	.			trans	-125.9	71.9	-178.7	-56.1	-74.1	0	0	0	111.6	T295 L320 F323 V361 A367	T295-F365 HydrophobicContact CG2-CD1 3.52Å; T295-F365 HydrophobicContact CG2-CE1 3.67Å; T295-F365 HydrophobicContact CG2-CG 4.06Å; T295-F365 HydrophobicContact CG2-CZ 4.33Å; L320-F365 HydrophobicContact CB-CZ 4.39Å; L320-F365 HydrophobicContact CD1-CZ 4.27Å; F323-F365 HydrophobicContact CB-CE2 4.47Å; F323-F365 HydrophobicContact CD1-CE2 4.37Å; F323-F365 HydrophobicContact CG-CE2 4.21Å; V361-F365 HydrophobicContact CG1-CD2 4.45Å; V361-F365 WeakPolarHBondContact O-CA 3.31Å; V361-F365 WeakPolarHBondContact O-CB 3.46Å; V361-F365 PolarHBondContact O-N 3.3Å; F365-A367 VanDerWaalsContact C-N 3.26Å; F365-A367 PolarHBondContact O-N 3.06Å
366	P	68.4	Low	72.5	Confident	115 Å²	115	78.9 Å²	78.9	75%	0.747	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-11.9	-177.4	28.5	-34.9	0	0	0	114.4	H364	H364-P366 VanDerWaalsContact C-CD 3.49Å; H364-P366 WeakPolarHBondContact O-CD 3.45Å
367	A	60.8	Low	73.1	Confident	100 Å²	100	75.9 Å²	75.9	83%	0.826	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-4.6	-168.8	0	0	0	0	0	115.4	F365	F365-A367 VanDerWaalsContact C-N 3.26Å; F365-A367 PolarHBondContact O-N 3.06Å
368	E	62.3	Low	73.4	Confident	81 Å²	81	75.8 Å²	75.8	38%	0.379	41%	0.406	S	S	.	.			trans	-104.6	137.9	-173.3	-72.6	-167.2	156.8	0	0	113.9	T295 L374	T295-E368 WeakPolarHBondContact CB-OE1 3.41Å; T295-E368 HydrophobicContact CG2-CG 4.49Å; T295-E368 WeakPolarHBondContact CG2-OE1 3.49Å; T295-E368 WeakPolarHBondContact CG2-OE2 3.45Å; T295-E368 PolarHBondContact OG1-OE1 2.74Å; E368-L374 WeakPolarHBondContact OE2-CD1 3.32Å
369	S	54.4	Low	73.8	Confident	132 Å²	132	75.9 Å²	75.9	92%	0.923	40%	0.403	S	S	*	.	S	Bend	trans	-86.2	-7.7	-176.7	51.4	0	0	0	0	114.8
370	A	59.3	Low	74.1	Confident	56 Å²	56	71.1 Å²	71.1	46%	0.463	38%	0.384	S	S	.	.			trans	-114	57.1	-174.2	0	0	0	0	0	113.3	D372	A370-D372 PolarHBondContact O-N 3.25Å
371	S	64.5	Low	74.6	Confident	43 Å²	43	67 Å²	67	30%	0.301	37%	0.368	S	S	.	.	H	α-helix	trans	-65.2	-33.6	-173.4	51.6	0	0	0	0	114.9	K373 L374 V375	S371-K373 PolarHBondContact O-N 2.71Å; S371-L374 PolarHBondContact O-N 2.99Å; S371-V375 WeakPolarHBondContact O-CG2 3.41Å; S371-V375 PolarHBondContact O-N 3.3Å
372	D	72.5	Confident	74.8	Confident	122 Å²	122	68.7 Å²	68.7	65%	0.652	37%	0.374	S	S	*	.	H	α-helix	trans	-64.3	-40.8	-174.8	-64.6	-31.1	0	0	0	113.8	A370 L374 V375 E376	A370-D372 PolarHBondContact O-N 3.25Å; D372-L374 VanDerWaalsContact C-N 3.31Å; D372-L374 PolarHBondContact O-N 2.91Å; D372-V375 PolarHBondContact O-N 3.21Å; D372-E376 PolarHBondContact O-N 3.3Å; D372-E376 VanDerWaalsContact O-N 3.11Å
373	K	77.9	Confident	75.1	Confident	142 Å²	142	69.3 Å²	69.3	62%	0.617	38%	0.38	S	S	*	.	H	α-helix	trans	-68.2	-31.8	178.3	-70	-175.6	179.5	-179.4	0	112.5	S371 R377	S371-K373 PolarHBondContact O-N 2.71Å; K373-R377 WeakPolarHBondContact O-CG 3.49Å; K373-R377 PolarHBondContact O-N 3.16Å
374	L	76.4	Confident	75.1	Confident	12 Å²	12	64.9 Å²	64.9	6%	0.063	37%	0.365	C	S	.	.	H	α-helix	trans	-73.2	-38	177.7	-62.7	166.6	0	0	0	110.7	L298 V361 E368 S371 D372 R377 A378	L298-L374 HydrophobicContact CD2-CB 4.43Å; L298-L374 HydrophobicContact CD2-CD2 3.76Å; V361-L374 HydrophobicContact CG1-CB 4.16Å; V361-L374 HydrophobicContact CG1-CD1 4.37Å; E368-L374 WeakPolarHBondContact OE2-CD1 3.32Å; S371-L374 PolarHBondContact O-N 2.99Å; D372-L374 VanDerWaalsContact C-N 3.31Å; D372-L374 PolarHBondContact O-N 2.91Å; L374-R377 PolarHBondContact O-N 3.49Å; L374-A378 WeakPolarHBondContact O-CB 3.5Å; L374-A378 PolarHBondContact O-N 3.07Å
375	V	80.3	Confident	75.5	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.03	38%	0.377	C	S	.	.	H	α-helix	trans	-64.5	-42.5	175.7	173.5	0	0	0	0	111.1	K354 V357 A358 V361 S371 D372 R377 A378 L379	K354-V375 HydrophobicContact CG-CG1 3.79Å; V357-V375 HydrophobicContact CB-CG1 4.45Å; V357-V375 HydrophobicContact CG1-CG1 4.1Å; A358-V375 HydrophobicContact CB-CG2 3.84Å; V361-V375 HydrophobicContact CB-CG2 4.33Å; V361-V375 HydrophobicContact CG2-CG2 4.07Å; S371-V375 WeakPolarHBondContact O-CG2 3.41Å; S371-V375 PolarHBondContact O-N 3.3Å; D372-V375 PolarHBondContact O-N 3.21Å; V375-R377 VanDerWaalsContact C-N 3.34Å; V375-R377 PolarHBondContact O-N 2.92Å; V375-A378 PolarHBondContact O-N 3.45Å; V375-L379 HydrophobicContact CG1-CD1 4.33Å; V375-L379 WeakPolarHBondContact O-CG 3.32Å; V375-L379 PolarHBondContact O-N 3.05Å
376	E	82.6	Confident	75.5	Confident	115 Å²	115	71.3 Å²	71.3	54%	0.537	39%	0.393	S	S	.	.	H	α-helix	trans	-61.5	-41	175.2	-73.8	-175.6	171.6	0	0	112.7	D372 L379 S380	D372-E376 PolarHBondContact O-N 3.3Å; D372-E376 VanDerWaalsContact O-N 3.11Å; E376-L379 PolarHBondContact O-N 3.29Å; E376-S380 PolarHBondContact O-N 3.42Å; E376-S380 VanDerWaalsContact O-N 3.1Å
377	R	83.5	Confident	76.2	Confident	63 Å²	63	66.2 Å²	66.2	24%	0.238	36%	0.36	C	S	.	.	H	α-helix	trans	-69.8	-35.9	175.3	-72.5	170	174	162.7	-12.4	113	L298 E299 K373 L374 V375 L379 S380 I381	L298-R377 HydrophobicContact CD2-CB 4.43Å; E299-R377 VanDerWaalsContact CD-NH2 3.3Å; E299-R377 VanDerWaalsContact CG-NH1 3.34Å; E299-R377 IonicContact OE1-CZ 3.83Å; E299-R377 IonicContact OE1-NH1 3.12Å; E299-R377 PolarHBondContact OE1-NH1 3.29Å; E299-R377 IonicContact OE1-NH2 3.4Å; E299-R377 PolarHBondContact OE1-NH2 3.39Å; E299-R377 IonicContact OE2-NH2 3.8Å; K373-R377 WeakPolarHBondContact O-CG 3.49Å; K373-R377 PolarHBondContact O-N 3.16Å; L374-R377 PolarHBondContact O-N 3.49Å; V375-R377 VanDerWaalsContact C-N 3.34Å; V375-R377 PolarHBondContact O-N 2.92Å; R377-L379 VanDerWaalsContact C-N 3.28Å; R377-L379 PolarHBondContact O-N 2.91Å; R377-S380 WeakPolarHBondContact CA-OG 3.18Å; R377-S380 PolarHBondContact O-N 2.84Å; R377-S380 PolarHBondContact O-OG 3.15Å; R377-I381 WeakPolarHBondContact O-CD1 3.45Å; R377-I381 VanDerWaalsContact O-CG1 3.22Å; R377-I381 WeakPolarHBondContact O-CG1 3.33Å; R377-I381 PolarHBondContact O-N 2.86Å
378	A	82.3	Confident	77.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.1	-36.1	174.6	0	0	0	0	0	111.5	F323 V357 L374 V375 I381 Y382	F323-A378 HydrophobicContact CE1-CB 4.1Å; F323-A378 HydrophobicContact CZ-CB 3.87Å; V357-A378 HydrophobicContact CG1-CB 3.61Å; L374-A378 WeakPolarHBondContact O-CB 3.5Å; L374-A378 PolarHBondContact O-N 3.07Å; V375-A378 PolarHBondContact O-N 3.45Å; A378-I381 PolarHBondContact O-N 3.41Å; A378-Y382 PolarHBondContact O-N 3.4Å
379	L	82.8	Confident	78.7	Confident	32 Å²	32	60 Å²	60	17%	0.168	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-40.6	174.6	-73.3	170.1	0	0	0	112.5	L353 K354 V357 V375 E376 R377 I381 Y382 Q383	L353-L379 HydrophobicContact CD2-CD2 3.9Å; L353-L379 HydrophobicContact CG-CD2 4.02Å; K354-L379 HydrophobicContact CB-CD1 4.28Å; K354-L379 HydrophobicContact CD-CD1 4.39Å; K354-L379 HydrophobicContact CG-CD1 4.02Å; V357-L379 HydrophobicContact CG2-CD2 4.05Å; V375-L379 HydrophobicContact CG1-CD1 4.33Å; V375-L379 WeakPolarHBondContact O-CG 3.32Å; V375-L379 PolarHBondContact O-N 3.05Å; E376-L379 PolarHBondContact O-N 3.29Å; R377-L379 VanDerWaalsContact C-N 3.28Å; R377-L379 PolarHBondContact O-N 2.91Å; L379-I381 VanDerWaalsContact C-N 3.32Å; L379-I381 PolarHBondContact O-N 3.28Å; L379-Y382 PolarHBondContact O-N 3.5Å; L379-Q383 WeakPolarHBondContact O-CG 3.28Å; L379-Q383 PolarHBondContact O-N 3.09Å; L379-Q383 VanDerWaalsContact O-N 3.14Å
380	S	84.4	Confident	80.2	Confident	28 Å²	28	55.9 Å²	55.9	20%	0.196	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-38	174.4	61.4	0	0	0	0	111.9	D302 E376 R377 Q383 C384	D302-S380 WeakPolarHBondContact OD1-CB 3.45Å; D302-S380 PolarHBondContact OD1-OG 3.27Å; E376-S380 PolarHBondContact O-N 3.42Å; E376-S380 VanDerWaalsContact O-N 3.1Å; R377-S380 WeakPolarHBondContact CA-OG 3.18Å; R377-S380 PolarHBondContact O-N 2.84Å; R377-S380 PolarHBondContact O-OG 3.15Å; S380-Q383 PolarHBondContact O-N 3.2Å; S380-C384 PolarHBondContact O-N 2.95Å
381	I	85.4	Confident	81.4	Confident	3 Å²	3	53.3 Å²	53.3	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-42.6	174.5	-68.1	165.1	0	0	0	111.1	L298 M301 L305 R377 A378 L379 Q383 C384 I388	L298-I381 HydrophobicContact CD1-CD1 3.34Å; L298-I381 HydrophobicContact CG-CD1 4.13Å; M301-I381 HydrophobicContact CB-CD1 4.39Å; M301-I381 HydrophobicContact CE-CG2 3.98Å; M301-I381 HydrophobicContact CG-CD1 4.23Å; M301-I381 HydrophobicContact CG-CG1 4.48Å; M301-I381 HydrophobicContact SD-CD1 4.32Å; M301-I381 HydrophobicContact SD-CG2 4.45Å; L305-I381 HydrophobicContact CD1-CB 4.22Å; L305-I381 HydrophobicContact CD1-CG1 3.85Å; L305-I381 HydrophobicContact CD1-CG2 3.99Å; R377-I381 WeakPolarHBondContact O-CD1 3.45Å; R377-I381 VanDerWaalsContact O-CG1 3.22Å; R377-I381 WeakPolarHBondContact O-CG1 3.33Å; R377-I381 PolarHBondContact O-N 2.86Å; A378-I381 PolarHBondContact O-N 3.41Å; L379-I381 VanDerWaalsContact C-N 3.32Å; L379-I381 PolarHBondContact O-N 3.28Å; I381-Q383 VanDerWaalsContact C-N 3.3Å; I381-Q383 PolarHBondContact O-N 3.5Å; I381-C384 CarbonylContact O-C 3.56Å; I381-C384 PolarHBondContact O-N 2.89Å; I381-I388 HydrophobicContact CG2-CD1 3.68Å
382	Y	83.1	Confident	82.1	Confident	38 Å²	38	55.3 Å²	55.3	15%	0.149	27%	0.265	C	S	.	.	H	α-helix	trans	-62.1	-36.4	178	-177.3	-100.3	0	0	0	112.8	L327 L328 V331 L353 A378 L379 C384 R385	L327-Y382 HydrophobicContact CG-CD2 4.3Å; L328-Y382 HydrophobicContact CD2-CD2 4.41Å; V331-Y382 HydrophobicContact CB-CE2 3.63Å; V331-Y382 HydrophobicContact CG1-CE1 4.04Å; V331-Y382 HydrophobicContact CG1-CE2 3.65Å; V331-Y382 WeakPolarHBondContact CG1-OH 3.5Å; V331-Y382 HydrophobicContact CG2-CE2 4.32Å; L353-Y382 HydrophobicContact CD2-CD1 4.46Å; A378-Y382 PolarHBondContact O-N 3.4Å; L379-Y382 PolarHBondContact O-N 3.5Å; Y382-C384 PolarHBondContact O-N 3.47Å; Y382-R385 PolarHBondContact O-N 3.42Å
383	Q	83.4	Confident	81.7	Confident	156 Å²	156	50.2 Å²	50.2	73%	0.729	24%	0.241	S	C	*	.	H	α-helix	trans	-62.4	-25.9	175.3	-70.3	172.3	-0.5	0	0	112.6	L379 S380 I381	L379-Q383 WeakPolarHBondContact O-CG 3.28Å; L379-Q383 PolarHBondContact O-N 3.09Å; L379-Q383 VanDerWaalsContact O-N 3.14Å; S380-Q383 PolarHBondContact O-N 3.2Å; I381-Q383 VanDerWaalsContact C-N 3.3Å; I381-Q383 PolarHBondContact O-N 3.5Å
384	C	80.7	Confident	80.9	Confident	40 Å²	40	50.2 Å²	50.2	27%	0.27	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	29.8	179.1	-63.9	0	0	0	0	113.4	L305 S380 I381 Y382 D386 L387	L305-C384 HydrophobicContact CB-CB 4.43Å; L305-C384 HydrophobicContact CD1-CB 4.48Å; L305-C384 HydrophobicContact CD2-CB 4.25Å; S380-C384 PolarHBondContact O-N 2.95Å; I381-C384 CarbonylContact O-C 3.56Å; I381-C384 PolarHBondContact O-N 2.89Å; Y382-C384 PolarHBondContact O-N 3.47Å; C384-D386 PolarHBondContact O-N 3.36Å; C384-D386 VanDerWaalsContact O-N 3.11Å; C384-L387 PolarHBondContact O-N 3.01Å; C384-L387 VanDerWaalsContact O-N 3.14Å
385	R	82.5	Confident	80	Confident	125 Å²	125	57.4 Å²	57.4	47%	0.472	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-54.9	-31	-176.4	69	-178.6	-171.5	-173.2	0.5	114.6	L328 Y382 L387 I388	L328-R385 HydrophobicContact CD2-CB 3.53Å; Y382-R385 PolarHBondContact O-N 3.42Å; R385-L387 PolarHBondContact O-N 3.06Å; R385-I388 PolarHBondContact O-N 2.88Å; R385-I388 VanDerWaalsContact O-N 3.12Å
386	D	78.4	Confident	79.2	Confident	89 Å²	89	61.6 Å²	61.6	48%	0.476	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-71	-18.5	-175.2	-53.7	-34.4	0	0	0	112.5	C384 Q415	C384-D386 PolarHBondContact O-N 3.36Å; C384-D386 VanDerWaalsContact O-N 3.11Å; D386-Q415 PolarHBondContact OD2-NE2 2.8Å
387	L	83.4	Confident	78.2	Confident	9 Å²	9	57.7 Å²	57.7	5%	0.047	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-89.3	-4.7	175	-65.2	173.8	0	0	0	113.1	L305 P310 W311 C384 R385 A412	L305-L387 HydrophobicContact CD2-CB 3.95Å; L305-L387 HydrophobicContact CD2-CD1 4.28Å; P310-L387 WeakPolarHBondContact CA-O 3.34Å; W311-L387 PolarHBondContact N-O 3.42Å; C384-L387 PolarHBondContact O-N 3.01Å; C384-L387 VanDerWaalsContact O-N 3.14Å; R385-L387 PolarHBondContact O-N 3.06Å; L387-A412 HydrophobicContact CD2-CB 3.84Å
388	I	87.4	Confident	77.1	Confident	15 Å²	15	56.7 Å²	56.7	8%	0.077	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.7	-174.9	-54.3	169.2	0	0	0	109.2	M301 L305 W311 V313 V324 L328 I381 R385	M301-I388 HydrophobicContact CE-CD1 3.63Å; M301-I388 HydrophobicContact CE-CG1 4Å; M301-I388 HydrophobicContact CE-CG2 4.46Å; L305-I388 HydrophobicContact CD1-CD1 4.25Å; L305-I388 HydrophobicContact CD2-CG1 4.18Å; W311-I388 HydrophobicContact CB-CG1 4.42Å; W311-I388 WeakPolarHBondContact O-CA 3.44Å; V313-I388 HydrophobicContact CG2-CG2 3.74Å; V324-I388 HydrophobicContact CG1-CG2 4.3Å; L328-I388 HydrophobicContact CD1-CB 4.03Å; L328-I388 HydrophobicContact CD1-CD1 4.29Å; L328-I388 HydrophobicContact CD1-CG2 3.63Å; I381-I388 HydrophobicContact CG2-CD1 3.68Å; R385-I388 PolarHBondContact O-N 2.88Å; R385-I388 VanDerWaalsContact O-N 3.12Å
389	S	87.3	Confident	76.2	Confident	34 Å²	34	59.8 Å²	59.8	24%	0.238	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.4	173.9	-60.1	0	0	0	0	110.1	W311 L312 V313 A408	W311-S389 PolarHBondContact O-N 3.48Å; L312-S389 WeakPolarHBondContact CA-O 3.38Å; V313-S389 PolarHBondContact N-O 3Å; S389-A408 WeakPolarHBondContact OG-CA 3.48Å; S389-A408 WeakPolarHBondContact OG-CB 3.44Å
390	I	87.1	Confident	75.5	Confident	46 Å²	46	61.5 Å²	61.5	24%	0.236	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	130.4	179.1	-56.7	170.3	0	0	0	108.7	A315 A325 L328 Y392	A315-I390 HydrophobicContact CB-CG2 3.75Å; A325-I390 HydrophobicContact CB-CG2 4.45Å; L328-I390 HydrophobicContact CB-CD1 3.88Å; L328-I390 HydrophobicContact CD1-CD1 3.87Å; L328-I390 HydrophobicContact CD1-CG1 4.16Å; I390-Y392 HydrophobicContact CB-CE2 4.49Å; I390-Y392 HydrophobicContact CG2-CE1 4.06Å; I390-Y392 HydrophobicContact CG2-CE2 3.97Å
391	H	83.6	Confident	75.3	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.009	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.9	173.9	177.6	71.1	0	0	0	110.7	L312 V313 L314 A315 G393 E396 V404	L312-H391 HydrophobicContact CD1-CB 4.09Å; V313-H391 PolarHBondContact O-N 3.28Å; L314-H391 HydrophobicContact CD2-CB 4.22Å; L314-H391 VanDerWaalsContact CD2-CD2 3.49Å; L314-H391 WeakPolarHBondContact CD2-CD2 3.32Å; A315-H391 PolarHBondContact N-O 2.97Å; H391-G393 PolarHBondContact O-N 2.93Å; H391-E396 IonicContact CE1-OE2 2.83Å; H391-E396 PolarHBondContact CE1-OE2 3.27Å; H391-E396 IonicContact ND1-OE2 3.23Å; H391-E396 PolarHBondContact ND1-OE2 3.37Å; H391-V404 HydrophobicContact CB-CG1 4.27Å
392	Y	78.8	Confident	74.9	Confident	86 Å²	86	60.5 Å²	60.5	34%	0.337	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	94.5	179.5	-59.5	-83.5	0	0	0	110.1	A315 E329 I390 E394 Q395 E396	A315-Y392 HydrophobicContact CB-CD1 3.92Å; A315-Y392 HydrophobicContact CB-CE1 4.07Å; E329-Y392 WeakPolarHBondContact OE1-CE1 3.46Å; E329-Y392 PolarHBondContact OE1-OH 2.86Å; I390-Y392 HydrophobicContact CB-CE2 4.49Å; I390-Y392 HydrophobicContact CG2-CE1 4.06Å; I390-Y392 HydrophobicContact CG2-CE2 3.97Å; Y392-E394 PolarHBondContact O-N 2.83Å; Y392-E394 VanDerWaalsContact O-N 3.07Å; Y392-Q395 PolarHBondContact O-N 2.83Å; Y392-E396 PolarHBondContact O-N 2.9Å
393	G	64.4	Low	74.6	Confident	15 Å²	15	60 Å²	60	16%	0.155	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.6	-173.4	0	0	0	0	0	116.3	H391	H391-G393 PolarHBondContact O-N 2.93Å
394	E	61	Low	74.5	Confident	141 Å²	141	53.6 Å²	53.6	66%	0.659	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-12	177	-70.2	-175.2	177.3	0	0	113.9	Y392	Y392-E394 PolarHBondContact O-N 2.83Å; Y392-E394 VanDerWaalsContact O-N 3.07Å
395	Q	58.6	Low	74.7	Confident	163 Å²	163	51.8 Å²	51.8	76%	0.762	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	-32.3	-177.1	-65.7	-178.5	4.2	0	0	113	Y392	Y392-Q395 PolarHBondContact O-N 2.83Å
396	E	61.5	Low	74.5	Confident	94 Å²	94	46.2 Å²	46.2	44%	0.439	24%	0.243	S	C	.	.	S	Bend	trans	-99.4	137.4	-178.6	-68.1	-175	162.5	0	0	112	H391 Y392	H391-E396 IonicContact CE1-OE2 2.83Å; H391-E396 PolarHBondContact CE1-OE2 3.27Å; H391-E396 IonicContact ND1-OE2 3.23Å; H391-E396 PolarHBondContact ND1-OE2 3.37Å; Y392-E396 PolarHBondContact O-N 2.9Å
397	S	63.3	Low	74.4	Confident	33 Å²	33	47.2 Å²	47.2	23%	0.231	24%	0.243	C	C	.	.			trans	-67.5	138.8	-179.5	95.1	0	0	0	0	111.1	T399 D400	S397-T399 PolarHBondContact O-N 3.5Å; S397-T399 PolarHBondContact OG-OG1 3.48Å; S397-D400 PolarHBondContact O-N 3.03Å; S397-D400 PolarHBondContact OG-OD2 3.22Å
398	P	60.5	Low	74.3	Confident	41 Å²	41	46.9 Å²	46.9	27%	0.266	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-64.9	-13.7	178.9	26.2	-34.4	0	0	0	112.9	V149 D400	V149-P398 HydrophobicContact CG2-CB 4.4Å; P398-D400 VanDerWaalsContact C-N 3.31Å
399	T	61.7	Low	74	Confident	65 Å²	65	46.6 Å²	46.6	40%	0.399	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-74.7	-20.5	179.5	61.4	0	0	0	0	113.8	S397 K1201	S397-T399 PolarHBondContact O-N 3.5Å; S397-T399 PolarHBondContact OG-OG1 3.48Å; T399-K1201 PolarHBondContact OG1-NZ 2.98Å
400	D	69.9	Low	73.4	Confident	69 Å²	69	45.3 Å²	45.3	37%	0.369	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-100.7	9.7	-176	-55.9	-43.5	0	0	0	112.1	S397 P398 D402 T403 V404 K1201	S397-D400 PolarHBondContact O-N 3.03Å; S397-D400 PolarHBondContact OG-OD2 3.22Å; P398-D400 VanDerWaalsContact C-N 3.31Å; D400-D402 PolarHBondContact O-N 3.45Å; D400-D402 VanDerWaalsContact O-N 3.1Å; D400-T403 WeakPolarHBondContact O-CB 3.42Å; D400-T403 PolarHBondContact O-N 2.99Å; D400-T403 PolarHBondContact O-OG1 3.35Å; D400-V404 PolarHBondContact O-N 2.97Å; D400-K1201 IonicContact OD1-NZ 3.98Å; D400-K1201 IonicContact OD2-NZ 2.78Å; D400-K1201 PolarHBondContact OD2-NZ 2.84Å
401	F	79.1	Confident	72.6	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-56.8	-29.4	-178.2	-167.3	-101.7	0	0	0	113.5	V149 L154 M289 L312 T403 V404 L405	V149-F401 HydrophobicContact CG1-CD2 3.91Å; V149-F401 HydrophobicContact CG1-CE2 3.82Å; V149-F401 HydrophobicContact CG1-CZ 4.4Å; L154-F401 HydrophobicContact CB-CE1 4.24Å; L154-F401 HydrophobicContact CD1-CE1 4.26Å; M289-F401 HydrophobicContact CE-CE2 4.08Å; M289-F401 HydrophobicContact CE-CZ 3.62Å; M289-F401 HydrophobicContact SD-CZ 3.96Å; L312-F401 HydrophobicContact CD2-CE2 4.02Å; L312-F401 HydrophobicContact CD2-CZ 3.71Å; F401-T403 VanDerWaalsContact C-N 3.28Å; F401-T403 PolarHBondContact O-N 3.49Å; F401-V404 PolarHBondContact O-N 3.16Å; F401-L405 HydrophobicContact CE1-CD1 4.39Å; F401-L405 WeakPolarHBondContact O-CB 3.42Å; F401-L405 PolarHBondContact O-N 3.46Å
402	D	76.1	Confident	72.1	Confident	9 Å²	9	44.8 Å²	44.8	5%	0.048	24%	0.237	C	C	.	.	H	α-helix	trans	-60.3	-38.1	174.6	-60.2	-13.8	0	0	0	112	A157 R160 D400 L406 R436	A157-D402 WeakPolarHBondContact CA-OD1 3.4Å; A157-D402 WeakPolarHBondContact CB-OD1 3.36Å; R160-D402 IonicContact CZ-OD2 3.42Å; R160-D402 IonicContact NH1-OD2 2.73Å; R160-D402 PolarHBondContact NH1-OD2 3.47Å; D400-D402 PolarHBondContact O-N 3.45Å; D400-D402 VanDerWaalsContact O-N 3.1Å; D402-L406 PolarHBondContact O-N 3.02Å; D402-L406 VanDerWaalsContact O-N 3.16Å; D402-R436 IonicContact OD2-CZ 3.04Å; D402-R436 IonicContact OD2-NH1 3.33Å; D402-R436 PolarHBondContact OD2-NH1 2.91Å; D402-R436 IonicContact OD2-NH2 3.05Å
403	T	78.1	Confident	71.7	Confident	28 Å²	28	41.7 Å²	41.7	17%	0.172	23%	0.228	C	C	.	.	H	α-helix	trans	-73.9	-38.3	178.5	69.2	0	0	0	0	111.1	D400 F401 L405 L406 K407 I439	D400-T403 WeakPolarHBondContact O-CB 3.42Å; D400-T403 PolarHBondContact O-N 2.99Å; D400-T403 PolarHBondContact O-OG1 3.35Å; F401-T403 VanDerWaalsContact C-N 3.28Å; F401-T403 PolarHBondContact O-N 3.49Å; T403-L405 VanDerWaalsContact C-N 3.33Å; T403-L405 PolarHBondContact O-N 2.92Å; T403-L406 PolarHBondContact O-N 2.76Å; T403-K407 WeakPolarHBondContact O-CB 3.4Å; T403-K407 WeakPolarHBondContact O-CG 3.37Å; T403-K407 PolarHBondContact O-N 2.99Å; T403-I439 HydrophobicContact CG2-CD1 4.13Å; T403-I439 HydrophobicContact CG2-CG1 4.18Å
404	V	81.3	Confident	71.9	Confident	21 Å²	21	45.4 Å²	45.4	13%	0.127	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-43.8	175	179.3	0	0	0	0	110.4	L312 H391 D400 F401 L406 K407 A408	L312-V404 HydrophobicContact CD1-CG1 4.11Å; H391-V404 HydrophobicContact CB-CG1 4.27Å; D400-V404 PolarHBondContact O-N 2.97Å; F401-V404 PolarHBondContact O-N 3.16Å; V404-L406 VanDerWaalsContact C-N 3.34Å; V404-L406 PolarHBondContact O-N 3.12Å; V404-K407 PolarHBondContact O-N 3.35Å; V404-A408 WeakPolarHBondContact O-CB 3.49Å; V404-A408 PolarHBondContact O-N 3.26Å
405	L	84.1	Confident	72	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-44.5	176.8	-165	77	0	0	0	111.7	L129 V131 A157 L287 F401 T403 L409 W434	L129-L405 HydrophobicContact CD2-CD2 3.49Å; L129-L405 VanDerWaalsContact CD2-CD2 3.49Å; L129-L405 HydrophobicContact CD2-CG 4.29Å; V131-L405 HydrophobicContact CG2-CD1 4.43Å; A157-L405 HydrophobicContact CB-CD2 4.28Å; L287-L405 HydrophobicContact CD2-CD1 3.18Å; L287-L405 HydrophobicContact CD2-CG 4.15Å; F401-L405 HydrophobicContact CE1-CD1 4.39Å; F401-L405 WeakPolarHBondContact O-CB 3.42Å; F401-L405 PolarHBondContact O-N 3.46Å; T403-L405 VanDerWaalsContact C-N 3.33Å; T403-L405 PolarHBondContact O-N 2.92Å; L405-L409 WeakPolarHBondContact O-CG 3.37Å; L405-L409 PolarHBondContact O-N 3.4Å; L405-W434 HydrophobicContact CD2-CH2 4.01Å; L405-W434 HydrophobicContact CD2-CZ3 4.32Å; L405-W434 HydrophobicContact CG-CH2 4.18Å
406	L	78.5	Confident	72.2	Confident	8 Å²	8	41.7 Å²	41.7	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-65.8	-47.3	177.8	-165.1	138.8	0	0	0	110.7	D402 T403 V404 A408 L409 V410 A431 W434 I439	D402-L406 PolarHBondContact O-N 3.02Å; D402-L406 VanDerWaalsContact O-N 3.16Å; T403-L406 PolarHBondContact O-N 2.76Å; V404-L406 VanDerWaalsContact C-N 3.34Å; V404-L406 PolarHBondContact O-N 3.12Å; L406-A408 VanDerWaalsContact C-N 3.31Å; L406-A408 PolarHBondContact O-N 3.38Å; L406-L409 PolarHBondContact O-N 2.91Å; L406-V410 HydrophobicContact CD2-CG2 3.82Å; L406-V410 HydrophobicContact CG-CG2 4.37Å; L406-V410 VanDerWaalsContact O-CB 3.25Å; L406-V410 WeakPolarHBondContact O-CB 3.45Å; L406-V410 WeakPolarHBondContact O-CG2 3.49Å; L406-V410 PolarHBondContact O-N 3.18Å; L406-A431 HydrophobicContact CD1-CB 4.39Å; L406-W434 HydrophobicContact CB-CH2 4.32Å; L406-W434 HydrophobicContact CB-CZ3 3.76Å; L406-W434 HydrophobicContact CD1-CE3 3.79Å; L406-W434 HydrophobicContact CD1-CZ3 3.8Å; L406-W434 HydrophobicContact CG-CZ3 4.11Å; L406-I439 HydrophobicContact CD1-CD1 4.43Å; L406-I439 HydrophobicContact CD1-CG2 4.28Å; L406-I439 HydrophobicContact CD2-CG2 4.35Å
407	K	77.4	Confident	71.9	Confident	110 Å²	110	39.6 Å²	39.6	48%	0.478	21%	0.211	S	C	.	.	H	α-helix	trans	-57.2	-42.2	176.3	-77.4	175.7	-179.1	162.7	0	112.7	T403 V404 V410 G411 E443	T403-K407 WeakPolarHBondContact O-CB 3.4Å; T403-K407 WeakPolarHBondContact O-CG 3.37Å; T403-K407 PolarHBondContact O-N 2.99Å; V404-K407 PolarHBondContact O-N 3.35Å; K407-V410 PolarHBondContact O-N 3.35Å; K407-G411 PolarHBondContact O-N 2.87Å; K407-E443 WeakPolarHBondContact CE-OE1 3.46Å; K407-E443 IonicContact NZ-OE1 2.67Å; K407-E443 PolarHBondContact NZ-OE1 2.97Å
408	A	81.4	Confident	71.3	Confident	2 Å²	2	42.3 Å²	42.3	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-43.9	178.5	0	0	0	0	0	112.3	L287 L312 S389 V404 L406 A412	L287-A408 HydrophobicContact CD1-CB 4.38Å; L312-A408 HydrophobicContact CD1-CB 4.31Å; S389-A408 WeakPolarHBondContact OG-CA 3.48Å; S389-A408 WeakPolarHBondContact OG-CB 3.44Å; V404-A408 WeakPolarHBondContact O-CB 3.49Å; V404-A408 PolarHBondContact O-N 3.26Å; L406-A408 VanDerWaalsContact C-N 3.31Å; L406-A408 PolarHBondContact O-N 3.38Å; A408-A412 PolarHBondContact O-N 3.11Å
409	L	80.7	Confident	70.9	Confident	8 Å²	8	47.7 Å²	47.7	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-67.3	-40	177.4	-74	173.2	0	0	0	112.5	L129 P285 L287 P310 L405 L406 A412 S413 W434	L129-L409 HydrophobicContact CD1-CD1 3.63Å; L129-L409 HydrophobicContact CD1-CD2 4.45Å; P285-L409 HydrophobicContact CB-CD1 4.12Å; P285-L409 HydrophobicContact CB-CD2 3.86Å; P285-L409 HydrophobicContact CG-CD1 4.41Å; L287-L409 HydrophobicContact CB-CD2 3.95Å; L287-L409 HydrophobicContact CD1-CD2 4.17Å; P310-L409 HydrophobicContact CG-CD2 3.94Å; L405-L409 WeakPolarHBondContact O-CG 3.37Å; L405-L409 PolarHBondContact O-N 3.4Å; L406-L409 PolarHBondContact O-N 2.91Å; L409-A412 PolarHBondContact O-N 3.37Å; L409-S413 WeakPolarHBondContact O-CB 3.3Å; L409-S413 PolarHBondContact O-N 2.89Å; L409-W434 HydrophobicContact CD1-CH2 3.46Å; L409-W434 VanDerWaalsContact CD1-CH2 3.46Å; L409-W434 HydrophobicContact CD1-CZ2 3.4Å
410	V	74.1	Confident	70.2	Confident	8 Å²	8	53.6 Å²	53.6	5%	0.048	29%	0.285	C	S	.	.	H	α-helix	trans	-67	-44.9	178.4	156.2	0	0	0	0	111.8	L406 K407 A412 S413 K414 E427	L406-V410 HydrophobicContact CD2-CG2 3.82Å; L406-V410 HydrophobicContact CG-CG2 4.37Å; L406-V410 VanDerWaalsContact O-CB 3.25Å; L406-V410 WeakPolarHBondContact O-CB 3.45Å; L406-V410 WeakPolarHBondContact O-CG2 3.49Å; L406-V410 PolarHBondContact O-N 3.18Å; K407-V410 PolarHBondContact O-N 3.35Å; V410-A412 PolarHBondContact O-N 3.15Å; V410-S413 PolarHBondContact O-N 2.95Å; V410-S413 PolarHBondContact O-OG 2.95Å; V410-K414 WeakPolarHBondContact O-CG 3.43Å; V410-K414 PolarHBondContact O-N 3.21Å; V410-E427 HydrophobicContact CB-CG 4.04Å; V410-E427 HydrophobicContact CG1-CB 4.45Å; V410-E427 HydrophobicContact CG1-CG 3.39Å; V410-E427 WeakPolarHBondContact CG1-OE1 3.15Å; V410-E427 HydrophobicContact CG2-CB 3.79Å; V410-E427 HydrophobicContact CG2-CG 3.55Å
411	G	71.4	Confident	69.5	Low	34 Å²	34	52.9 Å²	52.9	35%	0.351	29%	0.288	S	S	.	.	H	α-helix	trans	-55.7	-42.9	175.7	0	0	0	0	0	111.1	K407	K407-G411 PolarHBondContact O-N 2.87Å
412	A	71.6	Confident	68.7	Low	3 Å²	3	54.5 Å²	54.5	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-74.7	-32.4	177.9	0	0	0	0	0	114.5	P310 L387 A408 L409 V410 K414 Q415	P310-A412 HydrophobicContact CB-CB 3.53Å; P310-A412 HydrophobicContact CG-CB 4.18Å; L387-A412 HydrophobicContact CD2-CB 3.84Å; A408-A412 PolarHBondContact O-N 3.11Å; L409-A412 PolarHBondContact O-N 3.37Å; V410-A412 PolarHBondContact O-N 3.15Å; A412-K414 VanDerWaalsContact C-N 3.33Å; A412-K414 PolarHBondContact O-N 2.88Å; A412-Q415 PolarHBondContact O-N 3.39Å
413	S	71.2	Confident	68.2	Low	21 Å²	21	56.5 Å²	56.5	15%	0.147	31%	0.313	C	S	.	.	H	α-helix	trans	-69.5	-31.2	-179.5	70.5	0	0	0	0	112.6	L409 V410 Q415 R416 T417	L409-S413 WeakPolarHBondContact O-CB 3.3Å; L409-S413 PolarHBondContact O-N 2.89Å; V410-S413 PolarHBondContact O-N 2.95Å; V410-S413 PolarHBondContact O-OG 2.95Å; S413-Q415 PolarHBondContact O-N 3.19Å; S413-Q415 VanDerWaalsContact O-N 3.1Å; S413-R416 PolarHBondContact O-N 3.24Å; S413-T417 PolarHBondContact O-N 2.57Å; S413-T417 PolarHBondContact O-OG1 3.44Å
414	K	67.6	Low	68	Low	93 Å²	93	59.5 Å²	59.5	40%	0.404	32%	0.322	S	S	.	.	H	α-helix	trans	-54.3	-27.6	175.1	-75	173.8	-178.2	169.9	0	113.7	V410 A412 P423 E427	V410-K414 WeakPolarHBondContact O-CG 3.43Å; V410-K414 PolarHBondContact O-N 3.21Å; A412-K414 VanDerWaalsContact C-N 3.33Å; A412-K414 PolarHBondContact O-N 2.88Å; K414-P423 HydrophobicContact CD-CB 4.49Å; K414-P423 HydrophobicContact CG-CB 4.03Å; K414-E427 WeakPolarHBondContact CE-OE1 3.43Å; K414-E427 IonicContact NZ-OE1 3.88Å; K414-E427 PolarHBondContact NZ-OE1 2.82Å
415	Q	63.7	Low	67.8	Low	107 Å²	107	59.5 Å²	59.5	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-90.2	-22.7	-179.3	-161.2	169.9	29.5	0	0	113.2	D386 A412 S413	D386-Q415 PolarHBondContact OD2-NE2 2.8Å; A412-Q415 PolarHBondContact O-N 3.39Å; S413-Q415 PolarHBondContact O-N 3.19Å; S413-Q415 VanDerWaalsContact O-N 3.1Å
416	R	62.5	Low	67.3	Low	118 Å²	118	61.8 Å²	61.8	45%	0.445	33%	0.332	S	S	.	.	H	α-helix	trans	-78.4	-22.9	176.6	-69.5	-173.6	-173.8	177.8	-0.8	112.9	S308 S413	S308-R416 PolarHBondContact O-NE 2.83Å; S308-R416 PolarHBondContact O-NH2 3.35Å; S413-R416 PolarHBondContact O-N 3.24Å
417	T	54.8	Low	67.3	Low	51 Å²	51	62.4 Å²	62.4	31%	0.313	34%	0.335	S	S	.	.	S	Bend	trans	-88.1	131	-176.7	8.2	0	0	0	0	111	S413	S413-T417 PolarHBondContact O-N 2.57Å; S413-T417 PolarHBondContact O-OG1 3.44Å
418	S	51.6	Low	67.5	Low	89 Å²	89	57.1 Å²	57.1	62%	0.622	31%	0.312	S	S	*	.			trans	-60.1	152.9	172.2	58.7	0	0	0	0	111.7	E420 A421	S418-E420 PolarHBondContact O-N 3.19Å; S418-A421 PolarHBondContact O-N 2.97Å
419	V	51.5	Low	67.4	Low	155 Å²	155	59.1 Å²	59.1	94%	0.939	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-11.4	-171.1	-179.9	0	0	0	0	116.6
420	E	47.3	Very low	67.3	Low	189 Å²	189	59.3 Å²	59.3	88%	0.883	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-14.6	-171.3	-69.7	-179.5	163.5	0	0	116.4	S418	S418-E420 PolarHBondContact O-N 3.19Å
421	A	55.2	Low	67.6	Low	53 Å²	53	58.9 Å²	58.9	44%	0.438	32%	0.319	S	S	.	.	S	Bend	trans	-97.5	140	178.6	0	0	0	0	0	111.7	S418	S418-A421 PolarHBondContact O-N 2.97Å
422	S	63.4	Low	68.1	Low	35 Å²	35	57.5 Å²	57.5	25%	0.245	30%	0.304	C	S	.	.			trans	-60.2	130.1	176.9	70.2	0	0	0	0	110.2	Y424 N425	S422-Y424 PolarHBondContact O-N 2.94Å; S422-N425 PolarHBondContact O-N 2.68Å; S422-N425 PolarHBondContact OG-ND2 3.31Å
423	P	65.1	Low	68.4	Low	51 Å²	51	57.8 Å²	57.8	33%	0.331	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.3	-173.2	23.4	-33.3	0	0	0	113.5	K414	K414-P423 HydrophobicContact CD-CB 4.49Å; K414-P423 HydrophobicContact CG-CB 4.03Å
424	Y	73.9	Confident	68.7	Low	91 Å²	91	57.4 Å²	57.4	36%	0.357	30%	0.301	S	S	.	.	H	α-helix	trans	-83	-15	-175.5	-50.5	-74.2	0	0	0	114.5	S422 E426 E427 L428 I449	S422-Y424 PolarHBondContact O-N 2.94Å; Y424-E426 VanDerWaalsContact C-N 3.34Å; Y424-E426 PolarHBondContact O-N 3.4Å; Y424-E427 WeakPolarHBondContact O-CB 2.94Å; Y424-E427 PolarHBondContact O-N 3.16Å; Y424-L428 PolarHBondContact O-N 2.93Å; Y424-I449 HydrophobicContact CD1-CD1 3.77Å; Y424-I449 HydrophobicContact CD2-CG2 4.32Å; Y424-I449 HydrophobicContact CE1-CD1 4.02Å; Y424-I449 HydrophobicContact CG-CD1 4.09Å
425	N	76.4	Confident	69.2	Low	22 Å²	22	57 Å²	57	12%	0.118	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-38.7	-179.1	-89.2	-24.9	0	0	0	111.9	S422 L428 K429 D455	S422-N425 PolarHBondContact O-N 2.68Å; S422-N425 PolarHBondContact OG-ND2 3.31Å; N425-L428 PolarHBondContact O-N 2.94Å; N425-K429 WeakPolarHBondContact O-CB 3.09Å; N425-K429 VanDerWaalsContact O-CG 3.23Å; N425-K429 WeakPolarHBondContact O-CG 3.32Å; N425-K429 PolarHBondContact O-N 3.02Å; N425-D455 PolarHBondContact ND2-OD1 3.3Å; N425-D455 WeakPolarHBondContact OD1-CB 3.26Å
426	E	74.4	Confident	70	Confident	50 Å²	50	53.4 Å²	53.4	23%	0.234	29%	0.285	C	S	.	.	H	α-helix	trans	-70.5	-35.4	176	-65	-55.6	130.4	0	0	111.5	Y424 L428 K429 L430	Y424-E426 VanDerWaalsContact C-N 3.34Å; Y424-E426 PolarHBondContact O-N 3.4Å; E426-L428 PolarHBondContact O-N 3.27Å; E426-K429 PolarHBondContact O-N 2.94Å; E426-K429 IonicContact OE1-NZ 3.97Å; E426-K429 PolarHBondContact OE1-NZ 2.97Å; E426-L430 WeakPolarHBondContact O-CB 3.39Å; E426-L430 VanDerWaalsContact O-CG 3.27Å; E426-L430 WeakPolarHBondContact O-CG 3.45Å; E426-L430 PolarHBondContact O-N 2.74Å
427	E	77.8	Confident	71	Confident	20 Å²	20	48.8 Å²	48.8	9%	0.093	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-45.9	173.4	-46.1	-171.7	177.5	0	0	111.1	V410 K414 Y424 L430 A431 L444	V410-E427 HydrophobicContact CB-CG 4.04Å; V410-E427 HydrophobicContact CG1-CB 4.45Å; V410-E427 HydrophobicContact CG1-CG 3.39Å; V410-E427 WeakPolarHBondContact CG1-OE1 3.15Å; V410-E427 HydrophobicContact CG2-CB 3.79Å; V410-E427 HydrophobicContact CG2-CG 3.55Å; K414-E427 WeakPolarHBondContact CE-OE1 3.43Å; K414-E427 IonicContact NZ-OE1 3.88Å; K414-E427 PolarHBondContact NZ-OE1 2.82Å; Y424-E427 WeakPolarHBondContact O-CB 2.94Å; Y424-E427 PolarHBondContact O-N 3.16Å; E427-L430 PolarHBondContact O-N 3.4Å; E427-A431 WeakPolarHBondContact O-CB 3.27Å; E427-A431 PolarHBondContact O-N 2.87Å; E427-L444 HydrophobicContact CB-CD2 4.01Å; E427-L444 WeakPolarHBondContact OE2-CD2 3.48Å
428	L	81.7	Confident	72.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-45.8	178.5	-179	62.5	0	0	0	111.7	Y424 N425 E426 L430 A431 V432 L444 F445 W451 L456 F475	Y424-L428 PolarHBondContact O-N 2.93Å; N425-L428 PolarHBondContact O-N 2.94Å; E426-L428 PolarHBondContact O-N 3.27Å; L428-L430 VanDerWaalsContact C-N 3.31Å; L428-L430 PolarHBondContact O-N 2.78Å; L428-A431 PolarHBondContact O-N 3.33Å; L428-V432 HydrophobicContact CD1-CG2 4.38Å; L428-V432 HydrophobicContact CG-CG2 4.49Å; L428-V432 WeakPolarHBondContact O-CB 3.36Å; L428-V432 VanDerWaalsContact O-CG2 3.29Å; L428-V432 WeakPolarHBondContact O-CG2 3.03Å; L428-V432 PolarHBondContact O-N 3.37Å; L428-L444 HydrophobicContact CB-CD1 4.06Å; L428-L444 HydrophobicContact CD1-CD1 3.82Å; L428-F445 HydrophobicContact CD1-CE2 4.15Å; L428-F445 HydrophobicContact CD1-CZ 4.44Å; L428-W451 HydrophobicContact CB-CH2 4.05Å; L428-W451 HydrophobicContact CD2-CH2 4.07Å; L428-W451 HydrophobicContact CD2-CZ3 3.94Å; L428-L456 HydrophobicContact CD2-CD2 3.58Å; L428-F475 HydrophobicContact CD1-CE1 3.89Å; L428-F475 HydrophobicContact CD1-CZ 3.97Å; L428-F475 HydrophobicContact CD2-CE1 4.25Å; L428-F475 HydrophobicContact CD2-CZ 4.09Å; L428-F475 HydrophobicContact CG-CZ 4.29Å
429	K	79.5	Confident	73.6	Confident	44 Å²	44	46.5 Å²	46.5	19%	0.191	25%	0.249	C	C	.	.	H	α-helix	trans	-58.8	-41.8	177.2	-80.8	179.1	-166.2	168.6	0	112	I282 N425 E426 V432 A433	I282-K429 HydrophobicContact CD1-CB 3.61Å; I282-K429 HydrophobicContact CD1-CG 4.45Å; I282-K429 WeakPolarHBondContact CD1-O 3.27Å; I282-K429 HydrophobicContact CG1-CB 4.1Å; I282-K429 HydrophobicContact CG1-CD 4.22Å; N425-K429 WeakPolarHBondContact O-CB 3.09Å; N425-K429 VanDerWaalsContact O-CG 3.23Å; N425-K429 WeakPolarHBondContact O-CG 3.32Å; N425-K429 PolarHBondContact O-N 3.02Å; E426-K429 PolarHBondContact O-N 2.94Å; E426-K429 IonicContact OE1-NZ 3.97Å; E426-K429 PolarHBondContact OE1-NZ 2.97Å; K429-V432 PolarHBondContact O-N 2.88Å; K429-A433 WeakPolarHBondContact O-CB 3.38Å; K429-A433 PolarHBondContact O-N 2.83Å
430	L	79.1	Confident	75.1	Confident	11 Å²	11	39.1 Å²	39.1	6%	0.058	20%	0.204	C	C	.	.	H	α-helix	trans	-66.7	-45.2	175.2	-72.4	171.8	0	0	0	112.1	I282 P285 E426 E427 L428 V432 A433 W434	I282-L430 HydrophobicContact CG2-CD2 4.16Å; P285-L430 HydrophobicContact CG-CD2 3.87Å; E426-L430 WeakPolarHBondContact O-CB 3.39Å; E426-L430 VanDerWaalsContact O-CG 3.27Å; E426-L430 WeakPolarHBondContact O-CG 3.45Å; E426-L430 PolarHBondContact O-N 2.74Å; E427-L430 PolarHBondContact O-N 3.4Å; L428-L430 VanDerWaalsContact C-N 3.31Å; L428-L430 PolarHBondContact O-N 2.78Å; L430-V432 VanDerWaalsContact C-N 3.29Å; L430-V432 PolarHBondContact O-N 2.81Å; L430-A433 WeakPolarHBondContact O-CB 3.43Å; L430-A433 PolarHBondContact O-N 2.76Å; L430-A433 VanDerWaalsContact O-N 3.15Å; L430-W434 PolarHBondContact O-N 2.79Å
431	A	80.8	Confident	76.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-41	176.5	0	0	0	0	0	111.8	L406 E427 L428 W434 N435 R436 A440 L444 F471	L406-A431 HydrophobicContact CD1-CB 4.39Å; E427-A431 WeakPolarHBondContact O-CB 3.27Å; E427-A431 PolarHBondContact O-N 2.87Å; L428-A431 PolarHBondContact O-N 3.33Å; A431-W434 PolarHBondContact O-N 3.07Å; A431-N435 PolarHBondContact O-N 2.94Å; A431-R436 PolarHBondContact O-N 2.67Å; A431-R436 VanDerWaalsContact O-N 3.09Å; A431-A440 HydrophobicContact CB-CB 4.3Å; A431-L444 HydrophobicContact CB-CD1 4.38Å; A431-F471 WeakPolarHBondContact O-CZ 3.31Å
432	V	81.8	Confident	78.1	Confident	5 Å²	5	36 Å²	36	3%	0.03	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-52.2	171.9	167.1	0	0	0	0	109.7	L428 K429 L430 W434 N435 V463 K468 F471 F475	L428-V432 HydrophobicContact CD1-CG2 4.38Å; L428-V432 HydrophobicContact CG-CG2 4.49Å; L428-V432 WeakPolarHBondContact O-CB 3.36Å; L428-V432 VanDerWaalsContact O-CG2 3.29Å; L428-V432 WeakPolarHBondContact O-CG2 3.03Å; L428-V432 PolarHBondContact O-N 3.37Å; K429-V432 PolarHBondContact O-N 2.88Å; L430-V432 VanDerWaalsContact C-N 3.29Å; L430-V432 PolarHBondContact O-N 2.81Å; V432-W434 VanDerWaalsContact C-N 3.27Å; V432-W434 PolarHBondContact O-N 3.44Å; V432-N435 PolarHBondContact O-N 2.89Å; V432-V463 HydrophobicContact CB-CG2 4.32Å; V432-V463 HydrophobicContact CG1-CG2 3.52Å; V432-V463 HydrophobicContact CG2-CG2 3.76Å; V432-K468 HydrophobicContact CG1-CD 4.3Å; V432-K468 WeakPolarHBondContact O-CD 3.19Å; V432-K468 WeakPolarHBondContact O-CE 3.44Å; V432-K468 PolarHBondContact O-NZ 3.44Å; V432-F471 HydrophobicContact CG2-CD1 3.83Å; V432-F471 HydrophobicContact CG2-CE1 3.82Å; V432-F471 HydrophobicContact CG2-CG 4.26Å; V432-F471 HydrophobicContact CG2-CZ 4.25Å; V432-F475 HydrophobicContact CG2-CZ 4.05Å
433	A	77.3	Confident	78.7	Confident	9 Å²	9	37.3 Å²	37.3	7%	0.074	19%	0.187	C	C	.	.	H	α-helix	trans	-53.8	-43.4	-179.5	0	0	0	0	0	111.9	I276 I282 K429 L430 N435 K468	I276-A433 HydrophobicContact CD1-CB 4.15Å; I282-A433 HydrophobicContact CD1-CB 4.23Å; K429-A433 WeakPolarHBondContact O-CB 3.38Å; K429-A433 PolarHBondContact O-N 2.83Å; L430-A433 WeakPolarHBondContact O-CB 3.43Å; L430-A433 PolarHBondContact O-N 2.76Å; L430-A433 VanDerWaalsContact O-N 3.15Å; A433-N435 VanDerWaalsContact C-N 3.27Å; A433-N435 PolarHBondContact O-N 3.38Å; A433-K468 PolarHBondContact O-NZ 3.35Å
434	W	77.1	Confident	79.3	Confident	13 Å²	13	35.2 Å²	35.2	5%	0.049	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-2	-179.6	-63	1.7	0	0	0	114.8	L129 A161 L405 L406 L409 L430 A431 V432 R436	L129-W434 HydrophobicContact CB-CZ2 4.24Å; L129-W434 HydrophobicContact CD1-CZ2 4.18Å; L129-W434 HydrophobicContact CD2-CH2 4Å; L129-W434 HydrophobicContact CD2-CZ2 3.66Å; L129-W434 HydrophobicContact CG-CZ2 4.24Å; A161-W434 HydrophobicContact CB-CD2 4.32Å; A161-W434 HydrophobicContact CB-CG 4.24Å; L405-W434 HydrophobicContact CD2-CH2 4.01Å; L405-W434 HydrophobicContact CD2-CZ3 4.32Å; L405-W434 HydrophobicContact CG-CH2 4.18Å; L406-W434 HydrophobicContact CB-CH2 4.32Å; L406-W434 HydrophobicContact CB-CZ3 3.76Å; L406-W434 HydrophobicContact CD1-CE3 3.79Å; L406-W434 HydrophobicContact CD1-CZ3 3.8Å; L406-W434 HydrophobicContact CG-CZ3 4.11Å; L409-W434 HydrophobicContact CD1-CH2 3.46Å; L409-W434 VanDerWaalsContact CD1-CH2 3.46Å; L409-W434 HydrophobicContact CD1-CZ2 3.4Å; L430-W434 PolarHBondContact O-N 2.79Å; A431-W434 PolarHBondContact O-N 3.07Å; V432-W434 VanDerWaalsContact C-N 3.27Å; V432-W434 PolarHBondContact O-N 3.44Å; W434-R436 VanDerWaalsContact C-N 3.29Å; W434-R436 HydrophobicContact CB-CG 4.17Å; W434-R436 PolarHBondContact O-N 2.97Å
435	N	78.6	Confident	79.7	Confident	84 Å²	84	32 Å²	32	45%	0.449	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	39.2	-177	-160.2	27.6	0	0	0	113.2	A431 V432 A433 K468	A431-N435 PolarHBondContact O-N 2.94Å; V432-N435 PolarHBondContact O-N 2.89Å; A433-N435 VanDerWaalsContact C-N 3.27Å; A433-N435 PolarHBondContact O-N 3.38Å; N435-K468 HydrophobicContact CB-CD 4.46Å
436	R	79.7	Confident	79.7	Confident	32 Å²	32	36 Å²	36	12%	0.121	18%	0.183	C	C	.	.			trans	-106.6	81	-178.8	-68.7	-57.7	-64.4	-95.5	0.4	112.2	D402 A431 W434 D438 I439 A440	D402-R436 IonicContact OD2-CZ 3.04Å; D402-R436 IonicContact OD2-NH1 3.33Å; D402-R436 PolarHBondContact OD2-NH1 2.91Å; D402-R436 IonicContact OD2-NH2 3.05Å; A431-R436 PolarHBondContact O-N 2.67Å; A431-R436 VanDerWaalsContact O-N 3.09Å; W434-R436 VanDerWaalsContact C-N 3.29Å; W434-R436 HydrophobicContact CB-CG 4.17Å; W434-R436 PolarHBondContact O-N 2.97Å; R436-D438 VanDerWaalsContact C-N 3.31Å; R436-D438 IonicContact CZ-OD1 3.56Å; R436-D438 IonicContact CZ-OD2 3.65Å; R436-D438 IonicContact NE-OD1 3.88Å; R436-D438 PolarHBondContact NE-OD1 3.04Å; R436-D438 IonicContact NE-OD2 3.21Å; R436-D438 PolarHBondContact NE-OD2 3.06Å; R436-D438 IonicContact NH2-OD1 2.61Å; R436-D438 IonicContact NH2-OD2 3.03Å; R436-D438 PolarHBondContact NH2-OD2 3.36Å; R436-I439 HydrophobicContact CB-CB 4.26Å; R436-I439 HydrophobicContact CB-CD1 3.89Å; R436-I439 HydrophobicContact CB-CG1 4.07Å; R436-I439 HydrophobicContact CG-CD1 4.12Å; R436-A440 PolarHBondContact O-N 3.03Å
437	V	84.3	Confident	79.4	Confident	20 Å²	20	36.7 Å²	36.7	12%	0.121	20%	0.203	C	C	.	.	H	α-helix	trans	-68.7	-33.7	179.9	-176.7	0	0	0	0	111.5	A440 K441 Q470 F471 L474	V437-A440 PolarHBondContact O-N 3.26Å; V437-K441 VanDerWaalsContact O-CB 3.22Å; V437-K441 WeakPolarHBondContact O-CB 3.37Å; V437-K441 PolarHBondContact O-N 3.24Å; V437-Q470 HydrophobicContact CB-CB 4.44Å; V437-Q470 HydrophobicContact CG1-CB 4.25Å; V437-Q470 HydrophobicContact CG2-CB 3.61Å; V437-F471 HydrophobicContact CB-CE2 4.29Å; V437-F471 HydrophobicContact CB-CZ 4.4Å; V437-F471 HydrophobicContact CG2-CD2 3.45Å; V437-F471 VanDerWaalsContact CG2-CD2 3.45Å; V437-F471 HydrophobicContact CG2-CE1 4.46Å; V437-F471 HydrophobicContact CG2-CE2 3.34Å; V437-F471 HydrophobicContact CG2-CG 4.06Å; V437-F471 HydrophobicContact CG2-CZ 3.9Å; V437-L474 HydrophobicContact CG1-CD2 4.28Å
438	D	81.2	Confident	79.3	Confident	88 Å²	88	43 Å²	43	47%	0.471	24%	0.238	S	C	.	.	H	α-helix	trans	-59.3	-48.8	176.8	56.9	-27.9	0	0	0	111.6	R436 K441 S442	R436-D438 VanDerWaalsContact C-N 3.31Å; R436-D438 IonicContact CZ-OD1 3.56Å; R436-D438 IonicContact CZ-OD2 3.65Å; R436-D438 IonicContact NE-OD1 3.88Å; R436-D438 PolarHBondContact NE-OD1 3.04Å; R436-D438 IonicContact NE-OD2 3.21Å; R436-D438 PolarHBondContact NE-OD2 3.06Å; R436-D438 IonicContact NH2-OD1 2.61Å; R436-D438 IonicContact NH2-OD2 3.03Å; R436-D438 PolarHBondContact NH2-OD2 3.36Å; D438-K441 PolarHBondContact O-N 3.04Å; D438-S442 WeakPolarHBondContact O-CB 3.15Å; D438-S442 PolarHBondContact O-N 3.28Å; D438-S442 PolarHBondContact O-OG 3.05Å
439	I	80.1	Confident	79.1	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-46.4	177.6	-56.8	178.7	0	0	0	110.4	T403 L406 R436 K441 S442 E443	T403-I439 HydrophobicContact CG2-CD1 4.13Å; T403-I439 HydrophobicContact CG2-CG1 4.18Å; L406-I439 HydrophobicContact CD1-CD1 4.43Å; L406-I439 HydrophobicContact CD1-CG2 4.28Å; L406-I439 HydrophobicContact CD2-CG2 4.35Å; R436-I439 HydrophobicContact CB-CB 4.26Å; R436-I439 HydrophobicContact CB-CD1 3.89Å; R436-I439 HydrophobicContact CB-CG1 4.07Å; R436-I439 HydrophobicContact CG-CD1 4.12Å; I439-K441 VanDerWaalsContact C-N 3.31Å; I439-K441 PolarHBondContact O-N 3.47Å; I439-S442 PolarHBondContact O-N 3.4Å; I439-S442 PolarHBondContact O-OG 3.14Å; I439-E443 HydrophobicContact CG2-CG 4.33Å; I439-E443 WeakPolarHBondContact O-CB 3.05Å; I439-E443 PolarHBondContact O-N 3.02Å
440	A	82.5	Confident	79	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.279	C	S	.	.	I	π-helix	trans	-58.9	-44.8	177.7	0	0	0	0	0	111.3	A431 R436 V437 L444 F445 F471 L474	A431-A440 HydrophobicContact CB-CB 4.3Å; R436-A440 PolarHBondContact O-N 3.03Å; V437-A440 PolarHBondContact O-N 3.26Å; A440-L444 HydrophobicContact CB-CD1 4.26Å; A440-L444 WeakPolarHBondContact O-CA 3.05Å; A440-L444 VanDerWaalsContact O-CB 3.29Å; A440-L444 WeakPolarHBondContact O-CB 2.95Å; A440-L444 PolarHBondContact O-N 3.28Å; A440-F445 WeakPolarHBondContact O-CD2 3.49Å; A440-F445 PolarHBondContact O-N 3.44Å; A440-F445 VanDerWaalsContact O-N 3.11Å; A440-F471 HydrophobicContact CB-CE1 3.64Å; A440-F471 HydrophobicContact CB-CZ 4.16Å; A440-L474 HydrophobicContact CB-CD2 4.09Å
441	K	84.2	Confident	79.1	Confident	117 Å²	117	53.3 Å²	53.3	51%	0.509	29%	0.285	S	S	.	.	I	π-helix	trans	-66	-40.9	179.4	-172.5	169.1	-176	158.6	0	112.4	V437 D438 I439 N446 L474	V437-K441 VanDerWaalsContact O-CB 3.22Å; V437-K441 WeakPolarHBondContact O-CB 3.37Å; V437-K441 PolarHBondContact O-N 3.24Å; D438-K441 PolarHBondContact O-N 3.04Å; I439-K441 VanDerWaalsContact C-N 3.31Å; I439-K441 PolarHBondContact O-N 3.47Å; K441-N446 PolarHBondContact O-OD1 2.87Å; K441-L474 HydrophobicContact CB-CD1 4.24Å; K441-L474 HydrophobicContact CD-CD1 4.34Å; K441-L474 HydrophobicContact CG-CD1 4.16Å
442	S	81.1	Confident	79.2	Confident	59 Å²	59	62.2 Å²	62.2	41%	0.413	32%	0.318	S	S	.	.	I	π-helix	trans	-86.3	-17.8	-175.7	68.1	0	0	0	0	115.3	D438 I439 N446	D438-S442 WeakPolarHBondContact O-CB 3.15Å; D438-S442 PolarHBondContact O-N 3.28Å; D438-S442 PolarHBondContact O-OG 3.05Å; I439-S442 PolarHBondContact O-N 3.4Å; I439-S442 PolarHBondContact O-OG 3.14Å; S442-N446 WeakPolarHBondContact CA-OD1 3.42Å; S442-N446 PolarHBondContact O-ND2 3.22Å; S442-N446 PolarHBondContact O-OD1 2.96Å; S442-N446 VanDerWaalsContact O-OD1 3.09Å
443	E	75.4	Confident	79.2	Confident	63 Å²	63	65.4 Å²	65.4	29%	0.294	33%	0.33	S	S	.	.	I	π-helix	trans	-119	-40.6	-177.9	-61.1	-163.3	152.4	0	0	112.2	K407 I439	K407-E443 WeakPolarHBondContact CE-OE1 3.46Å; K407-E443 IonicContact NZ-OE1 2.67Å; K407-E443 PolarHBondContact NZ-OE1 2.97Å; I439-E443 HydrophobicContact CG2-CG 4.33Å; I439-E443 WeakPolarHBondContact O-CB 3.05Å; I439-E443 PolarHBondContact O-N 3.02Å
444	L	78.3	Confident	79.3	Confident	7 Å²	7	71.1 Å²	71.1	4%	0.037	36%	0.356	C	S	.	.	I	π-helix	trans	-90.9	-29.1	-175.2	-62.9	175.1	0	0	0	113.6	E427 L428 A431 A440 I449 W451	E427-L444 HydrophobicContact CB-CD2 4.01Å; E427-L444 WeakPolarHBondContact OE2-CD2 3.48Å; L428-L444 HydrophobicContact CB-CD1 4.06Å; L428-L444 HydrophobicContact CD1-CD1 3.82Å; A431-L444 HydrophobicContact CB-CD1 4.38Å; A440-L444 HydrophobicContact CB-CD1 4.26Å; A440-L444 WeakPolarHBondContact O-CA 3.05Å; A440-L444 VanDerWaalsContact O-CB 3.29Å; A440-L444 WeakPolarHBondContact O-CB 2.95Å; A440-L444 PolarHBondContact O-N 3.28Å; L444-I449 HydrophobicContact CD2-CD1 4.29Å; L444-W451 HydrophobicContact CB-CZ2 4.05Å; L444-W451 HydrophobicContact CD2-CZ2 4.36Å; L444-W451 PolarHBondContact O-NE1 3.3Å
445	F	82.3	Confident	79.5	Confident	25 Å²	25	72.1 Å²	72.1	11%	0.11	36%	0.362	C	S	.	.	S	Bend	trans	-113.1	20.9	-175.6	-66.7	-75.7	0	0	0	113.9	L428 A440 G447 W451 L456 L474 F475 N478	L428-F445 HydrophobicContact CD1-CE2 4.15Å; L428-F445 HydrophobicContact CD1-CZ 4.44Å; A440-F445 WeakPolarHBondContact O-CD2 3.49Å; A440-F445 PolarHBondContact O-N 3.44Å; A440-F445 VanDerWaalsContact O-N 3.11Å; F445-G447 PolarHBondContact O-N 3.14Å; F445-G447 VanDerWaalsContact O-N 3.14Å; F445-W451 AromaticContact CD1-CD1 3.72Å; F445-W451 AromaticContact CD1-NE1 3.57Å; F445-W451 AromaticContact CE1-CD1 3.5Å; F445-W451 HydrophobicContact CE1-CD2 4.27Å; F445-W451 AromaticContact CE1-CE2 3.97Å; F445-W451 HydrophobicContact CE1-CG 4.01Å; F445-W451 AromaticContact CE1-NE1 3.45Å; F445-L456 HydrophobicContact CZ-CD2 4.27Å; F445-L474 HydrophobicContact CD2-CD1 4.35Å; F445-L474 HydrophobicContact CD2-CD2 3.66Å; F445-L474 HydrophobicContact CD2-CG 4.03Å; F445-L474 HydrophobicContact CE2-CD2 3.71Å; F445-L474 HydrophobicContact CE2-CG 4.11Å; F445-F475 HydrophobicContact CE2-CD1 4.37Å; F445-F475 HydrophobicContact CE2-CE1 4.06Å; F445-F475 AromaticContact CZ-CD1 3.96Å; F445-F475 HydrophobicContact CZ-CD1 3.96Å; F445-F475 AromaticContact CZ-CE1 3.86Å; F445-F475 HydrophobicContact CZ-CE1 3.86Å; F445-N478 HydrophobicContact CD1-CB 3.92Å; F445-N478 VanDerWaalsContact CD1-CG 3.45Å; F445-N478 WeakPolarHBondContact CD1-ND2 3.45Å; F445-N478 HydrophobicContact CE1-CB 3.91Å; F445-N478 WeakPolarHBondContact CG-ND2 3.24Å
446	N	77.3	Confident	79.8	Confident	105 Å²	105	68.4 Å²	68.4	56%	0.561	34%	0.342	S	S	*	.	S	Bend	trans	-71.7	2.3	176.8	-90.1	9	0	0	0	115.2	K441 S442	K441-N446 PolarHBondContact O-OD1 2.87Å; S442-N446 WeakPolarHBondContact CA-OD1 3.42Å; S442-N446 PolarHBondContact O-ND2 3.22Å; S442-N446 PolarHBondContact O-OD1 2.96Å; S442-N446 VanDerWaalsContact O-OD1 3.09Å
447	G	68.4	Low	80	Confident	64 Å²	64	69.6 Å²	69.6	66%	0.66	35%	0.348	S	S	*	.	S	Bend	trans	95.8	-11.2	177.6	0	0	0	0	0	115.2	F445 I449	F445-G447 PolarHBondContact O-N 3.14Å; F445-G447 VanDerWaalsContact O-N 3.14Å; G447-I449 VanDerWaalsContact C-N 3.31Å
448	D	74.5	Confident	79.9	Confident	154 Å²	154	71.3 Å²	71.3	82%	0.824	36%	0.357	S	S	*	.	S	Bend	trans	-74.4	-22	177.3	-62.9	-33.5	0	0	0	112.9
449	I	77.1	Confident	80	Confident	35 Å²	35	67.2 Å²	67.2	18%	0.179	34%	0.335	C	S	.	.	S	Bend	trans	-106.5	125.5	-177	-56.7	174.6	0	0	0	110.1	Y424 L444 G447 W451	Y424-I449 HydrophobicContact CD1-CD1 3.77Å; Y424-I449 HydrophobicContact CD2-CG2 4.32Å; Y424-I449 HydrophobicContact CE1-CD1 4.02Å; Y424-I449 HydrophobicContact CG-CD1 4.09Å; L444-I449 HydrophobicContact CD2-CD1 4.29Å; G447-I449 VanDerWaalsContact C-N 3.31Å; I449-W451 HydrophobicContact CD1-CZ2 4.39Å; I449-W451 HydrophobicContact CG2-CD2 4.18Å; I449-W451 HydrophobicContact CG2-CG 4.42Å; I449-W451 HydrophobicContact CG2-CZ2 3.99Å; I449-W451 PolarHBondContact O-N 3.29Å
450	Q	77.9	Confident	80.4	Confident	187 Å²	187	67 Å²	67	87%	0.874	33%	0.334	S	S	*	.			trans	-89.3	102.9	171.1	-68.2	-175.4	-1.4	0	0	110.3
451	W	81.9	Confident	80.7	Confident	49 Å²	49	67 Å²	67	19%	0.186	33%	0.334	C	S	.	.			trans	-77.6	130.9	177.8	-68.3	96.4	0	0	0	111.7	L428 L444 F445 I449 D455 L456	L428-W451 HydrophobicContact CB-CH2 4.05Å; L428-W451 HydrophobicContact CD2-CH2 4.07Å; L428-W451 HydrophobicContact CD2-CZ3 3.94Å; L444-W451 HydrophobicContact CB-CZ2 4.05Å; L444-W451 HydrophobicContact CD2-CZ2 4.36Å; L444-W451 PolarHBondContact O-NE1 3.3Å; F445-W451 AromaticContact CD1-CD1 3.72Å; F445-W451 AromaticContact CD1-NE1 3.57Å; F445-W451 AromaticContact CE1-CD1 3.5Å; F445-W451 HydrophobicContact CE1-CD2 4.27Å; F445-W451 AromaticContact CE1-CE2 3.97Å; F445-W451 HydrophobicContact CE1-CG 4.01Å; F445-W451 AromaticContact CE1-NE1 3.45Å; I449-W451 HydrophobicContact CD1-CZ2 4.39Å; I449-W451 HydrophobicContact CG2-CD2 4.18Å; I449-W451 HydrophobicContact CG2-CG 4.42Å; I449-W451 HydrophobicContact CG2-CZ2 3.99Å; I449-W451 PolarHBondContact O-N 3.29Å; W451-D455 HydrophobicContact CE3-CB 4.24Å; W451-L456 HydrophobicContact CB-CD1 4Å; W451-L456 HydrophobicContact CB-CG 4.32Å; W451-L456 HydrophobicContact CD2-CD2 4.05Å; W451-L456 HydrophobicContact CE3-CD2 3.71Å; W451-L456 HydrophobicContact CE3-CG 4.26Å; W451-L456 HydrophobicContact CG-CD2 4.44Å; W451-L456 HydrophobicContact CZ3-CD2 4.28Å
452	R	81.7	Confident	80.6	Confident	187 Å²	187	61.8 Å²	61.8	71%	0.706	31%	0.311	S	S	*	.			trans	-91	154.5	168.5	-56.1	179.9	-179.9	-179.5	2.2	109.9	E454 D455	R452-E454 PolarHBondContact O-N 3.46Å; R452-D455 WeakPolarHBondContact CB-OD2 3.4Å; R452-D455 PolarHBondContact O-N 3.19Å
453	Y	81.4	Confident	80.9	Confident	71 Å²	71	59 Å²	59	28%	0.278	29%	0.291	S	S	.	.	H	α-helix	trans	-58.5	-36.8	176.4	170.2	-97.3	0	0	0	112.7	D455 L456 K457 L480 E484 Y485	Y453-D455 VanDerWaalsContact C-N 3.28Å; Y453-D455 PolarHBondContact O-N 3.03Å; Y453-L456 PolarHBondContact O-N 3.39Å; Y453-K457 PolarHBondContact O-N 3.33Å; Y453-L480 HydrophobicContact CD2-CD1 3.99Å; Y453-L480 HydrophobicContact CE2-CD1 4.09Å; Y453-E484 HydrophobicContact CE1-CG 4.29Å; Y453-E484 HydrophobicContact CE2-CB 4.37Å; Y453-E484 HydrophobicContact CE2-CG 4.39Å; Y453-E484 PolarHBondContact OH-O 3.48Å; Y453-E484 VanDerWaalsContact OH-O 3.12Å; Y453-Y485 WeakPolarHBondContact OH-CA 3.35Å; Y453-Y485 PolarHBondContact OH-N 2.96Å
454	E	81.1	Confident	81.6	Confident	130 Å²	130	56 Å²	56	61%	0.607	28%	0.277	S	S	*	.	H	α-helix	trans	-66.6	-29.5	-178.7	-65.3	-173	168.7	0	0	113.7	R452 K457	R452-E454 PolarHBondContact O-N 3.46Å; E454-K457 WeakPolarHBondContact O-CE 3.09Å; E454-K457 WeakPolarHBondContact O-CG 3.44Å
455	D	80.6	Confident	82	Confident	34 Å²	34	56.5 Å²	56.5	18%	0.182	28%	0.28	C	S	.	.	H	α-helix	trans	-72.8	-40.9	179.5	-65	-39.6	0	0	0	111	N425 W451 R452 Y453	N425-D455 PolarHBondContact ND2-OD1 3.3Å; N425-D455 WeakPolarHBondContact OD1-CB 3.26Å; W451-D455 HydrophobicContact CE3-CB 4.24Å; R452-D455 WeakPolarHBondContact CB-OD2 3.4Å; R452-D455 PolarHBondContact O-N 3.19Å; Y453-D455 VanDerWaalsContact C-N 3.28Å; Y453-D455 PolarHBondContact O-N 3.03Å
456	L	83.9	Confident	82	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-82.3	-23.4	-176.3	-62.4	176.7	0	0	0	113.9	L428 F445 W451 Y453 D458 S459 M460 F475 L480	L428-L456 HydrophobicContact CD2-CD2 3.58Å; F445-L456 HydrophobicContact CZ-CD2 4.27Å; W451-L456 HydrophobicContact CB-CD1 4Å; W451-L456 HydrophobicContact CB-CG 4.32Å; W451-L456 HydrophobicContact CD2-CD2 4.05Å; W451-L456 HydrophobicContact CE3-CD2 3.71Å; W451-L456 HydrophobicContact CE3-CG 4.26Å; W451-L456 HydrophobicContact CG-CD2 4.44Å; W451-L456 HydrophobicContact CZ3-CD2 4.28Å; Y453-L456 PolarHBondContact O-N 3.39Å; L456-D458 VanDerWaalsContact C-N 3.32Å; L456-D458 PolarHBondContact O-N 3.04Å; L456-S459 PolarHBondContact O-N 3.33Å; L456-M460 WeakPolarHBondContact O-CB 3.47Å; L456-M460 PolarHBondContact O-N 3.39Å; L456-F475 HydrophobicContact CD2-CE1 4.47Å; L456-L480 HydrophobicContact CB-CD1 3.68Å
457	K	84.4	Confident	82.4	Confident	57 Å²	57	56 Å²	56	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-60	-39.6	-171.9	81.7	-169.7	171	-165.8	0	112.7	Y453 E454 T461 Y485 R490	Y453-K457 PolarHBondContact O-N 3.33Å; E454-K457 WeakPolarHBondContact O-CE 3.09Å; E454-K457 WeakPolarHBondContact O-CG 3.44Å; K457-T461 PolarHBondContact O-N 3.33Å; K457-T461 PolarHBondContact O-OG1 3.18Å; K457-Y485 HydrophobicContact CB-CD2 4.3Å; K457-Y485 VanDerWaalsContact O-CE2 3.26Å; K457-Y485 WeakPolarHBondContact O-CE2 3.05Å; K457-R490 PolarHBondContact O-NH2 3.17Å
458	D	82.6	Confident	83.4	Confident	57 Å²	57	53.9 Å²	53.9	31%	0.305	25%	0.251	S	S	.	.	H	α-helix	trans	-79.4	-43.3	-174.7	-65.8	-25.9	0	0	0	110.1	L456 M460 T461 D462 R490	L456-D458 VanDerWaalsContact C-N 3.32Å; L456-D458 PolarHBondContact O-N 3.04Å; D458-M460 VanDerWaalsContact C-N 3.26Å; D458-M460 PolarHBondContact O-N 2.71Å; D458-T461 WeakPolarHBondContact O-CB 3.28Å; D458-T461 PolarHBondContact O-N 3.37Å; D458-D462 PolarHBondContact O-N 2.78Å; D458-R490 IonicContact OD1-CZ 3.4Å; D458-R490 IonicContact OD1-NH1 2.66Å; D458-R490 IonicContact OD1-NH2 3.82Å; D458-R490 PolarHBondContact OD1-NH2 3.3Å
459	S	84.3	Confident	84.2	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-36	171.4	-58.7	0	0	0	0	112.6	L456 T461 D462 V463	L456-S459 PolarHBondContact O-N 3.33Å; S459-T461 VanDerWaalsContact C-N 3.3Å; S459-T461 PolarHBondContact O-N 3.17Å; S459-D462 PolarHBondContact O-N 3.28Å; S459-V463 WeakPolarHBondContact O-CB 3.4Å; S459-V463 VanDerWaalsContact O-CG2 3.26Å; S459-V463 WeakPolarHBondContact O-CG2 3.35Å; S459-V463 PolarHBondContact O-N 3.05Å
460	M	88	Confident	84.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-38.9	173.8	-177	65.6	165.6	0	0	111.9	L456 D458 D462 V463 L464 V472 F475 L480 I482 Y485	L456-M460 WeakPolarHBondContact O-CB 3.47Å; L456-M460 PolarHBondContact O-N 3.39Å; D458-M460 VanDerWaalsContact C-N 3.26Å; D458-M460 PolarHBondContact O-N 2.71Å; M460-D462 VanDerWaalsContact C-N 3.34Å; M460-V463 PolarHBondContact O-N 2.8Å; M460-L464 HydrophobicContact CE-CD2 4.39Å; M460-L464 HydrophobicContact CG-CD1 4.45Å; M460-L464 VanDerWaalsContact O-CG 3.24Å; M460-L464 WeakPolarHBondContact O-CG 3.49Å; M460-L464 PolarHBondContact O-N 3Å; M460-V472 HydrophobicContact CE-CG1 3.72Å; M460-F475 HydrophobicContact CB-CD2 4.31Å; M460-F475 HydrophobicContact SD-CB 4.36Å; M460-F475 HydrophobicContact SD-CD2 3.82Å; M460-L480 HydrophobicContact CB-CD2 4.09Å; M460-L480 HydrophobicContact CE-CD2 3.95Å; M460-L480 HydrophobicContact CG-CD2 3.68Å; M460-L480 HydrophobicContact SD-CD2 3.88Å; M460-I482 HydrophobicContact CE-CD1 4.14Å; M460-I482 HydrophobicContact CE-CG1 4.29Å; M460-Y485 HydrophobicContact CB-CE2 4.07Å; M460-Y485 HydrophobicContact CG-CD1 4.47Å; M460-Y485 HydrophobicContact CG-CE1 4Å; M460-Y485 HydrophobicContact CG-CE2 4.07Å
461	T	87.5	Confident	85.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.7	-44.8	177.2	-51.9	0	0	0	0	110.5	K457 D458 S459 V463 L464 I465 Y485 R490 L494	K457-T461 PolarHBondContact O-N 3.33Å; K457-T461 PolarHBondContact O-OG1 3.18Å; D458-T461 WeakPolarHBondContact O-CB 3.28Å; D458-T461 PolarHBondContact O-N 3.37Å; S459-T461 VanDerWaalsContact C-N 3.3Å; S459-T461 PolarHBondContact O-N 3.17Å; T461-V463 PolarHBondContact O-N 3.29Å; T461-L464 PolarHBondContact O-N 3.12Å; T461-I465 HydrophobicContact CG2-CD1 3.94Å; T461-I465 VanDerWaalsContact O-CG1 3.31Å; T461-I465 WeakPolarHBondContact O-CG1 3.07Å; T461-I465 PolarHBondContact O-N 3.13Å; T461-Y485 VanDerWaalsContact CA-OH 3.29Å; T461-Y485 WeakPolarHBondContact CA-OH 3.35Å; T461-Y485 PolarHBondContact N-OH 2.65Å; T461-Y485 PolarHBondContact OG1-OH 3Å; T461-R490 PolarHBondContact OG1-NE 3.36Å; T461-R490 PolarHBondContact OG1-NH2 3.12Å; T461-L494 HydrophobicContact CG2-CD2 4.11Å
462	D	83	Confident	85.8	Confident	7 Å²	7	39.4 Å²	39.4	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-66.2	-38.6	-179.9	-60.9	-22.7	0	0	0	111.5	G278 S279 D458 S459 M460 I465 N466	G278-D462 VanDerWaalsContact CA-OD1 3.28Å; G278-D462 WeakPolarHBondContact CA-OD1 3.2Å; S279-D462 PolarHBondContact N-OD1 3.46Å; D458-D462 PolarHBondContact O-N 2.78Å; S459-D462 PolarHBondContact O-N 3.28Å; M460-D462 VanDerWaalsContact C-N 3.34Å; D462-I465 PolarHBondContact O-N 3.4Å; D462-N466 WeakPolarHBondContact O-CB 3.32Å; D462-N466 PolarHBondContact O-N 3.13Å; D462-N466 VanDerWaalsContact O-N 3.1Å; D462-N466 PolarHBondContact O-ND2 3.36Å
463	V	87.7	Confident	86.2	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.7	-44.1	174.3	166.5	0	0	0	0	111.5	V432 S459 M460 T461 D467 K468 F471 V472 F475	V432-V463 HydrophobicContact CB-CG2 4.32Å; V432-V463 HydrophobicContact CG1-CG2 3.52Å; V432-V463 HydrophobicContact CG2-CG2 3.76Å; S459-V463 WeakPolarHBondContact O-CB 3.4Å; S459-V463 VanDerWaalsContact O-CG2 3.26Å; S459-V463 WeakPolarHBondContact O-CG2 3.35Å; S459-V463 PolarHBondContact O-N 3.05Å; M460-V463 PolarHBondContact O-N 2.8Å; T461-V463 PolarHBondContact O-N 3.29Å; V463-D467 PolarHBondContact O-N 2.98Å; V463-K468 HydrophobicContact CG1-CB 4.08Å; V463-K468 VanDerWaalsContact CG1-O 3.27Å; V463-K468 WeakPolarHBondContact CG1-O 3.34Å; V463-K468 PolarHBondContact O-N 2.69Å; V463-F471 HydrophobicContact CB-CB 4.37Å; V463-F471 HydrophobicContact CG1-CB 3.6Å; V463-F471 HydrophobicContact CG2-CB 3.73Å; V463-F471 HydrophobicContact CG2-CG 4.28Å; V463-V472 HydrophobicContact CG1-CB 4.49Å; V463-V472 HydrophobicContact CG1-CG2 3.4Å; V463-V472 VanDerWaalsContact CG1-CG2 3.4Å; V463-F475 HydrophobicContact CB-CE2 4.42Å; V463-F475 HydrophobicContact CG2-CD2 4.49Å; V463-F475 HydrophobicContact CG2-CE2 3.66Å; V463-F475 HydrophobicContact CG2-CZ 4.25Å
464	L	88.8	Confident	86.6	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.1	-51.4	176.9	-68.7	176	0	0	0	110.3	M460 T461 N466 D467 V472 Y485 L494 L610 W613 R619 M622 F626	M460-L464 HydrophobicContact CE-CD2 4.39Å; M460-L464 HydrophobicContact CG-CD1 4.45Å; M460-L464 VanDerWaalsContact O-CG 3.24Å; M460-L464 WeakPolarHBondContact O-CG 3.49Å; M460-L464 PolarHBondContact O-N 3Å; T461-L464 PolarHBondContact O-N 3.12Å; L464-N466 VanDerWaalsContact C-N 3.32Å; L464-N466 PolarHBondContact O-N 3.31Å; L464-D467 PolarHBondContact O-N 3.44Å; L464-V472 HydrophobicContact CD2-CG2 4.02Å; L464-Y485 HydrophobicContact CD1-CE1 3.91Å; L464-L494 HydrophobicContact CB-CD2 4.16Å; L464-L494 HydrophobicContact CD1-CD1 4.01Å; L464-L494 HydrophobicContact CD1-CD2 4.27Å; L464-L610 HydrophobicContact CD1-CD2 4.3Å; L464-W613 HydrophobicContact CB-CH2 4.11Å; L464-W613 WeakPolarHBondContact O-CH2 3.43Å; L464-R619 PolarHBondContact O-NH1 2.92Å; L464-M622 HydrophobicContact CD2-CE 3.36Å; L464-F626 HydrophobicContact CD2-CZ 3.68Å
465	I	87.1	Confident	87	Confident	18 Å²	18	24.7 Å²	24.7	9%	0.092	12%	0.123	C	C	.	.	H	α-helix	trans	-60.2	-43.2	-175.5	-62.9	168.9	0	0	0	111.4	W277 T461 D462 D467 L494 S497 R619	W277-I465 HydrophobicContact CB-CG2 4.24Å; W277-I465 WeakPolarHBondContact O-CD1 3.31Å; W277-I465 WeakPolarHBondContact O-CG2 3.47Å; T461-I465 HydrophobicContact CG2-CD1 3.94Å; T461-I465 VanDerWaalsContact O-CG1 3.31Å; T461-I465 WeakPolarHBondContact O-CG1 3.07Å; T461-I465 PolarHBondContact O-N 3.13Å; D462-I465 PolarHBondContact O-N 3.4Å; I465-D467 VanDerWaalsContact C-N 3.29Å; I465-D467 PolarHBondContact O-N 3.42Å; I465-L494 HydrophobicContact CG1-CD2 4.07Å; I465-S497 WeakPolarHBondContact CG1-OG 3.29Å; I465-R619 PolarHBondContact O-NH2 2.76Å
466	N	83.1	Confident	87.3	Confident	47 Å²	47	24.4 Å²	24.4	25%	0.251	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	6.3	-176.8	-64.7	-57	0	0	0	115.8	I276 D462 L464 K468	I276-N466 WeakPolarHBondContact CG2-ND2 3.3Å; I276-N466 WeakPolarHBondContact CG2-OD1 3.33Å; D462-N466 WeakPolarHBondContact O-CB 3.32Å; D462-N466 PolarHBondContact O-N 3.13Å; D462-N466 VanDerWaalsContact O-N 3.1Å; D462-N466 PolarHBondContact O-ND2 3.36Å; L464-N466 VanDerWaalsContact C-N 3.32Å; L464-N466 PolarHBondContact O-N 3.31Å; N466-K468 HydrophobicContact CB-CD 4.21Å; N466-K468 HydrophobicContact CB-CG 4.35Å
467	D	86.1	Confident	87.4	Confident	72 Å²	72	30.5 Å²	30.5	39%	0.385	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	52.6	177.3	-151.3	40.5	0	0	0	114.2	V463 L464 I465 P469 R619 M622	V463-D467 PolarHBondContact O-N 2.98Å; L464-D467 PolarHBondContact O-N 3.44Å; I465-D467 VanDerWaalsContact C-N 3.29Å; I465-D467 PolarHBondContact O-N 3.42Å; D467-P469 VanDerWaalsContact C-CD 3.47Å; D467-P469 WeakPolarHBondContact O-CD 3.36Å; D467-R619 VanDerWaalsContact CA-NH1 3.3Å; D467-R619 VanDerWaalsContact CB-NH1 3.28Å; D467-R619 WeakPolarHBondContact OD1-CD 3.46Å; D467-R619 WeakPolarHBondContact OD1-CG 3.44Å; D467-R619 IonicContact OD1-CZ 3.99Å; D467-R619 IonicContact OD1-NE 2.74Å; D467-R619 IonicContact OD1-NH1 3.44Å; D467-R619 PolarHBondContact OD1-NH1 3.24Å; D467-M622 VanDerWaalsContact OD1-CG 3.32Å; D467-M622 WeakPolarHBondContact OD1-CG 3.49Å
468	K	89.2	Confident	87.4	Confident	20 Å²	20	31.1 Å²	31.1	9%	0.087	16%	0.157	C	C	.	.			trans	-109.6	76.7	-179.3	-68.5	175.7	-179.3	169.1	0	111.7	V432 A433 N435 V463 N466 Q470 F471 V472	V432-K468 HydrophobicContact CG1-CD 4.3Å; V432-K468 WeakPolarHBondContact O-CD 3.19Å; V432-K468 WeakPolarHBondContact O-CE 3.44Å; V432-K468 PolarHBondContact O-NZ 3.44Å; A433-K468 PolarHBondContact O-NZ 3.35Å; N435-K468 HydrophobicContact CB-CD 4.46Å; V463-K468 HydrophobicContact CG1-CB 4.08Å; V463-K468 VanDerWaalsContact CG1-O 3.27Å; V463-K468 WeakPolarHBondContact CG1-O 3.34Å; V463-K468 PolarHBondContact O-N 2.69Å; N466-K468 HydrophobicContact CB-CD 4.21Å; N466-K468 HydrophobicContact CB-CG 4.35Å; K468-Q470 VanDerWaalsContact C-N 3.34Å; K468-Q470 PolarHBondContact O-N 3.21Å; K468-F471 HydrophobicContact CB-CD2 4.24Å; K468-F471 PolarHBondContact O-N 3.04Å; K468-V472 PolarHBondContact O-N 3.4Å
469	P	90.3	Very high	87	Confident	14 Å²	14	31.4 Å²	31.4	9%	0.091	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-35.5	-170.5	22.1	-32.9	0	0	0	114.5	D467 F471 V472 Q473 E621 M622	D467-P469 VanDerWaalsContact C-CD 3.47Å; D467-P469 WeakPolarHBondContact O-CD 3.36Å; P469-F471 VanDerWaalsContact C-N 3.3Å; P469-F471 PolarHBondContact O-N 3.01Å; P469-V472 WeakPolarHBondContact O-CB 3.48Å; P469-V472 PolarHBondContact O-N 2.92Å; P469-V472 VanDerWaalsContact O-N 3.13Å; P469-Q473 PolarHBondContact O-N 3.25Å; P469-Q473 VanDerWaalsContact O-N 3.09Å; P469-E621 HydrophobicContact CB-CB 4.09Å; P469-E621 HydrophobicContact CG-CB 3.86Å; P469-E621 WeakPolarHBondContact CG-OE2 3.45Å; P469-M622 WeakPolarHBondContact CA-SD 3.3Å; P469-M622 HydrophobicContact CB-CG 4.06Å; P469-M622 HydrophobicContact CB-SD 3.6Å; P469-M622 VanDerWaalsContact CB-SD 3.6Å
470	Q	89.9	Confident	87	Confident	108 Å²	108	31.9 Å²	31.9	51%	0.505	18%	0.176	S	C	.	.	H	α-helix	trans	-64.7	-33	-179.6	-65.9	179.4	1.9	0	0	112.8	V437 K468 L474	V437-Q470 HydrophobicContact CB-CB 4.44Å; V437-Q470 HydrophobicContact CG1-CB 4.25Å; V437-Q470 HydrophobicContact CG2-CB 3.61Å; K468-Q470 VanDerWaalsContact C-N 3.34Å; K468-Q470 PolarHBondContact O-N 3.21Å; Q470-L474 PolarHBondContact O-N 3.09Å; Q470-L474 VanDerWaalsContact O-N 3.09Å
471	F	90.6	Very high	86.8	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-72.5	-33.5	173.8	-86.3	-77.9	0	0	0	112.2	A431 V432 V437 A440 V463 K468 P469 Q473 L474 F475	A431-F471 WeakPolarHBondContact O-CZ 3.31Å; V432-F471 HydrophobicContact CG2-CD1 3.83Å; V432-F471 HydrophobicContact CG2-CE1 3.82Å; V432-F471 HydrophobicContact CG2-CG 4.26Å; V432-F471 HydrophobicContact CG2-CZ 4.25Å; V437-F471 HydrophobicContact CB-CE2 4.29Å; V437-F471 HydrophobicContact CB-CZ 4.4Å; V437-F471 HydrophobicContact CG2-CD2 3.45Å; V437-F471 VanDerWaalsContact CG2-CD2 3.45Å; V437-F471 HydrophobicContact CG2-CE1 4.46Å; V437-F471 HydrophobicContact CG2-CE2 3.34Å; V437-F471 HydrophobicContact CG2-CG 4.06Å; V437-F471 HydrophobicContact CG2-CZ 3.9Å; A440-F471 HydrophobicContact CB-CE1 3.64Å; A440-F471 HydrophobicContact CB-CZ 4.16Å; V463-F471 HydrophobicContact CB-CB 4.37Å; V463-F471 HydrophobicContact CG1-CB 3.6Å; V463-F471 HydrophobicContact CG2-CB 3.73Å; V463-F471 HydrophobicContact CG2-CG 4.28Å; K468-F471 HydrophobicContact CB-CD2 4.24Å; K468-F471 PolarHBondContact O-N 3.04Å; P469-F471 VanDerWaalsContact C-N 3.3Å; P469-F471 PolarHBondContact O-N 3.01Å; F471-Q473 VanDerWaalsContact C-N 3.34Å; F471-L474 HydrophobicContact CD1-CD2 4.37Å; F471-L474 PolarHBondContact O-N 3.13Å; F471-F475 HydrophobicContact CD1-CE1 4.21Å; F471-F475 HydrophobicContact CD1-CZ 4.13Å; F471-F475 VanDerWaalsContact O-CG 3.27Å; F471-F475 WeakPolarHBondContact O-CG 3.24Å; F471-F475 PolarHBondContact O-N 3.46Å
472	V	90.6	Very high	86.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-48.1	174	-178	0	0	0	0	109.5	M460 V463 L464 K468 P469 L474 F475 T476 M622 F625 F626	M460-V472 HydrophobicContact CE-CG1 3.72Å; V463-V472 HydrophobicContact CG1-CB 4.49Å; V463-V472 HydrophobicContact CG1-CG2 3.4Å; V463-V472 VanDerWaalsContact CG1-CG2 3.4Å; L464-V472 HydrophobicContact CD2-CG2 4.02Å; K468-V472 PolarHBondContact O-N 3.4Å; P469-V472 WeakPolarHBondContact O-CB 3.48Å; P469-V472 PolarHBondContact O-N 2.92Å; P469-V472 VanDerWaalsContact O-N 3.13Å; V472-L474 PolarHBondContact O-N 3.43Å; V472-F475 PolarHBondContact O-N 3.36Å; V472-T476 VanDerWaalsContact O-CG2 3.3Å; V472-T476 WeakPolarHBondContact O-CG2 3.49Å; V472-T476 PolarHBondContact O-N 3.22Å; V472-T476 PolarHBondContact O-OG1 2.79Å; V472-M622 HydrophobicContact CB-SD 4.5Å; V472-M622 HydrophobicContact CG2-CE 3.75Å; V472-M622 HydrophobicContact CG2-SD 3.82Å; V472-F625 HydrophobicContact CG1-CD1 3.97Å; V472-F625 HydrophobicContact CG1-CE1 3.63Å; V472-F626 HydrophobicContact CG1-CE1 4Å; V472-F626 HydrophobicContact CG1-CZ 4.47Å
473	Q	90	Very high	86.9	Confident	72 Å²	72	38.5 Å²	38.5	34%	0.336	21%	0.214	S	C	.	.	H	α-helix	trans	-55.9	-51.9	175.1	-70.6	178	-7.9	0	0	111	P469 F471 F475 T476 E477 F625	P469-Q473 PolarHBondContact O-N 3.25Å; P469-Q473 VanDerWaalsContact O-N 3.09Å; F471-Q473 VanDerWaalsContact C-N 3.34Å; Q473-F475 VanDerWaalsContact C-N 3.33Å; Q473-F475 PolarHBondContact O-N 3.48Å; Q473-T476 PolarHBondContact O-N 3.32Å; Q473-T476 VanDerWaalsContact O-N 3.13Å; Q473-T476 PolarHBondContact O-OG1 3.09Å; Q473-E477 WeakPolarHBondContact O-CG 3.48Å; Q473-E477 PolarHBondContact O-N 2.65Å; Q473-F625 HydrophobicContact CB-CE2 4.45Å; Q473-F625 HydrophobicContact CG-CD2 3.66Å; Q473-F625 HydrophobicContact CG-CE1 4.46Å; Q473-F625 HydrophobicContact CG-CE2 3.52Å; Q473-F625 HydrophobicContact CG-CG 4.18Å; Q473-F625 HydrophobicContact CG-CZ 3.94Å
474	L	90	Very high	86.7	Confident	6 Å²	6	42.7 Å²	42.7	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-57.4	-42.2	179.5	-173.4	66.9	0	0	0	112.7	V437 A440 K441 F445 Q470 F471 V472 E477 N478	V437-L474 HydrophobicContact CG1-CD2 4.28Å; A440-L474 HydrophobicContact CB-CD2 4.09Å; K441-L474 HydrophobicContact CB-CD1 4.24Å; K441-L474 HydrophobicContact CD-CD1 4.34Å; K441-L474 HydrophobicContact CG-CD1 4.16Å; F445-L474 HydrophobicContact CD2-CD1 4.35Å; F445-L474 HydrophobicContact CD2-CD2 3.66Å; F445-L474 HydrophobicContact CD2-CG 4.03Å; F445-L474 HydrophobicContact CE2-CD2 3.71Å; F445-L474 HydrophobicContact CE2-CG 4.11Å; Q470-L474 PolarHBondContact O-N 3.09Å; Q470-L474 VanDerWaalsContact O-N 3.09Å; F471-L474 HydrophobicContact CD1-CD2 4.37Å; F471-L474 PolarHBondContact O-N 3.13Å; V472-L474 PolarHBondContact O-N 3.43Å; L474-E477 PolarHBondContact O-N 2.79Å; L474-N478 WeakPolarHBondContact CD1-ND2 3.35Å; L474-N478 WeakPolarHBondContact O-CB 3.29Å; L474-N478 PolarHBondContact O-N 3.33Å; L474-N478 VanDerWaalsContact O-N 3.13Å; L474-N478 PolarHBondContact O-ND2 3.43Å
475	F	89.5	Confident	86.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-70.1	-35.8	178.6	-66.3	-13.1	0	0	0	112.5	L428 V432 F445 L456 M460 V463 F471 V472 Q473 N478 G479 L480	L428-F475 HydrophobicContact CD1-CE1 3.89Å; L428-F475 HydrophobicContact CD1-CZ 3.97Å; L428-F475 HydrophobicContact CD2-CE1 4.25Å; L428-F475 HydrophobicContact CD2-CZ 4.09Å; L428-F475 HydrophobicContact CG-CZ 4.29Å; V432-F475 HydrophobicContact CG2-CZ 4.05Å; F445-F475 HydrophobicContact CE2-CD1 4.37Å; F445-F475 HydrophobicContact CE2-CE1 4.06Å; F445-F475 AromaticContact CZ-CD1 3.96Å; F445-F475 HydrophobicContact CZ-CD1 3.96Å; F445-F475 AromaticContact CZ-CE1 3.86Å; F445-F475 HydrophobicContact CZ-CE1 3.86Å; L456-F475 HydrophobicContact CD2-CE1 4.47Å; M460-F475 HydrophobicContact CB-CD2 4.31Å; M460-F475 HydrophobicContact SD-CB 4.36Å; M460-F475 HydrophobicContact SD-CD2 3.82Å; V463-F475 HydrophobicContact CB-CE2 4.42Å; V463-F475 HydrophobicContact CG2-CD2 4.49Å; V463-F475 HydrophobicContact CG2-CE2 3.66Å; V463-F475 HydrophobicContact CG2-CZ 4.25Å; F471-F475 HydrophobicContact CD1-CE1 4.21Å; F471-F475 HydrophobicContact CD1-CZ 4.13Å; F471-F475 VanDerWaalsContact O-CG 3.27Å; F471-F475 WeakPolarHBondContact O-CG 3.24Å; F471-F475 PolarHBondContact O-N 3.46Å; V472-F475 PolarHBondContact O-N 3.36Å; Q473-F475 VanDerWaalsContact C-N 3.33Å; Q473-F475 PolarHBondContact O-N 3.48Å; F475-N478 PolarHBondContact O-N 3.42Å; F475-G479 PolarHBondContact O-N 3.49Å; F475-L480 HydrophobicContact CB-CB 4.43Å; F475-L480 VanDerWaalsContact O-CB 3.26Å; F475-L480 WeakPolarHBondContact O-CB 3.49Å; F475-L480 PolarHBondContact O-N 3.34Å; F475-L480 VanDerWaalsContact O-N 3.1Å
476	T	87.2	Confident	86.8	Confident	29 Å²	29	41.9 Å²	41.9	18%	0.178	23%	0.229	C	C	.	.	H	α-helix	trans	-70.5	-37.3	175	59.9	0	0	0	0	112.9	V472 Q473 N478 G479 I482 W607 F625	V472-T476 VanDerWaalsContact O-CG2 3.3Å; V472-T476 WeakPolarHBondContact O-CG2 3.49Å; V472-T476 PolarHBondContact O-N 3.22Å; V472-T476 PolarHBondContact O-OG1 2.79Å; Q473-T476 PolarHBondContact O-N 3.32Å; Q473-T476 VanDerWaalsContact O-N 3.13Å; Q473-T476 PolarHBondContact O-OG1 3.09Å; T476-N478 VanDerWaalsContact C-N 3.29Å; T476-N478 PolarHBondContact O-N 2.88Å; T476-G479 PolarHBondContact O-N 2.99Å; T476-I482 HydrophobicContact CG2-CD1 3.47Å; T476-I482 VanDerWaalsContact CG2-CD1 3.47Å; T476-I482 HydrophobicContact CG2-CG1 4.48Å; T476-W607 HydrophobicContact CG2-CH2 4.19Å; T476-F625 HydrophobicContact CG2-CE1 4.32Å; T476-F625 HydrophobicContact CG2-CZ 4.23Å; T476-F625 WeakPolarHBondContact OG1-CZ 3.26Å
477	E	85.8	Confident	87.1	Confident	133 Å²	133	41.6 Å²	41.6	62%	0.621	23%	0.229	S	C	*	.	H	α-helix	trans	-63.9	-35.7	175.1	-73.7	176.6	-179.3	0	0	111.5	Q473 L474 G479	Q473-E477 WeakPolarHBondContact O-CG 3.48Å; Q473-E477 PolarHBondContact O-N 2.65Å; L474-E477 PolarHBondContact O-N 2.79Å; E477-G479 VanDerWaalsContact C-N 3.3Å; E477-G479 PolarHBondContact O-N 2.94Å
478	N	84.2	Confident	87.1	Confident	70 Å²	70	38.4 Å²	38.4	37%	0.374	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	18.5	-179.6	-67.5	-55.9	0	0	0	114.2	F445 L474 F475 T476	F445-N478 HydrophobicContact CD1-CB 3.92Å; F445-N478 VanDerWaalsContact CD1-CG 3.45Å; F445-N478 WeakPolarHBondContact CD1-ND2 3.45Å; F445-N478 HydrophobicContact CE1-CB 3.91Å; F445-N478 WeakPolarHBondContact CG-ND2 3.24Å; L474-N478 WeakPolarHBondContact CD1-ND2 3.35Å; L474-N478 WeakPolarHBondContact O-CB 3.29Å; L474-N478 PolarHBondContact O-N 3.33Å; L474-N478 VanDerWaalsContact O-N 3.13Å; L474-N478 PolarHBondContact O-ND2 3.43Å; F475-N478 PolarHBondContact O-N 3.42Å; T476-N478 VanDerWaalsContact C-N 3.29Å; T476-N478 PolarHBondContact O-N 2.88Å
479	G	73.8	Confident	86.9	Confident	63 Å²	63	38.2 Å²	38.2	65%	0.649	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	95	11.5	165.3	0	0	0	0	0	117	F475 T476 E477 N481	F475-G479 PolarHBondContact O-N 3.49Å; T476-G479 PolarHBondContact O-N 2.99Å; E477-G479 VanDerWaalsContact C-N 3.3Å; E477-G479 PolarHBondContact O-N 2.94Å; G479-N481 PolarHBondContact O-N 2.92Å; G479-N481 VanDerWaalsContact O-N 3.14Å
480	L	84.8	Confident	86.8	Confident	10 Å²	10	39.2 Å²	39.2	5%	0.052	22%	0.218	C	C	.	.			trans	-69.5	108.2	171.5	-172.8	97.2	0	0	0	110.8	Y453 L456 M460 F475 I482	Y453-L480 HydrophobicContact CD2-CD1 3.99Å; Y453-L480 HydrophobicContact CE2-CD1 4.09Å; L456-L480 HydrophobicContact CB-CD1 3.68Å; M460-L480 HydrophobicContact CB-CD2 4.09Å; M460-L480 HydrophobicContact CE-CD2 3.95Å; M460-L480 HydrophobicContact CG-CD2 3.68Å; M460-L480 HydrophobicContact SD-CD2 3.88Å; F475-L480 HydrophobicContact CB-CB 4.43Å; F475-L480 VanDerWaalsContact O-CB 3.26Å; F475-L480 WeakPolarHBondContact O-CB 3.49Å; F475-L480 PolarHBondContact O-N 3.34Å; F475-L480 VanDerWaalsContact O-N 3.1Å; L480-I482 HydrophobicContact CD2-CG1 4.47Å; L480-I482 PolarHBondContact O-N 3.45Å
481	N	84.6	Confident	86.7	Confident	79 Å²	79	34 Å²	34	42%	0.422	19%	0.194	S	C	.	.			trans	-77.9	109	176.6	-169.7	-13.8	0	0	0	111.9	G479 T483 E484 Y485	G479-N481 PolarHBondContact O-N 2.92Å; G479-N481 VanDerWaalsContact O-N 3.14Å; N481-T483 VanDerWaalsContact CG-OG1 3.22Å; N481-T483 PolarHBondContact ND2-OG1 3.09Å; N481-T483 PolarHBondContact O-N 3.27Å; N481-T483 WeakPolarHBondContact OD1-CB 3.49Å; N481-T483 PolarHBondContact OD1-N 3.29Å; N481-T483 PolarHBondContact OD1-OG1 3.33Å; N481-E484 HydrophobicContact CB-CB 4.47Å; N481-E484 PolarHBondContact O-N 3.24Å; N481-E484 VanDerWaalsContact O-N 3.13Å; N481-Y485 PolarHBondContact O-N 3.41Å; N481-Y485 VanDerWaalsContact O-N 3.15Å
482	I	87.1	Confident	86.6	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-64.5	-25.7	-179.5	-78.2	159.6	0	0	0	113.3	M460 T476 L480 E484 Y485 L486 P606 W607 L610	M460-I482 HydrophobicContact CE-CD1 4.14Å; M460-I482 HydrophobicContact CE-CG1 4.29Å; T476-I482 HydrophobicContact CG2-CD1 3.47Å; T476-I482 VanDerWaalsContact CG2-CD1 3.47Å; T476-I482 HydrophobicContact CG2-CG1 4.48Å; L480-I482 HydrophobicContact CD2-CG1 4.47Å; L480-I482 PolarHBondContact O-N 3.45Å; I482-E484 VanDerWaalsContact C-N 3.28Å; I482-E484 PolarHBondContact O-N 3.46Å; I482-Y485 PolarHBondContact O-N 3.29Å; I482-L486 PolarHBondContact O-N 3.46Å; I482-P606 HydrophobicContact CG2-CB 4.04Å; I482-P606 HydrophobicContact CG2-CG 4.46Å; I482-W607 HydrophobicContact CB-CH2 4.43Å; I482-W607 HydrophobicContact CB-CZ2 4.04Å; I482-W607 HydrophobicContact CD1-CE3 4.17Å; I482-W607 HydrophobicContact CD1-CH2 3.02Å; I482-W607 HydrophobicContact CD1-CZ2 3.48Å; I482-W607 VanDerWaalsContact CD1-CZ2 3.48Å; I482-W607 HydrophobicContact CD1-CZ3 3.38Å; I482-W607 HydrophobicContact CG1-CH2 4.26Å; I482-W607 HydrophobicContact CG1-CZ2 4.33Å; I482-W607 HydrophobicContact CG2-CD2 4.24Å; I482-W607 HydrophobicContact CG2-CE3 4.46Å; I482-W607 HydrophobicContact CG2-CZ2 4.4Å; I482-L610 HydrophobicContact CG2-CD1 3.86Å
483	T	84.1	Confident	86.4	Confident	64 Å²	64	37.6 Å²	37.6	39%	0.393	21%	0.21	S	C	.	.	H	α-helix	trans	-68.5	-28.4	176.6	67.4	0	0	0	0	112.8	N481 P606	N481-T483 VanDerWaalsContact CG-OG1 3.22Å; N481-T483 PolarHBondContact ND2-OG1 3.09Å; N481-T483 PolarHBondContact O-N 3.27Å; N481-T483 WeakPolarHBondContact OD1-CB 3.49Å; N481-T483 PolarHBondContact OD1-N 3.29Å; N481-T483 PolarHBondContact OD1-OG1 3.33Å; T483-P606 HydrophobicContact CG2-CG 3.83Å
484	E	84.9	Confident	86.3	Confident	88 Å²	88	34.2 Å²	34.2	41%	0.411	19%	0.194	S	C	.	.	H	α-helix	trans	-86.2	-31.6	175	-171.5	161.1	-153.2	0	0	111.8	Y453 N481 I482 R602	Y453-E484 HydrophobicContact CE1-CG 4.29Å; Y453-E484 HydrophobicContact CE2-CB 4.37Å; Y453-E484 HydrophobicContact CE2-CG 4.39Å; Y453-E484 PolarHBondContact OH-O 3.48Å; Y453-E484 VanDerWaalsContact OH-O 3.12Å; N481-E484 HydrophobicContact CB-CB 4.47Å; N481-E484 PolarHBondContact O-N 3.24Å; N481-E484 VanDerWaalsContact O-N 3.13Å; I482-E484 VanDerWaalsContact C-N 3.28Å; I482-E484 PolarHBondContact O-N 3.46Å; E484-R602 IonicContact OE1-NH2 2.8Å
485	Y	87.7	Confident	86.2	Confident	2 Å²	2	34 Å²	34	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-67.1	-44.8	177.7	172.7	-105.1	0	0	0	114.5	Y453 K457 M460 T461 L464 N481 I482 T487	Y453-Y485 WeakPolarHBondContact OH-CA 3.35Å; Y453-Y485 PolarHBondContact OH-N 2.96Å; K457-Y485 HydrophobicContact CB-CD2 4.3Å; K457-Y485 VanDerWaalsContact O-CE2 3.26Å; K457-Y485 WeakPolarHBondContact O-CE2 3.05Å; M460-Y485 HydrophobicContact CB-CE2 4.07Å; M460-Y485 HydrophobicContact CG-CD1 4.47Å; M460-Y485 HydrophobicContact CG-CE1 4Å; M460-Y485 HydrophobicContact CG-CE2 4.07Å; T461-Y485 VanDerWaalsContact CA-OH 3.29Å; T461-Y485 WeakPolarHBondContact CA-OH 3.35Å; T461-Y485 PolarHBondContact N-OH 2.65Å; T461-Y485 PolarHBondContact OG1-OH 3Å; L464-Y485 HydrophobicContact CD1-CE1 3.91Å; N481-Y485 PolarHBondContact O-N 3.41Å; N481-Y485 VanDerWaalsContact O-N 3.15Å; I482-Y485 PolarHBondContact O-N 3.29Å; Y485-T487 PolarHBondContact O-N 3.26Å
486	L	89.5	Confident	86	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.			trans	-89.1	95.2	-169.5	-161.7	74.6	0	0	0	112.3	I482 L491 L494 C603 P606 L610	I482-L486 PolarHBondContact O-N 3.46Å; L486-L491 HydrophobicContact CD1-CB 4.32Å; L486-L491 HydrophobicContact CD1-CD1 4.39Å; L486-L494 HydrophobicContact CD1-CD1 4.3Å; L486-C603 HydrophobicContact CD2-CB 4.02Å; L486-C603 HydrophobicContact CG-CB 4.3Å; L486-C603 WeakPolarHBondContact O-CB 3.49Å; L486-C603 PolarHBondContact O-N 3.33Å; L486-P606 HydrophobicContact CB-CB 3.9Å; L486-P606 HydrophobicContact CD2-CB 3.66Å; L486-P606 WeakPolarHBondContact CD2-O 3.27Å; L486-P606 HydrophobicContact CG-CB 4.43Å; L486-L610 HydrophobicContact CD1-CD2 4.01Å; L486-L610 HydrophobicContact CD1-CG 4.4Å; L486-L610 HydrophobicContact CD2-CG 4.12Å
487	T	89	Confident	85.8	Confident	41 Å²	41	36.4 Å²	36.4	25%	0.252	20%	0.2	S	C	.	.	B	Isolated β-bridge	trans	-89.4	157.4	163.5	64.1	0	0	0	0	111	Y485 G489 R490 L491	Y485-T487 PolarHBondContact O-N 3.26Å; T487-G489 VanDerWaalsContact C-N 3.25Å; T487-G489 PolarHBondContact O-N 2.85Å; T487-R490 PolarHBondContact O-N 3.27Å; T487-R490 PolarHBondContact OG1-N 3.36Å; T487-L491 PolarHBondContact O-N 3.37Å
488	Y	85.4	Confident	85.7	Confident	4 Å²	4	30 Å²	30	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-33.3	176.4	-72.9	-62.6	0	0	0	112.6	L491 E492 L550 Y569 I572 Q601 R602 C603 F604	Y488-L491 PolarHBondContact O-N 2.92Å; Y488-E492 WeakPolarHBondContact O-CG 3.35Å; Y488-E492 PolarHBondContact O-N 3.45Å; Y488-L550 HydrophobicContact CD1-CD1 3.53Å; Y488-L550 HydrophobicContact CE1-CD1 4.44Å; Y488-L550 HydrophobicContact CG-CD1 3.95Å; Y488-Y569 HydrophobicContact CE1-CD1 4.2Å; Y488-Y569 HydrophobicContact CE1-CE1 4.11Å; Y488-I572 HydrophobicContact CD2-CG2 4.48Å; Y488-I572 HydrophobicContact CE1-CD1 3.9Å; Y488-I572 HydrophobicContact CE2-CD1 4.38Å; Y488-I572 HydrophobicContact CE2-CG2 4.11Å; Y488-I572 WeakPolarHBondContact OH-CD1 3.45Å; Y488-Q601 HydrophobicContact CD2-CB 4Å; Y488-Q601 WeakPolarHBondContact CD2-O 3.18Å; Y488-Q601 HydrophobicContact CE2-CB 4.28Å; Y488-Q601 PolarHBondContact N-O 3.2Å; Y488-R602 WeakPolarHBondContact CE2-O 3.43Å; Y488-C603 HydrophobicContact CE1-CB 4.23Å; Y488-F604 PolarHBondContact OH-N 2.97Å
489	G	86	Confident	85.4	Confident	17 Å²	17	29.6 Å²	29.6	18%	0.175	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-42.8	173.9	0	0	0	0	0	113.1	T487 E492 Q493 Q599	T487-G489 VanDerWaalsContact C-N 3.25Å; T487-G489 PolarHBondContact O-N 2.85Å; G489-E492 PolarHBondContact O-N 3.32Å; G489-Q493 PolarHBondContact O-N 3.46Å; G489-Q493 VanDerWaalsContact O-N 3.12Å; G489-Q599 PolarHBondContact N-O 3.15Å
490	R	87.5	Confident	85.5	Confident	34 Å²	34	31.5 Å²	31.5	13%	0.128	17%	0.167	C	C	.	.	H	α-helix	trans	-71.2	-35.5	178	-156.3	166.3	-157.5	147.6	14.1	112	K457 D458 T461 T487 E492 Q493 L494	K457-R490 PolarHBondContact O-NH2 3.17Å; D458-R490 IonicContact OD1-CZ 3.4Å; D458-R490 IonicContact OD1-NH1 2.66Å; D458-R490 IonicContact OD1-NH2 3.82Å; D458-R490 PolarHBondContact OD1-NH2 3.3Å; T461-R490 PolarHBondContact OG1-NE 3.36Å; T461-R490 PolarHBondContact OG1-NH2 3.12Å; T487-R490 PolarHBondContact O-N 3.27Å; T487-R490 PolarHBondContact OG1-N 3.36Å; R490-E492 VanDerWaalsContact C-N 3.34Å; R490-E492 PolarHBondContact O-N 3.1Å; R490-Q493 WeakPolarHBondContact O-CB 3.47Å; R490-Q493 PolarHBondContact O-N 3.45Å; R490-Q493 VanDerWaalsContact O-N 3.16Å; R490-L494 WeakPolarHBondContact O-CG 3.38Å; R490-L494 PolarHBondContact O-N 2.99Å
491	L	88.5	Confident	85.1	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-42	172.3	-176.3	62	0	0	0	111.6	L486 T487 Y488 Q493 L494 Y495 L550 Y569	L486-L491 HydrophobicContact CD1-CB 4.32Å; L486-L491 HydrophobicContact CD1-CD1 4.39Å; T487-L491 PolarHBondContact O-N 3.37Å; Y488-L491 PolarHBondContact O-N 2.92Å; L491-Q493 VanDerWaalsContact C-N 3.31Å; L491-Q493 PolarHBondContact O-N 2.93Å; L491-L494 PolarHBondContact O-N 2.96Å; L491-Y495 HydrophobicContact CD1-CD2 4.04Å; L491-Y495 HydrophobicContact CD1-CE2 3.62Å; L491-Y495 HydrophobicContact CD2-CE2 4.34Å; L491-Y495 HydrophobicContact CG-CD2 4Å; L491-Y495 HydrophobicContact CG-CE2 3.78Å; L491-Y495 VanDerWaalsContact O-CD2 3.24Å; L491-Y495 WeakPolarHBondContact O-CD2 3.42Å; L491-Y495 PolarHBondContact O-N 2.97Å; L491-L550 HydrophobicContact CD2-CD2 3.97Å; L491-L550 HydrophobicContact CG-CD2 4.43Å; L491-Y569 HydrophobicContact CD2-CE1 4.33Å
492	E	87.5	Confident	85	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-61.4	-39.5	172.8	-72.7	-171.8	161.2	0	0	112.3	Y488 G489 R490 L494 Y495 R496 T549 L550 R596 Y598 Q599	Y488-E492 WeakPolarHBondContact O-CG 3.35Å; Y488-E492 PolarHBondContact O-N 3.45Å; G489-E492 PolarHBondContact O-N 3.32Å; R490-E492 VanDerWaalsContact C-N 3.34Å; R490-E492 PolarHBondContact O-N 3.1Å; E492-L494 VanDerWaalsContact C-N 3.32Å; E492-L494 PolarHBondContact O-N 3.36Å; E492-Y495 PolarHBondContact O-N 2.86Å; E492-R496 WeakPolarHBondContact O-CG 3.45Å; E492-R496 PolarHBondContact O-N 3.44Å; E492-R496 IonicContact OE2-CZ 2.79Å; E492-R496 IonicContact OE2-NH2 3.56Å; E492-R496 PolarHBondContact OE2-NH2 3.24Å; E492-T549 WeakPolarHBondContact OE1-CA 3.47Å; E492-L550 HydrophobicContact CG-CG 3.92Å; E492-L550 PolarHBondContact OE1-N 2.73Å; E492-L550 VanDerWaalsContact OE1-N 3.11Å; E492-R596 IonicContact OE2-NH1 3.53Å; E492-Y598 PolarHBondContact OE1-OH 3.03Å; E492-Q599 PolarHBondContact OE2-NE2 3.22Å
493	Q	86.4	Confident	84.9	Confident	74 Å²	74	34.8 Å²	34.8	35%	0.346	19%	0.194	S	C	.	.	H	α-helix	trans	-60.8	-41.4	174.7	-172.1	-180	-2.3	0	0	111.7	G489 R490 L491 Y495 R496 S497	G489-Q493 PolarHBondContact O-N 3.46Å; G489-Q493 VanDerWaalsContact O-N 3.12Å; R490-Q493 WeakPolarHBondContact O-CB 3.47Å; R490-Q493 PolarHBondContact O-N 3.45Å; R490-Q493 VanDerWaalsContact O-N 3.16Å; L491-Q493 VanDerWaalsContact C-N 3.31Å; L491-Q493 PolarHBondContact O-N 2.93Å; Q493-Y495 VanDerWaalsContact C-N 3.34Å; Q493-Y495 PolarHBondContact O-N 3.29Å; Q493-R496 PolarHBondContact O-N 3.37Å; Q493-S497 PolarHBondContact O-N 2.76Å
494	L	88.6	Confident	85.1	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66	-31.6	175.5	-70.2	174.1	0	0	0	113.4	T461 L464 I465 L486 R490 L491 E492 S497 L610 W613	T461-L494 HydrophobicContact CG2-CD2 4.11Å; L464-L494 HydrophobicContact CB-CD2 4.16Å; L464-L494 HydrophobicContact CD1-CD1 4.01Å; L464-L494 HydrophobicContact CD1-CD2 4.27Å; I465-L494 HydrophobicContact CG1-CD2 4.07Å; L486-L494 HydrophobicContact CD1-CD1 4.3Å; R490-L494 WeakPolarHBondContact O-CG 3.38Å; R490-L494 PolarHBondContact O-N 2.99Å; L491-L494 PolarHBondContact O-N 2.96Å; E492-L494 VanDerWaalsContact C-N 3.32Å; E492-L494 PolarHBondContact O-N 3.36Å; L494-S497 WeakPolarHBondContact CA-OG 3.47Å; L494-S497 PolarHBondContact O-OG 2.97Å; L494-L610 HydrophobicContact CD1-CD2 4.05Å; L494-W613 PolarHBondContact O-NE1 3.42Å
495	Y	87.8	Confident	85.2	Confident	1 Å²	1	30.5 Å²	30.5	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-79	-28.7	173.3	-80.5	-71.1	0	0	0	112.7	L491 E492 Q493 S497 V498 L504 I553 W613 L616	L491-Y495 HydrophobicContact CD1-CD2 4.04Å; L491-Y495 HydrophobicContact CD1-CE2 3.62Å; L491-Y495 HydrophobicContact CD2-CE2 4.34Å; L491-Y495 HydrophobicContact CG-CD2 4Å; L491-Y495 HydrophobicContact CG-CE2 3.78Å; L491-Y495 VanDerWaalsContact O-CD2 3.24Å; L491-Y495 WeakPolarHBondContact O-CD2 3.42Å; L491-Y495 PolarHBondContact O-N 2.97Å; E492-Y495 PolarHBondContact O-N 2.86Å; Q493-Y495 VanDerWaalsContact C-N 3.34Å; Q493-Y495 PolarHBondContact O-N 3.29Å; Y495-S497 VanDerWaalsContact C-N 3.28Å; Y495-V498 WeakPolarHBondContact O-CG2 3.47Å; Y495-L504 HydrophobicContact CD1-CD2 4.46Å; Y495-I553 HydrophobicContact CD1-CD1 4.08Å; Y495-I553 HydrophobicContact CD1-CG1 4.18Å; Y495-I553 HydrophobicContact CD2-CD1 3.23Å; Y495-I553 HydrophobicContact CD2-CG1 4.15Å; Y495-I553 HydrophobicContact CE1-CG1 4.47Å; Y495-I553 HydrophobicContact CE1-CG2 4.26Å; Y495-I553 HydrophobicContact CE2-CD1 3.74Å; Y495-I553 HydrophobicContact CE2-CG1 4.4Å; Y495-I553 HydrophobicContact CE2-CG2 4.12Å; Y495-I553 HydrophobicContact CG-CD1 3.41Å; Y495-I553 VanDerWaalsContact CG-CD1 3.41Å; Y495-I553 HydrophobicContact CG-CG1 4.01Å; Y495-W613 AromaticContact CD1-CD1 3.81Å; Y495-W613 HydrophobicContact CE1-CB 4.2Å; Y495-W613 AromaticContact CE1-CD1 3.74Å; Y495-W613 HydrophobicContact CE1-CG 4.36Å; Y495-W613 HydrophobicContact CE2-CB 4.48Å; Y495-L616 HydrophobicContact CE1-CD1 4.08Å
496	R	85.4	Confident	85.1	Confident	69 Å²	69	35.9 Å²	35.9	26%	0.26	19%	0.193	S	C	.	.	H	α-helix	trans	-70	-28.4	170.6	-72.4	176.3	-164.2	130.2	13.5	111.8	W277 E492 Q493 V498 I548 R596	W277-R496 WeakPolarHBondContact CH2-O 3.48Å; W277-R496 WeakPolarHBondContact CZ3-O 3.43Å; E492-R496 WeakPolarHBondContact O-CG 3.45Å; E492-R496 PolarHBondContact O-N 3.44Å; E492-R496 IonicContact OE2-CZ 2.79Å; E492-R496 IonicContact OE2-NH2 3.56Å; E492-R496 PolarHBondContact OE2-NH2 3.24Å; Q493-R496 PolarHBondContact O-N 3.37Å; R496-V498 PolarHBondContact O-N 3.06Å; R496-I548 HydrophobicContact CG-CB 4.34Å; R496-I548 PolarHBondContact NE-O 2.93Å; R496-I548 PolarHBondContact NH2-O 3.37Å; R496-R596 VanDerWaalsContact NH2-NH1 3.2Å
497	S	83	Confident	84.9	Confident	11 Å²	11	36.8 Å²	36.8	8%	0.077	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	4.9	-179	69.7	0	0	0	0	114.7	I465 Q493 L494 Y495	I465-S497 WeakPolarHBondContact CG1-OG 3.29Å; Q493-S497 PolarHBondContact O-N 2.76Å; L494-S497 WeakPolarHBondContact CA-OG 3.47Å; L494-S497 PolarHBondContact O-OG 2.97Å; Y495-S497 VanDerWaalsContact C-N 3.28Å
498	V	83.4	Confident	84.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	-75.2	132.8	-177.9	174.1	0	0	0	0	109.7	Y495 R496 T502 L504 Q617	Y495-V498 WeakPolarHBondContact O-CG2 3.47Å; R496-V498 PolarHBondContact O-N 3.06Å; V498-T502 WeakPolarHBondContact CG1-OG1 3.47Å; V498-L504 HydrophobicContact CG1-CB 4.48Å; V498-L504 HydrophobicContact CG1-CD2 4.18Å; V498-L504 HydrophobicContact CG2-CD2 4.11Å; V498-Q617 HydrophobicContact CG1-CG 4.49Å; V498-Q617 HydrophobicContact CG2-CG 4.42Å
499	P	78.3	Confident	84.8	Confident	60 Å²	60	38.5 Å²	38.5	39%	0.39	20%	0.203	S	C	.	.			trans	-68	142.4	-176.8	25.4	-33.4	0	0	0	112.9	S501 T502	P499-S501 PolarHBondContact O-N 3.3Å; P499-T502 HydrophobicContact CG-CG2 3.92Å; P499-T502 PolarHBondContact O-N 3.5Å; P499-T502 VanDerWaalsContact O-N 3.07Å; P499-T502 PolarHBondContact O-OG1 3.29Å
500	D	75.6	Confident	84.7	Confident	104 Å²	104	46.8 Å²	46.8	56%	0.556	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.7	-175.9	-68.4	-15.9	0	0	0	114.2	T502 Y505	D500-T502 VanDerWaalsContact C-N 3.29Å; D500-T502 PolarHBondContact O-N 3.16Å; D500-Y505 HydrophobicContact CB-CD1 4.12Å; D500-Y505 HydrophobicContact CB-CE1 4.01Å; D500-Y505 WeakPolarHBondContact OD1-CE1 3.31Å; D500-Y505 PolarHBondContact OD1-OH 3Å; D500-Y505 VanDerWaalsContact OD1-OH 3.11Å
501	S	76.5	Confident	84.4	Confident	103 Å²	103	47.9 Å²	47.9	72%	0.72	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-16.9	179.9	55.5	0	0	0	0	114	P499	P499-S501 PolarHBondContact O-N 3.3Å
502	T	82.9	Confident	84.1	Confident	35 Å²	35	48.4 Å²	48.4	22%	0.215	24%	0.236	C	C	.	.	S	Bend	trans	-82.4	147.1	-175.4	51.9	0	0	0	0	113.3	V498 P499 D500 L504 Y505 Q506	V498-T502 WeakPolarHBondContact CG1-OG1 3.47Å; P499-T502 HydrophobicContact CG-CG2 3.92Å; P499-T502 PolarHBondContact O-N 3.5Å; P499-T502 VanDerWaalsContact O-N 3.07Å; P499-T502 PolarHBondContact O-OG1 3.29Å; D500-T502 VanDerWaalsContact C-N 3.29Å; D500-T502 PolarHBondContact O-N 3.16Å; T502-L504 PolarHBondContact O-N 3.46Å; T502-Y505 PolarHBondContact O-N 2.92Å; T502-Y505 VanDerWaalsContact O-N 3.15Å; T502-Q506 PolarHBondContact O-N 2.9Å
503	L	85.6	Confident	83.9	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.12	26%	0.26	C	S	.	.	H	α-helix	trans	-55.5	-37.4	174.1	-179.7	69.3	0	0	0	112.4	Y505 Q506 L507 L647 L650 E651	L503-Y505 VanDerWaalsContact C-N 3.34Å; L503-Y505 PolarHBondContact O-N 3.05Å; L503-Q506 PolarHBondContact O-N 3.23Å; L503-L507 HydrophobicContact CG-CD1 4.2Å; L503-L507 HydrophobicContact CG-CG 4.37Å; L503-L507 WeakPolarHBondContact O-CG 3.23Å; L503-L507 PolarHBondContact O-N 3.37Å; L503-L647 HydrophobicContact CD2-CD2 4.14Å; L503-L650 HydrophobicContact CD2-CB 4.07Å; L503-E651 VanDerWaalsContact CB-OE2 3.3Å; L503-E651 WeakPolarHBondContact CB-OE2 3.49Å; L503-E651 HydrophobicContact CD2-CB 4.37Å; L503-E651 WeakPolarHBondContact CD2-OE2 3.39Å
504	L	87.1	Confident	83.5	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-57.6	-46.8	178.1	177.3	61.2	0	0	0	111.5	Y495 V498 T502 Q506 L507 L508 V556 L616 Q617	Y495-L504 HydrophobicContact CD1-CD2 4.46Å; V498-L504 HydrophobicContact CG1-CB 4.48Å; V498-L504 HydrophobicContact CG1-CD2 4.18Å; V498-L504 HydrophobicContact CG2-CD2 4.11Å; T502-L504 PolarHBondContact O-N 3.46Å; L504-Q506 VanDerWaalsContact C-N 3.35Å; L504-Q506 PolarHBondContact O-N 3.45Å; L504-L507 PolarHBondContact O-N 3.1Å; L504-L508 HydrophobicContact CD1-CD1 4.03Å; L504-L508 HydrophobicContact CD1-CG 4.15Å; L504-L508 HydrophobicContact CG-CD1 3.9Å; L504-L508 HydrophobicContact CG-CG 4.44Å; L504-L508 WeakPolarHBondContact O-CB 3.46Å; L504-L508 WeakPolarHBondContact O-CG 3.22Å; L504-L508 PolarHBondContact O-N 2.92Å; L504-V556 HydrophobicContact CD1-CG1 4.43Å; L504-L616 HydrophobicContact CD1-CB 4.07Å; L504-L616 HydrophobicContact CD1-CD1 3.97Å; L504-L616 HydrophobicContact CD1-CD2 4.44Å; L504-L616 HydrophobicContact CD1-CG 4.39Å; L504-L616 HydrophobicContact CD2-CB 3.75Å; L504-L616 HydrophobicContact CD2-CD1 4.43Å; L504-L616 HydrophobicContact CG-CB 4.41Å; L504-Q617 HydrophobicContact CD2-CG 4.06Å
505	Y	86.8	Confident	82.8	Confident	57 Å²	57	53 Å²	53	22%	0.224	27%	0.267	C	S	.	.	H	α-helix	trans	-62.3	-43.4	178.7	-177.5	-101.9	0	0	0	111.4	D500 T502 L503 L507 L508 Q509 I548	D500-Y505 HydrophobicContact CB-CD1 4.12Å; D500-Y505 HydrophobicContact CB-CE1 4.01Å; D500-Y505 WeakPolarHBondContact OD1-CE1 3.31Å; D500-Y505 PolarHBondContact OD1-OH 3Å; D500-Y505 VanDerWaalsContact OD1-OH 3.11Å; T502-Y505 PolarHBondContact O-N 2.92Å; T502-Y505 VanDerWaalsContact O-N 3.15Å; L503-Y505 VanDerWaalsContact C-N 3.34Å; L503-Y505 PolarHBondContact O-N 3.05Å; Y505-L507 VanDerWaalsContact C-N 3.33Å; Y505-L507 PolarHBondContact O-N 2.84Å; Y505-L508 PolarHBondContact O-N 3.04Å; Y505-Q509 VanDerWaalsContact O-CB 3.3Å; Y505-Q509 WeakPolarHBondContact O-CB 3.49Å; Y505-Q509 PolarHBondContact O-N 3.39Å; Y505-I548 HydrophobicContact CD2-CD1 4.41Å; Y505-I548 HydrophobicContact CE2-CD1 4.23Å
506	Q	85.9	Confident	82.1	Confident	115 Å²	115	55.2 Å²	55.2	54%	0.537	28%	0.281	S	S	.	.	H	α-helix	trans	-60.3	-40.5	175.9	-62	-179.9	2.7	0	0	112.5	T502 L503 L504 R510	T502-Q506 PolarHBondContact O-N 2.9Å; L503-Q506 PolarHBondContact O-N 3.23Å; L504-Q506 VanDerWaalsContact C-N 3.35Å; L504-Q506 PolarHBondContact O-N 3.45Å; Q506-R510 WeakPolarHBondContact O-CB 3.45Å; Q506-R510 PolarHBondContact O-N 3.04Å
507	L	85.9	Confident	81.2	Confident	20 Å²	20	54.3 Å²	54.3	11%	0.105	29%	0.293	C	S	.	.	H	α-helix	trans	-67.9	-42.9	176.8	-69.7	177.9	0	0	0	112.2	L503 L504 Y505 R510 R511 V556 L647 L650	L503-L507 HydrophobicContact CG-CD1 4.2Å; L503-L507 HydrophobicContact CG-CG 4.37Å; L503-L507 WeakPolarHBondContact O-CG 3.23Å; L503-L507 PolarHBondContact O-N 3.37Å; L504-L507 PolarHBondContact O-N 3.1Å; Y505-L507 VanDerWaalsContact C-N 3.33Å; Y505-L507 PolarHBondContact O-N 2.84Å; L507-R510 PolarHBondContact O-N 3Å; L507-R511 WeakPolarHBondContact O-CG 3.27Å; L507-R511 PolarHBondContact O-N 2.87Å; L507-R511 VanDerWaalsContact O-N 3.12Å; L507-V556 HydrophobicContact CB-CG2 4.26Å; L507-V556 HydrophobicContact CD1-CG1 4.45Å; L507-L647 HydrophobicContact CD1-CD2 4.26Å; L507-L650 HydrophobicContact CD1-CD1 4.22Å
508	L	86.6	Confident	80.1	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-63.1	-46.3	175.9	-72.3	170.3	0	0	0	110.8	L504 Y505 R510 R511 L512 I548 E552 I553 V556	L504-L508 HydrophobicContact CD1-CD1 4.03Å; L504-L508 HydrophobicContact CD1-CG 4.15Å; L504-L508 HydrophobicContact CG-CD1 3.9Å; L504-L508 HydrophobicContact CG-CG 4.44Å; L504-L508 WeakPolarHBondContact O-CB 3.46Å; L504-L508 WeakPolarHBondContact O-CG 3.22Å; L504-L508 PolarHBondContact O-N 2.92Å; Y505-L508 PolarHBondContact O-N 3.04Å; L508-R510 VanDerWaalsContact C-N 3.35Å; L508-R510 PolarHBondContact O-N 2.69Å; L508-R511 WeakPolarHBondContact O-CB 3.37Å; L508-R511 PolarHBondContact O-N 3.04Å; L508-R511 VanDerWaalsContact O-N 3.09Å; L508-L512 WeakPolarHBondContact O-CB 3.46Å; L508-L512 PolarHBondContact O-N 2.81Å; L508-I548 HydrophobicContact CB-CD1 4.3Å; L508-I548 HydrophobicContact CD1-CD1 4.45Å; L508-I548 HydrophobicContact CD1-CG2 4.35Å; L508-I548 HydrophobicContact CD2-CG2 4.3Å; L508-E552 HydrophobicContact CD2-CB 4.03Å; L508-I553 HydrophobicContact CD2-CG1 3.85Å; L508-V556 HydrophobicContact CD2-CG2 3.88Å; L508-V556 HydrophobicContact CG-CG2 4.42Å
509	Q	85.3	Confident	78.6	Confident	79 Å²	79	59.2 Å²	59.2	37%	0.369	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-42.1	178.3	-170.1	67	-11.4	0	0	111.7	Y505 R511 L512 V513	Y505-Q509 VanDerWaalsContact O-CB 3.3Å; Y505-Q509 WeakPolarHBondContact O-CB 3.49Å; Y505-Q509 PolarHBondContact O-N 3.39Å; Q509-R511 VanDerWaalsContact C-N 3.29Å; Q509-R511 PolarHBondContact O-N 3.15Å; Q509-L512 WeakPolarHBondContact O-CB 3.43Å; Q509-L512 PolarHBondContact O-N 2.85Å; Q509-V513 WeakPolarHBondContact O-CG2 3.42Å; Q509-V513 PolarHBondContact O-N 2.9Å
510	R	84.6	Confident	77.2	Confident	192 Å²	192	60.5 Å²	60.5	73%	0.725	34%	0.343	S	S	*	.	H	α-helix	trans	-60.3	-38.1	174.7	-173.8	178.7	-178.8	-177.4	3.2	112.1	Q506 L507 L508 V514	Q506-R510 WeakPolarHBondContact O-CB 3.45Å; Q506-R510 PolarHBondContact O-N 3.04Å; L507-R510 PolarHBondContact O-N 3Å; L508-R510 VanDerWaalsContact C-N 3.35Å; L508-R510 PolarHBondContact O-N 2.69Å; R510-V514 WeakPolarHBondContact O-CG2 3.49Å; R510-V514 PolarHBondContact O-N 2.76Å
511	R	81.1	Confident	75.5	Confident	57 Å²	57	61.2 Å²	61.2	22%	0.215	35%	0.351	C	S	.	.	H	α-helix	trans	-72.6	-37.7	176.5	-72.2	-61.1	-160	-158.6	1.8	112.2	L507 L508 Q509 V514 R515 E552 G555 V556	L507-R511 WeakPolarHBondContact O-CG 3.27Å; L507-R511 PolarHBondContact O-N 2.87Å; L507-R511 VanDerWaalsContact O-N 3.12Å; L508-R511 WeakPolarHBondContact O-CB 3.37Å; L508-R511 PolarHBondContact O-N 3.04Å; L508-R511 VanDerWaalsContact O-N 3.09Å; Q509-R511 VanDerWaalsContact C-N 3.29Å; Q509-R511 PolarHBondContact O-N 3.15Å; R511-V514 WeakPolarHBondContact O-CB 3.46Å; R511-V514 PolarHBondContact O-N 2.96Å; R511-R515 PolarHBondContact O-N 3.44Å; R511-R515 VanDerWaalsContact O-N 3.1Å; R511-E552 HydrophobicContact CB-CB 4.34Å; R511-E552 HydrophobicContact CB-CG 4.25Å; R511-G555 PolarHBondContact NE-O 3.26Å; R511-G555 PolarHBondContact NH2-O 3.37Å; R511-G555 VanDerWaalsContact NH2-O 3.08Å; R511-V556 HydrophobicContact CG-CG2 4.13Å
512	L	82.5	Confident	73.4	Confident	10 Å²	10	61.6 Å²	61.6	5%	0.052	35%	0.348	C	S	.	.	H	α-helix	trans	-61.1	-46.7	176.5	-168.1	144.1	0	0	0	111.2	L508 Q509 V514 R515 T516 T546 I548 E552	L508-L512 WeakPolarHBondContact O-CB 3.46Å; L508-L512 PolarHBondContact O-N 2.81Å; Q509-L512 WeakPolarHBondContact O-CB 3.43Å; Q509-L512 PolarHBondContact O-N 2.85Å; L512-V514 VanDerWaalsContact C-N 3.26Å; L512-V514 PolarHBondContact O-N 3.14Å; L512-R515 WeakPolarHBondContact O-CB 3.34Å; L512-R515 PolarHBondContact O-N 2.8Å; L512-T516 HydrophobicContact CD2-CG2 3.99Å; L512-T516 PolarHBondContact O-N 3.34Å; L512-T516 PolarHBondContact O-OG1 3.1Å; L512-T546 WeakPolarHBondContact CD1-O 3.27Å; L512-I548 HydrophobicContact CD1-CG1 3.84Å; L512-E552 HydrophobicContact CB-CG 4.3Å
513	V	81.8	Confident	71.2	Confident	84 Å²	84	65.4 Å²	65.4	51%	0.509	37%	0.374	S	S	.	.	H	α-helix	trans	-57.6	-38	174.9	172.2	0	0	0	0	112	Q509 T516 G517	Q509-V513 WeakPolarHBondContact O-CG2 3.42Å; Q509-V513 PolarHBondContact O-N 2.9Å; V513-T516 WeakPolarHBondContact CA-OG1 3.08Å; V513-T516 PolarHBondContact O-OG1 2.71Å; V513-G517 PolarHBondContact O-N 2.79Å
514	V	78.3	Confident	68.6	Low	74 Å²	74	69.2 Å²	69.2	45%	0.448	41%	0.408	S	S	.	.	H	α-helix	trans	-67.2	-37.6	177	171.7	0	0	0	0	111.6	R510 R511 L512 T518	R510-V514 WeakPolarHBondContact O-CG2 3.49Å; R510-V514 PolarHBondContact O-N 2.76Å; R511-V514 WeakPolarHBondContact O-CB 3.46Å; R511-V514 PolarHBondContact O-N 2.96Å; L512-V514 VanDerWaalsContact C-N 3.26Å; L512-V514 PolarHBondContact O-N 3.14Å; V514-T518 PolarHBondContact O-N 2.89Å; V514-T518 PolarHBondContact O-OG1 3.14Å
515	R	75.3	Confident	66	Low	13 Å²	13	73 Å²	73	5%	0.049	44%	0.44	C	S	.	.	H	α-helix	trans	-68.2	-49.6	176	-176.9	-179.8	61.2	79.6	-2.1	111.3	R511 L512 G517 T518 A519 Q545 D547 E552 V585	R511-R515 PolarHBondContact O-N 3.44Å; R511-R515 VanDerWaalsContact O-N 3.1Å; L512-R515 WeakPolarHBondContact O-CB 3.34Å; L512-R515 PolarHBondContact O-N 2.8Å; R515-G517 PolarHBondContact O-N 3.21Å; R515-T518 PolarHBondContact O-N 2.9Å; R515-T518 PolarHBondContact O-OG1 3.18Å; R515-A519 PolarHBondContact O-N 2.82Å; R515-A519 VanDerWaalsContact O-N 3.14Å; R515-Q545 PolarHBondContact NH1-O 3.21Å; R515-Q545 PolarHBondContact NH2-O 3.23Å; R515-D547 PolarHBondContact NH2-O 3.22Å; R515-E552 WeakPolarHBondContact CD-OE1 3.23Å; R515-E552 IonicContact CZ-OE1 3.43Å; R515-E552 IonicContact NE-OE1 3.75Å; R515-E552 PolarHBondContact NE-OE1 3.21Å; R515-E552 IonicContact NH2-OE1 3.69Å; R515-V585 HydrophobicContact CG-CG1 4.09Å
516	T	72.9	Confident	63.4	Low	49 Å²	49	76.7 Å²	76.7	30%	0.301	47%	0.469	S	S	.	.	H	α-helix	trans	-65.1	-40.7	-178.3	54.5	0	0	0	0	111.6	L512 V513 T518 A519 A520	L512-T516 HydrophobicContact CD2-CG2 3.99Å; L512-T516 PolarHBondContact O-N 3.34Å; L512-T516 PolarHBondContact O-OG1 3.1Å; V513-T516 WeakPolarHBondContact CA-OG1 3.08Å; V513-T516 PolarHBondContact O-OG1 2.71Å; T516-T518 VanDerWaalsContact C-N 3.28Å; T516-T518 PolarHBondContact O-N 2.89Å; T516-A519 PolarHBondContact O-N 2.81Å; T516-A520 PolarHBondContact O-N 3.24Å
517	G	66.8	Low	60.7	Low	50 Å²	50	77.1 Å²	77.1	52%	0.515	49%	0.485	S	S	.	.	H	α-helix	trans	-64.3	-25	176.3	0	0	0	0	0	114.9	V513 R515	V513-G517 PolarHBondContact O-N 2.79Å; R515-G517 PolarHBondContact O-N 3.21Å
518	T	59.2	Low	58	Low	73 Å²	73	85 Å²	85	45%	0.448	52%	0.521	S	S	.	.	H	α-helix	trans	-91.3	-16.9	174.5	36.4	0	0	0	0	114	V514 R515 T516	V514-T518 PolarHBondContact O-N 2.89Å; V514-T518 PolarHBondContact O-OG1 3.14Å; R515-T518 PolarHBondContact O-N 2.9Å; R515-T518 PolarHBondContact O-OG1 3.18Å; T516-T518 VanDerWaalsContact C-N 3.28Å; T516-T518 PolarHBondContact O-N 2.89Å
519	A	52.7	Low	55.4	Low	41 Å²	41	90.2 Å²	90.2	34%	0.339	56%	0.558	S	S	.	*	H	α-helix	trans	-81.6	-29.2	174.8	0	0	0	0	0	112.8	R515 T516 T521	R515-A519 PolarHBondContact O-N 2.82Å; R515-A519 VanDerWaalsContact O-N 3.14Å; T516-A519 PolarHBondContact O-N 2.81Å; A519-T521 PolarHBondContact O-N 2.66Å
520	A	47.4	Very low	52.6	Low	87 Å²	87	96.5 Å²	96.5	72%	0.719	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-3.3	-179.1	0	0	0	0	0	115.5	T516	T516-A520 PolarHBondContact O-N 3.24Å
521	T	40.2	Very low	49.9	Very low	119 Å²	119	92.1 Å²	92.1	73%	0.73	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	23.5	179.7	-12.7	0	0	0	0	113.8	A519	A519-T521 PolarHBondContact O-N 2.66Å
522	V	33.5	Very low	47.6	Very low	110 Å²	110	95.3 Å²	95.3	67%	0.667	61%	0.611	S	S	*	*	S	Bend	trans	-102.7	115.4	169.4	-178.3	0	0	0	0	108.1	A524	V522-A524 PolarHBondContact O-N 3.05Å; V522-A524 VanDerWaalsContact O-N 3.15Å
523	P	35.5	Very low	45.1	Very low	116 Å²	116	103.8 Å²	103.8	75%	0.753	65%	0.647	S	S	*	*			trans	-71.7	109.4	171.7	28.4	-28.3	0	0	0	108	A525	P523-A525 PolarHBondContact O-N 3.26Å; P523-A525 VanDerWaalsContact O-N 3.09Å
524	A	31	Very low	42.4	Very low	102 Å²	102	106.9 Å²	106.9	84%	0.843	67%	0.666	S	S	*	*			trans	-67.2	101.3	158.8	0	0	0	0	0	106.8	V522	V522-A524 PolarHBondContact O-N 3.05Å; V522-A524 VanDerWaalsContact O-N 3.15Å
525	A	32.8	Very low	40	Very low	83 Å²	83	106.5 Å²	106.5	69%	0.686	68%	0.678	S	S	*	*			trans	-69.2	133.2	169.9	0	0	0	0	0	109.1	P523	P523-A525 PolarHBondContact O-N 3.26Å; P523-A525 VanDerWaalsContact O-N 3.09Å
526	T	31.5	Very low	37.9	Very low	135 Å²	135	112 Å²	112	83%	0.828	72%	0.715	S	S	*	*			trans	62.8	98	160.2	54.2	0	0	0	0	118.6
527	S	29	Very low	35.8	Very low	125 Å²	125	118.4 Å²	118.4	87%	0.874	74%	0.742	S	S	*	*				-173.6	145.4	114.8	56.4	0	0	0	0	111
528	E	30.6	Very low	34.1	Very low	186 Å²	186	124.7 Å²	124.7	87%	0.869	76%	0.758	S	S	*	*			trans	-76.3	161.7	-159.4	-68.4	167.4	148.4	0	0	116.4
529	S	32.6	Very low	32.8	Very low	110 Å²	110	127 Å²	127	77%	0.769	77%	0.767	S	S	*	*			trans	-25	129.7	165.5	54.5	0	0	0	0	117.5
530	K	26.5	Very low	32	Very low	211 Å²	211	134.1 Å²	134.1	92%	0.917	79%	0.791	S	S	*	*			trans	-156	145.8	141.1	-104.8	164.6	-167	-177.5	0	111.4
531	S	27.3	Very low	31.4	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	80%	0.795	S	S	*	*			trans	-60.7	155.2	-172.6	48.2	0	0	0	0	115.7	F533	S531-F533 PolarHBondContact O-N 3.18Å
532	P	32.8	Very low	31.3	Very low	124 Å²	124	136.4 Å²	136.4	81%	0.805	79%	0.787	S	S	*	*			trans	-88	101.6	176.5	33.6	-28.2	0	0	0	110.9
533	F	30	Very low	31.6	Very low	188 Å²	188	140 Å²	140	83%	0.825	79%	0.789	S	S	*	*			trans	-150.1	120.8	157.6	-97.2	-79.2	0	0	0	108.5	S531	S531-F533 PolarHBondContact O-N 3.18Å
534	T	25.5	Very low	32.3	Very low	148 Å²	148	136.7 Å²	136.7	91%	0.908	77%	0.769	S	S	*	*	S	Bend	trans	120.2	126	158.1	58.4	0	0	0	0	117.1
535	G	26.1	Very low	33.2	Very low	67 Å²	67	137.4 Å²	137.4	69%	0.691	75%	0.754	S	S	*	*			trans	100.5	126.5	156.5	0	0	0	0	0	118	E537	G535-E537 VanDerWaalsContact C-N 3.32Å; G535-E537 PolarHBondContact O-N 3.27Å
536	P	32.2	Very low	34.5	Very low	128 Å²	128	137.2 Å²	137.2	83%	0.831	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	21	175.5	8.7	8.7	0	0	0	115.5
537	E	29.6	Very low	36.2	Very low	184 Å²	184	133.1 Å²	133.1	86%	0.86	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	0.6	-170.5	-70.7	-168.4	159.1	0	0	116.3	G535	G535-E537 VanDerWaalsContact C-N 3.32Å; G535-E537 PolarHBondContact O-N 3.27Å
538	E	29.4	Very low	38.6	Very low	182 Å²	182	127.8 Å²	127.8	85%	0.85	68%	0.68	S	S	*	*	S	Bend	trans	-107.5	10.6	179.9	-69	-164.5	164	0	0	115.9	F540	E538-F540 VanDerWaalsContact C-N 3.31Å; E538-F540 PolarHBondContact O-N 2.94Å
539	D	33	Very low	41.1	Very low	122 Å²	122	119 Å²	119	65%	0.652	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-0.3	-179.2	-88.9	-21.2	0	0	0	115.2
540	F	35.3	Very low	43.5	Very low	190 Å²	190	113.9 Å²	113.9	83%	0.833	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-25.9	-172.8	-131.9	-93.3	0	0	0	114.3	E538	E538-F540 VanDerWaalsContact C-N 3.31Å; E538-F540 PolarHBondContact O-N 2.94Å
541	Q	35.8	Very low	46.2	Very low	170 Å²	170	104.8 Å²	104.8	79%	0.794	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-33.4	-176.5	-79.5	179.4	-1.1	0	0	113.9	R543 S544	Q541-R543 VanDerWaalsContact C-N 3.34Å; Q541-R543 PolarHBondContact O-N 3.46Å; Q541-S544 PolarHBondContact O-N 3.5Å; Q541-S544 PolarHBondContact O-OG 3.46Å
542	S	37.5	Very low	48.9	Very low	83 Å²	83	100.1 Å²	100.1	58%	0.58	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-30	178.4	65.7	0	0	0	0	112.8	S544	S542-S544 VanDerWaalsContact C-N 3.32Å; S542-S544 PolarHBondContact O-N 2.83Å
543	R	40.4	Very low	51.5	Low	186 Å²	186	94.3 Å²	94.3	70%	0.702	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-69.4	-27.2	178	-133.9	172.1	-178.9	171.9	-0.1	113.3	Q541 Q545 T546	Q541-R543 VanDerWaalsContact C-N 3.34Å; Q541-R543 PolarHBondContact O-N 3.46Å; R543-Q545 VanDerWaalsContact C-N 3.33Å; R543-Q545 PolarHBondContact O-N 3.21Å; R543-T546 PolarHBondContact O-N 3.46Å; R543-T546 PolarHBondContact O-OG1 3.28Å
544	S	49.2	Very low	54.1	Low	46 Å²	46	85.4 Å²	85.4	32%	0.322	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-70.8	-20.8	-173.8	75	0	0	0	0	115	Q541 S542 R596	Q541-S544 PolarHBondContact O-N 3.5Å; Q541-S544 PolarHBondContact O-OG 3.46Å; S542-S544 VanDerWaalsContact C-N 3.32Å; S542-S544 PolarHBondContact O-N 2.83Å; S544-R596 PolarHBondContact O-NH2 3.04Å
545	Q	51.2	Low	56.9	Low	117 Å²	117	78.7 Å²	78.7	55%	0.547	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-84.5	-20.9	179.4	-73.3	-172.4	1.5	0	0	113.3	R515 R543	R515-Q545 PolarHBondContact NH1-O 3.21Å; R515-Q545 PolarHBondContact NH2-O 3.23Å; R543-Q545 VanDerWaalsContact C-N 3.33Å; R543-Q545 PolarHBondContact O-N 3.21Å
546	T	58.5	Low	59.8	Low	80 Å²	80	75.7 Å²	75.7	49%	0.491	38%	0.382	S	S	.	.	S	Bend	trans	-96.6	3	-175.7	48.6	0	0	0	0	114.1	L512 R543	L512-T546 WeakPolarHBondContact CD1-O 3.27Å; R543-T546 PolarHBondContact O-N 3.46Å; R543-T546 PolarHBondContact O-OG1 3.28Å
547	D	67.9	Low	62.4	Low	48 Å²	48	69.7 Å²	69.7	26%	0.257	34%	0.343	S	S	.	.	S	Bend	trans	-77.1	149	179.7	-63.2	-30.6	0	0	0	112.3	R515 R596	R515-D547 PolarHBondContact NH2-O 3.22Å; D547-R596 IonicContact OD2-NH2 2.73Å; D547-R596 PolarHBondContact OD2-NH2 3.19Å
548	I	78.7	Confident	65	Low	14 Å²	14	63.8 Å²	63.8	7%	0.072	32%	0.317	C	S	.	.			trans	-67.9	132.6	165.4	-61.1	167	0	0	0	108.5	R496 Y505 L508 L512	R496-I548 HydrophobicContact CG-CB 4.34Å; R496-I548 PolarHBondContact NE-O 2.93Å; R496-I548 PolarHBondContact NH2-O 3.37Å; Y505-I548 HydrophobicContact CD2-CD1 4.41Å; Y505-I548 HydrophobicContact CE2-CD1 4.23Å; L508-I548 HydrophobicContact CB-CD1 4.3Å; L508-I548 HydrophobicContact CD1-CD1 4.45Å; L508-I548 HydrophobicContact CD1-CG2 4.35Å; L508-I548 HydrophobicContact CD2-CG2 4.3Å; L512-I548 HydrophobicContact CD1-CG1 3.84Å
549	T	83.1	Confident	67.7	Low	2 Å²	2	59.3 Å²	59.3	1%	0.012	30%	0.299	C	S	.	.			trans	-126.2	170.5	179.8	73.5	0	0	0	0	111	E492 F551 E552 I553 L592	E492-T549 WeakPolarHBondContact OE1-CA 3.47Å; T549-F551 PolarHBondContact O-N 3.02Å; T549-F551 VanDerWaalsContact O-N 3.1Å; T549-F551 PolarHBondContact OG1-N 3.29Å; T549-E552 VanDerWaalsContact CA-OE2 3.31Å; T549-E552 WeakPolarHBondContact CA-OE2 3.41Å; T549-E552 WeakPolarHBondContact CB-OE2 3.12Å; T549-E552 PolarHBondContact N-OE2 2.94Å; T549-E552 PolarHBondContact O-N 2.93Å; T549-E552 VanDerWaalsContact O-OE2 3.05Å; T549-E552 PolarHBondContact OG1-OE2 3.4Å; T549-I553 PolarHBondContact O-N 3.17Å; T549-L592 HydrophobicContact CG2-CD1 4.08Å; T549-L592 HydrophobicContact CG2-CD2 3.73Å
550	L	82.9	Confident	70.3	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-57.7	-21.9	174.1	-71.5	168.8	0	0	0	113.8	Y488 L491 E492 I553 S554 Y569 Y598	Y488-L550 HydrophobicContact CD1-CD1 3.53Å; Y488-L550 HydrophobicContact CE1-CD1 4.44Å; Y488-L550 HydrophobicContact CG-CD1 3.95Å; L491-L550 HydrophobicContact CD2-CD2 3.97Å; L491-L550 HydrophobicContact CG-CD2 4.43Å; E492-L550 HydrophobicContact CG-CG 3.92Å; E492-L550 PolarHBondContact OE1-N 2.73Å; E492-L550 VanDerWaalsContact OE1-N 3.11Å; L550-I553 HydrophobicContact CD2-CD1 4.08Å; L550-S554 WeakPolarHBondContact O-CB 3.21Å; L550-S554 PolarHBondContact O-N 3.08Å; L550-S554 PolarHBondContact O-OG 2.9Å; L550-S554 VanDerWaalsContact O-OG 3.14Å; L550-Y569 HydrophobicContact CD2-CD1 4.33Å; L550-Y569 HydrophobicContact CD2-CD2 4.22Å; L550-Y569 HydrophobicContact CD2-CE1 4.28Å; L550-Y569 HydrophobicContact CD2-CE2 4.17Å; L550-Y569 HydrophobicContact CD2-CG 4.32Å; L550-Y598 HydrophobicContact CD1-CD2 4.28Å; L550-Y598 HydrophobicContact CD1-CE2 4.02Å
551	F	83.3	Confident	72.6	Confident	19 Å²	19	44.9 Å²	44.9	8%	0.083	23%	0.23	C	C	.	.	H	α-helix	trans	-68.2	-44.7	176.6	-177.5	-103.8	0	0	0	112.4	T549 I553 S554 G555 Y570 L573 I575 V585 V588	T549-F551 PolarHBondContact O-N 3.02Å; T549-F551 VanDerWaalsContact O-N 3.1Å; T549-F551 PolarHBondContact OG1-N 3.29Å; F551-I553 VanDerWaalsContact C-N 3.31Å; F551-I553 PolarHBondContact O-N 3.05Å; F551-S554 WeakPolarHBondContact CA-OG 3.22Å; F551-S554 PolarHBondContact O-N 2.83Å; F551-S554 PolarHBondContact O-OG 3.14Å; F551-G555 PolarHBondContact O-N 3.17Å; F551-Y570 HydrophobicContact CD2-CE1 4.19Å; F551-Y570 HydrophobicContact CE2-CE1 4.06Å; F551-L573 HydrophobicContact CB-CD1 4.18Å; F551-L573 HydrophobicContact CD2-CD1 4.26Å; F551-I575 HydrophobicContact CD2-CD1 3.93Å; F551-I575 HydrophobicContact CE2-CD1 4.05Å; F551-V585 HydrophobicContact CE1-CG2 3.85Å; F551-V585 HydrophobicContact CZ-CG2 3.81Å; F551-V588 HydrophobicContact CB-CG1 4.01Å; F551-V588 HydrophobicContact CB-CG2 4.45Å; F551-V588 HydrophobicContact CD1-CG1 4.48Å; F551-V588 HydrophobicContact CD2-CG2 3.72Å; F551-V588 HydrophobicContact CE2-CG2 4.11Å; F551-V588 HydrophobicContact CG-CG1 4.12Å; F551-V588 HydrophobicContact CG-CG2 4.05Å
552	E	84.1	Confident	74.6	Confident	3 Å²	3	38 Å²	38	1%	0.014	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-43.1	175.1	-70.4	74.7	-159.6	0	0	110.9	L508 R511 L512 R515 T549 G555 V556	L508-E552 HydrophobicContact CD2-CB 4.03Å; R511-E552 HydrophobicContact CB-CB 4.34Å; R511-E552 HydrophobicContact CB-CG 4.25Å; L512-E552 HydrophobicContact CB-CG 4.3Å; R515-E552 WeakPolarHBondContact CD-OE1 3.23Å; R515-E552 IonicContact CZ-OE1 3.43Å; R515-E552 IonicContact NE-OE1 3.75Å; R515-E552 PolarHBondContact NE-OE1 3.21Å; R515-E552 IonicContact NH2-OE1 3.69Å; T549-E552 VanDerWaalsContact CA-OE2 3.31Å; T549-E552 WeakPolarHBondContact CA-OE2 3.41Å; T549-E552 WeakPolarHBondContact CB-OE2 3.12Å; T549-E552 PolarHBondContact N-OE2 2.94Å; T549-E552 PolarHBondContact O-N 2.93Å; T549-E552 VanDerWaalsContact O-OE2 3.05Å; T549-E552 PolarHBondContact OG1-OE2 3.4Å; E552-G555 CarbonylContact O-C 3.56Å; E552-G555 WeakPolarHBondContact O-CA 3.44Å; E552-G555 PolarHBondContact O-N 3.14Å; E552-G555 VanDerWaalsContact O-N 3.12Å; E552-V556 PolarHBondContact O-N 3.29Å
553	I	87.4	Confident	76.1	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-49.3	179.3	-63.9	155.2	0	0	0	110.2	Y495 L508 T549 L550 F551 G555 V556 L557 Y569	Y495-I553 HydrophobicContact CD1-CD1 4.08Å; Y495-I553 HydrophobicContact CD1-CG1 4.18Å; Y495-I553 HydrophobicContact CD2-CD1 3.23Å; Y495-I553 HydrophobicContact CD2-CG1 4.15Å; Y495-I553 HydrophobicContact CE1-CG1 4.47Å; Y495-I553 HydrophobicContact CE1-CG2 4.26Å; Y495-I553 HydrophobicContact CE2-CD1 3.74Å; Y495-I553 HydrophobicContact CE2-CG1 4.4Å; Y495-I553 HydrophobicContact CE2-CG2 4.12Å; Y495-I553 HydrophobicContact CG-CD1 3.41Å; Y495-I553 VanDerWaalsContact CG-CD1 3.41Å; Y495-I553 HydrophobicContact CG-CG1 4.01Å; L508-I553 HydrophobicContact CD2-CG1 3.85Å; T549-I553 PolarHBondContact O-N 3.17Å; L550-I553 HydrophobicContact CD2-CD1 4.08Å; F551-I553 VanDerWaalsContact C-N 3.31Å; F551-I553 PolarHBondContact O-N 3.05Å; I553-G555 PolarHBondContact O-N 2.74Å; I553-V556 PolarHBondContact O-N 3.49Å; I553-L557 HydrophobicContact CG2-CD1 4.19Å; I553-L557 HydrophobicContact CG2-CG 4.47Å; I553-L557 WeakPolarHBondContact O-CG 3.14Å; I553-L557 PolarHBondContact O-N 2.87Å; I553-Y569 HydrophobicContact CG2-CD2 4.42Å; I553-Y569 HydrophobicContact CG2-CE2 3.99Å
554	S	85.1	Confident	77.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.9	-33.5	175.9	63.6	0	0	0	0	112.8	L550 F551 L557 D558 Y570	L550-S554 WeakPolarHBondContact O-CB 3.21Å; L550-S554 PolarHBondContact O-N 3.08Å; L550-S554 PolarHBondContact O-OG 2.9Å; L550-S554 VanDerWaalsContact O-OG 3.14Å; F551-S554 WeakPolarHBondContact CA-OG 3.22Å; F551-S554 PolarHBondContact O-N 2.83Å; F551-S554 PolarHBondContact O-OG 3.14Å; S554-L557 PolarHBondContact O-N 2.93Å; S554-D558 VanDerWaalsContact O-CB 3.27Å; S554-D558 WeakPolarHBondContact O-CB 3.47Å; S554-D558 PolarHBondContact O-N 2.92Å; S554-Y570 VanDerWaalsContact OG-CE1 3.28Å; S554-Y570 WeakPolarHBondContact OG-CE1 3.3Å
555	G	83.5	Confident	78.6	Confident	8 Å²	8	30.6 Å²	30.6	8%	0.082	17%	0.171	C	C	.	.	H	α-helix	trans	-74.2	-20.1	174	0	0	0	0	0	115.1	R511 F551 E552 I553	R511-G555 PolarHBondContact NE-O 3.26Å; R511-G555 PolarHBondContact NH2-O 3.37Å; R511-G555 VanDerWaalsContact NH2-O 3.08Å; F551-G555 PolarHBondContact O-N 3.17Å; E552-G555 CarbonylContact O-C 3.56Å; E552-G555 WeakPolarHBondContact O-CA 3.44Å; E552-G555 PolarHBondContact O-N 3.14Å; E552-G555 VanDerWaalsContact O-N 3.12Å; I553-G555 PolarHBondContact O-N 2.74Å
556	V	86.8	Confident	79.5	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.018	17%	0.17	C	C	.	.	H	α-helix	trans	-79.9	-44.3	167.1	174.2	0	0	0	0	109.8	L504 L507 L508 R511 E552 I553 D558 L559 L560	L504-V556 HydrophobicContact CD1-CG1 4.43Å; L507-V556 HydrophobicContact CB-CG2 4.26Å; L507-V556 HydrophobicContact CD1-CG1 4.45Å; L508-V556 HydrophobicContact CD2-CG2 3.88Å; L508-V556 HydrophobicContact CG-CG2 4.42Å; R511-V556 HydrophobicContact CG-CG2 4.13Å; E552-V556 PolarHBondContact O-N 3.29Å; I553-V556 PolarHBondContact O-N 3.49Å; V556-D558 VanDerWaalsContact C-N 3.31Å; V556-D558 PolarHBondContact O-N 3.22Å; V556-L559 WeakPolarHBondContact O-CA 3.48Å; V556-L559 VanDerWaalsContact O-CB 3.3Å; V556-L559 WeakPolarHBondContact O-CB 3.32Å; V556-L559 PolarHBondContact O-N 3.22Å; V556-L560 HydrophobicContact CG1-CD1 4.09Å; V556-L560 HydrophobicContact CG1-CG 4.48Å; V556-L560 WeakPolarHBondContact O-CG 3.11Å; V556-L560 PolarHBondContact O-N 2.95Å
557	L	86.9	Confident	80.1	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-38.8	175.8	-67.3	175.7	0	0	0	112.4	I553 S554 L559 L560 L561 F568 Y569 I612 L616 M643	I553-L557 HydrophobicContact CG2-CD1 4.19Å; I553-L557 HydrophobicContact CG2-CG 4.47Å; I553-L557 WeakPolarHBondContact O-CG 3.14Å; I553-L557 PolarHBondContact O-N 2.87Å; S554-L557 PolarHBondContact O-N 2.93Å; L557-L559 VanDerWaalsContact C-N 3.27Å; L557-L559 PolarHBondContact O-N 3.24Å; L557-L560 PolarHBondContact O-N 3.18Å; L557-L561 HydrophobicContact CB-CD1 4.5Å; L557-L561 WeakPolarHBondContact O-CB 3.42Å; L557-L561 PolarHBondContact O-N 3.1Å; L557-F568 HydrophobicContact CD1-CB 4.27Å; L557-Y569 HydrophobicContact CD1-CD2 4.3Å; L557-Y569 HydrophobicContact CD1-CE2 3.9Å; L557-I612 HydrophobicContact CD1-CD1 4.48Å; L557-I612 HydrophobicContact CD1-CG2 4.14Å; L557-I612 HydrophobicContact CD2-CG2 3.63Å; L557-I612 HydrophobicContact CG-CG2 4.46Å; L557-L616 HydrophobicContact CD2-CD1 4.28Å; L557-M643 HydrophobicContact CD2-CE 3.92Å; L557-M643 HydrophobicContact CD2-SD 4.42Å
558	D	85.6	Confident	80.4	Confident	60 Å²	60	27.4 Å²	27.4	32%	0.321	15%	0.151	S	C	.	.	H	α-helix	trans	-62.7	-33.8	173	-174.9	49.9	0	0	0	112	S554 V556 G562	S554-D558 VanDerWaalsContact O-CB 3.27Å; S554-D558 WeakPolarHBondContact O-CB 3.47Å; S554-D558 PolarHBondContact O-N 2.92Å; V556-D558 VanDerWaalsContact C-N 3.31Å; V556-D558 PolarHBondContact O-N 3.22Å; D558-G562 WeakPolarHBondContact O-CA 3.32Å; D558-G562 PolarHBondContact O-N 3.29Å
559	L	85.4	Confident	80.5	Confident	89 Å²	89	26.8 Å²	26.8	47%	0.466	15%	0.148	S	C	.	.	H	α-helix	trans	-68.5	-38.7	173.6	-178.5	67.9	0	0	0	112.1	V556 L557	V556-L559 WeakPolarHBondContact O-CA 3.48Å; V556-L559 VanDerWaalsContact O-CB 3.3Å; V556-L559 WeakPolarHBondContact O-CB 3.32Å; V556-L559 PolarHBondContact O-N 3.22Å; L557-L559 VanDerWaalsContact C-N 3.27Å; L557-L559 PolarHBondContact O-N 3.24Å
560	L	87.1	Confident	80.1	Confident	3 Å²	3	28.5 Å²	28.5	2%	0.016	16%	0.155	C	C	.	.	H	α-helix	trans	-83	-42.6	-175.7	-63.8	174.8	0	0	0	112.8	V556 L557 L616 K642 E646 L647 L650	V556-L560 HydrophobicContact CG1-CD1 4.09Å; V556-L560 HydrophobicContact CG1-CG 4.48Å; V556-L560 WeakPolarHBondContact O-CG 3.11Å; V556-L560 PolarHBondContact O-N 2.95Å; L557-L560 PolarHBondContact O-N 3.18Å; L560-L616 HydrophobicContact CD1-CD2 3.4Å; L560-K642 WeakPolarHBondContact O-CE 3.34Å; L560-E646 HydrophobicContact CD2-CB 3.94Å; L560-L647 HydrophobicContact CD1-CD1 4.42Å; L560-L647 HydrophobicContact CD1-CD2 4.02Å; L560-L647 HydrophobicContact CD1-CG 4.06Å; L560-L647 HydrophobicContact CD2-CD2 3.84Å; L560-L647 HydrophobicContact CD2-CG 3.88Å; L560-L650 HydrophobicContact CD2-CD1 4.4Å
561	L	84.4	Confident	79.5	Confident	6 Å²	6	33.3 Å²	33.3	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-82.8	-23.5	178.6	-62.6	170.1	0	0	0	111.2	L557 T564 C565 K642 M643 W697 M705	L557-L561 HydrophobicContact CB-CD1 4.5Å; L557-L561 WeakPolarHBondContact O-CB 3.42Å; L557-L561 PolarHBondContact O-N 3.1Å; L561-T564 PolarHBondContact O-N 2.83Å; L561-T564 PolarHBondContact O-OG1 3Å; L561-C565 HydrophobicContact CB-CB 4.18Å; L561-C565 HydrophobicContact CD1-CB 4.12Å; L561-K642 HydrophobicContact CD2-CD 4.25Å; L561-K642 VanDerWaalsContact O-CE 3.26Å; L561-K642 WeakPolarHBondContact O-CE 3.31Å; L561-K642 PolarHBondContact O-NZ 3.2Å; L561-M643 HydrophobicContact CD2-CG 3.98Å; L561-W697 HydrophobicContact CD1-CE3 4.49Å; L561-W697 HydrophobicContact CD1-CZ3 4.29Å; L561-M705 HydrophobicContact CD2-SD 4.38Å
562	G	77.5	Confident	78.7	Confident	24 Å²	24	34.6 Å²	34.6	25%	0.247	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	55	-149.3	-178.7	0	0	0	0	0	112.3	D558 T564	D558-G562 WeakPolarHBondContact O-CA 3.32Å; D558-G562 PolarHBondContact O-N 3.29Å; G562-T564 PolarHBondContact O-N 3.33Å
563	D	69.3	Low	78	Confident	113 Å²	113	34.9 Å²	34.9	60%	0.604	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-70.4	1.4	-175.9	-53.8	-58.3	0	0	0	114.6	M900	D563-M900 HydrophobicContact CB-CE 4.16Å; D563-M900 WeakPolarHBondContact OD2-CE 3.02Å
564	T	67.3	Low	76.9	Confident	34 Å²	34	36.9 Å²	36.9	21%	0.209	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-72.3	-46	178.7	55	0	0	0	0	111.5	L561 G562 K642 T700	L561-T564 PolarHBondContact O-N 2.83Å; L561-T564 PolarHBondContact O-OG1 3Å; G562-T564 PolarHBondContact O-N 3.33Å; T564-K642 PolarHBondContact OG1-NZ 3.35Å; T564-T700 WeakPolarHBondContact O-CG2 3.37Å
565	C	74	Confident	76	Confident	13 Å²	13	37 Å²	37	9%	0.088	21%	0.211	C	C	.	.	S	Bend	trans	-109.1	147.1	-176.5	-66.9	0	0	0	0	111.5	L561 T700 M705	L561-C565 HydrophobicContact CB-CB 4.18Å; L561-C565 HydrophobicContact CD1-CB 4.12Å; C565-T700 HydrophobicContact CB-CG2 4.1Å; C565-T700 VanDerWaalsContact SG-CG2 3.51Å; C565-M705 WeakPolarHBondContact SG-CE 3.5Å
566	Q	71.6	Confident	74.8	Confident	114 Å²	114	40 Å²	40	53%	0.533	23%	0.231	S	C	.	.			trans	-65	147.3	158.9	-69.5	-175.4	-28.3	0	0	110	F568	Q566-F568 PolarHBondContact O-N 3.45Å; Q566-F568 VanDerWaalsContact O-N 3.12Å
567	P	70.4	Confident	73.4	Confident	34 Å²	34	49 Å²	49	22%	0.221	27%	0.273	C	S	.	.			trans	-60.5	117.7	-177.9	20.6	-31.2	0	0	0	111.4	Y569 Y570	P567-Y569 VanDerWaalsContact C-N 3.35Å; P567-Y569 PolarHBondContact O-N 2.88Å; P567-Y569 VanDerWaalsContact O-N 3.16Å; P567-Y570 HydrophobicContact CB-CD1 3.64Å; P567-Y570 HydrophobicContact CB-CD2 3.92Å; P567-Y570 HydrophobicContact CB-CE1 3.95Å; P567-Y570 HydrophobicContact CB-CE2 4.2Å; P567-Y570 HydrophobicContact CB-CG 3.62Å; P567-Y570 HydrophobicContact CG-CD1 4Å; P567-Y570 HydrophobicContact CG-CD2 3.3Å; P567-Y570 HydrophobicContact CG-CE1 4.39Å; P567-Y570 HydrophobicContact CG-CE2 3.77Å; P567-Y570 HydrophobicContact CG-CG 3.43Å; P567-Y570 VanDerWaalsContact CG-CG 3.43Å; P567-Y570 PolarHBondContact O-N 3.02Å; P567-Y570 VanDerWaalsContact O-N 3.12Å
568	F	75.1	Confident	72.2	Confident	30 Å²	30	51.3 Å²	51.3	13%	0.132	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-38.2	-164.3	-167.6	-90.6	0	0	0	115.2	L557 Q566 A608 I612 V696 W697	L557-F568 HydrophobicContact CD1-CB 4.27Å; Q566-F568 PolarHBondContact O-N 3.45Å; Q566-F568 VanDerWaalsContact O-N 3.12Å; F568-A608 HydrophobicContact CZ-CB 4.38Å; F568-I612 HydrophobicContact CD2-CD1 4.45Å; F568-I612 HydrophobicContact CE1-CD1 4.36Å; F568-I612 HydrophobicContact CE2-CD1 4.25Å; F568-I612 HydrophobicContact CZ-CD1 4.22Å; F568-V696 WeakPolarHBondContact CD2-O 3.33Å; F568-V696 HydrophobicContact CE2-CG1 4.24Å; F568-V696 WeakPolarHBondContact CE2-O 3.24Å; F568-W697 HydrophobicContact CD2-CE3 4.38Å; F568-W697 HydrophobicContact CE2-CE3 4.41Å
569	Y	80.1	Confident	70.9	Confident	1 Å²	1	54.8 Å²	54.8	0%	0.004	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	3.7	-177.7	-59.7	-68.8	0	0	0	114.6	Y488 L491 L550 I553 L557 P567 I572 L573 S609	Y488-Y569 HydrophobicContact CE1-CD1 4.2Å; Y488-Y569 HydrophobicContact CE1-CE1 4.11Å; L491-Y569 HydrophobicContact CD2-CE1 4.33Å; L550-Y569 HydrophobicContact CD2-CD1 4.33Å; L550-Y569 HydrophobicContact CD2-CD2 4.22Å; L550-Y569 HydrophobicContact CD2-CE1 4.28Å; L550-Y569 HydrophobicContact CD2-CE2 4.17Å; L550-Y569 HydrophobicContact CD2-CG 4.32Å; I553-Y569 HydrophobicContact CG2-CD2 4.42Å; I553-Y569 HydrophobicContact CG2-CE2 3.99Å; L557-Y569 HydrophobicContact CD1-CD2 4.3Å; L557-Y569 HydrophobicContact CD1-CE2 3.9Å; P567-Y569 VanDerWaalsContact C-N 3.35Å; P567-Y569 PolarHBondContact O-N 2.88Å; P567-Y569 VanDerWaalsContact O-N 3.16Å; Y569-I572 HydrophobicContact CD1-CD1 3.96Å; Y569-I572 PolarHBondContact O-N 3.32Å; Y569-L573 WeakPolarHBondContact O-CG 3.23Å; Y569-L573 PolarHBondContact O-N 3.45Å; Y569-S609 PolarHBondContact OH-OG 3.46Å
570	Y	74.5	Confident	69.9	Low	38 Å²	38	52.7 Å²	52.7	15%	0.149	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-31.4	-174.3	-89.4	30.9	0	0	0	114	F551 S554 P567 I572 L573 G574 I575	F551-Y570 HydrophobicContact CD2-CE1 4.19Å; F551-Y570 HydrophobicContact CE2-CE1 4.06Å; S554-Y570 VanDerWaalsContact OG-CE1 3.28Å; S554-Y570 WeakPolarHBondContact OG-CE1 3.3Å; P567-Y570 HydrophobicContact CB-CD1 3.64Å; P567-Y570 HydrophobicContact CB-CD2 3.92Å; P567-Y570 HydrophobicContact CB-CE1 3.95Å; P567-Y570 HydrophobicContact CB-CE2 4.2Å; P567-Y570 HydrophobicContact CB-CG 3.62Å; P567-Y570 HydrophobicContact CG-CD1 4Å; P567-Y570 HydrophobicContact CG-CD2 3.3Å; P567-Y570 HydrophobicContact CG-CE1 4.39Å; P567-Y570 HydrophobicContact CG-CE2 3.77Å; P567-Y570 HydrophobicContact CG-CG 3.43Å; P567-Y570 VanDerWaalsContact CG-CG 3.43Å; P567-Y570 PolarHBondContact O-N 3.02Å; P567-Y570 VanDerWaalsContact O-N 3.12Å; Y570-I572 VanDerWaalsContact C-N 3.31Å; Y570-I572 PolarHBondContact O-N 3.04Å; Y570-L573 PolarHBondContact O-N 3.08Å; Y570-G574 PolarHBondContact O-N 3.23Å; Y570-I575 HydrophobicContact CD2-CB 4.1Å; Y570-I575 HydrophobicContact CD2-CG2 3.74Å; Y570-I575 HydrophobicContact CE2-CG2 3.87Å; Y570-I575 HydrophobicContact CG-CB 4.25Å; Y570-I575 HydrophobicContact CG-CG2 4.33Å; Y570-I575 PolarHBondContact O-N 2.84Å
571	D	69.5	Low	68.9	Low	104 Å²	104	59 Å²	59	56%	0.556	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-38.6	177.6	-74.8	-29.2	0	0	0	111.5	G574 S576	D571-G574 PolarHBondContact O-N 3.21Å; D571-S576 WeakPolarHBondContact OD1-CB 3.42Å; D571-S576 PolarHBondContact OD1-OG 3.15Å
572	I	68.3	Low	68.1	Low	45 Å²	45	68.2 Å²	68.2	23%	0.231	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-36.6	179.4	-61.2	143.4	0	0	0	111.1	Y488 Y569 Y570 G574	Y488-I572 HydrophobicContact CD2-CG2 4.48Å; Y488-I572 HydrophobicContact CE1-CD1 3.9Å; Y488-I572 HydrophobicContact CE2-CD1 4.38Å; Y488-I572 HydrophobicContact CE2-CG2 4.11Å; Y488-I572 WeakPolarHBondContact OH-CD1 3.45Å; Y569-I572 HydrophobicContact CD1-CD1 3.96Å; Y569-I572 PolarHBondContact O-N 3.32Å; Y570-I572 VanDerWaalsContact C-N 3.31Å; Y570-I572 PolarHBondContact O-N 3.04Å; I572-G574 PolarHBondContact O-N 3.42Å
573	L	68.6	Low	67.8	Low	9 Å²	9	74 Å²	74	5%	0.047	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-2.1	177.1	-64.7	169.4	0	0	0	113.2	F551 Y569 Y570 I575	F551-L573 HydrophobicContact CB-CD1 4.18Å; F551-L573 HydrophobicContact CD2-CD1 4.26Å; Y569-L573 WeakPolarHBondContact O-CG 3.23Å; Y569-L573 PolarHBondContact O-N 3.45Å; Y570-L573 PolarHBondContact O-N 3.08Å; L573-I575 HydrophobicContact CB-CD1 3.55Å; L573-I575 HydrophobicContact CB-CG1 3.77Å; L573-I575 HydrophobicContact CD1-CD1 3.91Å; L573-I575 HydrophobicContact CG-CD1 4.37Å; L573-I575 PolarHBondContact O-N 3.4Å
574	G	64.4	Low	67.8	Low	45 Å²	45	68.7 Å²	68.7	46%	0.464	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	17.9	-177.3	0	0	0	0	0	114.3	Y570 D571 I572	Y570-G574 PolarHBondContact O-N 3.23Å; D571-G574 PolarHBondContact O-N 3.21Å; I572-G574 PolarHBondContact O-N 3.42Å
575	I	66.4	Low	68.1	Low	1 Å²	1	67.7 Å²	67.7	1%	0.005	35%	0.349	C	S	.	.			trans	-92.5	-12.8	-172.1	-58	170.6	0	0	0	112	F551 Y570 L573 Q577 I578 A584 V588	F551-I575 HydrophobicContact CD2-CD1 3.93Å; F551-I575 HydrophobicContact CE2-CD1 4.05Å; Y570-I575 HydrophobicContact CD2-CB 4.1Å; Y570-I575 HydrophobicContact CD2-CG2 3.74Å; Y570-I575 HydrophobicContact CE2-CG2 3.87Å; Y570-I575 HydrophobicContact CG-CB 4.25Å; Y570-I575 HydrophobicContact CG-CG2 4.33Å; Y570-I575 PolarHBondContact O-N 2.84Å; L573-I575 HydrophobicContact CB-CD1 3.55Å; L573-I575 HydrophobicContact CB-CG1 3.77Å; L573-I575 HydrophobicContact CD1-CD1 3.91Å; L573-I575 HydrophobicContact CG-CD1 4.37Å; L573-I575 PolarHBondContact O-N 3.4Å; I575-Q577 PolarHBondContact O-N 3.22Å; I575-I578 HydrophobicContact CG2-CB 4.34Å; I575-I578 PolarHBondContact O-N 3.41Å; I575-A584 HydrophobicContact CG2-CB 3.52Å; I575-V588 HydrophobicContact CD1-CG2 3.3Å; I575-V588 HydrophobicContact CG1-CG2 4.32Å
576	S	58.4	Low	68	Low	72 Å²	72	74 Å²	74	50%	0.503	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.6	-170.4	58.2	0	0	0	0	115.4	D571	D571-S576 WeakPolarHBondContact OD1-CB 3.42Å; D571-S576 PolarHBondContact OD1-OG 3.15Å
577	Q	57.2	Low	68.2	Low	191 Å²	191	71.6 Å²	71.6	89%	0.893	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-7.1	174.2	-62.8	-167.2	-9	0	0	114.8	I575	I575-Q577 PolarHBondContact O-N 3.22Å
578	I	61.5	Low	68.3	Low	52 Å²	52	70.2 Å²	70.2	27%	0.267	35%	0.354	S	S	.	.			trans	-94.6	105.9	-173.3	-56.6	176.5	0	0	0	110.4	I575 S580 K583 A584 H587	I575-I578 HydrophobicContact CG2-CB 4.34Å; I575-I578 PolarHBondContact O-N 3.41Å; I578-S580 VanDerWaalsContact C-N 3.29Å; I578-S580 PolarHBondContact O-N 3.24Å; I578-K583 HydrophobicContact CG2-CB 3.49Å; I578-K583 VanDerWaalsContact CG2-CB 3.49Å; I578-A584 HydrophobicContact CG2-CB 4.41Å; I578-H587 HydrophobicContact CD1-CB 4.11Å
579	S	56.9	Low	68.1	Low	133 Å²	133	70.2 Å²	70.2	93%	0.93	36%	0.358	S	S	*	.			trans	-72.9	-15.2	-177.2	84.5	0	0	0	0	115.4
580	S	66.4	Low	67.7	Low	45 Å²	45	77.7 Å²	77.7	32%	0.315	39%	0.386	S	S	.	.			trans	-107.7	120.6	-173.9	177.3	0	0	0	0	111.7	I578 R582 K583 A584	I578-S580 VanDerWaalsContact C-N 3.29Å; I578-S580 PolarHBondContact O-N 3.24Å; S580-R582 PolarHBondContact O-N 3.13Å; S580-R582 VanDerWaalsContact O-N 3.17Å; S580-K583 WeakPolarHBondContact O-CA 3.47Å; S580-K583 WeakPolarHBondContact O-CB 3.24Å; S580-K583 PolarHBondContact O-N 3.12Å; S580-A584 PolarHBondContact O-N 3.04Å
581	R	65.2	Low	67.5	Low	136 Å²	136	77.7 Å²	77.7	51%	0.513	39%	0.389	S	S	.	.	H	α-helix	trans	-53.8	-35.3	176.3	-168	172.6	179.1	162.3	3.2	113.5	V585	R581-V585 VanDerWaalsContact O-CG2 3.29Å; R581-V585 WeakPolarHBondContact O-CG2 3.4Å; R581-V585 PolarHBondContact O-N 3.3Å
582	R	67.6	Low	67.4	Low	198 Å²	198	73.8 Å²	73.8	75%	0.747	37%	0.368	S	S	*	.	H	α-helix	trans	-69.2	-37.3	175.3	-70.6	-173.1	-166.7	164.2	3.3	112.5	S580 K586	S580-R582 PolarHBondContact O-N 3.13Å; S580-R582 VanDerWaalsContact O-N 3.17Å; R582-K586 WeakPolarHBondContact O-CG 3.47Å; R582-K586 PolarHBondContact O-N 3.26Å; R582-K586 VanDerWaalsContact O-N 3.08Å
583	K	71.1	Confident	67	Low	145 Å²	145	76.1 Å²	76.1	63%	0.63	39%	0.387	S	S	*	.	H	α-helix	trans	-71.7	-37.9	176.9	-68.5	-175.5	179.4	-178.4	0	111	I578 S580 K586 H587	I578-K583 HydrophobicContact CG2-CB 3.49Å; I578-K583 VanDerWaalsContact CG2-CB 3.49Å; S580-K583 WeakPolarHBondContact O-CA 3.47Å; S580-K583 WeakPolarHBondContact O-CB 3.24Å; S580-K583 PolarHBondContact O-N 3.12Å; K583-K586 PolarHBondContact O-N 3.42Å; K583-H587 WeakPolarHBondContact O-CB 3.2Å; K583-H587 PolarHBondContact O-N 2.98Å
584	A	69.6	Low	66.5	Low	2 Å²	2	81.9 Å²	81.9	2%	0.017	41%	0.414	C	S	.	.	H	α-helix	trans	-60.1	-50.1	173.2	0	0	0	0	0	111.5	I575 I578 S580 K586 H587 V588	I575-A584 HydrophobicContact CG2-CB 3.52Å; I578-A584 HydrophobicContact CG2-CB 4.41Å; S580-A584 PolarHBondContact O-N 3.04Å; A584-K586 VanDerWaalsContact C-N 3.35Å; A584-K586 PolarHBondContact O-N 3.28Å; A584-H587 PolarHBondContact O-N 3.02Å; A584-H587 VanDerWaalsContact O-N 3.16Å; A584-V588 WeakPolarHBondContact O-CG2 3.35Å; A584-V588 PolarHBondContact O-N 3.34Å
585	V	73.1	Confident	66.3	Low	14 Å²	14	87.4 Å²	87.4	9%	0.085	43%	0.433	C	S	.	.	H	α-helix	trans	-58.2	-45.5	175.6	170	0	0	0	0	111.4	R515 F551 R581 H587 V588 S589	R515-V585 HydrophobicContact CG-CG1 4.09Å; F551-V585 HydrophobicContact CE1-CG2 3.85Å; F551-V585 HydrophobicContact CZ-CG2 3.81Å; R581-V585 VanDerWaalsContact O-CG2 3.29Å; R581-V585 WeakPolarHBondContact O-CG2 3.4Å; R581-V585 PolarHBondContact O-N 3.3Å; V585-H587 VanDerWaalsContact C-N 3.32Å; V585-H587 PolarHBondContact O-N 3.4Å; V585-V588 PolarHBondContact O-N 3.42Å; V585-S589 PolarHBondContact O-N 3.18Å; V585-S589 PolarHBondContact O-OG 2.67Å
586	K	72.9	Confident	66.3	Low	144 Å²	144	89.4 Å²	89.4	63%	0.626	44%	0.44	S	S	*	.	H	α-helix	trans	-61.5	-38.3	176.8	-77	-177.1	178.5	-166.6	0	113.2	R582 K583 A584 R590	R582-K586 WeakPolarHBondContact O-CG 3.47Å; R582-K586 PolarHBondContact O-N 3.26Å; R582-K586 VanDerWaalsContact O-N 3.08Å; K583-K586 PolarHBondContact O-N 3.42Å; A584-K586 VanDerWaalsContact C-N 3.35Å; A584-K586 PolarHBondContact O-N 3.28Å; K586-R590 PolarHBondContact O-N 3.1Å
587	H	75.1	Confident	66.8	Low	65 Å²	65	89.9 Å²	89.9	30%	0.301	44%	0.444	S	S	.	.	H	α-helix	trans	-66.7	-45.8	177.2	-171.2	67.3	0	0	0	110.9	I578 K583 A584 V585 R590 L591	I578-H587 HydrophobicContact CD1-CB 4.11Å; K583-H587 WeakPolarHBondContact O-CB 3.2Å; K583-H587 PolarHBondContact O-N 2.98Å; A584-H587 PolarHBondContact O-N 3.02Å; A584-H587 VanDerWaalsContact O-N 3.16Å; V585-H587 VanDerWaalsContact C-N 3.32Å; V585-H587 PolarHBondContact O-N 3.4Å; H587-R590 WeakPolarHBondContact O-CB 3.35Å; H587-R590 PolarHBondContact O-N 3.27Å; H587-L591 WeakPolarHBondContact O-CB 3.45Å; H587-L591 PolarHBondContact O-N 2.83Å
588	V	71.7	Confident	67.7	Low	4 Å²	4	81.3 Å²	81.3	2%	0.024	40%	0.403	C	S	.	.	H	α-helix	trans	-62.7	-44.2	176.4	174.5	0	0	0	0	111.6	F551 I575 A584 V585 R590 L591 L592	F551-V588 HydrophobicContact CB-CG1 4.01Å; F551-V588 HydrophobicContact CB-CG2 4.45Å; F551-V588 HydrophobicContact CD1-CG1 4.48Å; F551-V588 HydrophobicContact CD2-CG2 3.72Å; F551-V588 HydrophobicContact CE2-CG2 4.11Å; F551-V588 HydrophobicContact CG-CG1 4.12Å; F551-V588 HydrophobicContact CG-CG2 4.05Å; I575-V588 HydrophobicContact CD1-CG2 3.3Å; I575-V588 HydrophobicContact CG1-CG2 4.32Å; A584-V588 WeakPolarHBondContact O-CG2 3.35Å; A584-V588 PolarHBondContact O-N 3.34Å; V585-V588 PolarHBondContact O-N 3.42Å; V588-R590 PolarHBondContact O-N 3.29Å; V588-L591 CarbonylContact O-C 3.44Å; V588-L591 PolarHBondContact O-N 3.2Å; V588-L591 VanDerWaalsContact O-N 3.12Å; V588-L592 HydrophobicContact CG1-CD1 3.85Å; V588-L592 HydrophobicContact CG1-CG 4.2Å; V588-L592 WeakPolarHBondContact O-CG 3.33Å; V588-L592 PolarHBondContact O-N 2.98Å
589	S	71.6	Confident	68.5	Low	30 Å²	30	80.8 Å²	80.8	21%	0.21	40%	0.399	C	S	.	.	H	α-helix	trans	-59.6	-34.8	176.6	-56.9	0	0	0	0	112.3	V585 C593	V585-S589 PolarHBondContact O-N 3.18Å; V585-S589 PolarHBondContact O-OG 2.67Å; S589-C593 PolarHBondContact O-N 2.89Å; S589-C593 PolarHBondContact O-SG 3.28Å; S589-C593 VanDerWaalsContact O-SG 3.41Å
590	R	71.8	Confident	69.5	Low	158 Å²	158	81.3 Å²	81.3	60%	0.596	39%	0.392	S	S	*	.	H	α-helix	trans	-70.9	-43.8	173.9	-171.2	-175.8	-62.2	158.7	-2.5	111.6	K586 H587 V588 L592 C593 E594	K586-R590 PolarHBondContact O-N 3.1Å; H587-R590 WeakPolarHBondContact O-CB 3.35Å; H587-R590 PolarHBondContact O-N 3.27Å; V588-R590 PolarHBondContact O-N 3.29Å; R590-L592 VanDerWaalsContact C-N 3.25Å; R590-L592 PolarHBondContact O-N 2.87Å; R590-C593 PolarHBondContact O-N 2.96Å; R590-C593 VanDerWaalsContact O-N 3.08Å; R590-E594 PolarHBondContact O-N 2.94Å
591	L	69.8	Low	70.3	Confident	38 Å²	38	83.6 Å²	83.6	20%	0.199	40%	0.397	C	S	.	.	H	α-helix	trans	-67.4	-24.2	179.3	-150.9	165.2	0	0	0	112.4	H587 V588 Y598	H587-L591 WeakPolarHBondContact O-CB 3.45Å; H587-L591 PolarHBondContact O-N 2.83Å; V588-L591 CarbonylContact O-C 3.44Å; V588-L591 PolarHBondContact O-N 3.2Å; V588-L591 VanDerWaalsContact O-N 3.12Å; L591-Y598 HydrophobicContact CD2-CD1 3.59Å; L591-Y598 HydrophobicContact CD2-CE1 3.71Å
592	L	67.9	Low	71	Confident	22 Å²	22	84.6 Å²	84.6	12%	0.115	40%	0.401	C	S	.	.	H	α-helix	trans	-79.6	-23.7	171.7	-69.7	170	0	0	0	113	T549 V588 R590	T549-L592 HydrophobicContact CG2-CD1 4.08Å; T549-L592 HydrophobicContact CG2-CD2 3.73Å; V588-L592 HydrophobicContact CG1-CD1 3.85Å; V588-L592 HydrophobicContact CG1-CG 4.2Å; V588-L592 WeakPolarHBondContact O-CG 3.33Å; V588-L592 PolarHBondContact O-N 2.98Å; R590-L592 VanDerWaalsContact C-N 3.25Å; R590-L592 PolarHBondContact O-N 2.87Å
593	C	59.9	Low	71.7	Confident	94 Å²	94	75.6 Å²	75.6	64%	0.635	37%	0.368	S	S	*	.	H	α-helix	trans	-83.7	-33	174.8	-71.7	0	0	0	0	112.8	S589 R590	S589-C593 PolarHBondContact O-N 2.89Å; S589-C593 PolarHBondContact O-SG 3.28Å; S589-C593 VanDerWaalsContact O-SG 3.41Å; R590-C593 PolarHBondContact O-N 2.96Å; R590-C593 VanDerWaalsContact O-N 3.08Å
594	E	58.1	Low	72	Confident	131 Å²	131	75.8 Å²	75.8	61%	0.612	37%	0.37	S	S	*	.	S	Bend	trans	-82	130.8	169.4	-71.3	173.2	-176	0	0	108.6	R590 R596	R590-E594 PolarHBondContact O-N 2.94Å; E594-R596 PolarHBondContact O-N 2.66Å
595	N	59.2	Low	72.8	Confident	161 Å²	161	79.8 Å²	79.8	86%	0.861	39%	0.385	S	S	*	.			trans	-34	120.9	-175.6	-86.8	-20.9	0	0	0	113.1	S597	N595-S597 PolarHBondContact O-N 2.73Å
596	R	67.6	Low	73.6	Confident	42 Å²	42	79.6 Å²	79.6	16%	0.158	38%	0.384	C	S	.	.			trans	-60.1	68	-170.1	-58.9	-176	-176.7	177.6	8.5	113.6	E492 R496 S544 D547 E594 Y598 Q599	E492-R596 IonicContact OE2-NH1 3.53Å; R496-R596 VanDerWaalsContact NH2-NH1 3.2Å; S544-R596 PolarHBondContact O-NH2 3.04Å; D547-R596 IonicContact OD2-NH2 2.73Å; D547-R596 PolarHBondContact OD2-NH2 3.19Å; E594-R596 PolarHBondContact O-N 2.66Å; R596-Y598 HydrophobicContact CB-CE1 4.23Å; R596-Y598 PolarHBondContact O-N 2.78Å; R596-Y598 VanDerWaalsContact O-N 3.15Å; R596-Q599 HydrophobicContact CB-CG 3.85Å; R596-Q599 WeakPolarHBondContact O-CB 3.41Å; R596-Q599 PolarHBondContact O-N 3.05Å
597	S	68.9	Low	74.5	Confident	83 Å²	83	75.3 Å²	75.3	58%	0.58	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-62.7	-26.2	-169.7	58.7	0	0	0	0	114	N595 Q599	N595-S597 PolarHBondContact O-N 2.73Å; S597-Q599 VanDerWaalsContact C-N 3.3Å; S597-Q599 PolarHBondContact O-N 3.1Å
598	Y	75.6	Confident	75.2	Confident	11 Å²	11	72.5 Å²	72.5	4%	0.043	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-70.7	-21.4	176.3	70.1	-88.9	0	0	0	113.5	E492 L550 L591 R596 N600 Q601	E492-Y598 PolarHBondContact OE1-OH 3.03Å; L550-Y598 HydrophobicContact CD1-CD2 4.28Å; L550-Y598 HydrophobicContact CD1-CE2 4.02Å; L591-Y598 HydrophobicContact CD2-CD1 3.59Å; L591-Y598 HydrophobicContact CD2-CE1 3.71Å; R596-Y598 HydrophobicContact CB-CE1 4.23Å; R596-Y598 PolarHBondContact O-N 2.78Å; R596-Y598 VanDerWaalsContact O-N 3.15Å; Y598-N600 VanDerWaalsContact C-N 3.26Å; Y598-N600 PolarHBondContact O-N 3.1Å; Y598-Q601 WeakPolarHBondContact O-CB 3.43Å; Y598-Q601 PolarHBondContact O-N 3.17Å; Y598-Q601 VanDerWaalsContact O-N 3.09Å
599	Q	78.8	Confident	76.1	Confident	40 Å²	40	72.3 Å²	72.3	19%	0.187	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-65.3	-30.3	-177.7	-73.4	-175.9	-27	0	0	113	G489 E492 R596 S597 Q601	G489-Q599 PolarHBondContact N-O 3.15Å; E492-Q599 PolarHBondContact OE2-NE2 3.22Å; R596-Q599 HydrophobicContact CB-CG 3.85Å; R596-Q599 WeakPolarHBondContact O-CB 3.41Å; R596-Q599 PolarHBondContact O-N 3.05Å; S597-Q599 VanDerWaalsContact C-N 3.3Å; S597-Q599 PolarHBondContact O-N 3.1Å; Q599-Q601 VanDerWaalsContact C-N 3.31Å
600	N	78	Confident	77.1	Confident	144 Å²	144	70.9 Å²	70.9	77%	0.77	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-82.7	-7.5	177.6	-66.9	-17.2	0	0	0	113	Y598	Y598-N600 VanDerWaalsContact C-N 3.26Å; Y598-N600 PolarHBondContact O-N 3.1Å
601	Q	81.9	Confident	78.2	Confident	93 Å²	93	63.4 Å²	63.4	44%	0.435	31%	0.313	S	S	.	.	S	Bend	trans	-75.9	143.8	176.4	-64.4	179.6	0.9	0	0	110.7	Y488 Y598 Q599	Y488-Q601 HydrophobicContact CD2-CB 4Å; Y488-Q601 WeakPolarHBondContact CD2-O 3.18Å; Y488-Q601 HydrophobicContact CE2-CB 4.28Å; Y488-Q601 PolarHBondContact N-O 3.2Å; Y598-Q601 WeakPolarHBondContact O-CB 3.43Å; Y598-Q601 PolarHBondContact O-N 3.17Å; Y598-Q601 VanDerWaalsContact O-N 3.09Å; Q599-Q601 VanDerWaalsContact C-N 3.31Å
602	R	81.9	Confident	79.3	Confident	157 Å²	157	61.6 Å²	61.6	59%	0.592	30%	0.303	S	S	*	.	B	Isolated β-bridge	trans	-72.5	143.6	175.8	-64.3	-178.5	179.9	-177.7	-6.1	110.2	E484 Y488 F604	E484-R602 IonicContact OE1-NH2 2.8Å; Y488-R602 WeakPolarHBondContact CE2-O 3.43Å; R602-F604 PolarHBondContact O-N 2.94Å
603	C	81.5	Confident	80.5	Confident	9 Å²	9	60.5 Å²	60.5	6%	0.061	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-70.5	126.6	174.7	-170.8	0	0	0	0	110.5	L486 Y488 Y605 P606 S609	L486-C603 HydrophobicContact CD2-CB 4.02Å; L486-C603 HydrophobicContact CG-CB 4.3Å; L486-C603 WeakPolarHBondContact O-CB 3.49Å; L486-C603 PolarHBondContact O-N 3.33Å; Y488-C603 HydrophobicContact CE1-CB 4.23Å; C603-Y605 VanDerWaalsContact C-N 3.29Å; C603-Y605 PolarHBondContact O-N 3.26Å; C603-P606 HydrophobicContact CB-CB 4.36Å; C603-S609 PolarHBondContact SG-OG 3.02Å
604	F	77.8	Confident	82.1	Confident	149 Å²	149	56 Å²	56	65%	0.654	27%	0.267	S	S	*	.	S	Bend	trans	-64.8	-31.8	177.9	-72	-74.6	0	0	0	113.3	Y488 R602	Y488-F604 PolarHBondContact OH-N 2.97Å; R602-F604 PolarHBondContact O-N 2.94Å
605	Y	85.9	Confident	83.8	Confident	87 Å²	87	49.8 Å²	49.8	34%	0.341	24%	0.238	S	C	.	.	S	Bend	trans	-132.8	72.8	-177.7	-54	-62.2	0	0	0	110.8	C603 W607 A608 S609 P695 V696	C603-Y605 VanDerWaalsContact C-N 3.29Å; C603-Y605 PolarHBondContact O-N 3.26Å; Y605-W607 PolarHBondContact O-N 3.28Å; Y605-A608 PolarHBondContact O-N 2.79Å; Y605-S609 PolarHBondContact O-N 3.18Å; Y605-S609 VanDerWaalsContact O-N 3.09Å; Y605-S609 PolarHBondContact O-OG 2.95Å; Y605-P695 PolarHBondContact OH-O 3.18Å; Y605-V696 HydrophobicContact CD1-CG1 4.39Å; Y605-V696 HydrophobicContact CD1-CG2 3.83Å; Y605-V696 HydrophobicContact CD2-CB 4.49Å; Y605-V696 HydrophobicContact CD2-CG1 4.16Å; Y605-V696 HydrophobicContact CE1-CG2 3.7Å; Y605-V696 HydrophobicContact CE2-CB 4.48Å; Y605-V696 HydrophobicContact CE2-CG2 4.42Å; Y605-V696 HydrophobicContact CG-CG1 4.02Å; Y605-V696 HydrophobicContact CG-CG2 4.26Å
606	P	89.7	Confident	85.4	Confident	9 Å²	9	42.4 Å²	42.4	6%	0.058	20%	0.199	C	C	.	.	H	α-helix	trans	-68.4	-40.5	-167	26.5	-34.2	0	0	0	113.1	I482 T483 L486 C603 A608 S609 L610	I482-P606 HydrophobicContact CG2-CB 4.04Å; I482-P606 HydrophobicContact CG2-CG 4.46Å; T483-P606 HydrophobicContact CG2-CG 3.83Å; L486-P606 HydrophobicContact CB-CB 3.9Å; L486-P606 HydrophobicContact CD2-CB 3.66Å; L486-P606 WeakPolarHBondContact CD2-O 3.27Å; L486-P606 HydrophobicContact CG-CB 4.43Å; C603-P606 HydrophobicContact CB-CB 4.36Å; P606-A608 PolarHBondContact O-N 3.45Å; P606-S609 PolarHBondContact O-N 2.85Å; P606-L610 PolarHBondContact O-N 3Å
607	W	91.4	Very high	86.4	Confident	54 Å²	54	41.5 Å²	41.5	21%	0.205	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-40.7	176.2	-65.1	113.1	0	0	0	112.7	T476 I482 Y605 L610 F611 F625 F626 M629	T476-W607 HydrophobicContact CG2-CH2 4.19Å; I482-W607 HydrophobicContact CB-CH2 4.43Å; I482-W607 HydrophobicContact CB-CZ2 4.04Å; I482-W607 HydrophobicContact CD1-CE3 4.17Å; I482-W607 HydrophobicContact CD1-CH2 3.02Å; I482-W607 HydrophobicContact CD1-CZ2 3.48Å; I482-W607 VanDerWaalsContact CD1-CZ2 3.48Å; I482-W607 HydrophobicContact CD1-CZ3 3.38Å; I482-W607 HydrophobicContact CG1-CH2 4.26Å; I482-W607 HydrophobicContact CG1-CZ2 4.33Å; I482-W607 HydrophobicContact CG2-CD2 4.24Å; I482-W607 HydrophobicContact CG2-CE3 4.46Å; I482-W607 HydrophobicContact CG2-CZ2 4.4Å; Y605-W607 PolarHBondContact O-N 3.28Å; W607-L610 PolarHBondContact O-N 2.5Å; W607-F611 VanDerWaalsContact O-CB 3.23Å; W607-F611 WeakPolarHBondContact O-CB 3.35Å; W607-F611 PolarHBondContact O-N 3.03Å; W607-F625 HydrophobicContact CH2-CE1 4.47Å; W607-F625 HydrophobicContact CZ3-CE1 4.19Å; W607-F626 AromaticContact CE3-CD1 3.97Å; W607-F626 HydrophobicContact CE3-CD1 3.97Å; W607-F626 AromaticContact CZ3-CD1 3.86Å; W607-F626 HydrophobicContact CZ3-CD1 3.86Å; W607-F626 HydrophobicContact CZ3-CE1 4.33Å; W607-M629 HydrophobicContact CD2-CB 3.63Å; W607-M629 HydrophobicContact CE3-CB 3.46Å; W607-M629 VanDerWaalsContact CE3-CB 3.46Å; W607-M629 HydrophobicContact CE3-CG 4.18Å; W607-M629 HydrophobicContact CG-CB 4.31Å; W607-M629 HydrophobicContact CH2-CB 3.56Å; W607-M629 HydrophobicContact CH2-CG 3.48Å; W607-M629 VanDerWaalsContact CH2-CG 3.48Å; W607-M629 HydrophobicContact CH2-SD 4.25Å; W607-M629 HydrophobicContact CZ2-CB 3.82Å; W607-M629 HydrophobicContact CZ2-CG 4.05Å; W607-M629 HydrophobicContact CZ2-SD 4.47Å; W607-M629 HydrophobicContact CZ3-CB 3.43Å; W607-M629 VanDerWaalsContact CZ3-CB 3.43Å; W607-M629 HydrophobicContact CZ3-CG 3.6Å
608	A	90.4	Very high	87.5	Confident	7 Å²	7	39 Å²	39	6%	0.058	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-40.3	176.4	0	0	0	0	0	111.6	F568 Y605 P606 F611 I612 V696	F568-A608 HydrophobicContact CZ-CB 4.38Å; Y605-A608 PolarHBondContact O-N 2.79Å; P606-A608 PolarHBondContact O-N 3.45Å; A608-F611 PolarHBondContact O-N 2.87Å; A608-I612 VanDerWaalsContact O-CG1 3.23Å; A608-I612 WeakPolarHBondContact O-CG1 3.5Å; A608-I612 PolarHBondContact O-N 3.43Å; A608-V696 HydrophobicContact CB-CG1 3.93Å
609	S	90.6	Very high	88.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-42.8	175.4	-71.6	0	0	0	0	112.9	Y569 C603 Y605 P606 I612 W613	Y569-S609 PolarHBondContact OH-OG 3.46Å; C603-S609 PolarHBondContact SG-OG 3.02Å; Y605-S609 PolarHBondContact O-N 3.18Å; Y605-S609 VanDerWaalsContact O-N 3.09Å; Y605-S609 PolarHBondContact O-OG 2.95Å; P606-S609 PolarHBondContact O-N 2.85Å; S609-I612 PolarHBondContact O-N 2.97Å; S609-W613 WeakPolarHBondContact O-CB 3.12Å; S609-W613 PolarHBondContact O-N 3.2Å
610	L	92.7	Very high	88.9	Confident	0 Å²	0	41 Å²	41	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.3	-38.9	175.3	-72.6	176.3	0	0	0	112.1	L464 I482 L486 L494 P606 W607 W613 A614 F626	L464-L610 HydrophobicContact CD1-CD2 4.3Å; I482-L610 HydrophobicContact CG2-CD1 3.86Å; L486-L610 HydrophobicContact CD1-CD2 4.01Å; L486-L610 HydrophobicContact CD1-CG 4.4Å; L486-L610 HydrophobicContact CD2-CG 4.12Å; L494-L610 HydrophobicContact CD1-CD2 4.05Å; P606-L610 PolarHBondContact O-N 3Å; W607-L610 PolarHBondContact O-N 2.5Å; L610-W613 PolarHBondContact O-N 2.92Å; L610-A614 WeakPolarHBondContact O-CB 3.49Å; L610-A614 PolarHBondContact O-N 2.93Å; L610-F626 HydrophobicContact CB-CD1 4.31Å; L610-F626 HydrophobicContact CB-CD2 3.89Å; L610-F626 HydrophobicContact CB-CE1 4.31Å; L610-F626 HydrophobicContact CB-CE2 3.89Å; L610-F626 HydrophobicContact CB-CG 4.11Å; L610-F626 HydrophobicContact CB-CZ 4.09Å; L610-F626 HydrophobicContact CD1-CE1 4.14Å; L610-F626 HydrophobicContact CD1-CZ 4.27Å; L610-F626 WeakPolarHBondContact O-CD2 3.35Å
611	F	94.5	Very high	89.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.2	-49.5	172.2	174	-102.9	0	0	0	111.4	W607 A608 W613 A614 V615 A623 F626 W627 T636 F667	W607-F611 VanDerWaalsContact O-CB 3.23Å; W607-F611 WeakPolarHBondContact O-CB 3.35Å; W607-F611 PolarHBondContact O-N 3.03Å; A608-F611 PolarHBondContact O-N 2.87Å; F611-W613 VanDerWaalsContact C-N 3.32Å; F611-W613 PolarHBondContact O-N 3.37Å; F611-A614 PolarHBondContact O-N 2.99Å; F611-V615 HydrophobicContact CD1-CG2 4.24Å; F611-V615 HydrophobicContact CD2-CG2 3.99Å; F611-V615 HydrophobicContact CE1-CG2 3.89Å; F611-V615 HydrophobicContact CE2-CG2 3.6Å; F611-V615 HydrophobicContact CG-CG2 4.3Å; F611-V615 HydrophobicContact CZ-CG2 3.57Å; F611-V615 WeakPolarHBondContact O-CB 3.2Å; F611-V615 VanDerWaalsContact O-CG2 3.24Å; F611-V615 WeakPolarHBondContact O-CG2 3.07Å; F611-V615 PolarHBondContact O-N 3.11Å; F611-A623 WeakPolarHBondContact CD2-O 3.5Å; F611-A623 HydrophobicContact CE2-CB 4.43Å; F611-F626 HydrophobicContact CB-CB 4.02Å; F611-F626 HydrophobicContact CD2-CB 4.48Å; F611-W627 HydrophobicContact CD2-CB 3.92Å; F611-W627 HydrophobicContact CE2-CB 3.76Å; F611-W627 HydrophobicContact CE2-CG 4.47Å; F611-T636 HydrophobicContact CD1-CG2 3.51Å; F611-T636 HydrophobicContact CD2-CG2 4.41Å; F611-T636 HydrophobicContact CE1-CG2 3.51Å; F611-T636 WeakPolarHBondContact CE1-O 3.32Å; F611-T636 HydrophobicContact CE2-CG2 4.41Å; F611-T636 HydrophobicContact CG-CG2 3.97Å; F611-T636 HydrophobicContact CZ-CG2 3.97Å; F611-F667 AromaticContact CE2-CE1 3.73Å; F611-F667 HydrophobicContact CE2-CE1 3.73Å; F611-F667 HydrophobicContact CE2-CE2 4.31Å; F611-F667 AromaticContact CE2-CZ 3.61Å; F611-F667 HydrophobicContact CE2-CZ 3.61Å; F611-F667 HydrophobicContact CZ-CE1 4.15Å; F611-F667 HydrophobicContact CZ-CE2 4.45Å; F611-F667 HydrophobicContact CZ-CZ 4.11Å
612	I	92.9	Very high	90.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57.2	-46.7	175.6	-71.3	166.1	0	0	0	110.6	L557 F568 A608 S609 A614 V615 L616 M643 W697	L557-I612 HydrophobicContact CD1-CD1 4.48Å; L557-I612 HydrophobicContact CD1-CG2 4.14Å; L557-I612 HydrophobicContact CD2-CG2 3.63Å; L557-I612 HydrophobicContact CG-CG2 4.46Å; F568-I612 HydrophobicContact CD2-CD1 4.45Å; F568-I612 HydrophobicContact CE1-CD1 4.36Å; F568-I612 HydrophobicContact CE2-CD1 4.25Å; F568-I612 HydrophobicContact CZ-CD1 4.22Å; A608-I612 VanDerWaalsContact O-CG1 3.23Å; A608-I612 WeakPolarHBondContact O-CG1 3.5Å; A608-I612 PolarHBondContact O-N 3.43Å; S609-I612 PolarHBondContact O-N 2.97Å; I612-A614 PolarHBondContact O-N 3.44Å; I612-V615 PolarHBondContact O-N 3.4Å; I612-L616 HydrophobicContact CG2-CD1 3.81Å; I612-L616 HydrophobicContact CG2-CG 4.3Å; I612-L616 WeakPolarHBondContact O-CB 3.44Å; I612-L616 WeakPolarHBondContact O-CG 3.12Å; I612-L616 PolarHBondContact O-N 3.29Å; I612-M643 HydrophobicContact CB-CE 4.4Å; I612-M643 HydrophobicContact CG1-CE 4.42Å; I612-M643 HydrophobicContact CG1-SD 4.4Å; I612-M643 HydrophobicContact CG2-CE 3.88Å; I612-W697 HydrophobicContact CD1-CH2 3.74Å; I612-W697 HydrophobicContact CD1-CZ3 3.96Å; I612-W697 HydrophobicContact CG1-CH2 3.7Å; I612-W697 HydrophobicContact CG1-CZ3 4.28Å
613	W	92.8	Very high	90.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.6	-40.7	178.8	171.3	87.9	0	0	0	112.9	L464 L494 Y495 S609 L610 F611 Q617 M622 F626	L464-W613 HydrophobicContact CB-CH2 4.11Å; L464-W613 WeakPolarHBondContact O-CH2 3.43Å; L494-W613 PolarHBondContact O-NE1 3.42Å; Y495-W613 AromaticContact CD1-CD1 3.81Å; Y495-W613 HydrophobicContact CE1-CB 4.2Å; Y495-W613 AromaticContact CE1-CD1 3.74Å; Y495-W613 HydrophobicContact CE1-CG 4.36Å; Y495-W613 HydrophobicContact CE2-CB 4.48Å; S609-W613 WeakPolarHBondContact O-CB 3.12Å; S609-W613 PolarHBondContact O-N 3.2Å; L610-W613 PolarHBondContact O-N 2.92Å; F611-W613 VanDerWaalsContact C-N 3.32Å; F611-W613 PolarHBondContact O-N 3.37Å; W613-Q617 VanDerWaalsContact CD2-NE2 3.34Å; W613-Q617 VanDerWaalsContact CZ2-NE2 3.26Å; W613-Q617 PolarHBondContact O-NE2 3.41Å; W613-M622 HydrophobicContact CZ3-CE 4.33Å; W613-F626 HydrophobicContact CE3-CE2 4.4Å; W613-F626 HydrophobicContact CZ3-CE2 4.38Å
614	A	93.6	Very high	91.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-70.9	-44.3	177.7	0	0	0	0	0	112.4	L610 F611 I612 L616 Q617 N618 R619 M622 A623 F626	L610-A614 WeakPolarHBondContact O-CB 3.49Å; L610-A614 PolarHBondContact O-N 2.93Å; F611-A614 PolarHBondContact O-N 2.99Å; I612-A614 PolarHBondContact O-N 3.44Å; A614-L616 PolarHBondContact O-N 3.23Å; A614-Q617 PolarHBondContact O-N 2.9Å; A614-N618 PolarHBondContact O-N 3.45Å; A614-R619 PolarHBondContact O-N 3.32Å; A614-R619 VanDerWaalsContact O-N 3.17Å; A614-M622 HydrophobicContact CB-CB 4.18Å; A614-A623 HydrophobicContact CB-CB 4.05Å; A614-F626 HydrophobicContact CB-CD2 3.86Å; A614-F626 HydrophobicContact CB-CE2 4.07Å
615	V	94	Very high	91.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.4	-42.2	179.4	170.1	0	0	0	0	111.5	F611 I612 Q617 N618 A623 M643 L644 F667	F611-V615 HydrophobicContact CD1-CG2 4.24Å; F611-V615 HydrophobicContact CD2-CG2 3.99Å; F611-V615 HydrophobicContact CE1-CG2 3.89Å; F611-V615 HydrophobicContact CE2-CG2 3.6Å; F611-V615 HydrophobicContact CG-CG2 4.3Å; F611-V615 HydrophobicContact CZ-CG2 3.57Å; F611-V615 WeakPolarHBondContact O-CB 3.2Å; F611-V615 VanDerWaalsContact O-CG2 3.24Å; F611-V615 WeakPolarHBondContact O-CG2 3.07Å; F611-V615 PolarHBondContact O-N 3.11Å; I612-V615 PolarHBondContact O-N 3.4Å; V615-Q617 PolarHBondContact O-N 2.89Å; V615-N618 PolarHBondContact O-N 3.27Å; V615-N618 VanDerWaalsContact O-N 3.13Å; V615-A623 HydrophobicContact CG2-CB 3.9Å; V615-M643 HydrophobicContact CB-CE 4.44Å; V615-M643 HydrophobicContact CG1-CB 4.19Å; V615-M643 HydrophobicContact CG1-CE 4.09Å; V615-L644 HydrophobicContact CG1-CD1 4.14Å; V615-L644 HydrophobicContact CG1-CD2 3.84Å; V615-L644 HydrophobicContact CG1-CG 3.64Å; V615-F667 HydrophobicContact CG2-CE2 4.35Å
616	L	92	Very high	92.3	Very high	6 Å²	6	18.7 Å²	18.7	3%	0.031	10%	0.095	C	C	.	.	H	α-helix	trans	-64.5	-22.2	179.1	-70.5	173.3	0	0	0	113.5	Y495 L504 L557 L560 I612 A614 M643 L647	Y495-L616 HydrophobicContact CE1-CD1 4.08Å; L504-L616 HydrophobicContact CD1-CB 4.07Å; L504-L616 HydrophobicContact CD1-CD1 3.97Å; L504-L616 HydrophobicContact CD1-CD2 4.44Å; L504-L616 HydrophobicContact CD1-CG 4.39Å; L504-L616 HydrophobicContact CD2-CB 3.75Å; L504-L616 HydrophobicContact CD2-CD1 4.43Å; L504-L616 HydrophobicContact CG-CB 4.41Å; L557-L616 HydrophobicContact CD2-CD1 4.28Å; L560-L616 HydrophobicContact CD1-CD2 3.4Å; I612-L616 HydrophobicContact CG2-CD1 3.81Å; I612-L616 HydrophobicContact CG2-CG 4.3Å; I612-L616 WeakPolarHBondContact O-CB 3.44Å; I612-L616 WeakPolarHBondContact O-CG 3.12Å; I612-L616 PolarHBondContact O-N 3.29Å; A614-L616 PolarHBondContact O-N 3.23Å; L616-M643 HydrophobicContact CD1-CE 4.43Å; L616-M643 HydrophobicContact CD2-CE 3.54Å; L616-M643 HydrophobicContact CG-CE 3.67Å; L616-L647 HydrophobicContact CD2-CD1 3.95Å
617	Q	90.1	Very high	92.5	Very high	23 Å²	23	18.4 Å²	18.4	11%	0.107	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	1.4	177.3	-73.8	174	82	0	0	113.6	V498 L504 W613 A614 V615 R619	V498-Q617 HydrophobicContact CG1-CG 4.49Å; V498-Q617 HydrophobicContact CG2-CG 4.42Å; L504-Q617 HydrophobicContact CD2-CG 4.06Å; W613-Q617 VanDerWaalsContact CD2-NE2 3.34Å; W613-Q617 VanDerWaalsContact CZ2-NE2 3.26Å; W613-Q617 PolarHBondContact O-NE2 3.41Å; A614-Q617 PolarHBondContact O-N 2.9Å; V615-Q617 PolarHBondContact O-N 2.89Å; Q617-R619 VanDerWaalsContact C-N 3.32Å; Q617-R619 HydrophobicContact CB-CG 4.04Å; Q617-R619 PolarHBondContact O-N 2.91Å
618	N	91.9	Very high	92.4	Very high	31 Å²	31	19.1 Å²	19.1	17%	0.166	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	35.3	-176.3	-163	39.9	0	0	0	114.1	A614 V615 T620 S659 M660	A614-N618 PolarHBondContact O-N 3.45Å; V615-N618 PolarHBondContact O-N 3.27Å; V615-N618 VanDerWaalsContact O-N 3.13Å; N618-T620 PolarHBondContact O-N 3.02Å; N618-S659 PolarHBondContact ND2-OG 2.95Å; N618-M660 HydrophobicContact CB-CE 4.08Å; N618-M660 HydrophobicContact CB-CG 4.22Å; N618-M660 WeakPolarHBondContact OD1-CG 3.32Å
619	R	91.4	Very high	92.4	Very high	24 Å²	24	22.7 Å²	22.7	9%	0.091	12%	0.115	C	C	.	.			trans	-88.7	99.2	176.2	-64.9	166.5	176.3	-128.9	11.6	110.2	L464 I465 D467 A614 Q617 M622 A623	L464-R619 PolarHBondContact O-NH1 2.92Å; I465-R619 PolarHBondContact O-NH2 2.76Å; D467-R619 VanDerWaalsContact CA-NH1 3.3Å; D467-R619 VanDerWaalsContact CB-NH1 3.28Å; D467-R619 WeakPolarHBondContact OD1-CD 3.46Å; D467-R619 WeakPolarHBondContact OD1-CG 3.44Å; D467-R619 IonicContact OD1-CZ 3.99Å; D467-R619 IonicContact OD1-NE 2.74Å; D467-R619 IonicContact OD1-NH1 3.44Å; D467-R619 PolarHBondContact OD1-NH1 3.24Å; A614-R619 PolarHBondContact O-N 3.32Å; A614-R619 VanDerWaalsContact O-N 3.17Å; Q617-R619 VanDerWaalsContact C-N 3.32Å; Q617-R619 HydrophobicContact CB-CG 4.04Å; Q617-R619 PolarHBondContact O-N 2.91Å; R619-M622 HydrophobicContact CB-CB 4.07Å; R619-M622 HydrophobicContact CB-CG 4.49Å; R619-A623 WeakPolarHBondContact O-CB 3.13Å; R619-A623 PolarHBondContact O-N 2.88Å
620	T	91.8	Very high	92.2	Very high	68 Å²	68	22.9 Å²	22.9	42%	0.417	12%	0.116	S	C	.	.	H	α-helix	trans	-64.6	-58.9	-168.7	55.8	0	0	0	0	112.7	N618 M622 A623 T624 L663	N618-T620 PolarHBondContact O-N 3.02Å; T620-M622 VanDerWaalsContact C-N 3.35Å; T620-M622 PolarHBondContact O-N 3.47Å; T620-A623 PolarHBondContact O-N 2.81Å; T620-T624 WeakPolarHBondContact O-CG2 3.4Å; T620-T624 PolarHBondContact O-N 3.12Å; T620-T624 PolarHBondContact O-OG1 3.12Å; T620-L663 HydrophobicContact CG2-CD1 3.98Å; T620-L663 HydrophobicContact CG2-CD2 4.15Å; T620-L663 HydrophobicContact CG2-CG 4.44Å
621	E	91.7	Very high	91.7	Very high	118 Å²	118	24.6 Å²	24.6	55%	0.551	13%	0.134	S	C	*	.	H	α-helix	trans	-64	-37.5	-175.3	-63.5	-175	-176.3	0	0	112.8	P469 T624 F625	P469-E621 HydrophobicContact CB-CB 4.09Å; P469-E621 HydrophobicContact CG-CB 3.86Å; P469-E621 WeakPolarHBondContact CG-OE2 3.45Å; E621-T624 WeakPolarHBondContact CA-OG1 3.26Å; E621-T624 PolarHBondContact O-OG1 3.01Å; E621-F625 PolarHBondContact O-N 3.02Å; E621-F625 VanDerWaalsContact O-N 3.14Å
622	M	92.7	Very high	91.4	Very high	1 Å²	1	25 Å²	25	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-66.9	-43.9	175.4	-72.3	-68.6	-79.5	0	0	111.7	L464 D467 P469 V472 W613 A614 R619 T620 F625 F626	L464-M622 HydrophobicContact CD2-CE 3.36Å; D467-M622 VanDerWaalsContact OD1-CG 3.32Å; D467-M622 WeakPolarHBondContact OD1-CG 3.49Å; P469-M622 WeakPolarHBondContact CA-SD 3.3Å; P469-M622 HydrophobicContact CB-CG 4.06Å; P469-M622 HydrophobicContact CB-SD 3.6Å; P469-M622 VanDerWaalsContact CB-SD 3.6Å; V472-M622 HydrophobicContact CB-SD 4.5Å; V472-M622 HydrophobicContact CG2-CE 3.75Å; V472-M622 HydrophobicContact CG2-SD 3.82Å; W613-M622 HydrophobicContact CZ3-CE 4.33Å; A614-M622 HydrophobicContact CB-CB 4.18Å; R619-M622 HydrophobicContact CB-CB 4.07Å; R619-M622 HydrophobicContact CB-CG 4.49Å; T620-M622 VanDerWaalsContact C-N 3.35Å; T620-M622 PolarHBondContact O-N 3.47Å; M622-F625 PolarHBondContact O-N 3.27Å; M622-F626 HydrophobicContact CB-CE2 4.31Å; M622-F626 HydrophobicContact CE-CE1 4.47Å; M622-F626 HydrophobicContact CE-CE2 3.73Å; M622-F626 HydrophobicContact CE-CZ 3.47Å; M622-F626 VanDerWaalsContact CE-CZ 3.47Å; M622-F626 WeakPolarHBondContact O-CD2 3.34Å; M622-F626 VanDerWaalsContact O-CG 3.3Å; M622-F626 WeakPolarHBondContact O-CG 3.48Å; M622-F626 PolarHBondContact O-N 3Å; M622-F626 HydrophobicContact SD-CZ 4.5Å
623	A	94.8	Very high	91.3	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.8	-38.1	179.8	0	0	0	0	0	111.8	F611 A614 V615 R619 T620 W627 F667	F611-A623 WeakPolarHBondContact CD2-O 3.5Å; F611-A623 HydrophobicContact CE2-CB 4.43Å; A614-A623 HydrophobicContact CB-CB 4.05Å; V615-A623 HydrophobicContact CG2-CB 3.9Å; R619-A623 WeakPolarHBondContact O-CB 3.13Å; R619-A623 PolarHBondContact O-N 2.88Å; T620-A623 PolarHBondContact O-N 2.81Å; A623-W627 VanDerWaalsContact O-CB 3.28Å; A623-W627 WeakPolarHBondContact O-CB 3.35Å; A623-W627 PolarHBondContact O-N 2.92Å; A623-F667 HydrophobicContact CB-CE2 4.36Å; A623-F667 HydrophobicContact CB-CZ 3.86Å
624	T	92.9	Very high	91.3	Very high	44 Å²	44	25 Å²	25	27%	0.27	14%	0.136	S	C	.	.	H	α-helix	trans	-63.9	-45	175	51.5	0	0	0	0	111.1	T620 E621 W627 E628	T620-T624 WeakPolarHBondContact O-CG2 3.4Å; T620-T624 PolarHBondContact O-N 3.12Å; T620-T624 PolarHBondContact O-OG1 3.12Å; E621-T624 WeakPolarHBondContact CA-OG1 3.26Å; E621-T624 PolarHBondContact O-OG1 3.01Å; T624-W627 WeakPolarHBondContact O-CB 3.48Å; T624-W627 PolarHBondContact O-N 2.94Å; T624-E628 WeakPolarHBondContact O-CG 3.46Å; T624-E628 PolarHBondContact O-N 3.02Å
625	F	92.3	Very high	91.2	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.035	14%	0.137	C	C	.	.	H	α-helix	trans	-63.5	-45.2	177.8	178.1	-107.4	0	0	0	112.9	V472 Q473 T476 W607 E621 M622 W627 E628 M629	V472-F625 HydrophobicContact CG1-CD1 3.97Å; V472-F625 HydrophobicContact CG1-CE1 3.63Å; Q473-F625 HydrophobicContact CB-CE2 4.45Å; Q473-F625 HydrophobicContact CG-CD2 3.66Å; Q473-F625 HydrophobicContact CG-CE1 4.46Å; Q473-F625 HydrophobicContact CG-CE2 3.52Å; Q473-F625 HydrophobicContact CG-CG 4.18Å; Q473-F625 HydrophobicContact CG-CZ 3.94Å; T476-F625 HydrophobicContact CG2-CE1 4.32Å; T476-F625 HydrophobicContact CG2-CZ 4.23Å; T476-F625 WeakPolarHBondContact OG1-CZ 3.26Å; W607-F625 HydrophobicContact CH2-CE1 4.47Å; W607-F625 HydrophobicContact CZ3-CE1 4.19Å; E621-F625 PolarHBondContact O-N 3.02Å; E621-F625 VanDerWaalsContact O-N 3.14Å; M622-F625 PolarHBondContact O-N 3.27Å; F625-W627 PolarHBondContact O-N 2.95Å; F625-E628 WeakPolarHBondContact O-CB 3.41Å; F625-E628 PolarHBondContact O-N 3.12Å; F625-M629 HydrophobicContact CD2-CE 4.5Å; F625-M629 HydrophobicContact CE1-CG 4.41Å; F625-M629 HydrophobicContact CE2-CE 3.47Å; F625-M629 VanDerWaalsContact CE2-CE 3.47Å; F625-M629 HydrophobicContact CE2-CG 4.24Å; F625-M629 HydrophobicContact CZ-CE 3.64Å; F625-M629 HydrophobicContact CZ-CG 4.08Å; F625-M629 PolarHBondContact O-N 3.3Å
626	F	93.2	Very high	91.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.7	-29.7	177.3	-65.2	-33.4	0	0	0	113.2	L464 V472 W607 L610 F611 W613 A614 M622 A630	L464-F626 HydrophobicContact CD2-CZ 3.68Å; V472-F626 HydrophobicContact CG1-CE1 4Å; V472-F626 HydrophobicContact CG1-CZ 4.47Å; W607-F626 AromaticContact CE3-CD1 3.97Å; W607-F626 HydrophobicContact CE3-CD1 3.97Å; W607-F626 AromaticContact CZ3-CD1 3.86Å; W607-F626 HydrophobicContact CZ3-CD1 3.86Å; W607-F626 HydrophobicContact CZ3-CE1 4.33Å; L610-F626 HydrophobicContact CB-CD1 4.31Å; L610-F626 HydrophobicContact CB-CD2 3.89Å; L610-F626 HydrophobicContact CB-CE1 4.31Å; L610-F626 HydrophobicContact CB-CE2 3.89Å; L610-F626 HydrophobicContact CB-CG 4.11Å; L610-F626 HydrophobicContact CB-CZ 4.09Å; L610-F626 HydrophobicContact CD1-CE1 4.14Å; L610-F626 HydrophobicContact CD1-CZ 4.27Å; L610-F626 WeakPolarHBondContact O-CD2 3.35Å; F611-F626 HydrophobicContact CB-CB 4.02Å; F611-F626 HydrophobicContact CD2-CB 4.48Å; W613-F626 HydrophobicContact CE3-CE2 4.4Å; W613-F626 HydrophobicContact CZ3-CE2 4.38Å; A614-F626 HydrophobicContact CB-CD2 3.86Å; A614-F626 HydrophobicContact CB-CE2 4.07Å; M622-F626 HydrophobicContact CB-CE2 4.31Å; M622-F626 HydrophobicContact CE-CE1 4.47Å; M622-F626 HydrophobicContact CE-CE2 3.73Å; M622-F626 HydrophobicContact CE-CZ 3.47Å; M622-F626 VanDerWaalsContact CE-CZ 3.47Å; M622-F626 WeakPolarHBondContact O-CD2 3.34Å; M622-F626 VanDerWaalsContact O-CG 3.3Å; M622-F626 WeakPolarHBondContact O-CG 3.48Å; M622-F626 PolarHBondContact O-N 3Å; M622-F626 HydrophobicContact SD-CZ 4.5Å; F626-A630 PolarHBondContact O-N 2.85Å; F626-A630 VanDerWaalsContact O-N 3.15Å
627	W	94.3	Very high	91.3	Very high	2 Å²	2	25 Å²	25	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-70.6	-41.7	172.5	171.9	81.9	0	0	0	112.2	F611 A623 T624 F625 M629 A630 S633 A637 F667 L670 I674 L1174	F611-W627 HydrophobicContact CD2-CB 3.92Å; F611-W627 HydrophobicContact CE2-CB 3.76Å; F611-W627 HydrophobicContact CE2-CG 4.47Å; A623-W627 VanDerWaalsContact O-CB 3.28Å; A623-W627 WeakPolarHBondContact O-CB 3.35Å; A623-W627 PolarHBondContact O-N 2.92Å; T624-W627 WeakPolarHBondContact O-CB 3.48Å; T624-W627 PolarHBondContact O-N 2.94Å; F625-W627 PolarHBondContact O-N 2.95Å; W627-M629 PolarHBondContact O-N 3.05Å; W627-A630 WeakPolarHBondContact O-CB 3.08Å; W627-A630 PolarHBondContact O-N 3.41Å; W627-S633 PolarHBondContact NE1-O 3.05Å; W627-A637 HydrophobicContact CZ2-CB 4.49Å; W627-F667 HydrophobicContact CB-CE1 4.06Å; W627-F667 HydrophobicContact CG-CE1 4.13Å; W627-L670 HydrophobicContact CD2-CD1 4.48Å; W627-L670 HydrophobicContact CE3-CD1 4.08Å; W627-L670 HydrophobicContact CH2-CB 3.73Å; W627-L670 HydrophobicContact CH2-CD1 3.93Å; W627-L670 HydrophobicContact CH2-CD2 3.86Å; W627-L670 HydrophobicContact CH2-CG 4.04Å; W627-L670 HydrophobicContact CZ2-CB 3.81Å; W627-L670 HydrophobicContact CZ2-CD1 4.36Å; W627-L670 HydrophobicContact CZ3-CB 4.46Å; W627-L670 HydrophobicContact CZ3-CD1 3.81Å; W627-L670 HydrophobicContact CZ3-CD2 4.06Å; W627-L670 HydrophobicContact CZ3-CG 4.33Å; W627-I674 HydrophobicContact CH2-CD1 3.26Å; W627-I674 HydrophobicContact CZ2-CD1 3.22Å; W627-L1174 HydrophobicContact CZ3-CD2 4.26Å
628	E	90.9	Very high	91.5	Very high	70 Å²	70	23.9 Å²	23.9	33%	0.327	13%	0.131	S	C	.	.	H	α-helix	trans	-57.2	-33.5	174.5	-73.5	173.7	-179.9	0	0	111.6	T624 F625 K1170 L1174	T624-E628 WeakPolarHBondContact O-CG 3.46Å; T624-E628 PolarHBondContact O-N 3.02Å; F625-E628 WeakPolarHBondContact O-CB 3.41Å; F625-E628 PolarHBondContact O-N 3.12Å; E628-K1170 WeakPolarHBondContact O-CE 3.44Å; E628-K1170 PolarHBondContact O-NZ 3.28Å; E628-L1174 HydrophobicContact CB-CD1 4.27Å; E628-L1174 HydrophobicContact CG-CD1 3.98Å; E628-L1174 HydrophobicContact CG-CD2 4.29Å
629	M	88.4	Confident	91.6	Very high	81 Å²	81	22.4 Å²	22.4	40%	0.399	12%	0.123	S	C	.	.	H	α-helix	trans	-86.8	-13.3	178	-64.2	-65.3	178.8	0	0	114.1	W607 F625 W627	W607-M629 HydrophobicContact CD2-CB 3.63Å; W607-M629 HydrophobicContact CE3-CB 3.46Å; W607-M629 VanDerWaalsContact CE3-CB 3.46Å; W607-M629 HydrophobicContact CE3-CG 4.18Å; W607-M629 HydrophobicContact CG-CB 4.31Å; W607-M629 HydrophobicContact CH2-CB 3.56Å; W607-M629 HydrophobicContact CH2-CG 3.48Å; W607-M629 VanDerWaalsContact CH2-CG 3.48Å; W607-M629 HydrophobicContact CH2-SD 4.25Å; W607-M629 HydrophobicContact CZ2-CB 3.82Å; W607-M629 HydrophobicContact CZ2-CG 4.05Å; W607-M629 HydrophobicContact CZ2-SD 4.47Å; W607-M629 HydrophobicContact CZ3-CB 3.43Å; W607-M629 VanDerWaalsContact CZ3-CB 3.43Å; W607-M629 HydrophobicContact CZ3-CG 3.6Å; F625-M629 HydrophobicContact CD2-CE 4.5Å; F625-M629 HydrophobicContact CE1-CG 4.41Å; F625-M629 HydrophobicContact CE2-CE 3.47Å; F625-M629 VanDerWaalsContact CE2-CE 3.47Å; F625-M629 HydrophobicContact CE2-CG 4.24Å; F625-M629 HydrophobicContact CZ-CE 3.64Å; F625-M629 HydrophobicContact CZ-CG 4.08Å; F625-M629 PolarHBondContact O-N 3.3Å; W627-M629 PolarHBondContact O-N 3.05Å
630	A	87.6	Confident	91.7	Very high	4 Å²	4	21.2 Å²	21.2	3%	0.033	12%	0.118	C	C	.	.			trans	-72	142.2	179.6	0	0	0	0	0	111.9	F626 W627 T636 K1170	F626-A630 PolarHBondContact O-N 2.85Å; F626-A630 VanDerWaalsContact O-N 3.15Å; W627-A630 WeakPolarHBondContact O-CB 3.08Å; W627-A630 PolarHBondContact O-N 3.41Å; A630-T636 HydrophobicContact CB-CG2 4.22Å; A630-K1170 PolarHBondContact O-NZ 3.07Å
631	G	81.3	Confident	91.8	Very high	36 Å²	36	18 Å²	18	37%	0.371	10%	0.099	S	C	.	.	S	Bend	trans	-69.1	-52	178.8	0	0	0	0	0	113.2	S633 M1163	G631-S633 PolarHBondContact O-N 3.43Å; G631-S633 VanDerWaalsContact O-N 3.1Å; G631-M1163 VanDerWaalsContact O-CE 3.27Å; G631-M1163 WeakPolarHBondContact O-CE 3.41Å
632	E	88.3	Confident	91.9	Very high	9 Å²	9	13 Å²	13	4%	0.042	8%	0.075	C	C	.	.			trans	-84	78.9	-178.6	-64.9	-166.9	159.7	0	0	111.4	L635 T636 R692 S694 V696 M1163	E632-L635 HydrophobicContact CB-CB 4.49Å; E632-T636 WeakPolarHBondContact O-CB 3.29Å; E632-T636 PolarHBondContact O-N 2.86Å; E632-T636 PolarHBondContact O-OG1 3.46Å; E632-R692 IonicContact OE1-CZ 3.1Å; E632-R692 IonicContact OE1-NH1 3.06Å; E632-R692 PolarHBondContact OE1-NH1 3.08Å; E632-R692 IonicContact OE1-NH2 2.82Å; E632-S694 PolarHBondContact OE1-OG 3.07Å; E632-S694 VanDerWaalsContact OE1-OG 3.1Å; E632-S694 WeakPolarHBondContact OE2-CB 3.48Å; E632-S694 PolarHBondContact OE2-OG 2.88Å; E632-V696 HydrophobicContact CG-CG2 4.22Å; E632-M1163 HydrophobicContact CB-CE 4.09Å; E632-M1163 HydrophobicContact CG-CE 3.31Å; E632-M1163 HydrophobicContact CG-SD 3.55Å; E632-M1163 VanDerWaalsContact CG-SD 3.55Å
633	S	90.8	Very high	92	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62.5	-51.9	-170	69.2	0	0	0	0	114.1	W627 G631 A637 E1166	W627-S633 PolarHBondContact NE1-O 3.05Å; G631-S633 PolarHBondContact O-N 3.43Å; G631-S633 VanDerWaalsContact O-N 3.1Å; S633-A637 WeakPolarHBondContact O-CB 3.45Å; S633-A637 PolarHBondContact O-N 2.72Å; S633-A637 VanDerWaalsContact O-N 3.1Å; S633-E1166 PolarHBondContact N-OE1 3.37Å; S633-E1166 PolarHBondContact OG-OE1 3.05Å
634	V	93.3	Very high	92	Very high	1 Å²	1	13 Å²	13	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-68.3	-45.9	-175.1	179.4	0	0	0	0	110.2	L638 A671 I674 L689 F714 E1166	V634-L638 HydrophobicContact CG1-CD1 4.32Å; V634-L638 WeakPolarHBondContact O-CG 3.5Å; V634-L638 PolarHBondContact O-N 2.85Å; V634-L638 VanDerWaalsContact O-N 3.14Å; V634-A671 HydrophobicContact CG1-CB 4.45Å; V634-I674 HydrophobicContact CG2-CB 4.35Å; V634-I674 HydrophobicContact CG2-CG2 3.79Å; V634-L689 HydrophobicContact CG2-CD2 4.28Å; V634-F714 HydrophobicContact CG1-CE2 3.88Å; V634-F714 HydrophobicContact CG1-CZ 4.2Å; V634-E1166 PolarHBondContact N-OE1 2.97Å
635	L	92.1	Very high	92	Very high	2 Å²	2	13.5 Å²	13.5	1%	0.01	7%	0.072	C	C	.	.	H	α-helix	trans	-69.2	-41.2	-178.4	-171.9	61.3	0	0	0	111.9	E632 A637 L638 S639 W697 M705	E632-L635 HydrophobicContact CB-CB 4.49Å; L635-A637 VanDerWaalsContact C-N 3.33Å; L635-A637 PolarHBondContact O-N 3.3Å; L635-L638 PolarHBondContact O-N 2.83Å; L635-S639 WeakPolarHBondContact O-CB 3.31Å; L635-S639 PolarHBondContact O-N 3.42Å; L635-S639 PolarHBondContact O-OG 2.86Å; L635-W697 HydrophobicContact CD2-CB 3.96Å; L635-W697 HydrophobicContact CD2-CG 4.09Å; L635-W697 HydrophobicContact CG-CB 4.46Å; L635-W697 HydrophobicContact CG-CG 4.23Å; L635-M705 HydrophobicContact CD1-CB 3.61Å; L635-M705 HydrophobicContact CD1-CE 4.25Å; L635-M705 HydrophobicContact CD1-CG 4Å
636	T	93.3	Very high	92	Very high	2 Å²	2	15.8 Å²	15.8	1%	0.012	8%	0.083	C	C	.	.	H	α-helix	trans	-63.9	-39.5	178.8	-59.5	0	0	0	0	111.4	F611 A630 E632 S639 G640 W697	F611-T636 HydrophobicContact CD1-CG2 3.51Å; F611-T636 HydrophobicContact CD2-CG2 4.41Å; F611-T636 HydrophobicContact CE1-CG2 3.51Å; F611-T636 WeakPolarHBondContact CE1-O 3.32Å; F611-T636 HydrophobicContact CE2-CG2 4.41Å; F611-T636 HydrophobicContact CG-CG2 3.97Å; F611-T636 HydrophobicContact CZ-CG2 3.97Å; A630-T636 HydrophobicContact CB-CG2 4.22Å; E632-T636 WeakPolarHBondContact O-CB 3.29Å; E632-T636 PolarHBondContact O-N 2.86Å; E632-T636 PolarHBondContact O-OG1 3.46Å; T636-S639 PolarHBondContact O-N 3.09Å; T636-G640 PolarHBondContact O-N 3.27Å; T636-W697 HydrophobicContact CG2-CZ2 4.16Å; T636-W697 PolarHBondContact OG1-NE1 2.77Å
637	A	94.9	Very high	91.9	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-61.5	-46.2	173.2	0	0	0	0	0	112.3	W627 S633 L635 S639 G640 C641 F667 A671	W627-A637 HydrophobicContact CZ2-CB 4.49Å; S633-A637 WeakPolarHBondContact O-CB 3.45Å; S633-A637 PolarHBondContact O-N 2.72Å; S633-A637 VanDerWaalsContact O-N 3.1Å; L635-A637 VanDerWaalsContact C-N 3.33Å; L635-A637 PolarHBondContact O-N 3.3Å; A637-S639 VanDerWaalsContact C-N 3.35Å; A637-S639 PolarHBondContact O-N 3.05Å; A637-G640 PolarHBondContact O-N 2.91Å; A637-C641 WeakPolarHBondContact O-CB 3.33Å; A637-C641 PolarHBondContact O-N 3.37Å; A637-F667 HydrophobicContact CB-CB 4.45Å; A637-F667 WeakPolarHBondContact CB-O 3.38Å; A637-A671 HydrophobicContact CB-CB 3.79Å
638	L	94.5	Very high	91.8	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.3	-38.2	177.2	-68.3	174.5	0	0	0	112.3	V634 L635 C641 K642 A671 C702 M705 A711 F714	V634-L638 HydrophobicContact CG1-CD1 4.32Å; V634-L638 WeakPolarHBondContact O-CG 3.5Å; V634-L638 PolarHBondContact O-N 2.85Å; V634-L638 VanDerWaalsContact O-N 3.14Å; L635-L638 PolarHBondContact O-N 2.83Å; L638-C641 WeakPolarHBondContact O-CB 3.48Å; L638-C641 PolarHBondContact O-N 3.11Å; L638-K642 PolarHBondContact O-N 3.2Å; L638-A671 HydrophobicContact CD2-CB 4.03Å; L638-A671 HydrophobicContact CG-CB 4.09Å; L638-C702 HydrophobicContact CD1-CB 4.46Å; L638-M705 HydrophobicContact CB-CB 4.39Å; L638-M705 HydrophobicContact CB-CG 3.83Å; L638-A711 HydrophobicContact CD2-CB 3.89Å; L638-F714 HydrophobicContact CD1-CD1 4.3Å; L638-F714 HydrophobicContact CD1-CE1 4.06Å; L638-F714 HydrophobicContact CD1-CE2 4.41Å; L638-F714 HydrophobicContact CD1-CZ 4.12Å; L638-F714 HydrophobicContact CD2-CB 4.31Å; L638-F714 HydrophobicContact CD2-CD1 4.41Å; L638-F714 HydrophobicContact CD2-CD2 4.43Å; L638-F714 HydrophobicContact CD2-CG 4.13Å
639	S	92.6	Very high	91.9	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.5	-45.9	173.3	-62	0	0	0	0	111.8	L635 T636 A637 K642 M643 W697 M705	L635-S639 WeakPolarHBondContact O-CB 3.31Å; L635-S639 PolarHBondContact O-N 3.42Å; L635-S639 PolarHBondContact O-OG 2.86Å; T636-S639 PolarHBondContact O-N 3.09Å; A637-S639 VanDerWaalsContact C-N 3.35Å; A637-S639 PolarHBondContact O-N 3.05Å; S639-K642 PolarHBondContact O-N 2.63Å; S639-M643 WeakPolarHBondContact O-CG 3.26Å; S639-M643 PolarHBondContact O-N 2.99Å; S639-W697 VanDerWaalsContact CB-CH2 3.49Å; S639-M705 VanDerWaalsContact OG-CE 3.23Å; S639-M705 WeakPolarHBondContact OG-CE 3.31Å
640	G	93.9	Very high	91.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.7	-45.4	175.1	0	0	0	0	0	112.2	T636 A637 K642 M643 L644	T636-G640 PolarHBondContact O-N 3.27Å; A637-G640 PolarHBondContact O-N 2.91Å; G640-K642 VanDerWaalsContact C-N 3.34Å; G640-K642 PolarHBondContact O-N 3.1Å; G640-M643 PolarHBondContact O-N 2.78Å; G640-L644 WeakPolarHBondContact O-CB 3.34Å; G640-L644 WeakPolarHBondContact O-CG 3.44Å; G640-L644 PolarHBondContact O-N 2.86Å
641	C	94.9	Very high	91.9	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-56.6	-46.2	175	-175.1	0	0	0	0	111.8	A637 L638 R645 A664 F667	A637-C641 WeakPolarHBondContact O-CB 3.33Å; A637-C641 PolarHBondContact O-N 3.37Å; L638-C641 WeakPolarHBondContact O-CB 3.48Å; L638-C641 PolarHBondContact O-N 3.11Å; C641-R645 WeakPolarHBondContact O-CB 3.19Å; C641-R645 VanDerWaalsContact O-CG 3.31Å; C641-R645 WeakPolarHBondContact O-CG 3.4Å; C641-R645 PolarHBondContact O-N 3.14Å; C641-A664 PolarHBondContact SG-O 2.89Å; C641-F667 HydrophobicContact CB-CB 4.43Å
642	K	93.6	Very high	92.1	Very high	13 Å²	13	23.7 Å²	23.7	6%	0.057	12%	0.121	C	C	.	.	H	α-helix	trans	-60.5	-51.7	176.9	-177.3	166.9	-178.2	163.6	0	112.1	L560 L561 T564 L638 S639 G640 L644 R645 E646 M705 G708 A709	L560-K642 WeakPolarHBondContact O-CE 3.34Å; L561-K642 HydrophobicContact CD2-CD 4.25Å; L561-K642 VanDerWaalsContact O-CE 3.26Å; L561-K642 WeakPolarHBondContact O-CE 3.31Å; L561-K642 PolarHBondContact O-NZ 3.2Å; T564-K642 PolarHBondContact OG1-NZ 3.35Å; L638-K642 PolarHBondContact O-N 3.2Å; S639-K642 PolarHBondContact O-N 2.63Å; G640-K642 VanDerWaalsContact C-N 3.34Å; G640-K642 PolarHBondContact O-N 3.1Å; K642-L644 VanDerWaalsContact C-N 3.35Å; K642-L644 PolarHBondContact O-N 3.11Å; K642-R645 PolarHBondContact O-N 2.97Å; K642-E646 PolarHBondContact O-N 3.22Å; K642-M705 HydrophobicContact CD-SD 4.05Å; K642-G708 WeakPolarHBondContact CE-O 3.25Å; K642-A709 HydrophobicContact CB-CB 3.73Å; K642-A709 HydrophobicContact CG-CB 4.39Å
643	M	93.8	Very high	92.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.5	-46.9	-177.7	-72.5	169.7	56.8	0	0	111.4	L557 L561 I612 V615 L616 S639 G640 R645 E646 L647	L557-M643 HydrophobicContact CD2-CE 3.92Å; L557-M643 HydrophobicContact CD2-SD 4.42Å; L561-M643 HydrophobicContact CD2-CG 3.98Å; I612-M643 HydrophobicContact CB-CE 4.4Å; I612-M643 HydrophobicContact CG1-CE 4.42Å; I612-M643 HydrophobicContact CG1-SD 4.4Å; I612-M643 HydrophobicContact CG2-CE 3.88Å; V615-M643 HydrophobicContact CB-CE 4.44Å; V615-M643 HydrophobicContact CG1-CB 4.19Å; V615-M643 HydrophobicContact CG1-CE 4.09Å; L616-M643 HydrophobicContact CD1-CE 4.43Å; L616-M643 HydrophobicContact CD2-CE 3.54Å; L616-M643 HydrophobicContact CG-CE 3.67Å; S639-M643 WeakPolarHBondContact O-CG 3.26Å; S639-M643 PolarHBondContact O-N 2.99Å; G640-M643 PolarHBondContact O-N 2.78Å; M643-R645 PolarHBondContact O-N 3.4Å; M643-E646 PolarHBondContact O-N 2.99Å; M643-L647 WeakPolarHBondContact O-CB 3.32Å; M643-L647 VanDerWaalsContact O-CG 3.25Å; M643-L647 WeakPolarHBondContact O-CG 3.23Å; M643-L647 PolarHBondContact O-N 2.89Å
644	L	94.6	Very high	92	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.4	-38.6	179.4	-71.1	165.5	0	0	0	112.5	V615 G640 K642 L647 S648 M660 L663 A664 F667	V615-L644 HydrophobicContact CG1-CD1 4.14Å; V615-L644 HydrophobicContact CG1-CD2 3.84Å; V615-L644 HydrophobicContact CG1-CG 3.64Å; G640-L644 WeakPolarHBondContact O-CB 3.34Å; G640-L644 WeakPolarHBondContact O-CG 3.44Å; G640-L644 PolarHBondContact O-N 2.86Å; K642-L644 VanDerWaalsContact C-N 3.35Å; K642-L644 PolarHBondContact O-N 3.11Å; L644-L647 PolarHBondContact O-N 2.81Å; L644-S648 VanDerWaalsContact O-CB 3.3Å; L644-S648 WeakPolarHBondContact O-CB 3.33Å; L644-S648 PolarHBondContact O-N 2.67Å; L644-M660 HydrophobicContact CD2-CB 4.44Å; L644-M660 HydrophobicContact CD2-CG 4.36Å; L644-L663 HydrophobicContact CD1-CB 3.96Å; L644-L663 HydrophobicContact CD1-CD2 3.66Å; L644-L663 HydrophobicContact CD1-CG 3.56Å; L644-L663 HydrophobicContact CD2-CD2 3.98Å; L644-L663 HydrophobicContact CG-CD2 4.49Å; L644-A664 HydrophobicContact CB-CB 3.74Å; L644-A664 HydrophobicContact CD1-CB 4.26Å; L644-F667 HydrophobicContact CD1-CD2 3.82Å; L644-F667 HydrophobicContact CD1-CE2 4.03Å
645	R	94.1	Very high	91.8	Very high	56 Å²	56	41.1 Å²	41.1	21%	0.211	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-44.2	176.5	-77.6	175.7	176.1	-175.6	-0.2	112.1	C641 K642 M643 S648 K649 A664 E668 A709 D710	C641-R645 WeakPolarHBondContact O-CB 3.19Å; C641-R645 VanDerWaalsContact O-CG 3.31Å; C641-R645 WeakPolarHBondContact O-CG 3.4Å; C641-R645 PolarHBondContact O-N 3.14Å; K642-R645 PolarHBondContact O-N 2.97Å; M643-R645 PolarHBondContact O-N 3.4Å; R645-S648 PolarHBondContact O-N 3.02Å; R645-S648 PolarHBondContact O-OG 3.04Å; R645-K649 WeakPolarHBondContact O-CG 3.45Å; R645-K649 PolarHBondContact O-N 3.03Å; R645-A664 HydrophobicContact CG-CB 3.97Å; R645-E668 IonicContact CZ-OE2 2.87Å; R645-E668 IonicContact NH1-OE2 3.24Å; R645-E668 IonicContact NH2-OE2 2.69Å; R645-E668 PolarHBondContact NH2-OE2 2.83Å; R645-A709 WeakPolarHBondContact CD-O 3.28Å; R645-A709 PolarHBondContact NH1-O 3.08Å; R645-D710 PolarHBondContact NH1-O 3.34Å
646	E	91.1	Very high	91.6	Very high	56 Å²	56	43.9 Å²	43.9	26%	0.262	22%	0.224	S	C	.	.	H	α-helix	trans	-68.5	-39.2	176.1	-65.8	-52.5	141.9	0	0	112.1	L560 K642 M643 S648 K649 L650	L560-E646 HydrophobicContact CD2-CB 3.94Å; K642-E646 PolarHBondContact O-N 3.22Å; M643-E646 PolarHBondContact O-N 2.99Å; E646-S648 PolarHBondContact O-N 3.05Å; E646-K649 WeakPolarHBondContact O-CB 3.23Å; E646-K649 PolarHBondContact O-N 3.04Å; E646-K649 IonicContact OE1-NZ 3.72Å; E646-K649 PolarHBondContact OE1-NZ 3.06Å; E646-K649 WeakPolarHBondContact OE2-CD 3.46Å; E646-K649 IonicContact OE2-NZ 2.79Å; E646-K649 PolarHBondContact OE2-NZ 3.34Å; E646-K649 VanDerWaalsContact OE2-NZ 3.1Å; E646-L650 PolarHBondContact O-N 3.23Å
647	L	91.3	Very high	91.5	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-44.4	172.7	-76.1	171.1	0	0	0	111.8	L503 L507 L560 L616 M643 L644 K649 L650 E651 M660	L503-L647 HydrophobicContact CD2-CD2 4.14Å; L507-L647 HydrophobicContact CD1-CD2 4.26Å; L560-L647 HydrophobicContact CD1-CD1 4.42Å; L560-L647 HydrophobicContact CD1-CD2 4.02Å; L560-L647 HydrophobicContact CD1-CG 4.06Å; L560-L647 HydrophobicContact CD2-CD2 3.84Å; L560-L647 HydrophobicContact CD2-CG 3.88Å; L616-L647 HydrophobicContact CD2-CD1 3.95Å; M643-L647 WeakPolarHBondContact O-CB 3.32Å; M643-L647 VanDerWaalsContact O-CG 3.25Å; M643-L647 WeakPolarHBondContact O-CG 3.23Å; M643-L647 PolarHBondContact O-N 2.89Å; L644-L647 PolarHBondContact O-N 2.81Å; L647-K649 PolarHBondContact O-N 3.27Å; L647-K649 VanDerWaalsContact O-N 3.09Å; L647-L650 PolarHBondContact O-N 3.37Å; L647-E651 PolarHBondContact O-N 3.32Å; L647-M660 HydrophobicContact CB-SD 4.05Å
648	S	93.4	Very high	91.3	Very high	6 Å²	6	51.7 Å²	51.7	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-21.4	178.5	81.2	0	0	0	0	113.7	L644 R645 E646 K657	L644-S648 VanDerWaalsContact O-CB 3.3Å; L644-S648 WeakPolarHBondContact O-CB 3.33Å; L644-S648 PolarHBondContact O-N 2.67Å; R645-S648 PolarHBondContact O-N 3.02Å; R645-S648 PolarHBondContact O-OG 3.04Å; E646-S648 PolarHBondContact O-N 3.05Å; S648-K657 WeakPolarHBondContact O-CD 3.5Å; S648-K657 WeakPolarHBondContact O-CE 3.33Å; S648-K657 WeakPolarHBondContact O-CG 3.48Å; S648-K657 PolarHBondContact O-NZ 3.06Å
649	K	91.1	Very high	91.2	Very high	131 Å²	131	53.4 Å²	53.4	57%	0.57	27%	0.274	S	S	*	.	H	α-helix	trans	-79.8	-29.1	174.4	-66.7	173.6	-165.8	168.3	0	112.2	R645 E646 L647	R645-K649 WeakPolarHBondContact O-CG 3.45Å; R645-K649 PolarHBondContact O-N 3.03Å; E646-K649 WeakPolarHBondContact O-CB 3.23Å; E646-K649 PolarHBondContact O-N 3.04Å; E646-K649 IonicContact OE1-NZ 3.72Å; E646-K649 PolarHBondContact OE1-NZ 3.06Å; E646-K649 WeakPolarHBondContact OE2-CD 3.46Å; E646-K649 IonicContact OE2-NZ 2.79Å; E646-K649 PolarHBondContact OE2-NZ 3.34Å; E646-K649 VanDerWaalsContact OE2-NZ 3.1Å; L647-K649 PolarHBondContact O-N 3.27Å; L647-K649 VanDerWaalsContact O-N 3.09Å
650	L	88.8	Confident	91.2	Very high	88 Å²	88	53.8 Å²	53.8	46%	0.461	28%	0.276	S	S	.	.	H	α-helix	trans	-85.1	-22	179.3	-62.8	175.5	0	0	0	112.5	L503 L507 L560 E646 L647	L503-L650 HydrophobicContact CD2-CB 4.07Å; L507-L650 HydrophobicContact CD1-CD1 4.22Å; L560-L650 HydrophobicContact CD2-CD1 4.4Å; E646-L650 PolarHBondContact O-N 3.23Å; L647-L650 PolarHBondContact O-N 3.37Å
651	E	88.4	Confident	91.2	Very high	21 Å²	21	58.6 Å²	58.6	10%	0.098	30%	0.297	C	S	.	.			trans	-73.6	134	-179.3	-167	53.9	-106.3	0	0	112.9	L503 L647 E653 I656 K657	L503-E651 VanDerWaalsContact CB-OE2 3.3Å; L503-E651 WeakPolarHBondContact CB-OE2 3.49Å; L503-E651 HydrophobicContact CD2-CB 4.37Å; L503-E651 WeakPolarHBondContact CD2-OE2 3.39Å; L647-E651 PolarHBondContact O-N 3.32Å; E651-E653 PolarHBondContact OE1-N 3.05Å; E651-I656 HydrophobicContact CG-CB 4.17Å; E651-I656 HydrophobicContact CG-CG2 4.07Å; E651-K657 HydrophobicContact CB-CB 4.47Å; E651-K657 HydrophobicContact CG-CB 4.42Å
652	S	86.3	Confident	91.2	Very high	110 Å²	110	64.5 Å²	64.5	77%	0.769	33%	0.325	S	S	*	.			trans	-89.6	-32.3	176.5	49.8	0	0	0	0	112.8
653	E	87.3	Confident	91.3	Very high	114 Å²	114	64.2 Å²	64.2	53%	0.533	32%	0.324	S	S	.	.			trans	-77	128.3	-177.3	-66	-173.1	-178.6	0	0	111.7	E651 I656 K657	E651-E653 PolarHBondContact OE1-N 3.05Å; E653-I656 HydrophobicContact CB-CB 4.43Å; E653-I656 HydrophobicContact CB-CD1 4.36Å; E653-I656 HydrophobicContact CB-CG1 4.38Å; E653-I656 WeakPolarHBondContact OE2-CD1 3.27Å; E653-K657 WeakPolarHBondContact O-CB 3.39Å; E653-K657 PolarHBondContact O-N 2.92Å; E653-K657 VanDerWaalsContact O-N 3.09Å
654	T	89.6	Confident	91.4	Very high	104 Å²	104	64.2 Å²	64.2	64%	0.638	32%	0.324	S	S	*	.	H	α-helix	trans	-70.5	-36	-172.4	49.1	0	0	0	0	113.4	L658	T654-L658 VanDerWaalsContact O-CG 3.32Å; T654-L658 WeakPolarHBondContact O-CG 3.42Å; T654-L658 PolarHBondContact O-N 2.93Å
655	E	88.8	Confident	91.4	Very high	159 Å²	159	69 Å²	69	74%	0.743	35%	0.346	S	S	*	.	H	α-helix	trans	-70.4	-49.1	-178.3	-65.5	-179.2	-179.1	0	0	111.5	K657 L658 S659	E655-K657 VanDerWaalsContact C-N 3.28Å; E655-K657 PolarHBondContact O-N 2.96Å; E655-L658 PolarHBondContact O-N 3.27Å; E655-L658 VanDerWaalsContact O-N 3.14Å; E655-S659 PolarHBondContact O-N 3.47Å; E655-S659 PolarHBondContact O-OG 3.04Å
656	I	87.9	Confident	91.4	Very high	59 Å²	59	69.3 Å²	69.3	30%	0.303	35%	0.354	S	S	.	.	H	α-helix	trans	-60.1	-41.8	174.7	-58.9	-177.7	0	0	0	110.1	E651 E653 L658 S659 M660	E651-I656 HydrophobicContact CG-CB 4.17Å; E651-I656 HydrophobicContact CG-CG2 4.07Å; E653-I656 HydrophobicContact CB-CB 4.43Å; E653-I656 HydrophobicContact CB-CD1 4.36Å; E653-I656 HydrophobicContact CB-CG1 4.38Å; E653-I656 WeakPolarHBondContact OE2-CD1 3.27Å; I656-L658 VanDerWaalsContact C-N 3.33Å; I656-L658 PolarHBondContact O-N 3.06Å; I656-S659 WeakPolarHBondContact CA-OG 3.05Å; I656-S659 PolarHBondContact O-N 2.8Å; I656-S659 PolarHBondContact O-OG 2.8Å; I656-M660 HydrophobicContact CG2-CE 3.59Å; I656-M660 HydrophobicContact CG2-CG 4.34Å; I656-M660 HydrophobicContact CG2-SD 4.18Å; I656-M660 WeakPolarHBondContact O-CB 3.48Å; I656-M660 WeakPolarHBondContact O-CG 3.28Å; I656-M660 PolarHBondContact O-N 2.88Å
657	K	90.5	Very high	91.6	Very high	65 Å²	65	66.6 Å²	66.6	28%	0.283	34%	0.342	S	S	.	.	H	α-helix	trans	-61.8	-37.2	176.1	179.7	171.6	-173	157.9	0	113.6	S648 E651 E653 E655 K661	S648-K657 WeakPolarHBondContact O-CD 3.5Å; S648-K657 WeakPolarHBondContact O-CE 3.33Å; S648-K657 WeakPolarHBondContact O-CG 3.48Å; S648-K657 PolarHBondContact O-NZ 3.06Å; E651-K657 HydrophobicContact CB-CB 4.47Å; E651-K657 HydrophobicContact CG-CB 4.42Å; E653-K657 WeakPolarHBondContact O-CB 3.39Å; E653-K657 PolarHBondContact O-N 2.92Å; E653-K657 VanDerWaalsContact O-N 3.09Å; E655-K657 VanDerWaalsContact C-N 3.28Å; E655-K657 PolarHBondContact O-N 2.96Å; K657-K661 VanDerWaalsContact O-CG 3.3Å; K657-K661 WeakPolarHBondContact O-CG 3.16Å; K657-K661 PolarHBondContact O-N 3.44Å
658	L	91.5	Very high	91.8	Very high	101 Å²	101	66.7 Å²	66.7	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-68.7	-49.4	175.5	-76.6	167.3	0	0	0	110.7	T654 E655 I656 M660 K661 E662	T654-L658 VanDerWaalsContact O-CG 3.32Å; T654-L658 WeakPolarHBondContact O-CG 3.42Å; T654-L658 PolarHBondContact O-N 2.93Å; E655-L658 PolarHBondContact O-N 3.27Å; E655-L658 VanDerWaalsContact O-N 3.14Å; I656-L658 VanDerWaalsContact C-N 3.33Å; I656-L658 PolarHBondContact O-N 3.06Å; L658-M660 VanDerWaalsContact C-N 3.33Å; L658-M660 PolarHBondContact O-N 3.31Å; L658-K661 WeakPolarHBondContact O-CB 3.46Å; L658-K661 PolarHBondContact O-N 2.91Å; L658-E662 WeakPolarHBondContact O-CG 3.38Å; L658-E662 PolarHBondContact O-N 3.37Å
659	S	92.1	Very high	91.9	Very high	36 Å²	36	69.3 Å²	69.3	25%	0.252	36%	0.355	S	S	.	.	H	α-helix	trans	-59.7	-40.3	178	63.2	0	0	0	0	112.9	N618 E655 I656 K661 E662 L663	N618-S659 PolarHBondContact ND2-OG 2.95Å; E655-S659 PolarHBondContact O-N 3.47Å; E655-S659 PolarHBondContact O-OG 3.04Å; I656-S659 WeakPolarHBondContact CA-OG 3.05Å; I656-S659 PolarHBondContact O-N 2.8Å; I656-S659 PolarHBondContact O-OG 2.8Å; S659-K661 VanDerWaalsContact C-N 3.32Å; S659-K661 PolarHBondContact O-N 2.96Å; S659-E662 PolarHBondContact O-N 2.83Å; S659-L663 WeakPolarHBondContact O-CB 3.41Å; S659-L663 PolarHBondContact O-N 2.94Å
660	M	92.6	Very high	92.1	Very high	8 Å²	8	64.1 Å²	64.1	4%	0.039	33%	0.334	C	S	.	.	H	α-helix	trans	-62.1	-37.6	173.7	-74	179.6	177.4	0	0	112.5	N618 L644 L647 I656 L658 A664	N618-M660 HydrophobicContact CB-CE 4.08Å; N618-M660 HydrophobicContact CB-CG 4.22Å; N618-M660 WeakPolarHBondContact OD1-CG 3.32Å; L644-M660 HydrophobicContact CD2-CB 4.44Å; L644-M660 HydrophobicContact CD2-CG 4.36Å; L647-M660 HydrophobicContact CB-SD 4.05Å; I656-M660 HydrophobicContact CG2-CE 3.59Å; I656-M660 HydrophobicContact CG2-CG 4.34Å; I656-M660 HydrophobicContact CG2-SD 4.18Å; I656-M660 WeakPolarHBondContact O-CB 3.48Å; I656-M660 WeakPolarHBondContact O-CG 3.28Å; I656-M660 PolarHBondContact O-N 2.88Å; L658-M660 VanDerWaalsContact C-N 3.33Å; L658-M660 PolarHBondContact O-N 3.31Å; M660-A664 WeakPolarHBondContact O-CB 3.48Å; M660-A664 PolarHBondContact O-N 3.03Å
661	K	93.8	Very high	92.4	Very high	102 Å²	102	59.9 Å²	59.9	44%	0.443	31%	0.312	S	S	.	.	H	α-helix	trans	-71	-40.4	177.3	-77.2	175.8	177.5	-175.7	0	112	K657 L658 S659 A664 Q665	K657-K661 VanDerWaalsContact O-CG 3.3Å; K657-K661 WeakPolarHBondContact O-CG 3.16Å; K657-K661 PolarHBondContact O-N 3.44Å; L658-K661 WeakPolarHBondContact O-CB 3.46Å; L658-K661 PolarHBondContact O-N 2.91Å; S659-K661 VanDerWaalsContact C-N 3.32Å; S659-K661 PolarHBondContact O-N 2.96Å; K661-A664 PolarHBondContact O-N 3.24Å; K661-Q665 PolarHBondContact O-N 3.33Å
662	E	94.9	Very high	92.7	Very high	123 Å²	123	60.8 Å²	60.8	58%	0.575	32%	0.316	S	S	*	.	H	α-helix	trans	-60.7	-49.5	174.1	-72.1	173.2	-176.3	0	0	110	L658 S659 A664 Q665 T666	L658-E662 WeakPolarHBondContact O-CG 3.38Å; L658-E662 PolarHBondContact O-N 3.37Å; S659-E662 PolarHBondContact O-N 2.83Å; E662-A664 VanDerWaalsContact C-N 3.32Å; E662-A664 PolarHBondContact O-N 3.25Å; E662-Q665 WeakPolarHBondContact O-CB 3.44Å; E662-Q665 PolarHBondContact O-N 2.95Å; E662-T666 WeakPolarHBondContact O-CG2 3.48Å; E662-T666 PolarHBondContact O-N 3.35Å
663	L	95.1	Very high	93	Very high	8 Å²	8	58.5 Å²	58.5	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-59.4	-42	175.5	-173.9	63.3	0	0	0	111.6	T620 L644 S659 Q665 T666 F667	T620-L663 HydrophobicContact CG2-CD1 3.98Å; T620-L663 HydrophobicContact CG2-CD2 4.15Å; T620-L663 HydrophobicContact CG2-CG 4.44Å; L644-L663 HydrophobicContact CD1-CB 3.96Å; L644-L663 HydrophobicContact CD1-CD2 3.66Å; L644-L663 HydrophobicContact CD1-CG 3.56Å; L644-L663 HydrophobicContact CD2-CD2 3.98Å; L644-L663 HydrophobicContact CG-CD2 4.49Å; S659-L663 WeakPolarHBondContact O-CB 3.41Å; S659-L663 PolarHBondContact O-N 2.94Å; L663-Q665 VanDerWaalsContact C-N 3.28Å; L663-Q665 PolarHBondContact O-N 3.04Å; L663-T666 WeakPolarHBondContact CA-OG1 3.5Å; L663-T666 PolarHBondContact O-N 2.93Å; L663-T666 PolarHBondContact O-OG1 3.39Å; L663-F667 HydrophobicContact CD1-CD2 4.25Å; L663-F667 HydrophobicContact CD1-CE2 3.66Å; L663-F667 HydrophobicContact CD1-CZ 4.24Å; L663-F667 HydrophobicContact CD2-CE2 4.17Å; L663-F667 HydrophobicContact CG-CD2 4.08Å; L663-F667 HydrophobicContact CG-CE2 3.68Å; L663-F667 WeakPolarHBondContact O-CD2 3.4Å; L663-F667 PolarHBondContact O-N 3.39Å; L663-F667 VanDerWaalsContact O-N 3.1Å
664	A	95.9	Very high	93.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-37.7	175.4	0	0	0	0	0	112.7	C641 L644 R645 M660 K661 E662 E668	C641-A664 PolarHBondContact SG-O 2.89Å; L644-A664 HydrophobicContact CB-CB 3.74Å; L644-A664 HydrophobicContact CD1-CB 4.26Å; R645-A664 HydrophobicContact CG-CB 3.97Å; M660-A664 WeakPolarHBondContact O-CB 3.48Å; M660-A664 PolarHBondContact O-N 3.03Å; K661-A664 PolarHBondContact O-N 3.24Å; E662-A664 VanDerWaalsContact C-N 3.32Å; E662-A664 PolarHBondContact O-N 3.25Å; A664-E668 PolarHBondContact O-N 2.88Å; A664-E668 VanDerWaalsContact O-N 3.11Å
665	Q	94.7	Very high	93.6	Very high	101 Å²	101	48.1 Å²	48.1	47%	0.472	24%	0.239	S	C	.	.	H	α-helix	trans	-70.6	-37.8	176.5	-173.1	172.5	-2	0	0	111.6	K661 E662 L663 F667 E668 N669	K661-Q665 PolarHBondContact O-N 3.33Å; E662-Q665 WeakPolarHBondContact O-CB 3.44Å; E662-Q665 PolarHBondContact O-N 2.95Å; L663-Q665 VanDerWaalsContact C-N 3.28Å; L663-Q665 PolarHBondContact O-N 3.04Å; Q665-F667 PolarHBondContact O-N 3.23Å; Q665-E668 PolarHBondContact O-N 3.31Å; Q665-N669 VanDerWaalsContact O-CG 3.29Å; Q665-N669 PolarHBondContact O-N 3.42Å; Q665-N669 PolarHBondContact O-ND2 2.87Å
666	T	94.3	Very high	93.9	Very high	61 Å²	61	41.6 Å²	41.6	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-60.2	-44.6	174.2	63.5	0	0	0	0	111.7	E662 L663 E668 N669 L670	E662-T666 WeakPolarHBondContact O-CG2 3.48Å; E662-T666 PolarHBondContact O-N 3.35Å; L663-T666 WeakPolarHBondContact CA-OG1 3.5Å; L663-T666 PolarHBondContact O-N 2.93Å; L663-T666 PolarHBondContact O-OG1 3.39Å; T666-E668 PolarHBondContact O-N 3.14Å; T666-N669 PolarHBondContact O-N 3.47Å; T666-L670 VanDerWaalsContact O-CG 3.32Å; T666-L670 WeakPolarHBondContact O-CG 3.19Å; T666-L670 PolarHBondContact O-N 3.09Å
667	F	95.7	Very high	94	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66	-35.4	175.7	-74.4	-58.2	0	0	0	113.1	F611 V615 A623 W627 A637 C641 L644 L663 Q665 L670 A671	F611-F667 AromaticContact CE2-CE1 3.73Å; F611-F667 HydrophobicContact CE2-CE1 3.73Å; F611-F667 HydrophobicContact CE2-CE2 4.31Å; F611-F667 AromaticContact CE2-CZ 3.61Å; F611-F667 HydrophobicContact CE2-CZ 3.61Å; F611-F667 HydrophobicContact CZ-CE1 4.15Å; F611-F667 HydrophobicContact CZ-CE2 4.45Å; F611-F667 HydrophobicContact CZ-CZ 4.11Å; V615-F667 HydrophobicContact CG2-CE2 4.35Å; A623-F667 HydrophobicContact CB-CE2 4.36Å; A623-F667 HydrophobicContact CB-CZ 3.86Å; W627-F667 HydrophobicContact CB-CE1 4.06Å; W627-F667 HydrophobicContact CG-CE1 4.13Å; A637-F667 HydrophobicContact CB-CB 4.45Å; A637-F667 WeakPolarHBondContact CB-O 3.38Å; C641-F667 HydrophobicContact CB-CB 4.43Å; L644-F667 HydrophobicContact CD1-CD2 3.82Å; L644-F667 HydrophobicContact CD1-CE2 4.03Å; L663-F667 HydrophobicContact CD1-CD2 4.25Å; L663-F667 HydrophobicContact CD1-CE2 3.66Å; L663-F667 HydrophobicContact CD1-CZ 4.24Å; L663-F667 HydrophobicContact CD2-CE2 4.17Å; L663-F667 HydrophobicContact CG-CD2 4.08Å; L663-F667 HydrophobicContact CG-CE2 3.68Å; L663-F667 WeakPolarHBondContact O-CD2 3.4Å; L663-F667 PolarHBondContact O-N 3.39Å; L663-F667 VanDerWaalsContact O-N 3.1Å; Q665-F667 PolarHBondContact O-N 3.23Å; F667-L670 HydrophobicContact CD1-CD1 4.14Å; F667-L670 PolarHBondContact O-N 3.03Å; F667-A671 WeakPolarHBondContact O-CB 3.39Å; F667-A671 PolarHBondContact O-N 2.68Å
668	E	95.9	Very high	94.1	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-42.1	173.9	-173.3	177.3	-175.8	0	0	112	R645 A664 Q665 T666 A671 H672 A711 R712 I713 F714	R645-E668 IonicContact CZ-OE2 2.87Å; R645-E668 IonicContact NH1-OE2 3.24Å; R645-E668 IonicContact NH2-OE2 2.69Å; R645-E668 PolarHBondContact NH2-OE2 2.83Å; A664-E668 PolarHBondContact O-N 2.88Å; A664-E668 VanDerWaalsContact O-N 3.11Å; Q665-E668 PolarHBondContact O-N 3.31Å; T666-E668 PolarHBondContact O-N 3.14Å; E668-A671 PolarHBondContact O-N 2.65Å; E668-H672 WeakPolarHBondContact O-CB 3.38Å; E668-H672 PolarHBondContact O-N 2.96Å; E668-A711 HydrophobicContact CG-CB 4.26Å; E668-A711 WeakPolarHBondContact OE1-CA 3.37Å; E668-R712 PolarHBondContact OE1-N 2.96Å; E668-I713 HydrophobicContact CG-CB 4.1Å; E668-I713 WeakPolarHBondContact OE1-CA 3.44Å; E668-I713 VanDerWaalsContact OE1-CB 3.31Å; E668-I713 WeakPolarHBondContact OE1-CB 3.45Å; E668-I713 PolarHBondContact OE1-N 3.32Å; E668-F714 PolarHBondContact OE1-N 3Å
669	N	95.1	Very high	94.2	Very high	61 Å²	61	35.1 Å²	35.1	33%	0.326	18%	0.179	S	C	.	.	H	α-helix	trans	-64.6	-44.4	176.5	-67.4	-17.3	0	0	0	111.2	Q665 T666 A671 H672 D673 I713	Q665-N669 VanDerWaalsContact O-CG 3.29Å; Q665-N669 PolarHBondContact O-N 3.42Å; Q665-N669 PolarHBondContact O-ND2 2.87Å; T666-N669 PolarHBondContact O-N 3.47Å; N669-A671 VanDerWaalsContact C-N 3.32Å; N669-A671 PolarHBondContact O-N 3.13Å; N669-H672 WeakPolarHBondContact O-CB 3.5Å; N669-H672 PolarHBondContact O-N 3.38Å; N669-H672 VanDerWaalsContact O-N 3.12Å; N669-D673 VanDerWaalsContact O-CG 3.28Å; N669-D673 PolarHBondContact O-N 3.41Å; N669-I713 WeakPolarHBondContact OD1-CD1 3.17Å
670	L	94.2	Very high	94.2	Very high	22 Å²	22	43.3 Å²	43.3	12%	0.115	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-41.5	175.7	-70.6	171.6	0	0	0	112.2	W627 T666 F667 D673 I674 F1173	W627-L670 HydrophobicContact CD2-CD1 4.48Å; W627-L670 HydrophobicContact CE3-CD1 4.08Å; W627-L670 HydrophobicContact CH2-CB 3.73Å; W627-L670 HydrophobicContact CH2-CD1 3.93Å; W627-L670 HydrophobicContact CH2-CD2 3.86Å; W627-L670 HydrophobicContact CH2-CG 4.04Å; W627-L670 HydrophobicContact CZ2-CB 3.81Å; W627-L670 HydrophobicContact CZ2-CD1 4.36Å; W627-L670 HydrophobicContact CZ3-CB 4.46Å; W627-L670 HydrophobicContact CZ3-CD1 3.81Å; W627-L670 HydrophobicContact CZ3-CD2 4.06Å; W627-L670 HydrophobicContact CZ3-CG 4.33Å; T666-L670 VanDerWaalsContact O-CG 3.32Å; T666-L670 WeakPolarHBondContact O-CG 3.19Å; T666-L670 PolarHBondContact O-N 3.09Å; F667-L670 HydrophobicContact CD1-CD1 4.14Å; F667-L670 PolarHBondContact O-N 3.03Å; L670-D673 PolarHBondContact O-N 2.91Å; L670-I674 PolarHBondContact O-N 3.03Å; L670-I674 VanDerWaalsContact O-N 3.09Å; L670-F1173 HydrophobicContact CD2-CE1 4.48Å
671	A	95.3	Very high	94.2	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-41	174.7	0	0	0	0	0	112.2	V634 A637 L638 F667 E668 N669 F675 F714	V634-A671 HydrophobicContact CG1-CB 4.45Å; A637-A671 HydrophobicContact CB-CB 3.79Å; L638-A671 HydrophobicContact CD2-CB 4.03Å; L638-A671 HydrophobicContact CG-CB 4.09Å; F667-A671 WeakPolarHBondContact O-CB 3.39Å; F667-A671 PolarHBondContact O-N 2.68Å; E668-A671 PolarHBondContact O-N 2.65Å; N669-A671 VanDerWaalsContact C-N 3.32Å; N669-A671 PolarHBondContact O-N 3.13Å; A671-F675 VanDerWaalsContact O-CB 3.26Å; A671-F675 WeakPolarHBondContact O-CB 3.43Å; A671-F675 PolarHBondContact O-N 3.1Å; A671-F675 VanDerWaalsContact O-N 3.16Å; A671-F714 HydrophobicContact CB-CD2 4.36Å
672	H	95	Very high	94	Very high	40 Å²	40	43.3 Å²	43.3	19%	0.185	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-47.7	176.7	178.2	95	0	0	0	111.7	E668 N669 F675 S676 I713 H717	E668-H672 WeakPolarHBondContact O-CB 3.38Å; E668-H672 PolarHBondContact O-N 2.96Å; N669-H672 WeakPolarHBondContact O-CB 3.5Å; N669-H672 PolarHBondContact O-N 3.38Å; N669-H672 VanDerWaalsContact O-N 3.12Å; H672-F675 PolarHBondContact O-N 2.93Å; H672-S676 WeakPolarHBondContact O-CB 3.42Å; H672-S676 PolarHBondContact O-N 2.62Å; H672-I713 HydrophobicContact CB-CG2 4.4Å; H672-I713 PolarHBondContact ND1-O 3.32Å; H672-H717 AromaticContact CE1-CD2 3.52Å; H672-H717 AromaticContact ND1-CD2 3.99Å; H672-H717 AromaticContact NE2-CD2 3.83Å
673	D	93.5	Very high	93.7	Very high	62 Å²	62	41 Å²	41	33%	0.332	20%	0.203	S	C	.	.	H	α-helix	trans	-69.9	-42.3	-174.4	-67.8	-27.3	0	0	0	112.5	N669 L670 S676 S677 F1173	N669-D673 VanDerWaalsContact O-CG 3.28Å; N669-D673 PolarHBondContact O-N 3.41Å; L670-D673 PolarHBondContact O-N 2.91Å; D673-S676 WeakPolarHBondContact O-CB 3.2Å; D673-S676 PolarHBondContact O-N 2.95Å; D673-S677 PolarHBondContact O-N 3.14Å; D673-F1173 HydrophobicContact CB-CE1 4.37Å; D673-F1173 HydrophobicContact CB-CE2 3.61Å; D673-F1173 HydrophobicContact CB-CZ 3.5Å
674	I	93.9	Very high	93.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.4	-42.8	174.9	-73.2	160.7	0	0	0	110.8	W627 V634 L670 S676 S677 C678 K1170 F1173	W627-I674 HydrophobicContact CH2-CD1 3.26Å; W627-I674 HydrophobicContact CZ2-CD1 3.22Å; V634-I674 HydrophobicContact CG2-CB 4.35Å; V634-I674 HydrophobicContact CG2-CG2 3.79Å; L670-I674 PolarHBondContact O-N 3.03Å; L670-I674 VanDerWaalsContact O-N 3.09Å; I674-S676 PolarHBondContact O-N 2.92Å; I674-S677 WeakPolarHBondContact O-CB 3.48Å; I674-S677 PolarHBondContact O-N 3.4Å; I674-S677 VanDerWaalsContact O-N 3.12Å; I674-C678 PolarHBondContact O-N 3.32Å; I674-C678 PolarHBondContact O-SG 2.87Å; I674-C678 VanDerWaalsContact O-SG 3.34Å; I674-K1170 HydrophobicContact CD1-CG 4.07Å; I674-F1173 HydrophobicContact CG1-CD1 3.84Å; I674-F1173 HydrophobicContact CG1-CE1 4.31Å; I674-F1173 HydrophobicContact CG1-CG 4.23Å
675	F	95.1	Very high	92.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-35.7	176.8	-175.7	-101.7	0	0	0	111.7	A671 H672 C678 Y679 L689 L690 F714 H717 V720	A671-F675 VanDerWaalsContact O-CB 3.26Å; A671-F675 WeakPolarHBondContact O-CB 3.43Å; A671-F675 PolarHBondContact O-N 3.1Å; A671-F675 VanDerWaalsContact O-N 3.16Å; H672-F675 PolarHBondContact O-N 2.93Å; F675-C678 PolarHBondContact O-N 3.39Å; F675-Y679 VanDerWaalsContact O-CB 3.3Å; F675-Y679 WeakPolarHBondContact O-CB 3.22Å; F675-Y679 PolarHBondContact O-N 2.92Å; F675-L689 HydrophobicContact CD2-CD2 4.35Å; F675-L690 HydrophobicContact CD2-CD2 4.12Å; F675-L690 HydrophobicContact CE2-CD1 4.03Å; F675-L690 HydrophobicContact CE2-CD2 3.59Å; F675-L690 HydrophobicContact CE2-CG 3.64Å; F675-L690 HydrophobicContact CZ-CD1 3.65Å; F675-L690 HydrophobicContact CZ-CD2 3.9Å; F675-L690 HydrophobicContact CZ-CG 3.81Å; F675-F714 HydrophobicContact CB-CE2 4.04Å; F675-F714 HydrophobicContact CD1-CE2 4.48Å; F675-F714 HydrophobicContact CG-CE2 4.13Å; F675-H717 AromaticContact CD1-CE1 3.6Å; F675-H717 AromaticContact CD1-ND1 3.33Å; F675-H717 VanDerWaalsContact CD1-ND1 3.33Å; F675-H717 WeakPolarHBondContact CD1-ND1 3.34Å; F675-H717 AromaticContact CE1-CE1 3.73Å; F675-H717 AromaticContact CE1-ND1 3.35Å; F675-H717 WeakPolarHBondContact CE1-ND1 2.81Å; F675-V720 HydrophobicContact CD1-CG2 4.11Å; F675-V720 HydrophobicContact CE1-CG2 3.65Å; F675-V720 HydrophobicContact CZ-CG2 4.26Å
676	S	94.1	Very high	92.5	Very high	21 Å²	21	42.1 Å²	42.1	15%	0.147	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-43.5	172.6	-173.8	0	0	0	0	112	H672 D673 I674 Y679 R680 H717	H672-S676 WeakPolarHBondContact O-CB 3.42Å; H672-S676 PolarHBondContact O-N 2.62Å; D673-S676 WeakPolarHBondContact O-CB 3.2Å; D673-S676 PolarHBondContact O-N 2.95Å; I674-S676 PolarHBondContact O-N 2.92Å; S676-Y679 PolarHBondContact O-N 3.31Å; S676-R680 VanDerWaalsContact O-CG 3.3Å; S676-R680 WeakPolarHBondContact O-CG 3.44Å; S676-R680 PolarHBondContact O-N 3.24Å; S676-H717 WeakPolarHBondContact CA-NE2 3.24Å; S676-H717 WeakPolarHBondContact CB-NE2 3.23Å
677	S	91.1	Very high	92.3	Very high	30 Å²	30	39.7 Å²	39.7	21%	0.21	20%	0.198	C	C	.	.	H	α-helix	trans	-60.7	-49.2	173.9	-163.1	0	0	0	0	111.8	D673 I674 Y679 R680 S681	D673-S677 PolarHBondContact O-N 3.14Å; I674-S677 WeakPolarHBondContact O-CB 3.48Å; I674-S677 PolarHBondContact O-N 3.4Å; I674-S677 VanDerWaalsContact O-N 3.12Å; S677-Y679 VanDerWaalsContact C-N 3.32Å; S677-Y679 PolarHBondContact O-N 2.89Å; S677-R680 PolarHBondContact O-N 2.85Å; S677-S681 PolarHBondContact O-N 3Å; S677-S681 VanDerWaalsContact O-N 3.1Å
678	C	92.2	Very high	91.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.3	-42.6	176.9	-68.1	0	0	0	0	112.3	I674 F675 S681 D682 W1165	I674-C678 PolarHBondContact O-N 3.32Å; I674-C678 PolarHBondContact O-SG 2.87Å; I674-C678 VanDerWaalsContact O-SG 3.34Å; F675-C678 PolarHBondContact O-N 3.39Å; C678-S681 PolarHBondContact O-N 3.46Å; C678-D682 PolarHBondContact O-N 2.94Å; C678-D682 VanDerWaalsContact O-N 3.08Å; C678-W1165 HydrophobicContact CB-CH2 3.67Å; C678-W1165 HydrophobicContact CB-CZ2 4.43Å; C678-W1165 HydrophobicContact CB-CZ3 4.11Å
679	Y	94.1	Very high	91.5	Very high	60 Å²	60	42.8 Å²	42.8	24%	0.235	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-36.4	178.9	-178.7	-102.8	0	0	0	112.7	F675 S676 S677 S681 E683 S686 F687 G719	F675-Y679 VanDerWaalsContact O-CB 3.3Å; F675-Y679 WeakPolarHBondContact O-CB 3.22Å; F675-Y679 PolarHBondContact O-N 2.92Å; S676-Y679 PolarHBondContact O-N 3.31Å; S677-Y679 VanDerWaalsContact C-N 3.32Å; S677-Y679 PolarHBondContact O-N 2.89Å; Y679-S681 VanDerWaalsContact C-N 3.3Å; Y679-E683 HydrophobicContact CE2-CB 4.23Å; Y679-E683 HydrophobicContact CE2-CG 3.8Å; Y679-S686 WeakPolarHBondContact CD2-OG 3.25Å; Y679-F687 HydrophobicContact CD2-CE1 4.49Å; Y679-F687 HydrophobicContact CE2-CE1 4.06Å; Y679-F687 HydrophobicContact CE2-CZ 4.35Å; Y679-G719 VanDerWaalsContact CE2-CA 3.48Å
680	R	92.6	Very high	91.3	Very high	208 Å²	208	39.9 Å²	39.9	79%	0.785	20%	0.199	S	C	*	.	H	α-helix	trans	-68.2	-30.2	174.9	-73	174.1	-174.5	-174.8	1.9	112.6	S676 S677	S676-R680 VanDerWaalsContact O-CG 3.3Å; S676-R680 WeakPolarHBondContact O-CG 3.44Å; S676-R680 PolarHBondContact O-N 3.24Å; S677-R680 PolarHBondContact O-N 2.85Å
681	S	91.4	Very high	90.9	Very high	65 Å²	65	39.6 Å²	39.6	46%	0.455	20%	0.197	S	C	.	.	H	α-helix	trans	-75.5	-53.5	177.4	179	0	0	0	0	112	S677 C678 Y679	S677-S681 PolarHBondContact O-N 3Å; S677-S681 VanDerWaalsContact O-N 3.1Å; C678-S681 PolarHBondContact O-N 3.46Å; Y679-S681 VanDerWaalsContact C-N 3.3Å
682	D	90.6	Very high	90.5	Very high	45 Å²	45	40.1 Å²	40.1	24%	0.241	20%	0.199	C	C	.	.			trans	-152.9	114.4	-179.4	-173.1	-24	0	0	0	111.3	C678 S684 R685 S686 W1165	C678-D682 PolarHBondContact O-N 2.94Å; C678-D682 VanDerWaalsContact O-N 3.08Å; D682-S684 VanDerWaalsContact C-N 3.33Å; D682-S684 PolarHBondContact O-N 2.96Å; D682-S684 WeakPolarHBondContact OD1-CA 3.39Å; D682-S684 WeakPolarHBondContact OD1-CB 3.25Å; D682-S684 PolarHBondContact OD1-N 3Å; D682-S684 PolarHBondContact OD1-OG 3.21Å; D682-R685 HydrophobicContact CB-CB 4.17Å; D682-R685 HydrophobicContact CB-CG 4.37Å; D682-R685 PolarHBondContact OD1-N 3.06Å; D682-R685 WeakPolarHBondContact OD2-CD 3.33Å; D682-R685 VanDerWaalsContact OD2-CG 3.26Å; D682-R685 WeakPolarHBondContact OD2-CG 3.49Å; D682-R685 IonicContact OD2-NE 3.28Å; D682-R685 PolarHBondContact OD2-NE 3.4Å; D682-S686 VanDerWaalsContact O-CB 3.27Å; D682-S686 WeakPolarHBondContact O-CB 3.44Å; D682-S686 PolarHBondContact O-N 3.42Å; D682-S686 VanDerWaalsContact O-N 3.12Å; D682-S686 PolarHBondContact O-OG 3.39Å; D682-W1165 HydrophobicContact CB-CZ2 4.14Å
683	E	88.8	Confident	90	Very high	73 Å²	73	41.7 Å²	41.7	34%	0.341	21%	0.205	S	C	.	.	H	α-helix	trans	-60.2	-42.3	177.8	177.8	171.9	-174.5	0	0	111.2	Y679 S686 F687 S722 R734	Y679-E683 HydrophobicContact CE2-CB 4.23Å; Y679-E683 HydrophobicContact CE2-CG 3.8Å; E683-S686 PolarHBondContact O-N 2.87Å; E683-S686 PolarHBondContact O-OG 3.28Å; E683-F687 HydrophobicContact CG-CD2 4.16Å; E683-F687 HydrophobicContact CG-CE1 3.99Å; E683-F687 HydrophobicContact CG-CE2 3.39Å; E683-F687 HydrophobicContact CG-CZ 3.32Å; E683-F687 WeakPolarHBondContact O-CD2 3.47Å; E683-F687 VanDerWaalsContact O-CG 3.29Å; E683-F687 WeakPolarHBondContact O-CG 3.43Å; E683-F687 PolarHBondContact O-N 3.27Å; E683-F687 VanDerWaalsContact O-N 3.16Å; E683-F687 WeakPolarHBondContact OE1-CE2 3.1Å; E683-F687 WeakPolarHBondContact OE1-CZ 3.2Å; E683-S722 PolarHBondContact OE1-OG 2.91Å; E683-R734 IonicContact OE1-CZ 3.62Å; E683-R734 IonicContact OE1-NH1 2.69Å; E683-R734 PolarHBondContact OE1-NH1 3.36Å; E683-R734 IonicContact OE1-NH2 3.4Å; E683-R734 PolarHBondContact OE1-NH2 3.39Å
684	S	85.1	Confident	89.5	Confident	66 Å²	66	38.8 Å²	38.8	46%	0.462	19%	0.19	S	C	.	.	H	α-helix	trans	-69.4	-47.4	-173.6	71.1	0	0	0	0	112.7	D682 S686 F687 D688	D682-S684 VanDerWaalsContact C-N 3.33Å; D682-S684 PolarHBondContact O-N 2.96Å; D682-S684 WeakPolarHBondContact OD1-CA 3.39Å; D682-S684 WeakPolarHBondContact OD1-CB 3.25Å; D682-S684 PolarHBondContact OD1-N 3Å; D682-S684 PolarHBondContact OD1-OG 3.21Å; S684-S686 VanDerWaalsContact C-N 3.32Å; S684-S686 PolarHBondContact O-N 3.31Å; S684-F687 WeakPolarHBondContact O-CB 3.3Å; S684-F687 PolarHBondContact O-N 3.39Å; S684-D688 PolarHBondContact O-N 2.97Å
685	R	86.6	Confident	88.9	Confident	67 Å²	67	42.8 Å²	42.8	25%	0.253	22%	0.216	S	C	.	.	H	α-helix	trans	-66.3	-35.1	176.5	-68.5	178.3	-170.3	-165.4	1.6	111.8	D682 F687 D688 L689 L1162 W1165	D682-R685 HydrophobicContact CB-CB 4.17Å; D682-R685 HydrophobicContact CB-CG 4.37Å; D682-R685 PolarHBondContact OD1-N 3.06Å; D682-R685 WeakPolarHBondContact OD2-CD 3.33Å; D682-R685 VanDerWaalsContact OD2-CG 3.26Å; D682-R685 WeakPolarHBondContact OD2-CG 3.49Å; D682-R685 IonicContact OD2-NE 3.28Å; D682-R685 PolarHBondContact OD2-NE 3.4Å; R685-F687 VanDerWaalsContact C-N 3.27Å; R685-F687 PolarHBondContact O-N 3.31Å; R685-D688 PolarHBondContact O-N 2.71Å; R685-L689 PolarHBondContact O-N 3.17Å; R685-L1162 HydrophobicContact CB-CD1 4.2Å; R685-W1165 HydrophobicContact CB-CE3 4.42Å; R685-W1165 HydrophobicContact CB-CH2 3.92Å; R685-W1165 HydrophobicContact CB-CZ2 4.23Å; R685-W1165 HydrophobicContact CB-CZ3 4.03Å
686	S	89.3	Confident	88.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.3	-32.1	176	79.3	0	0	0	0	112.5	Y679 D682 E683 S684 L689 L690	Y679-S686 WeakPolarHBondContact CD2-OG 3.25Å; D682-S686 VanDerWaalsContact O-CB 3.27Å; D682-S686 WeakPolarHBondContact O-CB 3.44Å; D682-S686 PolarHBondContact O-N 3.42Å; D682-S686 VanDerWaalsContact O-N 3.12Å; D682-S686 PolarHBondContact O-OG 3.39Å; E683-S686 PolarHBondContact O-N 2.87Å; E683-S686 PolarHBondContact O-OG 3.28Å; S684-S686 VanDerWaalsContact C-N 3.32Å; S684-S686 PolarHBondContact O-N 3.31Å; S686-L689 WeakPolarHBondContact O-CB 3.37Å; S686-L689 PolarHBondContact O-N 3.44Å; S686-L690 PolarHBondContact O-N 3.46Å
687	F	89	Confident	87.7	Confident	11 Å²	11	42.8 Å²	42.8	5%	0.048	21%	0.214	C	C	.	.	H	α-helix	trans	-70.1	-43.9	174.2	-65.6	-19.1	0	0	0	112.1	Y679 E683 S684 R685 L689 L690 I691 F723	Y679-F687 HydrophobicContact CD2-CE1 4.49Å; Y679-F687 HydrophobicContact CE2-CE1 4.06Å; Y679-F687 HydrophobicContact CE2-CZ 4.35Å; E683-F687 HydrophobicContact CG-CD2 4.16Å; E683-F687 HydrophobicContact CG-CE1 3.99Å; E683-F687 HydrophobicContact CG-CE2 3.39Å; E683-F687 HydrophobicContact CG-CZ 3.32Å; E683-F687 WeakPolarHBondContact O-CD2 3.47Å; E683-F687 VanDerWaalsContact O-CG 3.29Å; E683-F687 WeakPolarHBondContact O-CG 3.43Å; E683-F687 PolarHBondContact O-N 3.27Å; E683-F687 VanDerWaalsContact O-N 3.16Å; E683-F687 WeakPolarHBondContact OE1-CE2 3.1Å; E683-F687 WeakPolarHBondContact OE1-CZ 3.2Å; S684-F687 WeakPolarHBondContact O-CB 3.3Å; S684-F687 PolarHBondContact O-N 3.39Å; R685-F687 VanDerWaalsContact C-N 3.27Å; R685-F687 PolarHBondContact O-N 3.31Å; F687-L689 PolarHBondContact O-N 3.27Å; F687-L690 PolarHBondContact O-N 3.37Å; F687-L690 VanDerWaalsContact O-N 3.08Å; F687-I691 WeakPolarHBondContact O-CG1 3.48Å; F687-I691 PolarHBondContact O-N 3.32Å; F687-F723 HydrophobicContact CB-CD2 3.67Å; F687-F723 HydrophobicContact CB-CE2 3.82Å; F687-F723 HydrophobicContact CD1-CB 3.67Å; F687-F723 AromaticContact CD1-CD2 3.55Å; F687-F723 HydrophobicContact CD1-CD2 3.55Å; F687-F723 AromaticContact CD1-CG 3.89Å; F687-F723 HydrophobicContact CD1-CG 3.89Å; F687-F723 AromaticContact CD2-CD2 3.93Å; F687-F723 HydrophobicContact CD2-CD2 3.93Å; F687-F723 HydrophobicContact CE1-CB 3.55Å; F687-F723 HydrophobicContact CE1-CD2 4.09Å; F687-F723 HydrophobicContact CE1-CG 4.25Å; F687-F723 HydrophobicContact CE2-CD2 4.41Å; F687-F723 HydrophobicContact CG-CB 4.42Å; F687-F723 AromaticContact CG-CD2 3.44Å; F687-F723 HydrophobicContact CG-CD2 3.44Å; F687-F723 VanDerWaalsContact CG-CD2 3.44Å; F687-F723 HydrophobicContact CG-CE2 4.09Å; F687-F723 HydrophobicContact CG-CG 4.25Å; F687-F723 HydrophobicContact CZ-CB 4.19Å; F687-F723 HydrophobicContact CZ-CD2 4.46Å
688	D	86.1	Confident	86.9	Confident	66 Å²	66	42.1 Å²	42.1	35%	0.353	21%	0.213	S	C	.	.	H	α-helix	trans	-59.7	-35.8	174.3	-73.5	-15.7	0	0	0	111.5	S684 R685 L690 I691 R692 L1152 L1162	S684-D688 PolarHBondContact O-N 2.97Å; R685-D688 PolarHBondContact O-N 2.71Å; D688-L690 VanDerWaalsContact C-N 3.32Å; D688-L690 PolarHBondContact O-N 3.45Å; D688-I691 PolarHBondContact O-N 3.44Å; D688-R692 WeakPolarHBondContact O-CB 3.38Å; D688-R692 PolarHBondContact O-N 3.47Å; D688-L1152 HydrophobicContact CB-CD2 4.13Å; D688-L1162 HydrophobicContact CB-CD2 4.42Å
689	L	89.1	Confident	86.2	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-60	-38.3	174.5	-173.2	73.8	0	0	0	112.7	V634 F675 R685 S686 F687 R692 L1162 E1166	V634-L689 HydrophobicContact CG2-CD2 4.28Å; F675-L689 HydrophobicContact CD2-CD2 4.35Å; R685-L689 PolarHBondContact O-N 3.17Å; S686-L689 WeakPolarHBondContact O-CB 3.37Å; S686-L689 PolarHBondContact O-N 3.44Å; F687-L689 PolarHBondContact O-N 3.27Å; L689-R692 VanDerWaalsContact CD1-NE 3.28Å; L689-R692 WeakPolarHBondContact O-CG 3.43Å; L689-L1162 HydrophobicContact CD1-CD2 4.43Å; L689-L1162 HydrophobicContact CD1-CG 4.43Å; L689-E1166 HydrophobicContact CD1-CG 4.33Å; L689-E1166 VanDerWaalsContact CD1-OE2 3.27Å; L689-E1166 WeakPolarHBondContact CD1-OE2 3.47Å
690	L	90	Very high	85.8	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-69.9	-34.5	-179.2	-70.6	176.6	0	0	0	113.4	F675 S686 F687 D688 C702 L703 F714 V720 F723	F675-L690 HydrophobicContact CD2-CD2 4.12Å; F675-L690 HydrophobicContact CE2-CD1 4.03Å; F675-L690 HydrophobicContact CE2-CD2 3.59Å; F675-L690 HydrophobicContact CE2-CG 3.64Å; F675-L690 HydrophobicContact CZ-CD1 3.65Å; F675-L690 HydrophobicContact CZ-CD2 3.9Å; F675-L690 HydrophobicContact CZ-CG 3.81Å; S686-L690 PolarHBondContact O-N 3.46Å; F687-L690 PolarHBondContact O-N 3.37Å; F687-L690 VanDerWaalsContact O-N 3.08Å; D688-L690 VanDerWaalsContact C-N 3.32Å; D688-L690 PolarHBondContact O-N 3.45Å; L690-C702 HydrophobicContact CD2-CB 4.34Å; L690-C702 PolarHBondContact O-N 3.19Å; L690-L703 HydrophobicContact CB-CD1 4.28Å; L690-L703 HydrophobicContact CB-CG 4.2Å; L690-L703 HydrophobicContact CD2-CD2 4.39Å; L690-F714 HydrophobicContact CD2-CE1 4.24Å; L690-F714 HydrophobicContact CD2-CZ 3.7Å; L690-V720 HydrophobicContact CD1-CG2 4.28Å; L690-V720 HydrophobicContact CD2-CG2 4.42Å; L690-F723 HydrophobicContact CD1-CB 4.18Å; L690-F723 HydrophobicContact CD1-CD1 3.94Å; L690-F723 HydrophobicContact CD1-CG 4.12Å
691	I	86.5	Confident	85.6	Confident	16 Å²	16	32.1 Å²	32.1	8%	0.082	18%	0.183	C	C	.	.	H	α-helix	trans	-102.3	-8.5	-172.7	60.6	176.9	0	0	0	114.3	F687 D688 T701 L703 F723 L1152	F687-I691 WeakPolarHBondContact O-CG1 3.48Å; F687-I691 PolarHBondContact O-N 3.32Å; D688-I691 PolarHBondContact O-N 3.44Å; I691-T701 WeakPolarHBondContact O-CG2 3.44Å; I691-L703 HydrophobicContact CG2-CD1 4.24Å; I691-F723 HydrophobicContact CD1-CZ 4.49Å; I691-F723 HydrophobicContact CG2-CE1 3.61Å; I691-F723 HydrophobicContact CG2-CZ 3.39Å; I691-L1152 HydrophobicContact CB-CB 4.4Å; I691-L1152 HydrophobicContact CD1-CB 3.88Å; I691-L1152 HydrophobicContact CD1-CD2 4.24Å; I691-L1152 HydrophobicContact CG1-CB 3.74Å; I691-L1152 HydrophobicContact CG1-CD2 4.3Å; I691-L1152 PolarHBondContact O-N 2.89Å
692	R	87.3	Confident	85.5	Confident	11 Å²	11	29.1 Å²	29.1	4%	0.042	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-62.1	144	177.5	75.2	-173.8	179.8	90.7	-11.9	111.2	E632 D688 L689 L1154 M1163 E1166	E632-R692 IonicContact OE1-CZ 3.1Å; E632-R692 IonicContact OE1-NH1 3.06Å; E632-R692 PolarHBondContact OE1-NH1 3.08Å; E632-R692 IonicContact OE1-NH2 2.82Å; D688-R692 WeakPolarHBondContact O-CB 3.38Å; D688-R692 PolarHBondContact O-N 3.47Å; L689-R692 VanDerWaalsContact CD1-NE 3.28Å; L689-R692 WeakPolarHBondContact O-CG 3.43Å; R692-L1154 HydrophobicContact CB-CD1 4.09Å; R692-M1163 VanDerWaalsContact CZ-SD 3.54Å; R692-M1163 PolarHBondContact NH2-SD 3.35Å; R692-E1166 IonicContact CZ-OE2 3.73Å; R692-E1166 IonicContact NH2-OE2 2.76Å; R692-E1166 PolarHBondContact NH2-OE2 2.96Å
693	K	84.2	Confident	85.5	Confident	73 Å²	73	27 Å²	27	32%	0.317	15%	0.151	S	C	.	.	P	Polyproline II helix	trans	-83.4	123	166.5	-75.6	-176.3	151.1	171.6	0	110.7	S699 T700 T701 V1151 L1152 Q1153	K693-S699 WeakPolarHBondContact CE-O 3.36Å; K693-S699 WeakPolarHBondContact CG-O 3.43Å; K693-T700 WeakPolarHBondContact CA-O 3.45Å; K693-T701 HydrophobicContact CG-CG2 4.3Å; K693-V1151 HydrophobicContact CD-CG1 3.55Å; K693-V1151 HydrophobicContact CG-CG1 3.83Å; K693-L1152 PolarHBondContact N-O 3.07Å; K693-L1152 VanDerWaalsContact N-O 3.13Å; K693-Q1153 HydrophobicContact CD-CG 4.01Å
694	S	83.6	Confident	85.4	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.007	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-78.7	130.3	174.2	165.6	0	0	0	0	111.7	E632 V696 W697 S699 T700	E632-S694 PolarHBondContact OE1-OG 3.07Å; E632-S694 VanDerWaalsContact OE1-OG 3.1Å; E632-S694 WeakPolarHBondContact OE2-CB 3.48Å; E632-S694 PolarHBondContact OE2-OG 2.88Å; S694-V696 VanDerWaalsContact C-N 3.3Å; S694-V696 PolarHBondContact OG-N 3.41Å; S694-W697 PolarHBondContact OG-N 2.99Å; S694-S699 WeakPolarHBondContact O-CA 3.36Å; S694-S699 PolarHBondContact O-N 3.13Å; S694-T700 PolarHBondContact N-O 3.04Å
695	P	79.9	Confident	85.7	Confident	83 Å²	83	24.1 Å²	24.1	54%	0.539	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-17.3	169.1	33.7	-35.2	0	0	0	112.8	Y605	Y605-P695 PolarHBondContact OH-O 3.18Å
696	V	81.6	Confident	85.9	Confident	20 Å²	20	21 Å²	21	12%	0.121	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-49.3	178.3	-175.2	0	0	0	0	109.9	F568 Y605 A608 E632 S694 G698	F568-V696 WeakPolarHBondContact CD2-O 3.33Å; F568-V696 HydrophobicContact CE2-CG1 4.24Å; F568-V696 WeakPolarHBondContact CE2-O 3.24Å; Y605-V696 HydrophobicContact CD1-CG1 4.39Å; Y605-V696 HydrophobicContact CD1-CG2 3.83Å; Y605-V696 HydrophobicContact CD2-CB 4.49Å; Y605-V696 HydrophobicContact CD2-CG1 4.16Å; Y605-V696 HydrophobicContact CE1-CG2 3.7Å; Y605-V696 HydrophobicContact CE2-CB 4.48Å; Y605-V696 HydrophobicContact CE2-CG2 4.42Å; Y605-V696 HydrophobicContact CG-CG1 4.02Å; Y605-V696 HydrophobicContact CG-CG2 4.26Å; A608-V696 HydrophobicContact CB-CG1 3.93Å; E632-V696 HydrophobicContact CG-CG2 4.22Å; S694-V696 VanDerWaalsContact C-N 3.3Å; S694-V696 PolarHBondContact OG-N 3.41Å; V696-G698 PolarHBondContact O-N 3.09Å
697	W	83.3	Confident	85.9	Confident	1 Å²	1	22.5 Å²	22.5	0%	0.004	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	48	-173.2	-65.9	99	0	0	0	112.3	L561 F568 I612 L635 T636 S639 S694 S699 T700 M705	L561-W697 HydrophobicContact CD1-CE3 4.49Å; L561-W697 HydrophobicContact CD1-CZ3 4.29Å; F568-W697 HydrophobicContact CD2-CE3 4.38Å; F568-W697 HydrophobicContact CE2-CE3 4.41Å; I612-W697 HydrophobicContact CD1-CH2 3.74Å; I612-W697 HydrophobicContact CD1-CZ3 3.96Å; I612-W697 HydrophobicContact CG1-CH2 3.7Å; I612-W697 HydrophobicContact CG1-CZ3 4.28Å; L635-W697 HydrophobicContact CD2-CB 3.96Å; L635-W697 HydrophobicContact CD2-CG 4.09Å; L635-W697 HydrophobicContact CG-CB 4.46Å; L635-W697 HydrophobicContact CG-CG 4.23Å; T636-W697 HydrophobicContact CG2-CZ2 4.16Å; T636-W697 PolarHBondContact OG1-NE1 2.77Å; S639-W697 VanDerWaalsContact CB-CH2 3.49Å; S694-W697 PolarHBondContact OG-N 2.99Å; W697-S699 PolarHBondContact O-N 2.83Å; W697-T700 WeakPolarHBondContact CB-OG1 3.22Å; W697-T700 WeakPolarHBondContact O-CB 3.5Å; W697-T700 VanDerWaalsContact O-CG2 3.24Å; W697-T700 WeakPolarHBondContact O-CG2 3.18Å; W697-T700 PolarHBondContact O-N 3.05Å; W697-T700 PolarHBondContact O-OG1 3.47Å; W697-M705 HydrophobicContact CB-CE 4.4Å
698	G	74	Confident	85.7	Confident	17 Å²	17	23.1 Å²	23.1	18%	0.175	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	41.8	168.3	0	0	0	0	0	115.4	V696 T700	V696-G698 PolarHBondContact O-N 3.09Å; G698-T700 VanDerWaalsContact C-N 3.3Å; G698-T700 PolarHBondContact O-N 3.48Å
699	S	78.4	Confident	85.8	Confident	54 Å²	54	20.2 Å²	20.2	38%	0.378	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	29.5	-179.6	-65.1	0	0	0	0	115.2	K693 S694 W697	K693-S699 WeakPolarHBondContact CE-O 3.36Å; K693-S699 WeakPolarHBondContact CG-O 3.43Å; S694-S699 WeakPolarHBondContact O-CA 3.36Å; S694-S699 PolarHBondContact O-N 3.13Å; W697-S699 PolarHBondContact O-N 2.83Å
700	T	84.1	Confident	85.8	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.012	13%	0.134	C	C	.	.			trans	-87.2	158.2	176.5	56.5	0	0	0	0	113.5	T564 C565 K693 S694 W697 G698	T564-T700 WeakPolarHBondContact O-CG2 3.37Å; C565-T700 HydrophobicContact CB-CG2 4.1Å; C565-T700 VanDerWaalsContact SG-CG2 3.51Å; K693-T700 WeakPolarHBondContact CA-O 3.45Å; S694-T700 PolarHBondContact N-O 3.04Å; W697-T700 WeakPolarHBondContact CB-OG1 3.22Å; W697-T700 WeakPolarHBondContact O-CB 3.5Å; W697-T700 VanDerWaalsContact O-CG2 3.24Å; W697-T700 WeakPolarHBondContact O-CG2 3.18Å; W697-T700 PolarHBondContact O-N 3.05Å; W697-T700 PolarHBondContact O-OG1 3.47Å; G698-T700 VanDerWaalsContact C-N 3.3Å; G698-T700 PolarHBondContact O-N 3.48Å
701	T	88.3	Confident	85.9	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.012	13%	0.134	C	C	.	.			trans	-104.5	154.5	174.3	61.3	0	0	0	0	110.4	I691 K693 L703 Q704 M705 V1151	I691-T701 WeakPolarHBondContact O-CG2 3.44Å; K693-T701 HydrophobicContact CG-CG2 4.3Å; T701-L703 VanDerWaalsContact C-N 3.25Å; T701-L703 PolarHBondContact O-N 2.9Å; T701-Q704 PolarHBondContact O-N 3.41Å; T701-Q704 WeakPolarHBondContact OG1-CB 3.26Å; T701-Q704 VanDerWaalsContact OG1-CD 3.28Å; T701-Q704 WeakPolarHBondContact OG1-CG 3.43Å; T701-Q704 PolarHBondContact OG1-N 3.02Å; T701-Q704 PolarHBondContact OG1-OE1 3.17Å; T701-M705 PolarHBondContact O-N 3.1Å; T701-V1151 HydrophobicContact CG2-CG2 4.36Å
702	C	90.4	Very high	86.2	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.014	14%	0.144	C	C	.	.	H	α-helix	trans	-58.5	-38.2	177.4	-64.2	0	0	0	0	112.2	L638 L690 M705 G706	L638-C702 HydrophobicContact CD1-CB 4.46Å; L690-C702 HydrophobicContact CD2-CB 4.34Å; L690-C702 PolarHBondContact O-N 3.19Å; C702-M705 PolarHBondContact O-N 3.23Å; C702-G706 PolarHBondContact O-N 3.13Å
703	L	89.8	Confident	86.4	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-66.1	-42.4	177.7	-65.3	170.8	0	0	0	112.2	L690 I691 T701 M707 F715 V720 F723 Y1109	L690-L703 HydrophobicContact CB-CD1 4.28Å; L690-L703 HydrophobicContact CB-CG 4.2Å; L690-L703 HydrophobicContact CD2-CD2 4.39Å; I691-L703 HydrophobicContact CG2-CD1 4.24Å; T701-L703 VanDerWaalsContact C-N 3.25Å; T701-L703 PolarHBondContact O-N 2.9Å; L703-M707 WeakPolarHBondContact O-CB 3.5Å; L703-M707 WeakPolarHBondContact O-CG 3.31Å; L703-M707 PolarHBondContact O-N 2.94Å; L703-F715 HydrophobicContact CD2-CE1 3.77Å; L703-F715 HydrophobicContact CD2-CZ 4.14Å; L703-V720 HydrophobicContact CD2-CG1 4.12Å; L703-F723 HydrophobicContact CD1-CD1 4.21Å; L703-F723 HydrophobicContact CD1-CE1 3.81Å; L703-Y1109 HydrophobicContact CB-CE2 4.05Å; L703-Y1109 HydrophobicContact CD1-CE2 4.23Å; L703-Y1109 HydrophobicContact CD2-CE2 4.38Å; L703-Y1109 HydrophobicContact CG-CE2 4.45Å
704	Q	87.9	Confident	86.9	Confident	78 Å²	78	24.1 Å²	24.1	36%	0.364	14%	0.139	S	C	.	.	H	α-helix	trans	-65.6	-41	176.2	-74.5	170.7	-21.4	0	0	112	T701 G708	T701-Q704 PolarHBondContact O-N 3.41Å; T701-Q704 WeakPolarHBondContact OG1-CB 3.26Å; T701-Q704 VanDerWaalsContact OG1-CD 3.28Å; T701-Q704 WeakPolarHBondContact OG1-CG 3.43Å; T701-Q704 PolarHBondContact OG1-N 3.02Å; T701-Q704 PolarHBondContact OG1-OE1 3.17Å; Q704-G708 PolarHBondContact O-N 3.14Å
705	M	89.9	Confident	87.3	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.5	-47.9	177	-169.3	67.5	72.6	0	0	111.3	L561 C565 L635 L638 S639 K642 W697 T701 C702 M707 G708 A709	L561-M705 HydrophobicContact CD2-SD 4.38Å; C565-M705 WeakPolarHBondContact SG-CE 3.5Å; L635-M705 HydrophobicContact CD1-CB 3.61Å; L635-M705 HydrophobicContact CD1-CE 4.25Å; L635-M705 HydrophobicContact CD1-CG 4Å; L638-M705 HydrophobicContact CB-CB 4.39Å; L638-M705 HydrophobicContact CB-CG 3.83Å; S639-M705 VanDerWaalsContact OG-CE 3.23Å; S639-M705 WeakPolarHBondContact OG-CE 3.31Å; K642-M705 HydrophobicContact CD-SD 4.05Å; W697-M705 HydrophobicContact CB-CE 4.4Å; T701-M705 PolarHBondContact O-N 3.1Å; C702-M705 PolarHBondContact O-N 3.23Å; M705-M707 VanDerWaalsContact C-N 3.31Å; M705-M707 PolarHBondContact O-N 3.25Å; M705-G708 CarbonylContact O-C 3.5Å; M705-G708 PolarHBondContact O-N 3.28Å; M705-G708 VanDerWaalsContact O-N 3.14Å; M705-A709 WeakPolarHBondContact O-CB 3.45Å; M705-A709 PolarHBondContact O-N 2.93Å
706	G	91.3	Very high	87.9	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.2	-41.7	178.2	0	0	0	0	0	112.3	C702 A709 D710 A711 F715	C702-G706 PolarHBondContact O-N 3.13Å; G706-A709 PolarHBondContact O-N 3.39Å; G706-D710 PolarHBondContact O-N 3.19Å; G706-A711 PolarHBondContact O-N 3.05Å; G706-F715 VanDerWaalsContact C-CE2 3.49Å
707	M	88.6	Confident	88.4	Confident	32 Å²	32	21.2 Å²	21.2	16%	0.158	12%	0.12	C	C	.	.	H	α-helix	trans	-65.4	-43.1	175.6	-77.9	-51.4	-54.8	0	0	111.7	L703 M705 A709 D710 F715 F1106 Y1109 N1110	L703-M707 WeakPolarHBondContact O-CB 3.5Å; L703-M707 WeakPolarHBondContact O-CG 3.31Å; L703-M707 PolarHBondContact O-N 2.94Å; M705-M707 VanDerWaalsContact C-N 3.31Å; M705-M707 PolarHBondContact O-N 3.25Å; M707-A709 PolarHBondContact O-N 3.43Å; M707-D710 PolarHBondContact O-N 3.05Å; M707-F715 HydrophobicContact CB-CZ 4.48Å; M707-F715 HydrophobicContact CG-CE1 4.33Å; M707-F715 HydrophobicContact CG-CE2 3.91Å; M707-F715 HydrophobicContact CG-CZ 3.53Å; M707-F715 HydrophobicContact SD-CD2 4.12Å; M707-F715 HydrophobicContact SD-CE1 3.97Å; M707-F715 HydrophobicContact SD-CE2 3.54Å; M707-F715 VanDerWaalsContact SD-CE2 3.54Å; M707-F715 HydrophobicContact SD-CZ 3.46Å; M707-F715 WeakPolarHBondContact SD-CZ 3.48Å; M707-F1106 HydrophobicContact CE-CD2 4.41Å; M707-F1106 HydrophobicContact CE-CE1 3.87Å; M707-F1106 HydrophobicContact CE-CE2 3.61Å; M707-F1106 HydrophobicContact CE-CZ 3.3Å; M707-F1106 HydrophobicContact SD-CD2 4.02Å; M707-F1106 HydrophobicContact SD-CE2 3.47Å; M707-F1106 WeakPolarHBondContact SD-CE2 3.17Å; M707-F1106 HydrophobicContact SD-CZ 3.86Å; M707-Y1109 HydrophobicContact CE-CD1 4.04Å; M707-Y1109 HydrophobicContact CG-CD1 3.4Å; M707-Y1109 VanDerWaalsContact CG-CD1 3.4Å; M707-Y1109 HydrophobicContact CG-CE1 3.28Å; M707-Y1109 HydrophobicContact CG-CG 4.24Å; M707-Y1109 HydrophobicContact SD-CD1 3.31Å; M707-Y1109 WeakPolarHBondContact SD-CD1 3.15Å; M707-Y1109 HydrophobicContact SD-CE1 3.9Å; M707-Y1109 HydrophobicContact SD-CG 3.89Å; M707-N1110 WeakPolarHBondContact CE-ND2 3.31Å; M707-N1110 WeakPolarHBondContact CE-OD1 3.39Å
708	G	85.4	Confident	88.8	Confident	24 Å²	24	26.5 Å²	26.5	25%	0.247	15%	0.149	C	C	.	.	H	α-helix	trans	-64.9	-23.7	176	0	0	0	0	0	113.8	K642 Q704 M705	K642-G708 WeakPolarHBondContact CE-O 3.25Å; Q704-G708 PolarHBondContact O-N 3.14Å; M705-G708 CarbonylContact O-C 3.5Å; M705-G708 PolarHBondContact O-N 3.28Å; M705-G708 VanDerWaalsContact O-N 3.14Å
709	A	88.1	Confident	89.6	Confident	5 Å²	5	25.7 Å²	25.7	4%	0.041	14%	0.14	C	C	.	.	H	α-helix	trans	-88.2	-11.4	176.4	0	0	0	0	0	113.4	K642 R645 M705 G706 M707 A711	K642-A709 HydrophobicContact CB-CB 3.73Å; K642-A709 HydrophobicContact CG-CB 4.39Å; R645-A709 WeakPolarHBondContact CD-O 3.28Å; R645-A709 PolarHBondContact NH1-O 3.08Å; M705-A709 WeakPolarHBondContact O-CB 3.45Å; M705-A709 PolarHBondContact O-N 2.93Å; G706-A709 PolarHBondContact O-N 3.39Å; M707-A709 PolarHBondContact O-N 3.43Å; A709-A711 VanDerWaalsContact C-N 3.31Å; A709-A711 HydrophobicContact CB-CB 4.31Å
710	D	89.9	Confident	90.3	Very high	55 Å²	55	23.1 Å²	23.1	29%	0.294	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	39.8	-166.4	-167.5	9.4	0	0	0	112.5	R645 G706 M707 R712 F1106	R645-D710 PolarHBondContact NH1-O 3.34Å; G706-D710 PolarHBondContact O-N 3.19Å; M707-D710 PolarHBondContact O-N 3.05Å; D710-R712 PolarHBondContact O-N 3.48Å; D710-R712 IonicContact OD1-CZ 3.57Å; D710-R712 IonicContact OD1-NE 2.82Å; D710-R712 PolarHBondContact OD1-NE 3.12Å; D710-R712 IonicContact OD1-NH2 3.62Å; D710-R712 IonicContact OD2-CZ 2.95Å; D710-R712 IonicContact OD2-NE 3.15Å; D710-R712 PolarHBondContact OD2-NE 3.46Å; D710-R712 IonicContact OD2-NH2 2.82Å; D710-R712 PolarHBondContact OD2-NH2 3.26Å; D710-F1106 HydrophobicContact CB-CZ 4.46Å; D710-F1106 WeakPolarHBondContact OD1-CE1 3.42Å; D710-F1106 WeakPolarHBondContact OD1-CZ 3.43Å
711	A	92.4	Very high	90.7	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.125	C	C	.	.			trans	-76.9	76.6	-175	0	0	0	0	0	112.8	L638 E668 G706 A709 I713 F714 F715	L638-A711 HydrophobicContact CD2-CB 3.89Å; E668-A711 HydrophobicContact CG-CB 4.26Å; E668-A711 WeakPolarHBondContact OE1-CA 3.37Å; G706-A711 PolarHBondContact O-N 3.05Å; A709-A711 VanDerWaalsContact C-N 3.31Å; A709-A711 HydrophobicContact CB-CB 4.31Å; A711-I713 PolarHBondContact O-N 3.15Å; A711-F714 HydrophobicContact CB-CB 3.98Å; A711-F714 PolarHBondContact O-N 2.86Å; A711-F715 VanDerWaalsContact O-CD2 3.29Å; A711-F715 WeakPolarHBondContact O-CD2 3.22Å; A711-F715 PolarHBondContact O-N 3.49Å; A711-F715 VanDerWaalsContact O-N 3.13Å
712	R	91.1	Very high	90.8	Very high	79 Å²	79	24.4 Å²	24.4	30%	0.298	13%	0.13	S	C	.	.	H	α-helix	trans	-64.5	-38.9	-173.7	-62.1	168.6	-164.3	165.6	-1.2	113.9	E668 D710 F714 F715 S716 S1102 Y1103 F1106	E668-R712 PolarHBondContact OE1-N 2.96Å; D710-R712 PolarHBondContact O-N 3.48Å; D710-R712 IonicContact OD1-CZ 3.57Å; D710-R712 IonicContact OD1-NE 2.82Å; D710-R712 PolarHBondContact OD1-NE 3.12Å; D710-R712 IonicContact OD1-NH2 3.62Å; D710-R712 IonicContact OD2-CZ 2.95Å; D710-R712 IonicContact OD2-NE 3.15Å; D710-R712 PolarHBondContact OD2-NE 3.46Å; D710-R712 IonicContact OD2-NH2 2.82Å; D710-R712 PolarHBondContact OD2-NH2 3.26Å; R712-F714 VanDerWaalsContact C-N 3.34Å; R712-F715 PolarHBondContact O-N 3.23Å; R712-S716 WeakPolarHBondContact O-CB 3.5Å; R712-S716 PolarHBondContact O-N 3.4Å; R712-S716 PolarHBondContact O-OG 3.45Å; R712-S1102 PolarHBondContact O-OG 3.25Å; R712-Y1103 PolarHBondContact NH1-OH 3.43Å; R712-F1106 HydrophobicContact CG-CB 4.43Å; R712-F1106 HydrophobicContact CG-CD2 4.36Å; R712-F1106 HydrophobicContact CG-CG 4.24Å
713	I	91.8	Very high	90.8	Very high	50 Å²	50	24.8 Å²	24.8	26%	0.256	13%	0.132	S	C	.	.	H	α-helix	trans	-65.7	-43.9	179.3	-55.9	172.6	0	0	0	108.9	E668 N669 H672 A711 S716 H717	E668-I713 HydrophobicContact CG-CB 4.1Å; E668-I713 WeakPolarHBondContact OE1-CA 3.44Å; E668-I713 VanDerWaalsContact OE1-CB 3.31Å; E668-I713 WeakPolarHBondContact OE1-CB 3.45Å; E668-I713 PolarHBondContact OE1-N 3.32Å; N669-I713 WeakPolarHBondContact OD1-CD1 3.17Å; H672-I713 HydrophobicContact CB-CG2 4.4Å; H672-I713 PolarHBondContact ND1-O 3.32Å; A711-I713 PolarHBondContact O-N 3.15Å; I713-S716 WeakPolarHBondContact CA-OG 3.44Å; I713-S716 PolarHBondContact O-N 2.99Å; I713-S716 PolarHBondContact O-OG 2.75Å; I713-H717 PolarHBondContact O-N 3.04Å
714	F	94.8	Very high	90.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.9	-49.4	175.5	-178.3	-102.1	0	0	0	112.3	V634 L638 E668 A671 F675 L690 A711 R712 S716 H717 V720	V634-F714 HydrophobicContact CG1-CE2 3.88Å; V634-F714 HydrophobicContact CG1-CZ 4.2Å; L638-F714 HydrophobicContact CD1-CD1 4.3Å; L638-F714 HydrophobicContact CD1-CE1 4.06Å; L638-F714 HydrophobicContact CD1-CE2 4.41Å; L638-F714 HydrophobicContact CD1-CZ 4.12Å; L638-F714 HydrophobicContact CD2-CB 4.31Å; L638-F714 HydrophobicContact CD2-CD1 4.41Å; L638-F714 HydrophobicContact CD2-CD2 4.43Å; L638-F714 HydrophobicContact CD2-CG 4.13Å; E668-F714 PolarHBondContact OE1-N 3Å; A671-F714 HydrophobicContact CB-CD2 4.36Å; F675-F714 HydrophobicContact CB-CE2 4.04Å; F675-F714 HydrophobicContact CD1-CE2 4.48Å; F675-F714 HydrophobicContact CG-CE2 4.13Å; L690-F714 HydrophobicContact CD2-CE1 4.24Å; L690-F714 HydrophobicContact CD2-CZ 3.7Å; A711-F714 HydrophobicContact CB-CB 3.98Å; A711-F714 PolarHBondContact O-N 2.86Å; R712-F714 VanDerWaalsContact C-N 3.34Å; F714-S716 VanDerWaalsContact C-N 3.26Å; F714-S716 PolarHBondContact O-N 3.01Å; F714-H717 VanDerWaalsContact O-CB 3.23Å; F714-H717 WeakPolarHBondContact O-CB 3.27Å; F714-H717 PolarHBondContact O-N 2.75Å; F714-V720 HydrophobicContact CE1-CG2 4.25Å; F714-V720 HydrophobicContact CZ-CG2 4.27Å
715	F	92.8	Very high	90.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68.2	-24.2	177.9	-83.3	-79.6	0	0	0	114.1	L703 G706 M707 A711 R712 H717 V720 Q721 F1106 Y1109	L703-F715 HydrophobicContact CD2-CE1 3.77Å; L703-F715 HydrophobicContact CD2-CZ 4.14Å; G706-F715 VanDerWaalsContact C-CE2 3.49Å; M707-F715 HydrophobicContact CB-CZ 4.48Å; M707-F715 HydrophobicContact CG-CE1 4.33Å; M707-F715 HydrophobicContact CG-CE2 3.91Å; M707-F715 HydrophobicContact CG-CZ 3.53Å; M707-F715 HydrophobicContact SD-CD2 4.12Å; M707-F715 HydrophobicContact SD-CE1 3.97Å; M707-F715 HydrophobicContact SD-CE2 3.54Å; M707-F715 VanDerWaalsContact SD-CE2 3.54Å; M707-F715 HydrophobicContact SD-CZ 3.46Å; M707-F715 WeakPolarHBondContact SD-CZ 3.48Å; A711-F715 VanDerWaalsContact O-CD2 3.29Å; A711-F715 WeakPolarHBondContact O-CD2 3.22Å; A711-F715 PolarHBondContact O-N 3.49Å; A711-F715 VanDerWaalsContact O-N 3.13Å; R712-F715 PolarHBondContact O-N 3.23Å; F715-H717 PolarHBondContact O-N 3.05Å; F715-V720 HydrophobicContact CD1-CG1 3.9Å; F715-V720 HydrophobicContact CE1-CG1 4.3Å; F715-Q721 PolarHBondContact O-NE2 3.33Å; F715-F1106 HydrophobicContact CB-CB 4.36Å; F715-F1106 HydrophobicContact CB-CD2 4.07Å; F715-F1106 AromaticContact CD2-CD2 3.55Å; F715-F1106 HydrophobicContact CD2-CD2 3.55Å; F715-F1106 AromaticContact CD2-CE2 3.84Å; F715-F1106 HydrophobicContact CD2-CE2 3.84Å; F715-F1106 HydrophobicContact CE2-CD2 4.28Å; F715-F1106 HydrophobicContact CE2-CE2 4.16Å; F715-F1106 AromaticContact CG-CD2 3.94Å; F715-F1106 HydrophobicContact CG-CD2 3.94Å; F715-Y1109 HydrophobicContact CD1-CD2 4.49Å; F715-Y1109 HydrophobicContact CD1-CG 4.43Å; F715-Y1109 HydrophobicContact CE1-CD1 4.49Å; F715-Y1109 AromaticContact CE1-CD2 3.71Å; F715-Y1109 HydrophobicContact CE1-CD2 3.71Å; F715-Y1109 HydrophobicContact CE1-CE2 4.29Å; F715-Y1109 AromaticContact CE1-CG 3.82Å; F715-Y1109 HydrophobicContact CE1-CG 3.82Å; F715-Y1109 HydrophobicContact CZ-CD2 4.5Å; F715-Y1109 HydrophobicContact CZ-CG 4.47Å
716	S	91.2	Very high	90.6	Very high	28 Å²	28	24.1 Å²	24.1	20%	0.196	13%	0.131	C	C	.	.	H	α-helix	trans	-73.9	-12.6	176.5	72.4	0	0	0	0	113.8	R712 I713 F714	R712-S716 WeakPolarHBondContact O-CB 3.5Å; R712-S716 PolarHBondContact O-N 3.4Å; R712-S716 PolarHBondContact O-OG 3.45Å; I713-S716 WeakPolarHBondContact CA-OG 3.44Å; I713-S716 PolarHBondContact O-N 2.99Å; I713-S716 PolarHBondContact O-OG 2.75Å; F714-S716 VanDerWaalsContact C-N 3.26Å; F714-S716 PolarHBondContact O-N 3.01Å
717	H	93.7	Very high	90.3	Very high	15 Å²	15	24.8 Å²	24.8	7%	0.069	14%	0.135	C	C	.	.	S	Bend	trans	-59.6	136	177	-175.1	-98.7	0	0	0	111.9	H672 F675 S676 I713 F714 F715 G719 V720 Q721	H672-H717 AromaticContact CE1-CD2 3.52Å; H672-H717 AromaticContact ND1-CD2 3.99Å; H672-H717 AromaticContact NE2-CD2 3.83Å; F675-H717 AromaticContact CD1-CE1 3.6Å; F675-H717 AromaticContact CD1-ND1 3.33Å; F675-H717 VanDerWaalsContact CD1-ND1 3.33Å; F675-H717 WeakPolarHBondContact CD1-ND1 3.34Å; F675-H717 AromaticContact CE1-CE1 3.73Å; F675-H717 AromaticContact CE1-ND1 3.35Å; F675-H717 WeakPolarHBondContact CE1-ND1 2.81Å; S676-H717 WeakPolarHBondContact CA-NE2 3.24Å; S676-H717 WeakPolarHBondContact CB-NE2 3.23Å; I713-H717 PolarHBondContact O-N 3.04Å; F714-H717 VanDerWaalsContact O-CB 3.23Å; F714-H717 WeakPolarHBondContact O-CB 3.27Å; F714-H717 PolarHBondContact O-N 2.75Å; F715-H717 PolarHBondContact O-N 3.05Å; H717-G719 VanDerWaalsContact C-N 3.3Å; H717-G719 PolarHBondContact CE1-N 2.89Å; H717-G719 WeakPolarHBondContact ND1-CA 3.41Å; H717-G719 PolarHBondContact ND1-N 3.15Å; H717-G719 PolarHBondContact O-N 3.3Å; H717-V720 HydrophobicContact CB-CG2 4.23Å; H717-V720 PolarHBondContact O-N 2.8Å; H717-V720 VanDerWaalsContact O-N 3.11Å; H717-Q721 PolarHBondContact O-N 3.23Å
718	D	90.9	Very high	90.2	Very high	113 Å²	113	24.6 Å²	24.6	60%	0.604	13%	0.132	S	C	*	.	H	α-helix	trans	-63.4	-34.5	-174.3	-69.5	-32.6	0	0	0	112.6	V720 Q721 S722	D718-V720 PolarHBondContact O-N 2.85Å; D718-Q721 CarbonylContact O-C 3.48Å; D718-Q721 PolarHBondContact O-N 3.28Å; D718-S722 VanDerWaalsContact O-CB 3.27Å; D718-S722 WeakPolarHBondContact O-CB 3.41Å; D718-S722 PolarHBondContact O-N 2.65Å
719	G	91.3	Very high	90.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.8	-38.8	174.6	0	0	0	0	0	113.3	Y679 H717 S722 F723	Y679-G719 VanDerWaalsContact CE2-CA 3.48Å; H717-G719 VanDerWaalsContact C-N 3.3Å; H717-G719 PolarHBondContact CE1-N 2.89Å; H717-G719 WeakPolarHBondContact ND1-CA 3.41Å; H717-G719 PolarHBondContact ND1-N 3.15Å; H717-G719 PolarHBondContact O-N 3.3Å; G719-S722 WeakPolarHBondContact O-CB 3.48Å; G719-S722 PolarHBondContact O-N 3.08Å; G719-F723 PolarHBondContact O-N 3.23Å
720	V	92.3	Very high	89.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.6	-41.4	175.3	-179.4	0	0	0	0	109.5	F675 L690 L703 F714 F715 H717 D718 S722 F723 L724	F675-V720 HydrophobicContact CD1-CG2 4.11Å; F675-V720 HydrophobicContact CE1-CG2 3.65Å; F675-V720 HydrophobicContact CZ-CG2 4.26Å; L690-V720 HydrophobicContact CD1-CG2 4.28Å; L690-V720 HydrophobicContact CD2-CG2 4.42Å; L703-V720 HydrophobicContact CD2-CG1 4.12Å; F714-V720 HydrophobicContact CE1-CG2 4.25Å; F714-V720 HydrophobicContact CZ-CG2 4.27Å; F715-V720 HydrophobicContact CD1-CG1 3.9Å; F715-V720 HydrophobicContact CE1-CG1 4.3Å; H717-V720 HydrophobicContact CB-CG2 4.23Å; H717-V720 PolarHBondContact O-N 2.8Å; H717-V720 VanDerWaalsContact O-N 3.11Å; D718-V720 PolarHBondContact O-N 2.85Å; V720-S722 VanDerWaalsContact C-N 3.34Å; V720-S722 PolarHBondContact O-N 3.32Å; V720-F723 WeakPolarHBondContact O-CB 3.39Å; V720-F723 PolarHBondContact O-N 3.21Å; V720-L724 HydrophobicContact CG1-CD1 4.26Å; V720-L724 VanDerWaalsContact O-CG 3.3Å; V720-L724 WeakPolarHBondContact O-CG 3.38Å; V720-L724 PolarHBondContact O-N 3.35Å
721	Q	92.3	Very high	89.4	Confident	12 Å²	12	25.2 Å²	25.2	6%	0.056	13%	0.132	C	C	.	.	H	α-helix	trans	-67.8	-32.6	176.6	-67.1	-63.1	-46.8	0	0	113	F715 H717 D718 S725 K1105	F715-Q721 PolarHBondContact O-NE2 3.33Å; H717-Q721 PolarHBondContact O-N 3.23Å; D718-Q721 CarbonylContact O-C 3.48Å; D718-Q721 PolarHBondContact O-N 3.28Å; Q721-S725 WeakPolarHBondContact O-CB 3.48Å; Q721-S725 PolarHBondContact O-N 3.45Å; Q721-S725 PolarHBondContact O-OG 2.73Å; Q721-K1105 HydrophobicContact CG-CD 4.21Å; Q721-K1105 HydrophobicContact CG-CG 4.25Å; Q721-K1105 PolarHBondContact NE2-O 2.84Å
722	S	90.8	Very high	88.8	Confident	19 Å²	19	25.5 Å²	25.5	13%	0.133	13%	0.133	C	C	.	.	H	α-helix	trans	-64.1	-47.9	172.4	-176.3	0	0	0	0	110.1	E683 D718 G719 V720 L724 S725 Q726 R734	E683-S722 PolarHBondContact OE1-OG 2.91Å; D718-S722 VanDerWaalsContact O-CB 3.27Å; D718-S722 WeakPolarHBondContact O-CB 3.41Å; D718-S722 PolarHBondContact O-N 2.65Å; G719-S722 WeakPolarHBondContact O-CB 3.48Å; G719-S722 PolarHBondContact O-N 3.08Å; V720-S722 VanDerWaalsContact C-N 3.34Å; V720-S722 PolarHBondContact O-N 3.32Å; S722-L724 PolarHBondContact O-N 3.1Å; S722-S725 WeakPolarHBondContact O-CB 3.2Å; S722-S725 PolarHBondContact O-N 2.89Å; S722-S725 VanDerWaalsContact O-N 3.16Å; S722-Q726 PolarHBondContact O-N 3.5Å; S722-R734 PolarHBondContact OG-NH1 2.86Å; S722-R734 PolarHBondContact OG-NH2 3.36Å
723	F	89.6	Confident	88.3	Confident	9 Å²	9	25.7 Å²	25.7	4%	0.039	14%	0.137	C	C	.	.	H	α-helix	trans	-58.8	-47	174.4	-176	-116.6	0	0	0	112.6	F687 L690 I691 L703 G719 V720 S725 Q726 I727	F687-F723 HydrophobicContact CB-CD2 3.67Å; F687-F723 HydrophobicContact CB-CE2 3.82Å; F687-F723 HydrophobicContact CD1-CB 3.67Å; F687-F723 AromaticContact CD1-CD2 3.55Å; F687-F723 HydrophobicContact CD1-CD2 3.55Å; F687-F723 AromaticContact CD1-CG 3.89Å; F687-F723 HydrophobicContact CD1-CG 3.89Å; F687-F723 AromaticContact CD2-CD2 3.93Å; F687-F723 HydrophobicContact CD2-CD2 3.93Å; F687-F723 HydrophobicContact CE1-CB 3.55Å; F687-F723 HydrophobicContact CE1-CD2 4.09Å; F687-F723 HydrophobicContact CE1-CG 4.25Å; F687-F723 HydrophobicContact CE2-CD2 4.41Å; F687-F723 HydrophobicContact CG-CB 4.42Å; F687-F723 AromaticContact CG-CD2 3.44Å; F687-F723 HydrophobicContact CG-CD2 3.44Å; F687-F723 VanDerWaalsContact CG-CD2 3.44Å; F687-F723 HydrophobicContact CG-CE2 4.09Å; F687-F723 HydrophobicContact CG-CG 4.25Å; F687-F723 HydrophobicContact CZ-CB 4.19Å; F687-F723 HydrophobicContact CZ-CD2 4.46Å; L690-F723 HydrophobicContact CD1-CB 4.18Å; L690-F723 HydrophobicContact CD1-CD1 3.94Å; L690-F723 HydrophobicContact CD1-CG 4.12Å; I691-F723 HydrophobicContact CD1-CZ 4.49Å; I691-F723 HydrophobicContact CG2-CE1 3.61Å; I691-F723 HydrophobicContact CG2-CZ 3.39Å; L703-F723 HydrophobicContact CD1-CD1 4.21Å; L703-F723 HydrophobicContact CD1-CE1 3.81Å; G719-F723 PolarHBondContact O-N 3.23Å; V720-F723 WeakPolarHBondContact O-CB 3.39Å; V720-F723 PolarHBondContact O-N 3.21Å; F723-S725 VanDerWaalsContact C-N 3.28Å; F723-S725 PolarHBondContact O-N 3.35Å; F723-Q726 WeakPolarHBondContact O-CB 3.37Å; F723-Q726 PolarHBondContact O-N 3.44Å; F723-Q726 VanDerWaalsContact O-N 3.11Å; F723-I727 HydrophobicContact CD1-CD1 3.77Å; F723-I727 HydrophobicContact CE1-CD1 3.22Å; F723-I727 HydrophobicContact CE1-CG1 4.23Å; F723-I727 HydrophobicContact CE2-CD1 4.22Å; F723-I727 HydrophobicContact CE2-CG1 4.4Å; F723-I727 HydrophobicContact CG-CD1 4.45Å; F723-I727 HydrophobicContact CZ-CD1 3.47Å; F723-I727 VanDerWaalsContact CZ-CD1 3.47Å; F723-I727 HydrophobicContact CZ-CG1 4.08Å; F723-I727 PolarHBondContact O-N 3.15Å
724	L	89	Confident	87.7	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.7	-33.9	177	-67.6	175.6	0	0	0	112.5	V720 S722 I727 W728 Y1109 I1112	V720-L724 HydrophobicContact CG1-CD1 4.26Å; V720-L724 VanDerWaalsContact O-CG 3.3Å; V720-L724 WeakPolarHBondContact O-CG 3.38Å; V720-L724 PolarHBondContact O-N 3.35Å; S722-L724 PolarHBondContact O-N 3.1Å; L724-I727 HydrophobicContact CD2-CD1 4.43Å; L724-I727 PolarHBondContact O-N 3.31Å; L724-W728 WeakPolarHBondContact O-CB 3.42Å; L724-W728 PolarHBondContact O-N 3.22Å; L724-Y1109 HydrophobicContact CD1-CD2 4.16Å; L724-Y1109 HydrophobicContact CD2-CD2 3.57Å; L724-Y1109 HydrophobicContact CD2-CE2 4.17Å; L724-Y1109 HydrophobicContact CG-CD2 4.49Å; L724-I1112 HydrophobicContact CB-CD1 3.94Å
725	S	88.8	Confident	86.9	Confident	25 Å²	25	33.5 Å²	33.5	18%	0.175	17%	0.173	C	C	.	.	H	α-helix	trans	-67.7	-38.3	173.3	-55.9	0	0	0	0	111	Q721 S722 F723 W728 W729 R1108	Q721-S725 WeakPolarHBondContact O-CB 3.48Å; Q721-S725 PolarHBondContact O-N 3.45Å; Q721-S725 PolarHBondContact O-OG 2.73Å; S722-S725 WeakPolarHBondContact O-CB 3.2Å; S722-S725 PolarHBondContact O-N 2.89Å; S722-S725 VanDerWaalsContact O-N 3.16Å; F723-S725 VanDerWaalsContact C-N 3.28Å; F723-S725 PolarHBondContact O-N 3.35Å; S725-W728 WeakPolarHBondContact O-CB 3.48Å; S725-W728 PolarHBondContact O-N 3.32Å; S725-W729 PolarHBondContact O-N 3.02Å; S725-R1108 PolarHBondContact OG-NH1 3.23Å; S725-R1108 PolarHBondContact OG-NH2 2.84Å
726	Q	86.1	Confident	86.4	Confident	41 Å²	41	34 Å²	34	19%	0.192	18%	0.176	C	C	.	.	H	α-helix	trans	-62.3	-44	172.7	177.9	173.1	-37.8	0	0	112.2	S722 F723 W728 W729 G730 R759	S722-Q726 PolarHBondContact O-N 3.5Å; F723-Q726 WeakPolarHBondContact O-CB 3.37Å; F723-Q726 PolarHBondContact O-N 3.44Å; F723-Q726 VanDerWaalsContact O-N 3.11Å; Q726-W728 VanDerWaalsContact C-N 3.29Å; Q726-W728 PolarHBondContact O-N 2.79Å; Q726-W729 PolarHBondContact O-N 3.36Å; Q726-G730 PolarHBondContact O-N 2.86Å; Q726-R759 VanDerWaalsContact CD-NH1 3.27Å
727	I	85.5	Confident	86.1	Confident	14 Å²	14	35.2 Å²	35.2	7%	0.072	19%	0.188	C	C	.	.	H	α-helix	trans	-62.6	-40	174.6	-67.2	165	0	0	0	110.9	F723 L724 G730 P838 I1112 F1150	F723-I727 HydrophobicContact CD1-CD1 3.77Å; F723-I727 HydrophobicContact CE1-CD1 3.22Å; F723-I727 HydrophobicContact CE1-CG1 4.23Å; F723-I727 HydrophobicContact CE2-CD1 4.22Å; F723-I727 HydrophobicContact CE2-CG1 4.4Å; F723-I727 HydrophobicContact CG-CD1 4.45Å; F723-I727 HydrophobicContact CZ-CD1 3.47Å; F723-I727 VanDerWaalsContact CZ-CD1 3.47Å; F723-I727 HydrophobicContact CZ-CG1 4.08Å; F723-I727 PolarHBondContact O-N 3.15Å; L724-I727 HydrophobicContact CD2-CD1 4.43Å; L724-I727 PolarHBondContact O-N 3.31Å; I727-G730 PolarHBondContact O-N 3.27Å; I727-P838 WeakPolarHBondContact O-CG 3.3Å; I727-I1112 HydrophobicContact CG2-CG2 4.16Å; I727-F1150 HydrophobicContact CD1-CD1 4.2Å; I727-F1150 HydrophobicContact CD1-CE1 3.67Å; I727-F1150 HydrophobicContact CD1-CZ 4.12Å; I727-F1150 HydrophobicContact CG2-CE1 4.38Å; I727-F1150 HydrophobicContact CG2-CE2 4.21Å; I727-F1150 HydrophobicContact CG2-CZ 3.72Å
728	W	86.4	Confident	85.6	Confident	27 Å²	27	38.7 Å²	38.7	10%	0.102	21%	0.21	C	C	.	.	H	α-helix	trans	-62.4	-43.5	179.8	179.5	-105.5	0	0	0	113.5	L724 S725 Q726 P838 V839 F842 I962 I1112 Y1115	L724-W728 WeakPolarHBondContact O-CB 3.42Å; L724-W728 PolarHBondContact O-N 3.22Å; S725-W728 WeakPolarHBondContact O-CB 3.48Å; S725-W728 PolarHBondContact O-N 3.32Å; Q726-W728 VanDerWaalsContact C-N 3.29Å; Q726-W728 PolarHBondContact O-N 2.79Å; W728-P838 HydrophobicContact CE3-CB 4Å; W728-P838 HydrophobicContact CZ3-CB 4.25Å; W728-P838 WeakPolarHBondContact O-CD 3.35Å; W728-V839 HydrophobicContact CD2-CB 4.48Å; W728-V839 HydrophobicContact CZ2-CB 4.27Å; W728-V839 HydrophobicContact CZ2-CG2 4.27Å; W728-V839 PolarHBondContact O-N 3.49Å; W728-V839 VanDerWaalsContact O-N 3.13Å; W728-F842 HydrophobicContact CH2-CB 3.41Å; W728-F842 VanDerWaalsContact CH2-CB 3.41Å; W728-F842 HydrophobicContact CH2-CD1 4.07Å; W728-F842 AromaticContact CH2-CD2 3.96Å; W728-F842 HydrophobicContact CH2-CD2 3.96Å; W728-F842 AromaticContact CH2-CG 3.54Å; W728-F842 HydrophobicContact CH2-CG 3.54Å; W728-F842 HydrophobicContact CZ2-CB 3.84Å; W728-F842 AromaticContact CZ2-CD1 3.89Å; W728-F842 HydrophobicContact CZ2-CD1 3.89Å; W728-F842 AromaticContact CZ2-CG 3.85Å; W728-F842 HydrophobicContact CZ2-CG 3.85Å; W728-F842 HydrophobicContact CZ3-CB 4.41Å; W728-I962 HydrophobicContact CE3-CD1 4.28Å; W728-I962 HydrophobicContact CH2-CD1 3.35Å; W728-I962 HydrophobicContact CZ2-CD1 3.99Å; W728-I962 HydrophobicContact CZ3-CD1 3.54Å; W728-I1112 HydrophobicContact CB-CD1 4.49Å; W728-I1112 HydrophobicContact CE3-CG1 3.9Å; W728-I1112 HydrophobicContact CE3-CG2 4.4Å; W728-I1112 HydrophobicContact CZ3-CG1 4.45Å; W728-Y1115 HydrophobicContact CZ3-CG 4.46Å
729	W	84.8	Confident	85.3	Confident	35 Å²	35	42.2 Å²	42.2	13%	0.133	22%	0.215	C	C	.	.	H	α-helix	trans	-79.7	-20.8	177.3	-71.4	107.2	0	0	0	113	S725 Q726 D731 M732 T736 L741 V839	S725-W729 PolarHBondContact O-N 3.02Å; Q726-W729 PolarHBondContact O-N 3.36Å; W729-D731 PolarHBondContact O-N 3.22Å; W729-M732 WeakPolarHBondContact O-CB 3.49Å; W729-M732 PolarHBondContact O-N 3.46Å; W729-T736 WeakPolarHBondContact CH2-O 3.32Å; W729-T736 WeakPolarHBondContact CZ3-OG1 3.49Å; W729-L741 HydrophobicContact CH2-CD1 3.71Å; W729-L741 HydrophobicContact CZ3-CD1 3.42Å; W729-L741 VanDerWaalsContact CZ3-CD1 3.42Å; W729-L741 HydrophobicContact CZ3-CD2 4.36Å; W729-L741 HydrophobicContact CZ3-CG 4.24Å; W729-V839 HydrophobicContact CE3-CG1 3.88Å; W729-V839 HydrophobicContact CE3-CG2 4.47Å; W729-V839 HydrophobicContact CZ3-CG1 4.25Å; W729-V839 HydrophobicContact CZ3-CG2 4.28Å
730	G	83.4	Confident	85.1	Confident	21 Å²	21	46.2 Å²	46.2	22%	0.216	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	-128.3	179	0	0	0	0	0	112.1	Q726 I727 M732	Q726-G730 PolarHBondContact O-N 2.86Å; I727-G730 PolarHBondContact O-N 3.27Å; G730-M732 PolarHBondContact O-N 3.12Å
731	D	77.9	Confident	84.6	Confident	42 Å²	42	46.4 Å²	46.4	23%	0.225	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-0.8	179.5	-65	-31.6	0	0	0	113	W729 R759 Q833	W729-D731 PolarHBondContact O-N 3.22Å; D731-R759 PolarHBondContact O-N 3.48Å; D731-Q833 HydrophobicContact CB-CB 4.12Å; D731-Q833 HydrophobicContact CB-CG 4.07Å
732	M	81.4	Confident	84.2	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.03	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-90.3	151.9	179.1	-60.4	178.9	55.1	0	0	111.9	W729 G730 L741 I756 F758 F834 A837 T840	W729-M732 WeakPolarHBondContact O-CB 3.49Å; W729-M732 PolarHBondContact O-N 3.46Å; G730-M732 PolarHBondContact O-N 3.12Å; M732-L741 HydrophobicContact CE-CD2 3.34Å; M732-L741 HydrophobicContact SD-CD2 4.23Å; M732-I756 HydrophobicContact CE-CD1 4.21Å; M732-I756 HydrophobicContact CE-CG2 3.55Å; M732-F758 HydrophobicContact CG-CD1 3.94Å; M732-F758 HydrophobicContact CG-CE1 3.75Å; M732-F834 HydrophobicContact CE-CD2 4.31Å; M732-F834 HydrophobicContact CE-CE2 4.4Å; M732-F834 HydrophobicContact SD-CD2 3.91Å; M732-F834 HydrophobicContact SD-CE2 4.38Å; M732-A837 HydrophobicContact SD-CB 4.16Å; M732-T840 HydrophobicContact SD-CG2 4.27Å
733	Q	79.6	Confident	83.9	Confident	82 Å²	82	50.3 Å²	50.3	38%	0.383	25%	0.252	S	S	.	.			trans	-71.8	145.8	176.1	-165.8	174.7	-3.4	0	0	112.1	D735 T736 S757	Q733-D735 VanDerWaalsContact C-N 3.27Å; Q733-D735 PolarHBondContact NE2-OD2 3.39Å; Q733-D735 VanDerWaalsContact NE2-OD2 3.11Å; Q733-D735 PolarHBondContact O-N 2.92Å; Q733-T736 PolarHBondContact O-OG1 3.43Å; Q733-T736 VanDerWaalsContact O-OG1 3.04Å; Q733-S757 WeakPolarHBondContact CB-OG 3.35Å; Q733-S757 PolarHBondContact N-O 3.19Å; Q733-S757 VanDerWaalsContact N-O 3.08Å; Q733-S757 PolarHBondContact OE1-OG 3.48Å
734	R	78.6	Confident	83.7	Confident	88 Å²	88	49.9 Å²	49.9	33%	0.332	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.9	-175.4	-60.4	178.7	-174.4	162.7	1.1	113.8	E683 S722 T736	E683-R734 IonicContact OE1-CZ 3.62Å; E683-R734 IonicContact OE1-NH1 2.69Å; E683-R734 PolarHBondContact OE1-NH1 3.36Å; E683-R734 IonicContact OE1-NH2 3.4Å; E683-R734 PolarHBondContact OE1-NH2 3.39Å; S722-R734 PolarHBondContact OG-NH1 2.86Å; S722-R734 PolarHBondContact OG-NH2 3.36Å; R734-T736 VanDerWaalsContact C-N 3.28Å; R734-T736 PolarHBondContact O-N 3.43Å
735	D	77.8	Confident	83.5	Confident	127 Å²	127	51.6 Å²	51.6	68%	0.679	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	2.5	-172.8	-52.4	-45.4	0	0	0	114	Q733 A737	Q733-D735 VanDerWaalsContact C-N 3.27Å; Q733-D735 PolarHBondContact NE2-OD2 3.39Å; Q733-D735 VanDerWaalsContact NE2-OD2 3.11Å; Q733-D735 PolarHBondContact O-N 2.92Å; D735-A737 PolarHBondContact O-N 3.2Å
736	T	82.5	Confident	83.3	Confident	11 Å²	11	56.9 Å²	56.9	7%	0.067	28%	0.278	C	S	.	.			trans	-72.4	121	-177.1	55	0	0	0	0	111.1	W729 Q733 R734 I756	W729-T736 WeakPolarHBondContact CH2-O 3.32Å; W729-T736 WeakPolarHBondContact CZ3-OG1 3.49Å; Q733-T736 PolarHBondContact O-OG1 3.43Å; Q733-T736 VanDerWaalsContact O-OG1 3.04Å; R734-T736 VanDerWaalsContact C-N 3.28Å; R734-T736 PolarHBondContact O-N 3.43Å; T736-I756 HydrophobicContact CG2-CG2 4.44Å
737	A	84.6	Confident	83.2	Confident	53 Å²	53	57.7 Å²	57.7	44%	0.438	29%	0.288	S	S	.	.			trans	-70.2	141.9	179.9	0	0	0	0	0	111.9	D735 W739 K740 L741	D735-A737 PolarHBondContact O-N 3.2Å; A737-W739 VanDerWaalsContact C-N 3.26Å; A737-W739 PolarHBondContact O-N 2.81Å; A737-W739 VanDerWaalsContact O-N 3.17Å; A737-K740 HydrophobicContact CB-CG 4.36Å; A737-K740 VanDerWaalsContact O-CB 3.3Å; A737-K740 WeakPolarHBondContact O-CB 3.44Å; A737-K740 PolarHBondContact O-N 2.89Å; A737-L741 PolarHBondContact O-N 2.83Å
738	V	83.4	Confident	82.9	Confident	87 Å²	87	58.8 Å²	58.8	53%	0.527	30%	0.295	S	S	.	.	H	α-helix	trans	-58.2	-33.2	-176.5	-178.3	0	0	0	0	113.1	K740 L741 L742	V738-K740 VanDerWaalsContact C-N 3.29Å; V738-K740 PolarHBondContact O-N 2.95Å; V738-L741 WeakPolarHBondContact O-CB 3.17Å; V738-L741 PolarHBondContact O-N 2.87Å; V738-L742 HydrophobicContact CG1-CD1 4.44Å; V738-L742 PolarHBondContact O-N 2.89Å
739	W	85.1	Confident	82.7	Confident	187 Å²	187	65.7 Å²	65.7	71%	0.708	33%	0.327	S	S	*	.	H	α-helix	trans	-68.1	-30.3	177.4	-165.7	66.6	0	0	0	112.7	A737 L741 L742 L743	A737-W739 VanDerWaalsContact C-N 3.26Å; A737-W739 PolarHBondContact O-N 2.81Å; A737-W739 VanDerWaalsContact O-N 3.17Å; W739-L741 VanDerWaalsContact C-N 3.33Å; W739-L742 PolarHBondContact O-N 3.18Å; W739-L743 WeakPolarHBondContact O-CB 3.48Å; W739-L743 PolarHBondContact O-N 3.32Å
740	K	86.8	Confident	82.6	Confident	85 Å²	85	66.4 Å²	66.4	37%	0.37	33%	0.333	S	S	.	.	H	α-helix	trans	-63.3	-42.4	171.7	-61.7	-173.8	177.2	-178.2	0	110.5	A737 V738 L743 T744 F755	A737-K740 HydrophobicContact CB-CG 4.36Å; A737-K740 VanDerWaalsContact O-CB 3.3Å; A737-K740 WeakPolarHBondContact O-CB 3.44Å; A737-K740 PolarHBondContact O-N 2.89Å; V738-K740 VanDerWaalsContact C-N 3.29Å; V738-K740 PolarHBondContact O-N 2.95Å; K740-L743 PolarHBondContact O-N 3.45Å; K740-T744 WeakPolarHBondContact O-CG2 3.18Å; K740-T744 PolarHBondContact O-N 3.08Å; K740-T744 PolarHBondContact O-OG1 3.34Å; K740-T744 VanDerWaalsContact O-OG1 3.06Å; K740-F755 HydrophobicContact CB-CD1 4.24Å; K740-F755 HydrophobicContact CB-CE1 3.5Å; K740-F755 VanDerWaalsContact CB-CE1 3.5Å; K740-F755 HydrophobicContact CB-CZ 3.93Å; K740-F755 HydrophobicContact CD-CE1 4.31Å; K740-F755 HydrophobicContact CD-CZ 4.22Å; K740-F755 HydrophobicContact CG-CE1 3.77Å; K740-F755 HydrophobicContact CG-CE2 4.42Å; K740-F755 HydrophobicContact CG-CZ 3.66Å
741	L	83.2	Confident	82.3	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-60.6	-49	175.1	-67.9	167.9	0	0	0	112.1	W729 M732 A737 V738 W739 L743 T744 F745 F834 V839 T840 L843	W729-L741 HydrophobicContact CH2-CD1 3.71Å; W729-L741 HydrophobicContact CZ3-CD1 3.42Å; W729-L741 VanDerWaalsContact CZ3-CD1 3.42Å; W729-L741 HydrophobicContact CZ3-CD2 4.36Å; W729-L741 HydrophobicContact CZ3-CG 4.24Å; M732-L741 HydrophobicContact CE-CD2 3.34Å; M732-L741 HydrophobicContact SD-CD2 4.23Å; A737-L741 PolarHBondContact O-N 2.83Å; V738-L741 WeakPolarHBondContact O-CB 3.17Å; V738-L741 PolarHBondContact O-N 2.87Å; W739-L741 VanDerWaalsContact C-N 3.33Å; L741-L743 VanDerWaalsContact C-N 3.32Å; L741-L743 PolarHBondContact O-N 2.99Å; L741-T744 WeakPolarHBondContact CA-OG1 3.32Å; L741-T744 PolarHBondContact O-N 3.41Å; L741-T744 PolarHBondContact O-OG1 3.42Å; L741-F745 WeakPolarHBondContact O-CB 3.34Å; L741-F745 PolarHBondContact O-N 3.16Å; L741-F834 HydrophobicContact CD2-CE2 4.16Å; L741-V839 HydrophobicContact CD1-CG2 3.91Å; L741-T840 HydrophobicContact CD2-CG2 4.26Å; L741-L843 HydrophobicContact CB-CD2 4.11Å
742	L	83.7	Confident	82.4	Confident	53 Å²	53	67.1 Å²	67.1	28%	0.277	33%	0.326	S	S	.	.	H	α-helix	trans	-56.9	-46.8	177.2	-81.8	165	0	0	0	111.2	V738 W739 T744 F745 F746 L843	V738-L742 HydrophobicContact CG1-CD1 4.44Å; V738-L742 PolarHBondContact O-N 2.89Å; W739-L742 PolarHBondContact O-N 3.18Å; L742-T744 PolarHBondContact O-N 3.34Å; L742-F745 WeakPolarHBondContact O-CB 3.45Å; L742-F745 PolarHBondContact O-N 3.34Å; L742-F746 HydrophobicContact CD2-CE2 4.49Å; L742-F746 WeakPolarHBondContact O-CD2 3.34Å; L742-F746 PolarHBondContact O-N 3.22Å; L742-F746 VanDerWaalsContact O-N 3.15Å; L742-L843 HydrophobicContact CD2-CD1 3.8Å; L742-L843 HydrophobicContact CD2-CD2 3.88Å; L742-L843 HydrophobicContact CD2-CG 4.1Å; L742-L843 HydrophobicContact CG-CD1 4.25Å; L742-L843 HydrophobicContact CG-CD2 3.98Å
743	L	84.9	Confident	82.4	Confident	60 Å²	60	70 Å²	70	31%	0.314	34%	0.344	S	S	.	.	H	α-helix	trans	-62.3	-43.2	178.6	-170.5	67.6	0	0	0	111.9	W739 K740 L741 F745 F746 C747 L750 F755	W739-L743 WeakPolarHBondContact O-CB 3.48Å; W739-L743 PolarHBondContact O-N 3.32Å; K740-L743 PolarHBondContact O-N 3.45Å; L741-L743 VanDerWaalsContact C-N 3.32Å; L741-L743 PolarHBondContact O-N 2.99Å; L743-F745 VanDerWaalsContact C-N 3.33Å; L743-F745 PolarHBondContact O-N 3.31Å; L743-F746 PolarHBondContact O-N 3.43Å; L743-C747 WeakPolarHBondContact O-CB 3.42Å; L743-C747 PolarHBondContact O-N 3.09Å; L743-L750 HydrophobicContact CD2-CD1 3.93Å; L743-L750 HydrophobicContact CG-CD1 3.68Å; L743-F755 HydrophobicContact CD2-CE1 4.07Å; L743-F755 HydrophobicContact CD2-CZ 3.83Å
744	T	84.9	Confident	82.2	Confident	0 Å²	0	73 Å²	73	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-70.1	-26.4	176.1	54.7	0	0	0	0	114	K740 L741 L742 C747 P748 L750 F755 I756 F834	K740-T744 WeakPolarHBondContact O-CG2 3.18Å; K740-T744 PolarHBondContact O-N 3.08Å; K740-T744 PolarHBondContact O-OG1 3.34Å; K740-T744 VanDerWaalsContact O-OG1 3.06Å; L741-T744 WeakPolarHBondContact CA-OG1 3.32Å; L741-T744 PolarHBondContact O-N 3.41Å; L741-T744 PolarHBondContact O-OG1 3.42Å; L742-T744 PolarHBondContact O-N 3.34Å; T744-C747 CarbonylContact O-C 3.53Å; T744-P748 WeakPolarHBondContact O-CA 3.3Å; T744-L750 HydrophobicContact CG2-CB 3.69Å; T744-F755 HydrophobicContact CG2-CD1 3.73Å; T744-F755 HydrophobicContact CG2-CE1 4.11Å; T744-I756 HydrophobicContact CG2-CD1 3.43Å; T744-I756 VanDerWaalsContact CG2-CD1 3.43Å; T744-I756 HydrophobicContact CG2-CG1 4.01Å; T744-F834 WeakPolarHBondContact OG1-CE2 3.25Å; T744-F834 WeakPolarHBondContact OG1-CZ 3.36Å
745	F	84.3	Confident	82.3	Confident	36 Å²	36	72 Å²	72	16%	0.158	36%	0.361	C	S	.	.	H	α-helix	trans	-68.1	-43.6	174.6	-175.7	-88.2	0	0	0	111.1	L741 L742 L743 W835 L847	L741-F745 WeakPolarHBondContact O-CB 3.34Å; L741-F745 PolarHBondContact O-N 3.16Å; L742-F745 WeakPolarHBondContact O-CB 3.45Å; L742-F745 PolarHBondContact O-N 3.34Å; L743-F745 VanDerWaalsContact C-N 3.33Å; L743-F745 PolarHBondContact O-N 3.31Å; F745-W835 AromaticContact CD2-CH2 3.85Å; F745-W835 HydrophobicContact CD2-CH2 3.85Å; F745-W835 AromaticContact CD2-CZ3 3.91Å; F745-W835 HydrophobicContact CD2-CZ3 3.91Å; F745-W835 AromaticContact CE2-CH2 3.81Å; F745-W835 HydrophobicContact CE2-CH2 3.81Å; F745-W835 AromaticContact CE2-CZ3 3.63Å; F745-W835 HydrophobicContact CE2-CZ3 3.63Å; F745-L847 HydrophobicContact CD1-CD1 4.13Å; F745-L847 HydrophobicContact CE1-CD1 3.92Å; F745-L847 HydrophobicContact CE1-CD2 4.18Å
746	F	83.8	Confident	82.4	Confident	136 Å²	136	66.1 Å²	66.1	60%	0.596	33%	0.33	S	S	*	.	H	α-helix	trans	-75	-31.2	175.6	-71.7	-69.1	0	0	0	113.2	L742 L743 P748 L847	L742-F746 HydrophobicContact CD2-CE2 4.49Å; L742-F746 WeakPolarHBondContact O-CD2 3.34Å; L742-F746 PolarHBondContact O-N 3.22Å; L742-F746 VanDerWaalsContact O-N 3.15Å; L743-F746 PolarHBondContact O-N 3.43Å; F746-P748 WeakPolarHBondContact O-CD 3.42Å; F746-L847 HydrophobicContact CE1-CD1 3.91Å; F746-L847 HydrophobicContact CE2-CD1 4.1Å; F746-L847 HydrophobicContact CZ-CD1 3.41Å; F746-L847 VanDerWaalsContact CZ-CD1 3.41Å
747	C	85.1	Confident	82.2	Confident	59 Å²	59	67.8 Å²	67.8	40%	0.399	34%	0.342	S	S	.	.			trans	-121.6	83.1	179.4	-66.2	0	0	0	0	110.9	L743 T744 F749 L750	L743-C747 WeakPolarHBondContact O-CB 3.42Å; L743-C747 PolarHBondContact O-N 3.09Å; T744-C747 CarbonylContact O-C 3.53Å; C747-F749 PolarHBondContact O-N 3.49Å; C747-L750 HydrophobicContact CB-CD1 3.7Å; C747-L750 HydrophobicContact CB-CG 4.01Å; C747-L750 WeakPolarHBondContact O-CB 3.48Å; C747-L750 PolarHBondContact O-N 3.36Å
748	P	79	Confident	82	Confident	36 Å²	36	66.6 Å²	66.6	23%	0.234	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-61.4	-19.9	-174.6	-24.5	34	0	0	0	115	T744 F746 L750 C751 W831	T744-P748 WeakPolarHBondContact O-CA 3.3Å; F746-P748 WeakPolarHBondContact O-CD 3.42Å; P748-L750 PolarHBondContact O-N 3.14Å; P748-C751 WeakPolarHBondContact O-CB 3.35Å; P748-C751 PolarHBondContact O-N 2.99Å; P748-W831 HydrophobicContact CB-CH2 3.65Å; P748-W831 HydrophobicContact CB-CZ3 3.51Å; P748-W831 HydrophobicContact CG-CH2 4.37Å
749	F	82.1	Confident	81.5	Confident	173 Å²	173	68.1 Å²	68.1	76%	0.759	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-62.9	-25.8	174.7	-63.1	-72.9	0	0	0	112.9	C747 C751 Y752	C747-F749 PolarHBondContact O-N 3.49Å; F749-C751 PolarHBondContact O-N 2.76Å; F749-Y752 PolarHBondContact O-N 3.38Å
750	L	82.3	Confident	80.2	Confident	50 Å²	50	66.2 Å²	66.2	26%	0.262	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-70	-16.9	177.3	-65.2	173.7	0	0	0	113.2	L743 T744 C747 P748 Y752 T753	L743-L750 HydrophobicContact CD2-CD1 3.93Å; L743-L750 HydrophobicContact CG-CD1 3.68Å; T744-L750 HydrophobicContact CG2-CB 3.69Å; C747-L750 HydrophobicContact CB-CD1 3.7Å; C747-L750 HydrophobicContact CB-CG 4.01Å; C747-L750 WeakPolarHBondContact O-CB 3.48Å; C747-L750 PolarHBondContact O-N 3.36Å; P748-L750 PolarHBondContact O-N 3.14Å; L750-Y752 PolarHBondContact O-N 3.38Å; L750-T753 PolarHBondContact O-N 3.45Å; L750-T753 PolarHBondContact O-OG1 3.4Å
751	C	78.3	Confident	78.2	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-68	-19.9	174.7	-66.7	0	0	0	0	112.9	P748 F749	P748-C751 WeakPolarHBondContact O-CB 3.35Å; P748-C751 PolarHBondContact O-N 2.99Å; F749-C751 PolarHBondContact O-N 2.76Å
752	Y	79.2	Confident	75.9	Confident	78 Å²	78	68.7 Å²	68.7	31%	0.306	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-88.2	-14.6	178.7	-59.3	-62.7	0	0	0	113.1	F749 L750 I827 R830 W831	F749-Y752 PolarHBondContact O-N 3.38Å; L750-Y752 PolarHBondContact O-N 3.38Å; Y752-I827 HydrophobicContact CD1-CG2 4.38Å; Y752-I827 HydrophobicContact CE1-CB 4.22Å; Y752-I827 HydrophobicContact CE1-CG2 3.52Å; Y752-I827 WeakPolarHBondContact OH-CG2 3.43Å; Y752-R830 HydrophobicContact CD1-CB 4.49Å; Y752-R830 PolarHBondContact O-NH1 2.87Å; Y752-W831 HydrophobicContact CE2-CE3 4.32Å; Y752-W831 AromaticContact CZ-CE3 3.92Å
753	T	80.6	Confident	73.4	Confident	66 Å²	66	73.7 Å²	73.7	41%	0.405	37%	0.371	S	S	.	.	S	Bend	trans	-86.4	168.2	175.1	70.1	0	0	0	0	110.7	L750 F755	L750-T753 PolarHBondContact O-N 3.45Å; L750-T753 PolarHBondContact O-OG1 3.4Å; T753-F755 PolarHBondContact O-N 3.22Å; T753-F755 WeakPolarHBondContact OG1-CB 3.48Å
754	N	75.9	Confident	71	Confident	145 Å²	145	78.4 Å²	78.4	78%	0.775	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	20.3	175.8	-68.1	-15.7	0	0	0	113.2	I756	N754-I756 VanDerWaalsContact C-N 3.29Å
755	F	80.5	Confident	68.3	Low	67 Å²	67	85.5 Å²	85.5	29%	0.294	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-28.8	179	-171.2	-108.1	0	0	0	112.5	K740 L743 T744 T753	K740-F755 HydrophobicContact CB-CD1 4.24Å; K740-F755 HydrophobicContact CB-CE1 3.5Å; K740-F755 VanDerWaalsContact CB-CE1 3.5Å; K740-F755 HydrophobicContact CB-CZ 3.93Å; K740-F755 HydrophobicContact CD-CE1 4.31Å; K740-F755 HydrophobicContact CD-CZ 4.22Å; K740-F755 HydrophobicContact CG-CE1 3.77Å; K740-F755 HydrophobicContact CG-CE2 4.42Å; K740-F755 HydrophobicContact CG-CZ 3.66Å; L743-F755 HydrophobicContact CD2-CE1 4.07Å; L743-F755 HydrophobicContact CD2-CZ 3.83Å; T744-F755 HydrophobicContact CG2-CD1 3.73Å; T744-F755 HydrophobicContact CG2-CE1 4.11Å; T753-F755 PolarHBondContact O-N 3.22Å; T753-F755 WeakPolarHBondContact OG1-CB 3.48Å
756	I	80.3	Confident	65.7	Low	3 Å²	3	91 Å²	91	2%	0.015	44%	0.443	C	S	.	.	S	Bend	trans	-114.6	126.9	172.3	-67.1	174	0	0	0	108.6	M732 T736 T744 N754 F758 F834	M732-I756 HydrophobicContact CE-CD1 4.21Å; M732-I756 HydrophobicContact CE-CG2 3.55Å; T736-I756 HydrophobicContact CG2-CG2 4.44Å; T744-I756 HydrophobicContact CG2-CD1 3.43Å; T744-I756 VanDerWaalsContact CG2-CD1 3.43Å; T744-I756 HydrophobicContact CG2-CG1 4.01Å; N754-I756 VanDerWaalsContact C-N 3.29Å; I756-F758 HydrophobicContact CB-CE2 4.07Å; I756-F758 HydrophobicContact CB-CZ 4.36Å; I756-F758 HydrophobicContact CG2-CD2 4.17Å; I756-F758 HydrophobicContact CG2-CE1 4.2Å; I756-F758 HydrophobicContact CG2-CE2 3.72Å; I756-F758 HydrophobicContact CG2-CZ 3.74Å; I756-F834 HydrophobicContact CD1-CD2 3.91Å; I756-F834 HydrophobicContact CD1-CE2 3.59Å
757	S	79.1	Confident	63.3	Low	47 Å²	47	92.2 Å²	92.2	33%	0.329	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-84.1	126.7	168.6	52.1	0	0	0	0	110.3	Q733	Q733-S757 WeakPolarHBondContact CB-OG 3.35Å; Q733-S757 PolarHBondContact N-O 3.19Å; Q733-S757 VanDerWaalsContact N-O 3.08Å; Q733-S757 PolarHBondContact OE1-OG 3.48Å
758	F	79.8	Confident	60.9	Low	28 Å²	28	95.6 Å²	95.6	12%	0.123	46%	0.461	C	S	.	.	B	Isolated β-bridge	trans	-101	146.4	171.8	-66.6	-86	0	0	0	108.1	M732 I756 E760 Q833 F834	M732-F758 HydrophobicContact CG-CD1 3.94Å; M732-F758 HydrophobicContact CG-CE1 3.75Å; I756-F758 HydrophobicContact CB-CE2 4.07Å; I756-F758 HydrophobicContact CB-CZ 4.36Å; I756-F758 HydrophobicContact CG2-CD2 4.17Å; I756-F758 HydrophobicContact CG2-CE1 4.2Å; I756-F758 HydrophobicContact CG2-CE2 3.72Å; I756-F758 HydrophobicContact CG2-CZ 3.74Å; F758-E760 PolarHBondContact O-N 3.34Å; F758-Q833 HydrophobicContact CD1-CB 4.16Å; F758-Q833 HydrophobicContact CE1-CB 4.11Å; F758-F834 HydrophobicContact CE1-CB 4.35Å; F758-F834 HydrophobicContact CZ-CB 4.29Å
759	R	73.3	Confident	58.6	Low	118 Å²	118	102.6 Å²	102.6	45%	0.445	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-67.9	118.9	173.5	-169.6	172.4	68.5	-179.6	1.2	107.7	Q726 D731 N761	Q726-R759 VanDerWaalsContact CD-NH1 3.27Å; D731-R759 PolarHBondContact O-N 3.48Å; R759-N761 PolarHBondContact O-N 3.33Å
760	E	56.7	Low	56.1	Low	147 Å²	147	97.9 Å²	97.9	69%	0.687	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-61.9	134.1	170.8	-81.8	174.2	160.6	0	0	108.6	F758 G762	F758-E760 PolarHBondContact O-N 3.34Å; E760-G762 PolarHBondContact O-N 3.28Å
761	N	46.1	Very low	53.7	Low	124 Å²	124	100.7 Å²	100.7	66%	0.663	52%	0.515	S	S	*	.	S	Bend	trans	-72.5	33.4	166.3	-74	-22.1	0	0	0	110.6	R759	R759-N761 PolarHBondContact O-N 3.33Å
762	G	33.2	Very low	51.4	Low	17 Å²	17	105.9 Å²	105.9	18%	0.175	55%	0.551	C	S	.	*			trans	-101.8	-1.4	-152.9	0	0	0	0	0	116.9	E760 R764 Q765	E760-G762 PolarHBondContact O-N 3.28Å; G762-R764 PolarHBondContact O-N 3.21Å; G762-Q765 PolarHBondContact O-N 3.31Å
763	N	31.3	Very low	48.9	Very low	158 Å²	158	108 Å²	108	85%	0.845	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	26.6	166.1	-77	29.9	0	0	0	112.8
764	R	35.1	Very low	46.6	Very low	158 Å²	158	112.5 Å²	112.5	60%	0.596	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	-9.3	174.2	-92.6	-175.9	153.6	179.5	-6.3	114	G762 K796	G762-R764 PolarHBondContact O-N 3.21Å; R764-K796 PolarHBondContact O-NZ 3.43Å
765	Q	28.2	Very low	44.3	Very low	149 Å²	149	115.1 Å²	115.1	70%	0.696	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	-22.9	-176.6	-83.2	179.1	-48.8	0	0	115.2	G762 E767 E768	G762-Q765 PolarHBondContact O-N 3.31Å; Q765-E767 VanDerWaalsContact C-N 3.3Å; Q765-E767 PolarHBondContact O-N 3.16Å; Q765-E768 PolarHBondContact O-N 2.86Å
766	E	30.1	Very low	41.9	Very low	151 Å²	151	119.3 Å²	119.3	71%	0.706	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-10.2	-178.5	-69.8	-174.2	157.7	0	0	115
767	E	34.2	Very low	40.6	Very low	163 Å²	163	124 Å²	124	76%	0.762	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-6.5	171.2	-73.3	-179.2	173.7	0	0	113.4	Q765	Q765-E767 VanDerWaalsContact C-N 3.3Å; Q765-E767 PolarHBondContact O-N 3.16Å
768	E	34.1	Very low	38.1	Very low	129 Å²	129	127.2 Å²	127.2	60%	0.603	69%	0.685	S	S	*	*	S	Bend	trans	-90.1	-10.3	-176.9	-79	174.2	-167.7	0	0	113.9	Q765 K796	Q765-E768 PolarHBondContact O-N 2.86Å; E768-K796 IonicContact OE1-NZ 3.61Å; E768-K796 PolarHBondContact OE1-NZ 3.43Å
769	E	30.2	Very low	35.7	Very low	183 Å²	183	137.6 Å²	137.6	86%	0.855	72%	0.723	S	S	*	*	S	Bend	trans	-104.2	1.1	178.4	-70.7	-171	167.3	0	0	114.6
770	G	30.4	Very low	33.7	Very low	75 Å²	75	140 Å²	140	77%	0.773	75%	0.745	S	S	*	*	S	Bend	trans	-87.9	-7.1	-177.8	0	0	0	0	0	117
771	S	32	Very low	32.3	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	75%	0.75	S	S	*	*			trans	-126	83.4	-177.7	76.6	0	0	0	0	112.8
772	S	28.8	Very low	31.6	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	76%	0.755	S	S	*	*			trans	-138.8	89.1	154.5	56.4	0	0	0	0	109.6
773	S	27.7	Very low	31.3	Very low	122 Å²	122	146.4 Å²	146.4	85%	0.853	79%	0.789	S	S	*	*			trans	-160.3	108.3	151.8	-13.7	0	0	0	0	107
774	D	30.8	Very low	31.3	Very low	161 Å²	161	147 Å²	147	86%	0.861	79%	0.786	S	S	*	*			trans	-59.7	133.8	166.3	-66	-54.4	0	0	0	110.1
775	E	29	Very low	31.1	Very low	200 Å²	200	150.3 Å²	150.3	94%	0.935	80%	0.801	S	S	*	*			trans	-169.1	126.1	136.5	-105.6	176.1	-158.8	0	0	110.2
776	D	29.9	Very low	31.4	Very low	155 Å²	155	146.1 Å²	146.1	83%	0.829	80%	0.797	S	S	*	*			trans	-105.3	180	-174.6	-141	12.8	0	0	0	108.8
777	P	52.6	Low	31.4	Very low	102 Å²	102	145.8 Å²	145.8	66%	0.662	81%	0.806	S	S	*	*				-118.2	166.6	-89	33.5	-16.9	0	0	0	113.9
778	S	27.9	Very low	31.3	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	81%	0.809	S	S	*	*			trans	161.4	120.8	138.9	48.9	0	0	0	0	113.9
779	R	28.9	Very low	31.2	Very low	246 Å²	246	145 Å²	145	93%	0.928	81%	0.814	S	S	*	*				168.7	127.8	124.5	-96.7	176.5	163.6	173.4	-3.7	111.8
780	D	31	Very low	31.2	Very low	169 Å²	169	143.7 Å²	143.7	90%	0.904	81%	0.806	S	S	*	*			trans	-57.9	138	168.8	-61	-53.1	0	0	0	112.5
781	S	27.9	Very low	31.1	Very low	114 Å²	114	144 Å²	144	80%	0.797	80%	0.796	S	S	*	*			trans	-167	125.1	137.9	58.9	0	0	0	0	110.7
782	D	30.2	Very low	31.1	Very low	141 Å²	141	145.3 Å²	145.3	75%	0.754	79%	0.789	S	S	*	*			trans	-44.8	128.6	176.4	-71.8	-57.2	0	0	0	115	H784	D782-H784 IonicContact OD1-ND1 3.09Å
783	N	26.2	Very low	31.4	Very low	168 Å²	168	142.8 Å²	142.8	90%	0.898	77%	0.771	S	S	*	*			trans	-150	78.1	145.4	-118.7	-2.8	0	0	0	109.6	Y785	N783-Y785 PolarHBondContact O-N 3Å
784	H	32.4	Very low	31.6	Very low	170 Å²	170	141.6 Å²	141.6	79%	0.787	76%	0.755	S	S	*	*			trans	-75.3	94.7	170.4	-87	82.1	0	0	0	110.1	D782	D782-H784 IonicContact OD1-ND1 3.09Å
785	Y	30.5	Very low	32	Very low	228 Å²	228	137.7 Å²	137.7	89%	0.894	73%	0.733	S	S	*	*	S	Bend	trans	-173.4	118.9	133.3	-130.1	-104.1	0	0	0	111.7	N783	N783-Y785 PolarHBondContact O-N 3Å
786	G	35.1	Very low	32.1	Very low	60 Å²	60	132.6 Å²	132.6	62%	0.619	71%	0.708	S	S	*	*	S	Bend	trans	60.9	99.2	152.4	0	0	0	0	0	118
787	T	30.5	Very low	32.3	Very low	145 Å²	145	131.8 Å²	131.8	89%	0.89	70%	0.699	S	S	*	*			trans	167.6	35.7	142.5	35.5	0	0	0	0	114.4
788	T	31.4	Very low	31.5	Very low	135 Å²	135	131.7 Å²	131.7	83%	0.828	69%	0.692	S	S	*	*			trans	-153.4	86.9	171	40.4	0	0	0	0	112.3
789	I	31.5	Very low	31.8	Very low	140 Å²	140	133.7 Å²	133.7	72%	0.718	69%	0.689	S	S	*	*	S	Bend	trans	-139.1	129.8	147.3	-49.6	-178.6	0	0	0	107.5
790	F	31.2	Very low	32.1	Very low	155 Å²	155	127.5 Å²	127.5	68%	0.68	68%	0.678	S	S	*	*			trans	95.1	66.1	171.5	-43.1	-64.5	0	0	0	117.5
791	S	27.3	Very low	32	Very low	82 Å²	82	126.6 Å²	126.6	57%	0.573	67%	0.673	S	S	*	*			trans	-66.6	150	152.2	-178.4	0	0	0	0	110.8	S793	S791-S793 PolarHBondContact O-N 3.46Å; S791-S793 VanDerWaalsContact O-N 3.15Å; S791-S793 PolarHBondContact OG-OG 3.28Å
792	F	33.3	Very low	32.1	Very low	136 Å²	136	124.5 Å²	124.5	60%	0.596	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-16.7	-177	-154.7	-103.5	0	0	0	113.3	D794 I795	F792-D794 PolarHBondContact O-N 2.66Å; F792-I795 PolarHBondContact O-N 2.81Å
793	S	33.5	Very low	32.1	Very low	57 Å²	57	127.1 Å²	127.1	40%	0.399	68%	0.678	S	S	.	*	H	α-helix	trans	-62.6	-37.7	-177	-39.7	0	0	0	0	113.3	S791 I795 K796 H797	S791-S793 PolarHBondContact O-N 3.46Å; S791-S793 VanDerWaalsContact O-N 3.15Å; S791-S793 PolarHBondContact OG-OG 3.28Å; S793-I795 PolarHBondContact O-N 2.91Å; S793-K796 PolarHBondContact O-N 3.27Å; S793-H797 PolarHBondContact O-CD2 2.88Å; S793-H797 VanDerWaalsContact O-CD2 3.28Å
794	D	33.1	Very low	32.1	Very low	96 Å²	96	127.2 Å²	127.2	51%	0.513	68%	0.677	S	S	.	*	H	α-helix	trans	-74.1	-8.7	-176.9	-67.3	-24.2	0	0	0	114.2	F792 I798	F792-D794 PolarHBondContact O-N 2.66Å; D794-I798 WeakPolarHBondContact O-CD1 3.41Å
795	I	38.2	Very low	31.8	Very low	79 Å²	79	124.2 Å²	124.2	41%	0.405	68%	0.675	S	S	.	*	H	α-helix	trans	-83	-30.6	177.4	-52.8	-162.9	0	0	0	111.2	F792 S793	F792-I795 PolarHBondContact O-N 2.81Å; S793-I795 PolarHBondContact O-N 2.91Å
796	K	32	Very low	31.4	Very low	94 Å²	94	119.2 Å²	119.2	41%	0.409	67%	0.674	S	S	.	*	H	α-helix	trans	-85.1	-35.8	-178.3	-136.3	-177.1	177.7	-167.2	0	111.8	R764 E768 S793 I798 E799	R764-K796 PolarHBondContact O-NZ 3.43Å; E768-K796 IonicContact OE1-NZ 3.61Å; E768-K796 PolarHBondContact OE1-NZ 3.43Å; S793-K796 PolarHBondContact O-N 3.27Å; K796-I798 PolarHBondContact O-N 2.99Å; K796-E799 PolarHBondContact O-N 3.28Å
797	H	32.8	Very low	31.3	Very low	137 Å²	137	121.4 Å²	121.4	63%	0.634	68%	0.677	S	S	*	*	H	α-helix	trans	-70.2	-24.2	-177.3	-75.5	-71.8	0	0	0	114.7	S793	S793-H797 PolarHBondContact O-CD2 2.88Å; S793-H797 VanDerWaalsContact O-CD2 3.28Å
798	I	36.2	Very low	31.1	Very low	100 Å²	100	126.3 Å²	126.3	51%	0.513	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	-12.3	178.7	-57.1	172	0	0	0	112.4	D794 K796 V800	D794-I798 WeakPolarHBondContact O-CD1 3.41Å; K796-I798 PolarHBondContact O-N 2.99Å; I798-V800 VanDerWaalsContact C-N 3.26Å; I798-V800 PolarHBondContact O-N 3.06Å
799	E	35.7	Very low	30.7	Very low	155 Å²	155	125.4 Å²	125.4	72%	0.724	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-7.3	173.9	-89.4	-173.2	168.6	0	0	113.4	K796	K796-E799 PolarHBondContact O-N 3.28Å
800	V	34.7	Very low	30.7	Very low	116 Å²	116	124.7 Å²	124.7	70%	0.703	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	-33	-174.5	-174.8	0	0	0	0	114.4	I798 G802	I798-V800 VanDerWaalsContact C-N 3.26Å; I798-V800 PolarHBondContact O-N 3.06Å; V800-G802 PolarHBondContact O-N 2.96Å
801	D	27.9	Very low	30.4	Very low	151 Å²	151	122.7 Å²	122.7	81%	0.807	69%	0.688	S	S	*	*	S	Bend	trans	-104.6	55.5	-172.1	-78.8	-24	0	0	0	115.6
802	G	30.2	Very low	30.5	Very low	70 Å²	70	126.9 Å²	126.9	72%	0.722	70%	0.702	S	S	*	*			trans	-128.3	35	179.8	0	0	0	0	0	115.2	V800	V800-G802 PolarHBondContact O-N 2.96Å
803	Q	30.2	Very low	30.3	Very low	196 Å²	196	130.1 Å²	130.1	92%	0.916	72%	0.716	S	S	*	*			trans	-136.7	92.4	174.2	-97.3	170.2	0.6	0	0	112
804	L	26.4	Very low	30.2	Very low	170 Å²	170	131 Å²	131	89%	0.89	73%	0.734	S	S	*	*			trans	-129.9	102.5	159.3	-161.8	68.8	0	0	0	110.4
805	S	26.4	Very low	29.9	Very low	106 Å²	106	132.8 Å²	132.8	74%	0.741	75%	0.748	S	S	*	*			trans	33.5	115.3	149.7	60.8	0	0	0	0	122.5
806	S	21.9	Very low	29.6	Very low	124 Å²	124	134.9 Å²	134.9	87%	0.867	77%	0.766	S	S	*	*				-172.7	153.2	126.7	-153.7	0	0	0	0	111.3
807	P	32.3	Very low	29.4	Very low	106 Å²	106	138.8 Å²	138.8	69%	0.688	79%	0.786	S	S	*	*			trans	-104.4	156.7	-142.9	39.4	-36.5	0	0	0	118
808	R	27.1	Very low	29.3	Very low	248 Å²	248	138.2 Å²	138.2	94%	0.936	80%	0.795	S	S	*	*			trans	62	103.9	148.2	-76	178.2	172.6	160.5	-1.5	120
809	S	23.5	Very low	29.1	Very low	116 Å²	116	143.2 Å²	143.2	81%	0.811	81%	0.809	S	S	*	*			trans	-150.5	147.8	131.8	65.3	0	0	0	0	109.8
810	P	31.4	Very low	28.7	Very low	125 Å²	125	145.3 Å²	145.3	81%	0.812	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80.9	128.2	-164.2	31.1	-32.1	0	0	0	112.2
811	S	25.3	Very low	28.7	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.7	126.2	178.2	61.6	0	0	0	0	112.6
812	I	29.3	Very low	29.3	Very low	170 Å²	170	141.4 Å²	141.4	87%	0.872	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.3	127.7	162.1	-69.3	169.6	0	0	0	108.6
813	K	29.3	Very low	29.9	Very low	204 Å²	204	147.6 Å²	147.6	89%	0.887	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-63.6	134.8	-178	-70.7	170.8	174.2	174.2	0	112.1
814	G	31	Very low	30.9	Very low	74 Å²	74	144.8 Å²	144.8	76%	0.763	79%	0.786	S	S	*	*			trans	146.2	53	155.6	0	0	0	0	0	118.2
815	V	27	Very low	32.9	Very low	134 Å²	134	140.8 Å²	140.8	81%	0.812	77%	0.77	S	S	*	*			trans	-135.6	123.7	156.9	-177.4	0	0	0	0	107.5	E817	V815-E817 PolarHBondContact O-N 3.41Å
816	P	32.1	Very low	35	Very low	123 Å²	123	141.7 Å²	141.7	80%	0.799	76%	0.761	S	S	*	*			trans	-74.7	122.4	173.4	3.2	11.8	0	0	0	109.4
817	E	26.8	Very low	37.4	Very low	177 Å²	177	140.7 Å²	140.7	83%	0.827	75%	0.745	S	S	*	*			trans	-56.7	145.5	163.9	-77.5	177.8	145.4	0	0	110.8	V815 Y819	V815-E817 PolarHBondContact O-N 3.41Å; E817-Y819 PolarHBondContact O-N 3.41Å
818	P	31.2	Very low	39.4	Very low	125 Å²	125	141 Å²	141	81%	0.812	74%	0.74	S	S	*	*			trans	-67.1	108.6	175.3	26.7	-31.2	0	0	0	110.3	R820	P818-R820 PolarHBondContact O-N 3.3Å
819	Y	31	Very low	41.6	Very low	204 Å²	204	130.6 Å²	130.6	80%	0.8	71%	0.706	S	S	*	*			trans	-57.4	104.8	174.5	-166	-91.4	0	0	0	111	E817 P821	E817-Y819 PolarHBondContact O-N 3.41Å; Y819-P821 WeakPolarHBondContact O-CD 3.5Å
820	R	26.9	Very low	44.3	Very low	199 Å²	199	126.9 Å²	126.9	75%	0.751	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-74.8	118.9	165	-76.4	-175.7	-176.4	177.9	3.8	108.2	P818	P818-R820 PolarHBondContact O-N 3.3Å
821	P	36.5	Very low	46.7	Very low	86 Å²	86	126 Å²	126	56%	0.558	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-68.8	142.9	176.6	27.5	-31.7	0	0	0	110.2	Y819	Y819-P821 WeakPolarHBondContact O-CD 3.5Å
822	P	38.6	Very low	49.2	Very low	99 Å²	99	125.4 Å²	125.4	64%	0.643	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-62	147.7	175.2	25	-32.7	0	0	0	111.1	R824	P822-R824 PolarHBondContact O-N 3Å
823	Q	43.5	Very low	51.6	Low	201 Å²	201	118.8 Å²	118.8	94%	0.939	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-55.7	122.7	173.4	-75.1	-175.7	-7	0	0	109.3
824	R	51.8	Low	54.2	Low	137 Å²	137	109.1 Å²	109.1	52%	0.517	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-89.1	154.4	179.5	-67.1	-176.1	-176.2	-177.6	0.2	109.6	P822	P822-R824 PolarHBondContact O-N 3Å
825	P	68.6	Low	56.6	Low	85 Å²	85	108.1 Å²	108.1	55%	0.552	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-57.4	141.8	175.9	22.1	-32.1	0	0	0	111.4	I827 L828 S829	P825-I827 PolarHBondContact O-N 2.92Å; P825-L828 HydrophobicContact CG-CB 4.27Å; P825-L828 HydrophobicContact CG-CD1 3.82Å; P825-L828 PolarHBondContact O-N 3.31Å; P825-S829 PolarHBondContact O-N 2.99Å; P825-S829 VanDerWaalsContact O-N 3.1Å
826	F	69.4	Low	59.1	Low	125 Å²	125	106.9 Å²	106.9	55%	0.548	52%	0.516	S	S	.	.	H	α-helix	trans	-48.2	-35.9	-173	178.8	-98.5	0	0	0	114.8	S829 R830	F826-S829 WeakPolarHBondContact CA-OG 3.45Å; F826-S829 PolarHBondContact O-OG 3.3Å; F826-R830 HydrophobicContact CZ-CG 4.44Å; F826-R830 VanDerWaalsContact CZ-NE 3.29Å; F826-R830 PolarHBondContact O-N 2.97Å
827	I	72.3	Confident	61.5	Low	104 Å²	104	101.1 Å²	101.1	53%	0.533	48%	0.478	S	S	.	.	H	α-helix	trans	-68	-47.3	179.7	-59.7	172.2	0	0	0	110.8	Y752 P825 S829 W831	Y752-I827 HydrophobicContact CD1-CG2 4.38Å; Y752-I827 HydrophobicContact CE1-CB 4.22Å; Y752-I827 HydrophobicContact CE1-CG2 3.52Å; Y752-I827 WeakPolarHBondContact OH-CG2 3.43Å; P825-I827 PolarHBondContact O-N 2.92Å; I827-S829 VanDerWaalsContact C-N 3.34Å; I827-S829 PolarHBondContact O-N 3.5Å; I827-W831 WeakPolarHBondContact O-CB 3.4Å; I827-W831 PolarHBondContact O-N 3.13Å; I827-W831 VanDerWaalsContact O-N 3.08Å
828	L	73.9	Confident	64.3	Low	111 Å²	111	93 Å²	93	58%	0.581	44%	0.441	S	S	*	.	H	α-helix	trans	-72.6	-26.8	179.5	-92.8	129	0	0	0	112.6	P825 R832	P825-L828 HydrophobicContact CG-CB 4.27Å; P825-L828 HydrophobicContact CG-CD1 3.82Å; P825-L828 PolarHBondContact O-N 3.31Å; L828-R832 WeakPolarHBondContact O-CB 3.24Å; L828-R832 PolarHBondContact O-N 2.89Å
829	S	75.1	Confident	66.9	Low	31 Å²	31	87.6 Å²	87.6	22%	0.217	41%	0.406	C	S	.	.	H	α-helix	trans	-71.5	-49.6	173.3	61.1	0	0	0	0	111.3	P825 F826 I827 W831 R832 Q833	P825-S829 PolarHBondContact O-N 2.99Å; P825-S829 VanDerWaalsContact O-N 3.1Å; F826-S829 WeakPolarHBondContact CA-OG 3.45Å; F826-S829 PolarHBondContact O-OG 3.3Å; I827-S829 VanDerWaalsContact C-N 3.34Å; I827-S829 PolarHBondContact O-N 3.5Å; S829-W831 PolarHBondContact O-N 2.76Å; S829-R832 PolarHBondContact O-N 3.43Å; S829-R832 VanDerWaalsContact O-N 3.17Å; S829-Q833 VanDerWaalsContact O-CG 3.27Å; S829-Q833 WeakPolarHBondContact O-CG 3.49Å; S829-Q833 PolarHBondContact O-N 3.04Å
830	R	78.9	Confident	69.5	Low	37 Å²	37	78 Å²	78	14%	0.14	37%	0.368	C	S	.	.	H	α-helix	trans	-62.3	-43.1	178.8	-83.4	-159.8	174.2	178.4	2	112.8	Y752 F826 R832 Q833 F834	Y752-R830 HydrophobicContact CD1-CB 4.49Å; Y752-R830 PolarHBondContact O-NH1 2.87Å; F826-R830 HydrophobicContact CZ-CG 4.44Å; F826-R830 VanDerWaalsContact CZ-NE 3.29Å; F826-R830 PolarHBondContact O-N 2.97Å; R830-R832 VanDerWaalsContact C-N 3.29Å; R830-R832 PolarHBondContact O-N 3.39Å; R830-Q833 PolarHBondContact O-N 2.99Å; R830-F834 PolarHBondContact O-N 3.39Å
831	W	81.3	Confident	72.2	Confident	108 Å²	108	68.9 Å²	68.9	41%	0.409	34%	0.335	S	S	.	.	H	α-helix	trans	-58.6	-42.5	174.9	-173.3	-91.1	0	0	0	111.7	P748 Y752 I827 S829 W835	P748-W831 HydrophobicContact CB-CH2 3.65Å; P748-W831 HydrophobicContact CB-CZ3 3.51Å; P748-W831 HydrophobicContact CG-CH2 4.37Å; Y752-W831 HydrophobicContact CE2-CE3 4.32Å; Y752-W831 AromaticContact CZ-CE3 3.92Å; I827-W831 WeakPolarHBondContact O-CB 3.4Å; I827-W831 PolarHBondContact O-N 3.13Å; I827-W831 VanDerWaalsContact O-N 3.08Å; S829-W831 PolarHBondContact O-N 2.76Å; W831-W835 AromaticContact CD1-CD1 3.74Å; W831-W835 AromaticContact CD2-CD1 3.63Å; W831-W835 AromaticContact CD2-NE1 3.62Å; W831-W835 AromaticContact CE2-CD1 3.36Å; W831-W835 AromaticContact CE2-NE1 3.26Å; W831-W835 VanDerWaalsContact CE2-NE1 3.26Å; W831-W835 AromaticContact CE3-NE1 3.87Å; W831-W835 AromaticContact CG-CD1 3.89Å; W831-W835 AromaticContact CH2-NE1 3.55Å; W831-W835 AromaticContact CZ2-CD1 3.83Å; W831-W835 AromaticContact CZ2-NE1 3.22Å; W831-W835 AromaticContact CZ3-NE1 3.85Å; W831-W835 AromaticContact NE1-CD1 3.4Å; W831-W835 AromaticContact NE1-NE1 3.78Å; W831-W835 VanDerWaalsContact O-CD1 3.24Å; W831-W835 PolarHBondContact O-N 2.65Å; W831-W835 VanDerWaalsContact O-N 3.17Å
832	R	79.8	Confident	74.6	Confident	99 Å²	99	66.2 Å²	66.2	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-46.9	177.1	-165.8	-176	86.6	-166.7	5.7	111.5	L828 S829 R830 F834 W835 F836	L828-R832 WeakPolarHBondContact O-CB 3.24Å; L828-R832 PolarHBondContact O-N 2.89Å; S829-R832 PolarHBondContact O-N 3.43Å; S829-R832 VanDerWaalsContact O-N 3.17Å; R830-R832 VanDerWaalsContact C-N 3.29Å; R830-R832 PolarHBondContact O-N 3.39Å; R832-F834 VanDerWaalsContact C-N 3.3Å; R832-F834 PolarHBondContact O-N 2.97Å; R832-W835 PolarHBondContact O-N 3.45Å; R832-F836 HydrophobicContact CB-CD2 4.43Å; R832-F836 HydrophobicContact CG-CD2 3.43Å; R832-F836 VanDerWaalsContact CG-CD2 3.43Å; R832-F836 HydrophobicContact CG-CE2 3.6Å; R832-F836 HydrophobicContact CG-CG 4.06Å; R832-F836 HydrophobicContact CG-CZ 4.35Å; R832-F836 WeakPolarHBondContact O-CB 3.32Å; R832-F836 VanDerWaalsContact O-CD2 3.26Å; R832-F836 WeakPolarHBondContact O-CD2 3.43Å; R832-F836 PolarHBondContact O-N 2.78Å
833	Q	78.9	Confident	76.9	Confident	32 Å²	32	62.7 Å²	62.7	15%	0.15	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-42.7	-178.5	-73.6	170	-35	0	0	111.6	D731 F758 S829 R830	D731-Q833 HydrophobicContact CB-CB 4.12Å; D731-Q833 HydrophobicContact CB-CG 4.07Å; F758-Q833 HydrophobicContact CD1-CB 4.16Å; F758-Q833 HydrophobicContact CE1-CB 4.11Å; S829-Q833 VanDerWaalsContact O-CG 3.27Å; S829-Q833 WeakPolarHBondContact O-CG 3.49Å; S829-Q833 PolarHBondContact O-N 3.04Å; R830-Q833 PolarHBondContact O-N 2.99Å
834	F	84.6	Confident	78.9	Confident	1 Å²	1	53.3 Å²	53.3	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-68.4	-52	177.7	-177.3	-99.8	0	0	0	113	M732 L741 T744 I756 F758 R830 R832 F836 A837 T840	M732-F834 HydrophobicContact CE-CD2 4.31Å; M732-F834 HydrophobicContact CE-CE2 4.4Å; M732-F834 HydrophobicContact SD-CD2 3.91Å; M732-F834 HydrophobicContact SD-CE2 4.38Å; L741-F834 HydrophobicContact CD2-CE2 4.16Å; T744-F834 WeakPolarHBondContact OG1-CE2 3.25Å; T744-F834 WeakPolarHBondContact OG1-CZ 3.36Å; I756-F834 HydrophobicContact CD1-CD2 3.91Å; I756-F834 HydrophobicContact CD1-CE2 3.59Å; F758-F834 HydrophobicContact CE1-CB 4.35Å; F758-F834 HydrophobicContact CZ-CB 4.29Å; R830-F834 PolarHBondContact O-N 3.39Å; R832-F834 VanDerWaalsContact C-N 3.3Å; R832-F834 PolarHBondContact O-N 2.97Å; F834-F836 VanDerWaalsContact C-N 3.35Å; F834-F836 PolarHBondContact O-N 2.89Å; F834-A837 WeakPolarHBondContact O-CB 3.26Å; F834-A837 PolarHBondContact O-N 3.44Å; F834-T840 HydrophobicContact CD1-CG2 4.38Å; F834-T840 HydrophobicContact CD2-CG2 4.03Å; F834-T840 HydrophobicContact CE1-CG2 4.09Å; F834-T840 HydrophobicContact CE2-CG2 3.71Å; F834-T840 HydrophobicContact CG-CG2 4.36Å; F834-T840 HydrophobicContact CZ-CG2 3.75Å; F834-T840 WeakPolarHBondContact O-CB 3.45Å; F834-T840 WeakPolarHBondContact O-CG2 3.35Å; F834-T840 PolarHBondContact O-OG1 2.85Å
835	W	81.1	Confident	80.5	Confident	52 Å²	52	48.2 Å²	48.2	20%	0.197	23%	0.231	C	C	.	.	H	α-helix	trans	-77.6	-17.3	-174.7	-72.1	107.7	0	0	0	114.1	F745 W831 R832 S1120	F745-W835 AromaticContact CD2-CH2 3.85Å; F745-W835 HydrophobicContact CD2-CH2 3.85Å; F745-W835 AromaticContact CD2-CZ3 3.91Å; F745-W835 HydrophobicContact CD2-CZ3 3.91Å; F745-W835 AromaticContact CE2-CH2 3.81Å; F745-W835 HydrophobicContact CE2-CH2 3.81Å; F745-W835 AromaticContact CE2-CZ3 3.63Å; F745-W835 HydrophobicContact CE2-CZ3 3.63Å; W831-W835 AromaticContact CD1-CD1 3.74Å; W831-W835 AromaticContact CD2-CD1 3.63Å; W831-W835 AromaticContact CD2-NE1 3.62Å; W831-W835 AromaticContact CE2-CD1 3.36Å; W831-W835 AromaticContact CE2-NE1 3.26Å; W831-W835 VanDerWaalsContact CE2-NE1 3.26Å; W831-W835 AromaticContact CE3-NE1 3.87Å; W831-W835 AromaticContact CG-CD1 3.89Å; W831-W835 AromaticContact CH2-NE1 3.55Å; W831-W835 AromaticContact CZ2-CD1 3.83Å; W831-W835 AromaticContact CZ2-NE1 3.22Å; W831-W835 AromaticContact CZ3-NE1 3.85Å; W831-W835 AromaticContact NE1-CD1 3.4Å; W831-W835 AromaticContact NE1-NE1 3.78Å; W831-W835 VanDerWaalsContact O-CD1 3.24Å; W831-W835 PolarHBondContact O-N 2.65Å; W831-W835 VanDerWaalsContact O-N 3.17Å; R832-W835 PolarHBondContact O-N 3.45Å; W835-S1120 WeakPolarHBondContact O-CB 3.31Å
836	F	78.8	Confident	81.4	Confident	109 Å²	109	45.1 Å²	45.1	48%	0.478	21%	0.21	S	C	.	.	H	α-helix	trans	-87.9	-10.8	174.7	-83.4	-111.3	0	0	0	113.3	R832 F834	R832-F836 HydrophobicContact CB-CD2 4.43Å; R832-F836 HydrophobicContact CG-CD2 3.43Å; R832-F836 VanDerWaalsContact CG-CD2 3.43Å; R832-F836 HydrophobicContact CG-CE2 3.6Å; R832-F836 HydrophobicContact CG-CG 4.06Å; R832-F836 HydrophobicContact CG-CZ 4.35Å; R832-F836 WeakPolarHBondContact O-CB 3.32Å; R832-F836 VanDerWaalsContact O-CD2 3.26Å; R832-F836 WeakPolarHBondContact O-CD2 3.43Å; R832-F836 PolarHBondContact O-N 2.78Å; F834-F836 VanDerWaalsContact C-N 3.35Å; F834-F836 PolarHBondContact O-N 2.89Å
837	A	82.1	Confident	82.3	Confident	2 Å²	2	41 Å²	41	2%	0.017	19%	0.194	C	C	.	.	S	Bend	trans	-64.4	135	175.7	0	0	0	0	0	110.8	M732 F834 V839 T840 A841	M732-A837 HydrophobicContact SD-CB 4.16Å; F834-A837 WeakPolarHBondContact O-CB 3.26Å; F834-A837 PolarHBondContact O-N 3.44Å; A837-V839 VanDerWaalsContact C-N 3.29Å; A837-V839 HydrophobicContact CB-CG1 4.19Å; A837-V839 PolarHBondContact O-N 3.03Å; A837-T840 HydrophobicContact CB-CG2 4.4Å; A837-T840 PolarHBondContact O-N 2.9Å; A837-T840 PolarHBondContact O-OG1 2.93Å; A837-A841 PolarHBondContact O-N 3.43Å
838	P	85.8	Confident	83.1	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.039	18%	0.175	C	C	.	.	H	α-helix	trans	-60.7	-37	179.7	-27	35.8	0	0	0	113.6	I727 W728 T840 A841 F842 H1116	I727-P838 WeakPolarHBondContact O-CG 3.3Å; W728-P838 HydrophobicContact CE3-CB 4Å; W728-P838 HydrophobicContact CZ3-CB 4.25Å; W728-P838 WeakPolarHBondContact O-CD 3.35Å; P838-T840 VanDerWaalsContact C-N 3.32Å; P838-T840 PolarHBondContact O-N 3.03Å; P838-A841 PolarHBondContact O-N 2.73Å; P838-F842 WeakPolarHBondContact O-CB 3.35Å; P838-F842 PolarHBondContact O-N 3.41Å; P838-H1116 HydrophobicContact CG-CB 4.22Å
839	V	86.4	Confident	83.9	Confident	12 Å²	12	33.1 Å²	33.1	7%	0.073	15%	0.152	C	C	.	.	H	α-helix	trans	-60.3	-38	178.6	65.2	0	0	0	0	113.1	W728 W729 L741 A837 L843	W728-V839 HydrophobicContact CD2-CB 4.48Å; W728-V839 HydrophobicContact CZ2-CB 4.27Å; W728-V839 HydrophobicContact CZ2-CG2 4.27Å; W728-V839 PolarHBondContact O-N 3.49Å; W728-V839 VanDerWaalsContact O-N 3.13Å; W729-V839 HydrophobicContact CE3-CG1 3.88Å; W729-V839 HydrophobicContact CE3-CG2 4.47Å; W729-V839 HydrophobicContact CZ3-CG1 4.25Å; W729-V839 HydrophobicContact CZ3-CG2 4.28Å; L741-V839 HydrophobicContact CD1-CG2 3.91Å; A837-V839 VanDerWaalsContact C-N 3.29Å; A837-V839 HydrophobicContact CB-CG1 4.19Å; A837-V839 PolarHBondContact O-N 3.03Å; V839-L843 WeakPolarHBondContact O-CB 3.13Å; V839-L843 PolarHBondContact O-N 3.28Å
840	T	85.3	Confident	84.7	Confident	2 Å²	2	35.6 Å²	35.6	1%	0.012	16%	0.159	C	C	.	.	H	α-helix	trans	-75.6	-37.4	179.7	58.4	0	0	0	0	111	M732 L741 F834 A837 P838 L843 G844	M732-T840 HydrophobicContact SD-CG2 4.27Å; L741-T840 HydrophobicContact CD2-CG2 4.26Å; F834-T840 HydrophobicContact CD1-CG2 4.38Å; F834-T840 HydrophobicContact CD2-CG2 4.03Å; F834-T840 HydrophobicContact CE1-CG2 4.09Å; F834-T840 HydrophobicContact CE2-CG2 3.71Å; F834-T840 HydrophobicContact CG-CG2 4.36Å; F834-T840 HydrophobicContact CZ-CG2 3.75Å; F834-T840 WeakPolarHBondContact O-CB 3.45Å; F834-T840 WeakPolarHBondContact O-CG2 3.35Å; F834-T840 PolarHBondContact O-OG1 2.85Å; A837-T840 HydrophobicContact CB-CG2 4.4Å; A837-T840 PolarHBondContact O-N 2.9Å; A837-T840 PolarHBondContact O-OG1 2.93Å; P838-T840 VanDerWaalsContact C-N 3.32Å; P838-T840 PolarHBondContact O-N 3.03Å; T840-L843 PolarHBondContact O-N 3.44Å; T840-G844 PolarHBondContact O-N 2.74Å
841	A	83.6	Confident	85.3	Confident	7 Å²	7	38 Å²	38	6%	0.058	17%	0.173	C	C	.	.	H	α-helix	trans	-62.3	-43	171.7	0	0	0	0	0	111.9	A837 P838 G844 N845	A837-A841 PolarHBondContact O-N 3.43Å; P838-A841 PolarHBondContact O-N 2.73Å; A841-G844 PolarHBondContact O-N 2.79Å; A841-N845 WeakPolarHBondContact O-CB 2.85Å; A841-N845 VanDerWaalsContact O-CG 3.31Å; A841-N845 PolarHBondContact O-N 3.31Å; A841-N845 PolarHBondContact O-ND2 3.29Å
842	F	87.1	Confident	85.8	Confident	30 Å²	30	32.8 Å²	32.8	13%	0.132	15%	0.154	C	C	.	.	H	α-helix	trans	-60.3	-51.3	174.7	171.8	-99.6	0	0	0	111.6	W728 P838 G844 N845 V846 I959 I962 Y1115	W728-F842 HydrophobicContact CH2-CB 3.41Å; W728-F842 VanDerWaalsContact CH2-CB 3.41Å; W728-F842 HydrophobicContact CH2-CD1 4.07Å; W728-F842 AromaticContact CH2-CD2 3.96Å; W728-F842 HydrophobicContact CH2-CD2 3.96Å; W728-F842 AromaticContact CH2-CG 3.54Å; W728-F842 HydrophobicContact CH2-CG 3.54Å; W728-F842 HydrophobicContact CZ2-CB 3.84Å; W728-F842 AromaticContact CZ2-CD1 3.89Å; W728-F842 HydrophobicContact CZ2-CD1 3.89Å; W728-F842 AromaticContact CZ2-CG 3.85Å; W728-F842 HydrophobicContact CZ2-CG 3.85Å; W728-F842 HydrophobicContact CZ3-CB 4.41Å; P838-F842 WeakPolarHBondContact O-CB 3.35Å; P838-F842 PolarHBondContact O-N 3.41Å; F842-G844 VanDerWaalsContact C-N 3.29Å; F842-G844 PolarHBondContact O-N 2.79Å; F842-N845 WeakPolarHBondContact O-CB 3.37Å; F842-N845 PolarHBondContact O-N 3.09Å; F842-N845 VanDerWaalsContact O-N 3.13Å; F842-V846 HydrophobicContact CD1-CG2 4.19Å; F842-V846 HydrophobicContact CD2-CG2 4.22Å; F842-V846 HydrophobicContact CE1-CG2 3.75Å; F842-V846 HydrophobicContact CE2-CG2 3.79Å; F842-V846 HydrophobicContact CG-CG2 4.4Å; F842-V846 HydrophobicContact CZ-CG2 3.52Å; F842-V846 VanDerWaalsContact O-CG2 3.28Å; F842-V846 WeakPolarHBondContact O-CG2 3.3Å; F842-V846 PolarHBondContact O-N 3.12Å; F842-I959 HydrophobicContact CE2-CG2 3.85Å; F842-I959 HydrophobicContact CZ-CG2 3.99Å; F842-I962 HydrophobicContact CE1-CG2 4.1Å; F842-I962 HydrophobicContact CE2-CG2 3.68Å; F842-I962 HydrophobicContact CZ-CG2 3.41Å; F842-I962 VanDerWaalsContact CZ-CG2 3.41Å; F842-Y1115 HydrophobicContact CB-CD1 4.45Å; F842-Y1115 HydrophobicContact CD2-CD1 4.16Å; F842-Y1115 HydrophobicContact CD2-CD2 4.31Å; F842-Y1115 AromaticContact CD2-CE1 3.77Å; F842-Y1115 HydrophobicContact CD2-CE1 3.77Å; F842-Y1115 AromaticContact CD2-CE2 3.97Å; F842-Y1115 HydrophobicContact CD2-CE2 3.97Å; F842-Y1115 HydrophobicContact CD2-CG 4.43Å; F842-Y1115 AromaticContact CD2-CZ 3.68Å; F842-Y1115 HydrophobicContact CE2-CE2 4.26Å
843	L	86.1	Confident	86.4	Confident	26 Å²	26	28.7 Å²	28.7	14%	0.136	14%	0.139	C	C	.	.	H	α-helix	trans	-59.3	-41.8	179.6	-171.8	64.9	0	0	0	111.8	L741 L742 V839 T840 V846 L847	L741-L843 HydrophobicContact CB-CD2 4.11Å; L742-L843 HydrophobicContact CD2-CD1 3.8Å; L742-L843 HydrophobicContact CD2-CD2 3.88Å; L742-L843 HydrophobicContact CD2-CG 4.1Å; L742-L843 HydrophobicContact CG-CD1 4.25Å; L742-L843 HydrophobicContact CG-CD2 3.98Å; V839-L843 WeakPolarHBondContact O-CB 3.13Å; V839-L843 PolarHBondContact O-N 3.28Å; T840-L843 PolarHBondContact O-N 3.44Å; L843-V846 PolarHBondContact O-N 3.05Å; L843-L847 WeakPolarHBondContact O-CB 3.45Å; L843-L847 PolarHBondContact O-N 3.14Å
844	G	85.3	Confident	87.1	Confident	4 Å²	4	32.9 Å²	32.9	4%	0.041	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-44.6	174.4	0	0	0	0	0	112.5	T840 A841 F842 L847 M848	T840-G844 PolarHBondContact O-N 2.74Å; A841-G844 PolarHBondContact O-N 2.79Å; F842-G844 VanDerWaalsContact C-N 3.29Å; F842-G844 PolarHBondContact O-N 2.79Å; G844-L847 PolarHBondContact O-N 2.81Å; G844-M848 WeakPolarHBondContact O-CB 3.46Å; G844-M848 WeakPolarHBondContact O-CG 3.3Å; G844-M848 PolarHBondContact O-N 2.98Å
845	N	86.6	Confident	87.5	Confident	30 Å²	30	34.2 Å²	34.2	16%	0.16	17%	0.168	C	C	.	.	H	α-helix	trans	-62.1	-44.6	175.8	-75.2	-21.5	0	0	0	112	A841 F842 M848 Y849 A1122	A841-N845 WeakPolarHBondContact O-CB 2.85Å; A841-N845 VanDerWaalsContact O-CG 3.31Å; A841-N845 PolarHBondContact O-N 3.31Å; A841-N845 PolarHBondContact O-ND2 3.29Å; F842-N845 WeakPolarHBondContact O-CB 3.37Å; F842-N845 PolarHBondContact O-N 3.09Å; F842-N845 VanDerWaalsContact O-N 3.13Å; N845-M848 PolarHBondContact O-N 2.71Å; N845-Y849 WeakPolarHBondContact O-CB 3.37Å; N845-Y849 PolarHBondContact O-N 2.91Å; N845-A1122 VanDerWaalsContact OD1-CA 3.26Å; N845-A1122 WeakPolarHBondContact OD1-CA 3.36Å; N845-A1122 VanDerWaalsContact OD1-CB 3.23Å; N845-A1122 WeakPolarHBondContact OD1-CB 3.35Å
846	V	88.1	Confident	88.1	Confident	19 Å²	19	32 Å²	32	12%	0.115	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-49.6	178	176.4	0	0	0	0	110.8	F842 L843 M848 Y849 F850 I959	F842-V846 HydrophobicContact CD1-CG2 4.19Å; F842-V846 HydrophobicContact CD2-CG2 4.22Å; F842-V846 HydrophobicContact CE1-CG2 3.75Å; F842-V846 HydrophobicContact CE2-CG2 3.79Å; F842-V846 HydrophobicContact CG-CG2 4.4Å; F842-V846 HydrophobicContact CZ-CG2 3.52Å; F842-V846 VanDerWaalsContact O-CG2 3.28Å; F842-V846 WeakPolarHBondContact O-CG2 3.3Å; F842-V846 PolarHBondContact O-N 3.12Å; L843-V846 PolarHBondContact O-N 3.05Å; V846-M848 PolarHBondContact O-N 3.44Å; V846-Y849 PolarHBondContact O-N 2.87Å; V846-F850 HydrophobicContact CG1-CD2 3.83Å; V846-F850 HydrophobicContact CG1-CE2 3.7Å; V846-F850 VanDerWaalsContact O-CD2 3.29Å; V846-F850 WeakPolarHBondContact O-CD2 3.38Å; V846-F850 PolarHBondContact O-N 3.36Å; V846-I959 HydrophobicContact CG2-CG2 3.45Å; V846-I959 VanDerWaalsContact CG2-CG2 3.45Å
847	L	87.6	Confident	88.8	Confident	40 Å²	40	28 Å²	28	21%	0.209	15%	0.147	C	C	.	.	H	α-helix	trans	-61.9	-46.3	-178.8	-177	149.9	0	0	0	111.6	F745 F746 L843 G844 Y849 F850 L851	F745-L847 HydrophobicContact CD1-CD1 4.13Å; F745-L847 HydrophobicContact CE1-CD1 3.92Å; F745-L847 HydrophobicContact CE1-CD2 4.18Å; F746-L847 HydrophobicContact CE1-CD1 3.91Å; F746-L847 HydrophobicContact CE2-CD1 4.1Å; F746-L847 HydrophobicContact CZ-CD1 3.41Å; F746-L847 VanDerWaalsContact CZ-CD1 3.41Å; L843-L847 WeakPolarHBondContact O-CB 3.45Å; L843-L847 PolarHBondContact O-N 3.14Å; G844-L847 PolarHBondContact O-N 2.81Å; L847-Y849 VanDerWaalsContact C-N 3.3Å; L847-Y849 PolarHBondContact O-N 3.24Å; L847-F850 PolarHBondContact O-N 3.21Å; L847-L851 PolarHBondContact O-N 2.71Å; L847-L851 VanDerWaalsContact O-N 3.09Å
848	M	88.8	Confident	89.3	Confident	29 Å²	29	32 Å²	32	14%	0.143	17%	0.165	C	C	.	.	H	α-helix	trans	-66.4	-33	178.2	-68.6	-58.4	-76.1	0	0	112	G844 N845 V846 L851 F852 W882 A1122 P1123 F1125	G844-M848 WeakPolarHBondContact O-CB 3.46Å; G844-M848 WeakPolarHBondContact O-CG 3.3Å; G844-M848 PolarHBondContact O-N 2.98Å; N845-M848 PolarHBondContact O-N 2.71Å; V846-M848 PolarHBondContact O-N 3.44Å; M848-L851 PolarHBondContact O-N 2.98Å; M848-F852 PolarHBondContact O-N 3.15Å; M848-W882 HydrophobicContact CB-CZ2 4.16Å; M848-W882 HydrophobicContact CE-CH2 3.4Å; M848-W882 VanDerWaalsContact CE-CH2 3.4Å; M848-W882 HydrophobicContact CE-CZ2 3.73Å; M848-W882 HydrophobicContact CE-CZ3 4.4Å; M848-W882 WeakPolarHBondContact O-CZ2 3.36Å; M848-A1122 HydrophobicContact CB-CB 4.08Å; M848-A1122 HydrophobicContact CG-CB 3.71Å; M848-P1123 WeakPolarHBondContact CB-O 3.35Å; M848-P1123 VanDerWaalsContact CE-O 3.26Å; M848-P1123 WeakPolarHBondContact CE-O 3.35Å; M848-F1125 HydrophobicContact CE-CE2 4.22Å
849	Y	90.4	Very high	89.5	Confident	20 Å²	20	32.2 Å²	32.2	8%	0.078	17%	0.165	C	C	.	.	H	α-helix	trans	-68.2	-39.8	175.2	-166.3	-98	0	0	0	112.7	N845 V846 L847 L851 F852 L853 F952 R955 L956 I959	N845-Y849 WeakPolarHBondContact O-CB 3.37Å; N845-Y849 PolarHBondContact O-N 2.91Å; V846-Y849 PolarHBondContact O-N 2.87Å; L847-Y849 VanDerWaalsContact C-N 3.3Å; L847-Y849 PolarHBondContact O-N 3.24Å; Y849-L851 VanDerWaalsContact C-N 3.31Å; Y849-L851 PolarHBondContact O-N 3.16Å; Y849-F852 HydrophobicContact CD2-CD1 4.15Å; Y849-F852 AromaticContact CE2-CD1 3.96Å; Y849-F852 HydrophobicContact CE2-CD1 3.96Å; Y849-F852 HydrophobicContact CE2-CE1 4.18Å; Y849-F852 WeakPolarHBondContact O-CB 3.26Å; Y849-F852 PolarHBondContact O-N 3.12Å; Y849-L853 HydrophobicContact CD1-CD1 4.05Å; Y849-L853 HydrophobicContact CD1-CG 4.3Å; Y849-L853 HydrophobicContact CE1-CD1 3.77Å; Y849-L853 HydrophobicContact CE1-CD2 4.33Å; Y849-L853 HydrophobicContact CE1-CG 4.03Å; Y849-L853 PolarHBondContact O-N 3.49Å; Y849-F952 PolarHBondContact OH-O 3.26Å; Y849-R955 WeakPolarHBondContact OH-CB 3.36Å; Y849-L956 HydrophobicContact CD1-CD2 3.51Å; Y849-L956 HydrophobicContact CD1-CG 4.32Å; Y849-L956 HydrophobicContact CE1-CD2 3.69Å; Y849-L956 HydrophobicContact CE1-CG 4Å; Y849-I959 HydrophobicContact CD1-CD1 3.92Å; Y849-I959 HydrophobicContact CE1-CD1 4.29Å; Y849-I959 HydrophobicContact CG-CD1 4.11Å
850	F	91.6	Very high	89.6	Confident	83 Å²	83	32.6 Å²	32.6	36%	0.364	17%	0.167	S	C	.	.	H	α-helix	trans	-61.4	-41	171.3	-86.7	-71.3	0	0	0	112	V846 L847 F852 L853 I854 L956 F960	V846-F850 HydrophobicContact CG1-CD2 3.83Å; V846-F850 HydrophobicContact CG1-CE2 3.7Å; V846-F850 VanDerWaalsContact O-CD2 3.29Å; V846-F850 WeakPolarHBondContact O-CD2 3.38Å; V846-F850 PolarHBondContact O-N 3.36Å; L847-F850 PolarHBondContact O-N 3.21Å; F850-F852 VanDerWaalsContact C-N 3.33Å; F850-L853 PolarHBondContact O-N 3.31Å; F850-I854 WeakPolarHBondContact O-CG1 3.49Å; F850-I854 PolarHBondContact O-N 3.41Å; F850-L956 HydrophobicContact CE1-CD1 4.05Å; F850-L956 HydrophobicContact CE1-CD2 4.26Å; F850-L956 HydrophobicContact CE2-CD2 4.27Å; F850-L956 HydrophobicContact CZ-CD1 4.3Å; F850-L956 HydrophobicContact CZ-CD2 3.99Å; F850-F960 HydrophobicContact CE2-CZ 4.08Å; F850-F960 HydrophobicContact CZ-CE2 4.34Å; F850-F960 AromaticContact CZ-CZ 3.85Å; F850-F960 HydrophobicContact CZ-CZ 3.85Å
851	L	91.8	Very high	89.8	Confident	86 Å²	86	38.8 Å²	38.8	45%	0.45	20%	0.199	S	C	.	.	H	α-helix	trans	-64.4	-39.9	176.7	-148.2	158.3	0	0	0	111.2	L847 M848 Y849 I854 L855 W882	L847-L851 PolarHBondContact O-N 2.71Å; L847-L851 VanDerWaalsContact O-N 3.09Å; M848-L851 PolarHBondContact O-N 2.98Å; Y849-L851 VanDerWaalsContact C-N 3.31Å; Y849-L851 PolarHBondContact O-N 3.16Å; L851-I854 PolarHBondContact O-N 2.99Å; L851-L855 WeakPolarHBondContact O-CB 3.37Å; L851-L855 PolarHBondContact O-N 3.02Å; L851-W882 HydrophobicContact CD2-CH2 4.46Å
852	F	92.9	Very high	89.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.9	-46.7	170.9	162	-104.1	0	0	0	112.5	M848 Y849 F850 I854 L855 Y856 L879 W882 V883 I886 F952	M848-F852 PolarHBondContact O-N 3.15Å; Y849-F852 HydrophobicContact CD2-CD1 4.15Å; Y849-F852 AromaticContact CE2-CD1 3.96Å; Y849-F852 HydrophobicContact CE2-CD1 3.96Å; Y849-F852 HydrophobicContact CE2-CE1 4.18Å; Y849-F852 WeakPolarHBondContact O-CB 3.26Å; Y849-F852 PolarHBondContact O-N 3.12Å; F850-F852 VanDerWaalsContact C-N 3.33Å; F852-I854 PolarHBondContact O-N 3.44Å; F852-L855 PolarHBondContact O-N 2.98Å; F852-Y856 HydrophobicContact CE2-CD2 4.13Å; F852-Y856 AromaticContact CZ-CD2 3.85Å; F852-Y856 HydrophobicContact CZ-CD2 3.85Å; F852-Y856 WeakPolarHBondContact O-CB 3.5Å; F852-Y856 PolarHBondContact O-N 3.1Å; F852-L879 HydrophobicContact CD2-CD1 3.99Å; F852-L879 HydrophobicContact CE2-CD1 3.62Å; F852-W882 HydrophobicContact CB-CD2 4.43Å; F852-W882 HydrophobicContact CB-CZ2 4.12Å; F852-W882 HydrophobicContact CD2-CB 4.22Å; F852-W882 AromaticContact CD2-CD1 3.59Å; F852-W882 HydrophobicContact CD2-CD2 4.43Å; F852-W882 AromaticContact CD2-CG 3.84Å; F852-W882 HydrophobicContact CD2-CG 3.84Å; F852-V883 HydrophobicContact CE2-CG2 3.77Å; F852-V883 HydrophobicContact CZ-CG2 4.09Å; F852-I886 HydrophobicContact CE1-CD1 4.43Å; F852-I886 HydrophobicContact CE2-CD1 4.47Å; F852-I886 HydrophobicContact CZ-CD1 4.33Å; F852-F952 HydrophobicContact CE1-CB 4.38Å; F852-F952 AromaticContact CE1-CD1 3.93Å; F852-F952 HydrophobicContact CE1-CD1 3.93Å; F852-F952 HydrophobicContact CE1-CE1 4.42Å; F852-F952 HydrophobicContact CE1-CG 4.13Å; F852-F952 HydrophobicContact CZ-CD1 4.19Å; F852-F952 HydrophobicContact CZ-CE1 4.32Å; F852-F952 HydrophobicContact CZ-CG 4.32Å
853	L	92.8	Very high	89.6	Confident	12 Å²	12	44.8 Å²	44.8	6%	0.063	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-39.3	178.3	-69.8	176.3	0	0	0	112.5	Y849 F850 Y856 A857 F949 F952 T953 L956	Y849-L853 HydrophobicContact CD1-CD1 4.05Å; Y849-L853 HydrophobicContact CD1-CG 4.3Å; Y849-L853 HydrophobicContact CE1-CD1 3.77Å; Y849-L853 HydrophobicContact CE1-CD2 4.33Å; Y849-L853 HydrophobicContact CE1-CG 4.03Å; Y849-L853 PolarHBondContact O-N 3.49Å; F850-L853 PolarHBondContact O-N 3.31Å; L853-Y856 PolarHBondContact O-N 3.41Å; L853-A857 WeakPolarHBondContact O-CB 3.49Å; L853-A857 PolarHBondContact O-N 3.25Å; L853-F949 HydrophobicContact CB-CE2 4.44Å; L853-F949 HydrophobicContact CD2-CD2 4.46Å; L853-F949 HydrophobicContact CD2-CE2 4.05Å; L853-F952 HydrophobicContact CD2-CB 4.13Å; L853-T953 HydrophobicContact CD1-CG2 4.24Å; L853-T953 HydrophobicContact CD2-CG2 3.9Å; L853-L956 HydrophobicContact CD1-CD1 3.65Å; L853-L956 HydrophobicContact CD1-CD2 4.14Å; L853-L956 HydrophobicContact CD1-CG 3.94Å
854	I	93.4	Very high	89.3	Confident	120 Å²	120	44.9 Å²	44.9	62%	0.615	23%	0.23	S	C	*	.	H	α-helix	trans	-63.3	-44.9	175.3	-68.4	166	0	0	0	110.1	F850 L851 F852 A857 F858	F850-I854 WeakPolarHBondContact O-CG1 3.49Å; F850-I854 PolarHBondContact O-N 3.41Å; L851-I854 PolarHBondContact O-N 2.99Å; F852-I854 PolarHBondContact O-N 3.44Å; I854-A857 PolarHBondContact O-N 2.93Å; I854-F858 VanDerWaalsContact O-CB 3.31Å; I854-F858 WeakPolarHBondContact O-CB 3.29Å; I854-F858 PolarHBondContact O-N 2.87Å
855	L	92.2	Very high	88.8	Confident	30 Å²	30	50.7 Å²	50.7	16%	0.157	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-44.6	175.5	179.6	75.2	0	0	0	111.5	L851 F852 A857 F858 V859 L878 L879	L851-L855 WeakPolarHBondContact O-CB 3.37Å; L851-L855 PolarHBondContact O-N 3.02Å; F852-L855 PolarHBondContact O-N 2.98Å; L855-A857 PolarHBondContact O-N 2.94Å; L855-F858 WeakPolarHBondContact O-CB 3.49Å; L855-F858 PolarHBondContact O-N 2.96Å; L855-V859 WeakPolarHBondContact O-CG2 3.3Å; L855-V859 PolarHBondContact O-N 3.33Å; L855-L878 HydrophobicContact CD1-CD2 4.43Å; L855-L878 HydrophobicContact CD2-CD2 3.24Å; L855-L878 HydrophobicContact CG-CD2 4.45Å; L855-L879 HydrophobicContact CD2-CB 4.33Å; L855-L879 HydrophobicContact CD2-CD1 4.24Å
856	Y	92.9	Very high	88	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-48.3	177.8	-163.9	-60.3	0	0	0	110.4	F852 L853 F858 V859 L860 L879 F925 L945 D948 F949 F952	F852-Y856 HydrophobicContact CE2-CD2 4.13Å; F852-Y856 AromaticContact CZ-CD2 3.85Å; F852-Y856 HydrophobicContact CZ-CD2 3.85Å; F852-Y856 WeakPolarHBondContact O-CB 3.5Å; F852-Y856 PolarHBondContact O-N 3.1Å; L853-Y856 PolarHBondContact O-N 3.41Å; Y856-F858 VanDerWaalsContact C-N 3.34Å; Y856-F858 PolarHBondContact O-N 3.27Å; Y856-V859 PolarHBondContact O-N 2.98Å; Y856-L860 HydrophobicContact CE1-CD1 4.44Å; Y856-L860 WeakPolarHBondContact O-CB 3.39Å; Y856-L860 PolarHBondContact O-N 3.12Å; Y856-L879 HydrophobicContact CD2-CD1 3.75Å; Y856-L879 HydrophobicContact CD2-CD2 4.02Å; Y856-L879 HydrophobicContact CD2-CG 4.36Å; Y856-L879 HydrophobicContact CE2-CD2 4.32Å; Y856-L879 HydrophobicContact CG-CD1 4.14Å; Y856-L879 HydrophobicContact CG-CD2 4.25Å; Y856-F925 HydrophobicContact CE2-CD2 4.01Å; Y856-F925 AromaticContact CE2-CE2 3.87Å; Y856-F925 HydrophobicContact CE2-CE2 3.87Å; Y856-L945 WeakPolarHBondContact OH-CD2 3.24Å; Y856-L945 PolarHBondContact OH-O 2.98Å; Y856-D948 PolarHBondContact OH-OD2 3.16Å; Y856-D948 VanDerWaalsContact OH-OD2 3.05Å; Y856-F949 HydrophobicContact CD1-CB 3.92Å; Y856-F949 AromaticContact CD1-CD2 3.41Å; Y856-F949 HydrophobicContact CD1-CD2 3.41Å; Y856-F949 VanDerWaalsContact CD1-CD2 3.41Å; Y856-F949 HydrophobicContact CD1-CE2 4.29Å; Y856-F949 AromaticContact CD1-CG 3.99Å; Y856-F949 HydrophobicContact CD1-CG 3.99Å; Y856-F949 HydrophobicContact CE1-CB 3.59Å; Y856-F949 HydrophobicContact CE1-CD2 4.02Å; Y856-F949 HydrophobicContact CE1-CG 4.19Å; Y856-F949 AromaticContact CG-CD2 3.84Å; Y856-F949 HydrophobicContact CG-CD2 3.84Å; Y856-F952 HydrophobicContact CE2-CD2 4.28Å
857	A	93.6	Very high	86.9	Confident	25 Å²	25	57.1 Å²	57.1	21%	0.207	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-41.1	177.4	0	0	0	0	0	112	L853 I854 L855 L860 L861 F949	L853-A857 WeakPolarHBondContact O-CB 3.49Å; L853-A857 PolarHBondContact O-N 3.25Å; I854-A857 PolarHBondContact O-N 2.93Å; L855-A857 PolarHBondContact O-N 2.94Å; A857-L860 PolarHBondContact O-N 3.11Å; A857-L861 WeakPolarHBondContact O-CB 3.43Å; A857-L861 WeakPolarHBondContact O-CG 3.34Å; A857-L861 PolarHBondContact O-N 3.23Å; A857-F949 HydrophobicContact CB-CE2 4.14Å; A857-F949 HydrophobicContact CB-CZ 4.01Å
858	F	92.3	Very high	85.7	Confident	88 Å²	88	58.8 Å²	58.8	39%	0.386	29%	0.294	S	S	.	.	H	α-helix	trans	-59.4	-47.6	175.2	176.4	-93.4	0	0	0	111.6	I854 L855 Y856 L862 D863	I854-F858 VanDerWaalsContact O-CB 3.31Å; I854-F858 WeakPolarHBondContact O-CB 3.29Å; I854-F858 PolarHBondContact O-N 2.87Å; L855-F858 WeakPolarHBondContact O-CB 3.49Å; L855-F858 PolarHBondContact O-N 2.96Å; Y856-F858 VanDerWaalsContact C-N 3.34Å; Y856-F858 PolarHBondContact O-N 3.27Å; F858-L862 HydrophobicContact CD2-CD1 3.62Å; F858-L862 HydrophobicContact CE2-CB 4.38Å; F858-L862 HydrophobicContact CE2-CD1 3.51Å; F858-L862 HydrophobicContact CZ-CD1 4.47Å; F858-L862 WeakPolarHBondContact O-CB 3.45Å; F858-L862 PolarHBondContact O-N 3.46Å; F858-D863 HydrophobicContact CE1-CB 4.41Å; F858-D863 VanDerWaalsContact CE1-OD2 3.28Å; F858-D863 WeakPolarHBondContact CE1-OD2 3.45Å; F858-D863 PolarHBondContact O-N 3.25Å
859	V	89.9	Confident	84	Confident	9 Å²	9	63.7 Å²	63.7	6%	0.055	33%	0.328	C	S	.	.	I	π-helix	trans	-61.8	-45.3	177.1	170.7	0	0	0	0	111.1	L855 Y856 D863 F864 E876 L879	L855-V859 WeakPolarHBondContact O-CG2 3.3Å; L855-V859 PolarHBondContact O-N 3.33Å; Y856-V859 PolarHBondContact O-N 2.98Å; V859-D863 CarbonylContact O-C 3.52Å; V859-D863 PolarHBondContact O-N 3.47Å; V859-F864 PolarHBondContact O-N 3.21Å; V859-E876 HydrophobicContact CG1-CG 3.75Å; V859-L879 HydrophobicContact CB-CD2 4.19Å; V859-L879 HydrophobicContact CG1-CD2 4.06Å; V859-L879 HydrophobicContact CG2-CD2 4.35Å
860	L	89.6	Confident	82.3	Confident	20 Å²	20	67.4 Å²	67.4	11%	0.105	36%	0.357	C	S	.	.	I	π-helix	trans	-68	-36.7	-177.2	-167.1	81.3	0	0	0	113.4	Y856 A857 L945 C946	Y856-L860 HydrophobicContact CE1-CD1 4.44Å; Y856-L860 WeakPolarHBondContact O-CB 3.39Å; Y856-L860 PolarHBondContact O-N 3.12Å; A857-L860 PolarHBondContact O-N 3.11Å; L860-L945 HydrophobicContact CD1-CB 3.96Å; L860-C946 HydrophobicContact CD2-CB 4.44Å
861	L	89.1	Confident	80.8	Confident	132 Å²	132	70.7 Å²	70.7	69%	0.691	38%	0.378	S	S	*	.	I	π-helix	trans	-90.3	-39.5	-174.5	-68.6	174.4	0	0	0	113.7	A857	A857-L861 WeakPolarHBondContact O-CB 3.43Å; A857-L861 WeakPolarHBondContact O-CG 3.34Å; A857-L861 PolarHBondContact O-N 3.23Å
862	L	84.6	Confident	79.7	Confident	127 Å²	127	70.2 Å²	70.2	67%	0.665	38%	0.376	S	S	*	.	I	π-helix	trans	-111.7	-37.2	-169.4	-64.5	175	0	0	0	113.5	F858	F858-L862 HydrophobicContact CD2-CD1 3.62Å; F858-L862 HydrophobicContact CE2-CB 4.38Å; F858-L862 HydrophobicContact CE2-CD1 3.51Å; F858-L862 HydrophobicContact CZ-CD1 4.47Å; F858-L862 WeakPolarHBondContact O-CB 3.45Å; F858-L862 PolarHBondContact O-N 3.46Å
863	D	81.9	Confident	78.8	Confident	36 Å²	36	71 Å²	71	19%	0.193	38%	0.382	C	S	.	.	I	π-helix	trans	-109.9	4.9	-166.4	-104.4	-9.7	0	0	0	114.4	F858 V859 K865 S875	F858-D863 HydrophobicContact CE1-CB 4.41Å; F858-D863 VanDerWaalsContact CE1-OD2 3.28Å; F858-D863 WeakPolarHBondContact CE1-OD2 3.45Å; F858-D863 PolarHBondContact O-N 3.25Å; V859-D863 CarbonylContact O-C 3.52Å; V859-D863 PolarHBondContact O-N 3.47Å; D863-K865 PolarHBondContact O-N 3.1Å; D863-S875 PolarHBondContact OD2-OG 3.19Å
864	F	80	Confident	78.4	Confident	28 Å²	28	76.3 Å²	76.3	12%	0.123	42%	0.415	C	S	.	.			trans	-73	90.8	-179	-162.2	-101.3	0	0	0	111.5	V859 R932 Y938 R942 L945	V859-F864 PolarHBondContact O-N 3.21Å; F864-R932 HydrophobicContact CE2-CG 4.29Å; F864-R932 HydrophobicContact CZ-CG 4.07Å; F864-Y938 AromaticContact CD1-CE2 4Å; F864-Y938 HydrophobicContact CD1-CE2 4Å; F864-Y938 AromaticContact CD1-CZ 3.66Å; F864-Y938 WeakPolarHBondContact CD1-OH 3.49Å; F864-Y938 HydrophobicContact CE1-CD2 4.18Å; F864-Y938 HydrophobicContact CE1-CE1 4.15Å; F864-Y938 AromaticContact CE1-CE2 3.41Å; F864-Y938 HydrophobicContact CE1-CE2 3.41Å; F864-Y938 VanDerWaalsContact CE1-CE2 3.41Å; F864-Y938 AromaticContact CE1-CZ 3.41Å; F864-Y938 VanDerWaalsContact CE1-CZ 3.41Å; F864-Y938 WeakPolarHBondContact CE1-OH 3.42Å; F864-Y938 HydrophobicContact CZ-CE2 4.05Å; F864-Y938 PolarHBondContact O-OH 3.49Å; F864-Y938 VanDerWaalsContact O-OH 3.1Å; F864-R942 HydrophobicContact CD1-CB 4.26Å; F864-R942 HydrophobicContact CD1-CG 3.97Å; F864-R942 HydrophobicContact CE1-CB 3.53Å; F864-R942 HydrophobicContact CE1-CG 3.74Å; F864-R942 HydrophobicContact CZ-CB 3.89Å; F864-R942 HydrophobicContact CZ-CG 4.26Å; F864-L945 HydrophobicContact CE2-CD1 3.67Å; F864-L945 HydrophobicContact CZ-CD1 4.21Å
865	K	74.7	Confident	78	Confident	127 Å²	127	71.7 Å²	71.7	55%	0.552	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-97.4	154	-177.1	-67.8	175.2	-172.5	173.6	0	112	D863 Y938	D863-K865 PolarHBondContact O-N 3.1Å; K865-Y938 VanDerWaalsContact C-OH 3.3Å; K865-Y938 WeakPolarHBondContact O-CE2 3.46Å; K865-Y938 PolarHBondContact O-OH 2.73Å
866	K	69.2	Low	77.8	Confident	168 Å²	168	70.5 Å²	70.5	73%	0.73	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-56.8	149.6	173.8	-72.6	-174.9	-180	-175.2	0	111	Y938	K866-Y938 HydrophobicContact CG-CE1 4.12Å; K866-Y938 PolarHBondContact N-OH 3.4Å
867	P	65.8	Low	77.5	Confident	16 Å²	16	73.3 Å²	73.3	10%	0.104	41%	0.406	C	S	.	.	S	Bend	trans	-57	154.8	-174.2	22.4	-33.7	0	0	0	113.2	E935	P867-E935 HydrophobicContact CG-CG 3.68Å
868	P	61.4	Low	77.2	Confident	75 Å²	75	75.8 Å²	75.8	49%	0.487	42%	0.416	S	S	.	.	S	Bend	trans	-63.7	149	-168.9	24.5	-33.2	0	0	0	113.4
869	P	54.7	Low	77.1	Confident	132 Å²	132	71.9 Å²	71.9	86%	0.857	40%	0.399	S	S	*	.	S	Bend		-105	-6.7	75.2	31.4	-35.5	0	0	0	116.7
870	S	53.8	Low	77.1	Confident	97 Å²	97	73.6 Å²	73.6	68%	0.678	41%	0.405	S	S	*	.	S	Bend	trans	-92.6	111.5	176.7	56.1	0	0	0	0	112
871	N	59.3	Low	77.2	Confident	152 Å²	152	77 Å²	77	81%	0.813	42%	0.419	S	S	*	.			trans	13.8	113.7	169.9	-60.4	-21.2	0	0	0	118.1	A873	N871-A873 PolarHBondContact O-N 2.9Å
872	L	69.4	Low	77.3	Confident	76 Å²	76	71.4 Å²	71.4	40%	0.398	39%	0.389	S	S	.	.			trans	-47.9	122.9	163.8	-170.9	68.4	0	0	0	109.9	V874 E876 C877 Y880	L872-V874 PolarHBondContact O-N 2.96Å; L872-E876 HydrophobicContact CD1-CB 4.38Å; L872-E876 VanDerWaalsContact CD1-OE2 3.29Å; L872-E876 WeakPolarHBondContact CD1-OE2 3.33Å; L872-C877 HydrophobicContact CD2-CB 4.25Å; L872-C877 WeakPolarHBondContact CD2-SG 3.26Å; L872-Y880 HydrophobicContact CD1-CE2 4.25Å
873	A	75.2	Confident	77.6	Confident	16 Å²	16	65.6 Å²	65.6	13%	0.132	36%	0.358	C	S	.	.			trans	-61.8	138.8	-178.7	0	0	0	0	0	110	N871 S875 E876 C877	N871-A873 PolarHBondContact O-N 2.9Å; A873-S875 PolarHBondContact O-N 2.97Å; A873-E876 HydrophobicContact CB-CB 4.41Å; A873-E876 HydrophobicContact CB-CG 4.14Å; A873-E876 PolarHBondContact O-N 3.35Å; A873-E876 VanDerWaalsContact O-N 3.1Å; A873-C877 PolarHBondContact O-N 3.06Å
874	V	82.9	Confident	78	Confident	125 Å²	125	69.2 Å²	69.2	76%	0.758	37%	0.373	S	S	*	.	H	α-helix	trans	-59.9	-33.8	-179.6	-179.6	0	0	0	0	110.8	L872 C877 L878	L872-V874 PolarHBondContact O-N 2.96Å; V874-C877 PolarHBondContact O-N 3.36Å; V874-L878 WeakPolarHBondContact O-CB 3.35Å; V874-L878 PolarHBondContact O-N 3.14Å
875	S	85.6	Confident	78.5	Confident	22 Å²	22	67.9 Å²	67.9	15%	0.154	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-44	174.3	48	0	0	0	0	112.9	D863 A873 L878 L879	D863-S875 PolarHBondContact OD2-OG 3.19Å; A873-S875 PolarHBondContact O-N 2.97Å; S875-L878 PolarHBondContact O-N 3.37Å; S875-L879 PolarHBondContact O-N 3.27Å
876	E	87.1	Confident	79.1	Confident	5 Å²	5	62.4 Å²	62.4	2%	0.023	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-43.7	174.6	-71.4	-175.2	172	0	0	111.9	V859 L872 A873 L878 L879 Y880 R932	V859-E876 HydrophobicContact CG1-CG 3.75Å; L872-E876 HydrophobicContact CD1-CB 4.38Å; L872-E876 VanDerWaalsContact CD1-OE2 3.29Å; L872-E876 WeakPolarHBondContact CD1-OE2 3.33Å; A873-E876 HydrophobicContact CB-CB 4.41Å; A873-E876 HydrophobicContact CB-CG 4.14Å; A873-E876 PolarHBondContact O-N 3.35Å; A873-E876 VanDerWaalsContact O-N 3.1Å; E876-L878 VanDerWaalsContact C-N 3.3Å; E876-L878 PolarHBondContact O-N 3.01Å; E876-L879 WeakPolarHBondContact O-CB 3.48Å; E876-L879 PolarHBondContact O-N 2.87Å; E876-Y880 WeakPolarHBondContact O-CD1 3.46Å; E876-Y880 VanDerWaalsContact O-CG 3.26Å; E876-Y880 PolarHBondContact O-N 3.04Å; E876-R932 IonicContact OE1-NH1 3.61Å; E876-R932 IonicContact OE2-CZ 3.94Å; E876-R932 IonicContact OE2-NH1 3.96Å; E876-R932 PolarHBondContact OE2-NH1 3.32Å; E876-R932 IonicContact OE2-NH2 2.75Å
877	C	86.8	Confident	80.1	Confident	63 Å²	63	56.2 Å²	56.2	43%	0.426	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-40.4	179	-131.5	0	0	0	0	111.4	L872 A873 V874 Y880 F881	L872-C877 HydrophobicContact CD2-CB 4.25Å; L872-C877 WeakPolarHBondContact CD2-SG 3.26Å; A873-C877 PolarHBondContact O-N 3.06Å; V874-C877 PolarHBondContact O-N 3.36Å; C877-Y880 PolarHBondContact O-N 3.33Å; C877-F881 WeakPolarHBondContact O-CB 3.35Å; C877-F881 PolarHBondContact O-N 3.24Å
878	L	89.1	Confident	81	Confident	77 Å²	77	57 Å²	57	40%	0.403	33%	0.325	S	S	.	.	H	α-helix	trans	-65.4	-39.4	175.6	-165.1	148.5	0	0	0	111.5	L855 V874 S875 E876 F881 W882	L855-L878 HydrophobicContact CD1-CD2 4.43Å; L855-L878 HydrophobicContact CD2-CD2 3.24Å; L855-L878 HydrophobicContact CG-CD2 4.45Å; V874-L878 WeakPolarHBondContact O-CB 3.35Å; V874-L878 PolarHBondContact O-N 3.14Å; S875-L878 PolarHBondContact O-N 3.37Å; E876-L878 VanDerWaalsContact C-N 3.3Å; E876-L878 PolarHBondContact O-N 3.01Å; L878-F881 PolarHBondContact O-N 3.17Å; L878-W882 HydrophobicContact CD2-CE3 3.81Å; L878-W882 HydrophobicContact CD2-CZ3 4.13Å; L878-W882 WeakPolarHBondContact O-CB 3.39Å; L878-W882 PolarHBondContact O-N 2.9Å
879	L	90.2	Very high	82.1	Confident	6 Å²	6	54.1 Å²	54.1	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-45.7	174.3	-175.9	66.9	0	0	0	111.9	F852 L855 Y856 V859 S875 E876 F881 W882 V883	F852-L879 HydrophobicContact CD2-CD1 3.99Å; F852-L879 HydrophobicContact CE2-CD1 3.62Å; L855-L879 HydrophobicContact CD2-CB 4.33Å; L855-L879 HydrophobicContact CD2-CD1 4.24Å; Y856-L879 HydrophobicContact CD2-CD1 3.75Å; Y856-L879 HydrophobicContact CD2-CD2 4.02Å; Y856-L879 HydrophobicContact CD2-CG 4.36Å; Y856-L879 HydrophobicContact CE2-CD2 4.32Å; Y856-L879 HydrophobicContact CG-CD1 4.14Å; Y856-L879 HydrophobicContact CG-CD2 4.25Å; V859-L879 HydrophobicContact CB-CD2 4.19Å; V859-L879 HydrophobicContact CG1-CD2 4.06Å; V859-L879 HydrophobicContact CG2-CD2 4.35Å; S875-L879 PolarHBondContact O-N 3.27Å; E876-L879 WeakPolarHBondContact O-CB 3.48Å; E876-L879 PolarHBondContact O-N 2.87Å; L879-F881 PolarHBondContact O-N 2.74Å; L879-W882 WeakPolarHBondContact O-CB 3.45Å; L879-W882 PolarHBondContact O-N 3.34Å; L879-W882 VanDerWaalsContact O-N 3.13Å; L879-V883 PolarHBondContact O-N 2.91Å
880	Y	89.6	Confident	83.5	Confident	45 Å²	45	48.4 Å²	48.4	18%	0.176	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-43.2	178.7	-62.5	-13.1	0	0	0	111.9	L872 E876 C877 W882 V883 F884 F925 L929 R932	L872-Y880 HydrophobicContact CD1-CE2 4.25Å; E876-Y880 WeakPolarHBondContact O-CD1 3.46Å; E876-Y880 VanDerWaalsContact O-CG 3.26Å; E876-Y880 PolarHBondContact O-N 3.04Å; C877-Y880 PolarHBondContact O-N 3.33Å; Y880-W882 VanDerWaalsContact C-N 3.26Å; Y880-W882 PolarHBondContact O-N 2.91Å; Y880-V883 PolarHBondContact O-N 3.35Å; Y880-F884 WeakPolarHBondContact O-CB 3.19Å; Y880-F884 PolarHBondContact O-N 3.36Å; Y880-F925 HydrophobicContact CD1-CE1 4.35Å; Y880-F925 AromaticContact CD1-CZ 3.76Å; Y880-F925 HydrophobicContact CD1-CZ 3.76Å; Y880-F925 HydrophobicContact CE1-CZ 4.11Å; Y880-L929 HydrophobicContact CD1-CD1 3.91Å; Y880-L929 HydrophobicContact CD2-CD1 4.21Å; Y880-L929 HydrophobicContact CE1-CD1 3.79Å; Y880-L929 HydrophobicContact CE2-CD1 4.1Å; Y880-L929 HydrophobicContact CG-CD1 4.12Å; Y880-R932 PolarHBondContact OH-NE 2.92Å; Y880-R932 PolarHBondContact OH-NH2 2.77Å
881	F	90.6	Very high	84.9	Confident	93 Å²	93	47.9 Å²	47.9	41%	0.408	26%	0.256	S	S	.	.	H	α-helix	trans	-59.1	-41.8	173.4	-179.7	-109.7	0	0	0	111.2	C877 L878 L879 F884 T885 P1124	C877-F881 WeakPolarHBondContact O-CB 3.35Å; C877-F881 PolarHBondContact O-N 3.24Å; L878-F881 PolarHBondContact O-N 3.17Å; L879-F881 PolarHBondContact O-N 2.74Å; F881-F884 WeakPolarHBondContact O-CB 3.44Å; F881-F884 PolarHBondContact O-N 3.4Å; F881-T885 HydrophobicContact CE1-CG2 4.24Å; F881-T885 HydrophobicContact CE2-CG2 4.46Å; F881-T885 HydrophobicContact CZ-CG2 4.16Å; F881-T885 WeakPolarHBondContact O-CG2 3.31Å; F881-T885 PolarHBondContact O-N 3.02Å; F881-P1124 HydrophobicContact CD1-CB 4.22Å; F881-P1124 HydrophobicContact CE1-CB 3.89Å
882	W	91.8	Very high	85.9	Confident	14 Å²	14	41.8 Å²	41.8	5%	0.053	22%	0.221	C	C	.	.	H	α-helix	trans	-62.8	-49.6	177.9	-151.3	-64.8	0	0	0	112.5	M848 L851 F852 L878 L879 Y880 F884 T885 I886 P1123 P1124	M848-W882 HydrophobicContact CB-CZ2 4.16Å; M848-W882 HydrophobicContact CE-CH2 3.4Å; M848-W882 VanDerWaalsContact CE-CH2 3.4Å; M848-W882 HydrophobicContact CE-CZ2 3.73Å; M848-W882 HydrophobicContact CE-CZ3 4.4Å; M848-W882 WeakPolarHBondContact O-CZ2 3.36Å; L851-W882 HydrophobicContact CD2-CH2 4.46Å; F852-W882 HydrophobicContact CB-CD2 4.43Å; F852-W882 HydrophobicContact CB-CZ2 4.12Å; F852-W882 HydrophobicContact CD2-CB 4.22Å; F852-W882 AromaticContact CD2-CD1 3.59Å; F852-W882 HydrophobicContact CD2-CD2 4.43Å; F852-W882 AromaticContact CD2-CG 3.84Å; F852-W882 HydrophobicContact CD2-CG 3.84Å; L878-W882 HydrophobicContact CD2-CE3 3.81Å; L878-W882 HydrophobicContact CD2-CZ3 4.13Å; L878-W882 WeakPolarHBondContact O-CB 3.39Å; L878-W882 PolarHBondContact O-N 2.9Å; L879-W882 WeakPolarHBondContact O-CB 3.45Å; L879-W882 PolarHBondContact O-N 3.34Å; L879-W882 VanDerWaalsContact O-N 3.13Å; Y880-W882 VanDerWaalsContact C-N 3.26Å; Y880-W882 PolarHBondContact O-N 2.91Å; W882-F884 VanDerWaalsContact C-N 3.27Å; W882-F884 PolarHBondContact O-N 3.35Å; W882-T885 PolarHBondContact O-N 3.22Å; W882-T885 PolarHBondContact O-OG1 3.46Å; W882-I886 PolarHBondContact O-N 3.47Å; W882-I886 VanDerWaalsContact O-N 3.1Å; W882-P1123 WeakPolarHBondContact CZ2-O 3.36Å; W882-P1124 HydrophobicContact CD2-CB 4.28Å; W882-P1124 HydrophobicContact CD2-CG 4.44Å; W882-P1124 HydrophobicContact CE3-CB 4.23Å; W882-P1124 HydrophobicContact CE3-CG 4.02Å; W882-P1124 HydrophobicContact CH2-CG 4.31Å; W882-P1124 HydrophobicContact CZ3-CG 3.96Å
883	V	91.5	Very high	86.2	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.024	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-38.5	177.5	177.9	0	0	0	0	110.8	F852 L879 Y880 T885 I886 V887 F925	F852-V883 HydrophobicContact CE2-CG2 3.77Å; F852-V883 HydrophobicContact CZ-CG2 4.09Å; L879-V883 PolarHBondContact O-N 2.91Å; Y880-V883 PolarHBondContact O-N 3.35Å; V883-T885 VanDerWaalsContact C-N 3.29Å; V883-T885 PolarHBondContact O-N 2.88Å; V883-I886 WeakPolarHBondContact O-CB 3.44Å; V883-I886 PolarHBondContact O-N 3.32Å; V883-I886 VanDerWaalsContact O-N 3.09Å; V883-V887 HydrophobicContact CG1-CG2 4.41Å; V883-V887 WeakPolarHBondContact O-CG2 3.39Å; V883-V887 PolarHBondContact O-N 2.98Å; V883-F925 HydrophobicContact CB-CD1 4.21Å; V883-F925 HydrophobicContact CB-CE1 3.73Å; V883-F925 HydrophobicContact CB-CZ 3.91Å; V883-F925 HydrophobicContact CG1-CD1 3.58Å; V883-F925 HydrophobicContact CG1-CE1 3.62Å; V883-F925 HydrophobicContact CG1-CG 4.12Å; V883-F925 HydrophobicContact CG1-CZ 4.19Å; V883-F925 HydrophobicContact CG2-CD1 4.4Å; V883-F925 HydrophobicContact CG2-CD2 4.33Å; V883-F925 HydrophobicContact CG2-CE1 3.91Å; V883-F925 HydrophobicContact CG2-CE2 3.84Å; V883-F925 HydrophobicContact CG2-CZ 3.58Å
884	F	90.1	Very high	86	Confident	112 Å²	112	41 Å²	41	49%	0.491	22%	0.22	S	C	.	.	H	α-helix	trans	-58.1	-39.7	172.6	175.2	-100.9	0	0	0	112.5	Y880 F881 W882 V887 C888 I1127	Y880-F884 WeakPolarHBondContact O-CB 3.19Å; Y880-F884 PolarHBondContact O-N 3.36Å; F881-F884 WeakPolarHBondContact O-CB 3.44Å; F881-F884 PolarHBondContact O-N 3.4Å; W882-F884 VanDerWaalsContact C-N 3.27Å; W882-F884 PolarHBondContact O-N 3.35Å; F884-V887 PolarHBondContact O-N 2.88Å; F884-C888 PolarHBondContact O-N 3.03Å; F884-C888 PolarHBondContact O-SG 3.39Å; F884-I1127 HydrophobicContact CE1-CD1 4.26Å
885	T	89.8	Confident	85.3	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-67	-34.1	174.6	65.7	0	0	0	0	113.4	F881 W882 V883 C888 E889 P1124	F881-T885 HydrophobicContact CE1-CG2 4.24Å; F881-T885 HydrophobicContact CE2-CG2 4.46Å; F881-T885 HydrophobicContact CZ-CG2 4.16Å; F881-T885 WeakPolarHBondContact O-CG2 3.31Å; F881-T885 PolarHBondContact O-N 3.02Å; W882-T885 PolarHBondContact O-N 3.22Å; W882-T885 PolarHBondContact O-OG1 3.46Å; V883-T885 VanDerWaalsContact C-N 3.29Å; V883-T885 PolarHBondContact O-N 2.88Å; T885-C888 PolarHBondContact O-N 2.93Å; T885-E889 PolarHBondContact O-N 2.64Å; T885-E889 VanDerWaalsContact O-N 3.13Å; T885-P1124 HydrophobicContact CG2-CB 4.37Å
886	I	87.9	Confident	84.1	Confident	12 Å²	12	42.6 Å²	42.6	6%	0.062	22%	0.215	C	C	.	.	H	α-helix	trans	-65.3	-45.7	172.8	-64.6	172	0	0	0	109.9	F852 W882 V883 C888 E889 E890	F852-I886 HydrophobicContact CE1-CD1 4.43Å; F852-I886 HydrophobicContact CE2-CD1 4.47Å; F852-I886 HydrophobicContact CZ-CD1 4.33Å; W882-I886 PolarHBondContact O-N 3.47Å; W882-I886 VanDerWaalsContact O-N 3.1Å; V883-I886 WeakPolarHBondContact O-CB 3.44Å; V883-I886 PolarHBondContact O-N 3.32Å; V883-I886 VanDerWaalsContact O-N 3.09Å; I886-C888 VanDerWaalsContact C-N 3.29Å; I886-C888 PolarHBondContact O-N 3.48Å; I886-E889 WeakPolarHBondContact O-CA 3.35Å; I886-E889 VanDerWaalsContact O-CB 3.25Å; I886-E889 WeakPolarHBondContact O-CB 3.48Å; I886-E889 PolarHBondContact O-N 3.37Å; I886-E890 WeakPolarHBondContact O-CG 3.42Å; I886-E890 PolarHBondContact O-N 2.84Å
887	V	89	Confident	82.5	Confident	37 Å²	37	46 Å²	46	22%	0.224	24%	0.239	C	C	.	.	H	α-helix	trans	-58.5	-40.5	176.1	172.7	0	0	0	0	111.6	V883 F884 E889 E890 I891 I922	V883-V887 HydrophobicContact CG1-CG2 4.41Å; V883-V887 WeakPolarHBondContact O-CG2 3.39Å; V883-V887 PolarHBondContact O-N 2.98Å; F884-V887 PolarHBondContact O-N 2.88Å; V887-E889 VanDerWaalsContact C-N 3.27Å; V887-E889 PolarHBondContact O-N 2.73Å; V887-E890 PolarHBondContact O-N 3.47Å; V887-I891 HydrophobicContact CG1-CD1 3.85Å; V887-I891 WeakPolarHBondContact O-CB 3.48Å; V887-I891 WeakPolarHBondContact O-CD1 3.36Å; V887-I891 VanDerWaalsContact O-CG1 3.23Å; V887-I891 WeakPolarHBondContact O-CG1 3.21Å; V887-I891 PolarHBondContact O-N 2.84Å; V887-I922 HydrophobicContact CG2-CD1 4.05Å; V887-I922 HydrophobicContact CG2-CG1 4.08Å; V887-I922 HydrophobicContact CG2-CG2 3.78Å
888	C	85.8	Confident	80.9	Confident	32 Å²	32	48.6 Å²	48.6	22%	0.216	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-32.5	174.6	-67.9	0	0	0	0	112.8	F884 T885 I886 R892	F884-C888 PolarHBondContact O-N 3.03Å; F884-C888 PolarHBondContact O-SG 3.39Å; T885-C888 PolarHBondContact O-N 2.93Å; I886-C888 VanDerWaalsContact C-N 3.29Å; I886-C888 PolarHBondContact O-N 3.48Å; C888-R892 WeakPolarHBondContact O-CB 3.3Å; C888-R892 PolarHBondContact O-N 3.09Å
889	E	83.9	Confident	79.1	Confident	16 Å²	16	51.5 Å²	51.5	8%	0.075	27%	0.269	C	S	.	.	H	α-helix	trans	-69.4	-47.7	176.8	-154.4	-81.9	129.9	0	0	111.1	T885 I886 V887 I891 R892 E893 K1118 I1126	T885-E889 PolarHBondContact O-N 2.64Å; T885-E889 VanDerWaalsContact O-N 3.13Å; I886-E889 WeakPolarHBondContact O-CA 3.35Å; I886-E889 VanDerWaalsContact O-CB 3.25Å; I886-E889 WeakPolarHBondContact O-CB 3.48Å; I886-E889 PolarHBondContact O-N 3.37Å; V887-E889 VanDerWaalsContact C-N 3.27Å; V887-E889 PolarHBondContact O-N 2.73Å; E889-I891 VanDerWaalsContact C-N 3.32Å; E889-I891 PolarHBondContact O-N 3.42Å; E889-R892 WeakPolarHBondContact O-CA 3.47Å; E889-R892 WeakPolarHBondContact O-CB 3.47Å; E889-R892 PolarHBondContact O-N 3.38Å; E889-R892 IonicContact OE1-CZ 3.35Å; E889-R892 IonicContact OE1-NE 3.61Å; E889-R892 IonicContact OE1-NH2 3.6Å; E889-R892 PolarHBondContact OE1-NH2 2.89Å; E889-E893 PolarHBondContact O-N 3.43Å; E889-K1118 VanDerWaalsContact OE1-CE 3.27Å; E889-K1118 WeakPolarHBondContact OE1-CE 3.43Å; E889-K1118 IonicContact OE1-NZ 3.66Å; E889-K1118 IonicContact OE2-NZ 3.9Å; E889-K1118 PolarHBondContact OE2-NZ 3.44Å; E889-I1126 HydrophobicContact CB-CD1 4.28Å; E889-I1126 HydrophobicContact CG-CD1 3.58Å
890	E	84.8	Confident	77.7	Confident	11 Å²	11	53.7 Å²	53.7	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-40.7	175.8	-62	-58.5	161.3	0	0	111.8	I886 V887 E893 G894 Y909 I922 R955	I886-E890 WeakPolarHBondContact O-CG 3.42Å; I886-E890 PolarHBondContact O-N 2.84Å; V887-E890 PolarHBondContact O-N 3.47Å; E890-E893 PolarHBondContact O-N 3.18Å; E890-G894 PolarHBondContact O-N 3.05Å; E890-Y909 PolarHBondContact OE2-OH 3.27Å; E890-I922 HydrophobicContact CG-CD1 3.92Å; E890-R955 IonicContact OE1-CZ 2.76Å; E890-R955 VanDerWaalsContact OE1-CZ 3.28Å; E890-R955 IonicContact OE1-NH1 3.68Å; E890-R955 PolarHBondContact OE1-NH1 2.66Å; E890-R955 IonicContact OE1-NH2 2.66Å; E890-R955 PolarHBondContact OE1-NH2 3.32Å
891	I	81.8	Confident	76.4	Confident	87 Å²	87	55.5 Å²	55.5	45%	0.446	30%	0.296	S	S	.	.	H	α-helix	trans	-60	-50	171.8	-72.3	167.1	0	0	0	109.2	V887 E889 E893 G894 F895	V887-I891 HydrophobicContact CG1-CD1 3.85Å; V887-I891 WeakPolarHBondContact O-CB 3.48Å; V887-I891 WeakPolarHBondContact O-CD1 3.36Å; V887-I891 VanDerWaalsContact O-CG1 3.23Å; V887-I891 WeakPolarHBondContact O-CG1 3.21Å; V887-I891 PolarHBondContact O-N 2.84Å; E889-I891 VanDerWaalsContact C-N 3.32Å; E889-I891 PolarHBondContact O-N 3.42Å; I891-E893 VanDerWaalsContact C-N 3.29Å; I891-E893 PolarHBondContact O-N 3.39Å; I891-G894 PolarHBondContact O-N 2.99Å; I891-F895 HydrophobicContact CB-CD2 4.48Å; I891-F895 HydrophobicContact CG2-CD2 3.54Å; I891-F895 HydrophobicContact CG2-CE2 3.74Å; I891-F895 WeakPolarHBondContact O-CB 3.47Å; I891-F895 WeakPolarHBondContact O-CD2 3.4Å; I891-F895 PolarHBondContact O-N 3.14Å
892	R	80.4	Confident	75.2	Confident	24 Å²	24	58.9 Å²	58.9	9%	0.091	31%	0.306	C	S	.	.	H	α-helix	trans	-55.9	-46.5	177.9	-179.2	-150.5	60.5	87	3.2	110.9	C888 E889 G894 F895 F896	C888-R892 WeakPolarHBondContact O-CB 3.3Å; C888-R892 PolarHBondContact O-N 3.09Å; E889-R892 WeakPolarHBondContact O-CA 3.47Å; E889-R892 WeakPolarHBondContact O-CB 3.47Å; E889-R892 PolarHBondContact O-N 3.38Å; E889-R892 IonicContact OE1-CZ 3.35Å; E889-R892 IonicContact OE1-NE 3.61Å; E889-R892 IonicContact OE1-NH2 3.6Å; E889-R892 PolarHBondContact OE1-NH2 2.89Å; R892-G894 PolarHBondContact O-N 3.5Å; R892-F895 PolarHBondContact O-N 2.96Å; R892-F895 VanDerWaalsContact O-N 3.16Å; R892-F896 HydrophobicContact CB-CD2 4.06Å; R892-F896 HydrophobicContact CB-CE2 4.37Å; R892-F896 HydrophobicContact CG-CB 4.46Å; R892-F896 HydrophobicContact CG-CD2 3.27Å; R892-F896 HydrophobicContact CG-CE2 3.65Å; R892-F896 HydrophobicContact CG-CG 4Å; R892-F896 VanDerWaalsContact O-CB 3.32Å; R892-F896 WeakPolarHBondContact O-CB 3.46Å; R892-F896 VanDerWaalsContact O-CD2 3.29Å; R892-F896 WeakPolarHBondContact O-CD2 3.3Å; R892-F896 PolarHBondContact O-N 3.47Å
893	E	76.5	Confident	74.1	Confident	47 Å²	47	67.9 Å²	67.9	22%	0.22	34%	0.34	C	S	.	.	H	α-helix	trans	-59.2	-44.6	178.7	-171.5	158.2	165.4	0	0	112.2	E889 E890 I891 F895 K1118	E889-E893 PolarHBondContact O-N 3.43Å; E890-E893 PolarHBondContact O-N 3.18Å; I891-E893 VanDerWaalsContact C-N 3.29Å; I891-E893 PolarHBondContact O-N 3.39Å; E893-F895 VanDerWaalsContact C-N 3.31Å; E893-F895 PolarHBondContact O-N 2.93Å; E893-K1118 IonicContact OE2-NZ 2.65Å; E893-K1118 PolarHBondContact OE2-NZ 3.49Å
894	G	71.6	Confident	73	Confident	28 Å²	28	71.5 Å²	71.5	29%	0.289	36%	0.357	S	S	.	.	H	α-helix	trans	-65.7	-26.9	175.1	0	0	0	0	0	114.9	E890 I891 R892	E890-G894 PolarHBondContact O-N 3.05Å; I891-G894 PolarHBondContact O-N 2.99Å; R892-G894 PolarHBondContact O-N 3.5Å
895	F	67.9	Low	72.1	Confident	117 Å²	117	69 Å²	69	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-99.1	-27	-173.6	-82.3	-83.8	0	0	0	115.3	I891 R892 E893 S897 R905	I891-F895 HydrophobicContact CB-CD2 4.48Å; I891-F895 HydrophobicContact CG2-CD2 3.54Å; I891-F895 HydrophobicContact CG2-CE2 3.74Å; I891-F895 WeakPolarHBondContact O-CB 3.47Å; I891-F895 WeakPolarHBondContact O-CD2 3.4Å; I891-F895 PolarHBondContact O-N 3.14Å; R892-F895 PolarHBondContact O-N 2.96Å; R892-F895 VanDerWaalsContact O-N 3.16Å; E893-F895 VanDerWaalsContact C-N 3.31Å; E893-F895 PolarHBondContact O-N 2.93Å; F895-S897 PolarHBondContact O-N 3.34Å; F895-R905 PolarHBondContact O-NH1 3.09Å
896	F	59.5	Low	71.3	Confident	64 Å²	64	72.6 Å²	72.6	28%	0.281	36%	0.363	S	S	.	.			trans	-91.3	9.4	-162.6	-89.8	-89.7	0	0	0	118.2	R892 D898 L1133 R1137	R892-F896 HydrophobicContact CB-CD2 4.06Å; R892-F896 HydrophobicContact CB-CE2 4.37Å; R892-F896 HydrophobicContact CG-CB 4.46Å; R892-F896 HydrophobicContact CG-CD2 3.27Å; R892-F896 HydrophobicContact CG-CE2 3.65Å; R892-F896 HydrophobicContact CG-CG 4Å; R892-F896 VanDerWaalsContact O-CB 3.32Å; R892-F896 WeakPolarHBondContact O-CB 3.46Å; R892-F896 VanDerWaalsContact O-CD2 3.29Å; R892-F896 WeakPolarHBondContact O-CD2 3.3Å; R892-F896 PolarHBondContact O-N 3.47Å; F896-D898 PolarHBondContact O-N 3.43Å; F896-L1133 HydrophobicContact CD1-CD2 4.12Å; F896-L1133 HydrophobicContact CE1-CD2 3.27Å; F896-L1133 HydrophobicContact CE2-CD2 4.44Å; F896-L1133 HydrophobicContact CZ-CD2 3.46Å; F896-L1133 VanDerWaalsContact CZ-CD2 3.46Å; F896-R1137 VanDerWaalsContact CE1-CZ 3.46Å; F896-R1137 VanDerWaalsContact CE1-NH1 3.31Å
897	S	53.8	Low	70.8	Confident	76 Å²	76	80.4 Å²	80.4	53%	0.531	39%	0.391	S	S	.	.			trans	-80.8	114.8	169.7	-84	0	0	0	0	111.6	F895 V899 R905	F895-S897 PolarHBondContact O-N 3.34Å; S897-V899 VanDerWaalsContact C-N 3.32Å; S897-V899 PolarHBondContact O-N 3.39Å; S897-V899 VanDerWaalsContact O-N 3.12Å; S897-R905 PolarHBondContact O-NH1 3.09Å; S897-R905 PolarHBondContact O-NH2 2.98Å
898	D	52.3	Low	70.2	Confident	117 Å²	117	82.4 Å²	82.4	63%	0.626	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-2.6	-160.5	-81.4	-34	0	0	0	116.4	F896 R1137	F896-D898 PolarHBondContact O-N 3.43Å; D898-R1137 IonicContact OD1-NH1 2.67Å
899	V	53.1	Low	69.9	Low	139 Å²	139	82.6 Å²	82.6	84%	0.842	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	-16.6	-167.1	-166	0	0	0	0	116.1	S897	S897-V899 VanDerWaalsContact C-N 3.32Å; S897-V899 PolarHBondContact O-N 3.39Å; S897-V899 VanDerWaalsContact O-N 3.12Å
900	M	59.2	Low	69.7	Low	52 Å²	52	85.5 Å²	85.5	26%	0.256	42%	0.415	S	S	.	.	S	Bend	trans	-96	161.5	-169.7	-69.2	-170.9	134.8	0	0	115.5	D563 R905	D563-M900 HydrophobicContact CB-CE 4.16Å; D563-M900 WeakPolarHBondContact OD2-CE 3.02Å; M900-R905 HydrophobicContact CB-CG 3.55Å; M900-R905 PolarHBondContact O-NE 3.41Å; M900-R905 PolarHBondContact O-NH2 3.21Å; M900-R905 HydrophobicContact SD-CG 4.45Å
901	T	62.9	Low	69.5	Low	83 Å²	83	91.3 Å²	91.3	51%	0.509	44%	0.443	S	S	.	.			trans	-76.7	148.4	166.3	65.4	0	0	0	0	111.7	R903 Q904 R905	T901-R903 VanDerWaalsContact C-N 3.26Å; T901-R903 PolarHBondContact O-N 3.14Å; T901-R903 VanDerWaalsContact O-N 3.14Å; T901-Q904 PolarHBondContact O-N 3.1Å; T901-Q904 VanDerWaalsContact O-N 3.1Å; T901-Q904 PolarHBondContact OG1-OE1 3.01Å; T901-R905 WeakPolarHBondContact O-CG 3.29Å; T901-R905 PolarHBondContact O-N 3.07Å; T901-R905 VanDerWaalsContact O-N 3.09Å
902	W	64.6	Low	69.5	Low	163 Å²	163	90.5 Å²	90.5	62%	0.617	44%	0.439	S	S	*	.	H	α-helix	trans	-54.3	-36.4	-175.4	176.6	73	0	0	0	114.2	R905 L906	W902-R905 PolarHBondContact O-N 2.87Å; W902-L906 HydrophobicContact CZ2-CD2 4.41Å; W902-L906 PolarHBondContact O-N 3.34Å
903	R	68.8	Low	69.6	Low	204 Å²	204	93.2 Å²	93.2	77%	0.77	46%	0.458	S	S	*	.	H	α-helix	trans	-67.9	-40.1	178.2	-74.8	-173.9	179	-177	-0.6	113.5	T901 R907	T901-R903 VanDerWaalsContact C-N 3.26Å; T901-R903 PolarHBondContact O-N 3.14Å; T901-R903 VanDerWaalsContact O-N 3.14Å; R903-R907 PolarHBondContact O-N 3.48Å
904	Q	68.6	Low	70	Confident	80 Å²	80	94.4 Å²	94.4	37%	0.374	46%	0.461	S	S	.	.	H	α-helix	trans	-68.3	-39.4	176.3	-73.8	165.6	-42.8	0	0	110.4	T901 R907 V908	T901-Q904 PolarHBondContact O-N 3.1Å; T901-Q904 VanDerWaalsContact O-N 3.1Å; T901-Q904 PolarHBondContact OG1-OE1 3.01Å; Q904-R907 WeakPolarHBondContact O-CB 3.13Å; Q904-R907 PolarHBondContact O-N 3.24Å; Q904-V908 WeakPolarHBondContact O-CG2 3.38Å; Q904-V908 PolarHBondContact O-N 3.04Å
905	R	71.7	Confident	70.7	Confident	58 Å²	58	93.8 Å²	93.8	22%	0.219	45%	0.451	C	S	.	.	H	α-helix	trans	-57.9	-52	175.9	-65.1	176.7	-165.5	-159	-3.7	112.1	F895 S897 M900 T901 W902 R907 V908 Y909	F895-R905 PolarHBondContact O-NH1 3.09Å; S897-R905 PolarHBondContact O-NH1 3.09Å; S897-R905 PolarHBondContact O-NH2 2.98Å; M900-R905 HydrophobicContact CB-CG 3.55Å; M900-R905 PolarHBondContact O-NE 3.41Å; M900-R905 PolarHBondContact O-NH2 3.21Å; M900-R905 HydrophobicContact SD-CG 4.45Å; T901-R905 WeakPolarHBondContact O-CG 3.29Å; T901-R905 PolarHBondContact O-N 3.07Å; T901-R905 VanDerWaalsContact O-N 3.09Å; W902-R905 PolarHBondContact O-N 2.87Å; R905-R907 PolarHBondContact O-N 2.89Å; R905-V908 PolarHBondContact O-N 3.41Å; R905-Y909 WeakPolarHBondContact O-CB 3.38Å; R905-Y909 PolarHBondContact O-N 3.03Å
906	L	73.9	Confident	71.6	Confident	78 Å²	78	93.2 Å²	93.2	41%	0.408	45%	0.448	S	S	.	.	H	α-helix	trans	-61.2	-36.6	179.6	-173.9	65.5	0	0	0	111.6	W902 I910	W902-L906 HydrophobicContact CZ2-CD2 4.41Å; W902-L906 PolarHBondContact O-N 3.34Å; L906-I910 HydrophobicContact CD1-CD1 3.92Å; L906-I910 HydrophobicContact CD1-CG1 4.3Å; L906-I910 HydrophobicContact CD2-CD1 4.4Å; L906-I910 HydrophobicContact CG-CD1 3.76Å; L906-I910 HydrophobicContact CG-CG1 4.46Å; L906-I910 WeakPolarHBondContact O-CB 3.32Å; L906-I910 VanDerWaalsContact O-CG1 3.26Å; L906-I910 WeakPolarHBondContact O-CG1 3.42Å; L906-I910 PolarHBondContact O-N 3.08Å
907	R	77.3	Confident	73	Confident	175 Å²	175	94.4 Å²	94.4	66%	0.66	45%	0.453	S	S	*	.	H	α-helix	trans	-63.3	-47.5	175.8	-176.7	-174.8	-65.1	-179.8	-3.1	112.1	R903 Q904 R905 I910 Q911	R903-R907 PolarHBondContact O-N 3.48Å; Q904-R907 WeakPolarHBondContact O-CB 3.13Å; Q904-R907 PolarHBondContact O-N 3.24Å; R905-R907 PolarHBondContact O-N 2.89Å; R907-I910 PolarHBondContact O-N 3.37Å; R907-Q911 WeakPolarHBondContact O-CG 3.46Å; R907-Q911 PolarHBondContact O-N 3.05Å; R907-Q911 VanDerWaalsContact O-N 3.13Å
908	V	75.1	Confident	74.6	Confident	79 Å²	79	91.1 Å²	91.1	48%	0.479	43%	0.43	S	S	.	.	H	α-helix	trans	-64.4	-43.2	178.8	174.3	0	0	0	0	110.4	Q904 R905 I910 Q911	Q904-V908 WeakPolarHBondContact O-CG2 3.38Å; Q904-V908 PolarHBondContact O-N 3.04Å; R905-V908 PolarHBondContact O-N 3.41Å; V908-I910 PolarHBondContact O-N 3.28Å; V908-Q911 WeakPolarHBondContact O-CB 3.1Å; V908-Q911 PolarHBondContact O-N 3.17Å; V908-Q911 VanDerWaalsContact O-N 3.12Å
909	Y	80.7	Confident	76.3	Confident	36 Å²	36	88.8 Å²	88.8	14%	0.141	42%	0.416	C	S	.	.	H	α-helix	trans	-59.5	-45.2	177.6	-174.9	-93.4	0	0	0	112.5	E890 R905 Q911 D912 N915 I919	E890-Y909 PolarHBondContact OE2-OH 3.27Å; R905-Y909 WeakPolarHBondContact O-CB 3.38Å; R905-Y909 PolarHBondContact O-N 3.03Å; Y909-Q911 VanDerWaalsContact C-N 3.26Å; Y909-Q911 PolarHBondContact O-N 2.88Å; Y909-D912 PolarHBondContact O-N 3.39Å; Y909-N915 HydrophobicContact CD1-CB 4.25Å; Y909-N915 HydrophobicContact CD2-CB 4.46Å; Y909-N915 WeakPolarHBondContact CD2-ND2 3.45Å; Y909-N915 HydrophobicContact CE1-CB 3.88Å; Y909-N915 HydrophobicContact CE2-CB 4.12Å; Y909-N915 WeakPolarHBondContact O-CB 3.34Å; Y909-N915 PolarHBondContact O-ND2 3.11Å; Y909-I919 HydrophobicContact CD1-CD1 4.3Å; Y909-I919 HydrophobicContact CE1-CD1 3.8Å; Y909-I919 HydrophobicContact CE1-CG1 4.08Å
910	I	79.9	Confident	78.1	Confident	78 Å²	78	85.7 Å²	85.7	40%	0.4	40%	0.395	S	S	.	.	H	α-helix	trans	-71.7	-17.2	178.3	-68.5	171.8	0	0	0	112.2	L906 R907 V908 D912 K916	L906-I910 HydrophobicContact CD1-CD1 3.92Å; L906-I910 HydrophobicContact CD1-CG1 4.3Å; L906-I910 HydrophobicContact CD2-CD1 4.4Å; L906-I910 HydrophobicContact CG-CD1 3.76Å; L906-I910 HydrophobicContact CG-CG1 4.46Å; L906-I910 WeakPolarHBondContact O-CB 3.32Å; L906-I910 VanDerWaalsContact O-CG1 3.26Å; L906-I910 WeakPolarHBondContact O-CG1 3.42Å; L906-I910 PolarHBondContact O-N 3.08Å; R907-I910 PolarHBondContact O-N 3.37Å; V908-I910 PolarHBondContact O-N 3.28Å; I910-D912 VanDerWaalsContact C-N 3.34Å; I910-K916 WeakPolarHBondContact O-CE 3.46Å
911	Q	79.6	Confident	79.6	Confident	133 Å²	133	83.3 Å²	83.3	62%	0.621	38%	0.384	S	S	*	.	H	α-helix	trans	-72.4	-29.7	177.3	-82.5	175.1	-14.3	0	0	112.6	R907 V908 Y909	R907-Q911 WeakPolarHBondContact O-CG 3.46Å; R907-Q911 PolarHBondContact O-N 3.05Å; R907-Q911 VanDerWaalsContact O-N 3.13Å; V908-Q911 WeakPolarHBondContact O-CB 3.1Å; V908-Q911 PolarHBondContact O-N 3.17Å; V908-Q911 VanDerWaalsContact O-N 3.12Å; Y909-Q911 VanDerWaalsContact C-N 3.26Å; Y909-Q911 PolarHBondContact O-N 2.88Å
912	D	81.9	Confident	80.9	Confident	69 Å²	69	80.5 Å²	80.5	37%	0.369	37%	0.365	S	S	.	.	S	Bend	trans	-67.8	136.9	176.7	-157.9	-29.7	0	0	0	111.2	Y909 I910 W914 N915 K916	Y909-D912 PolarHBondContact O-N 3.39Å; I910-D912 VanDerWaalsContact C-N 3.34Å; D912-W914 PolarHBondContact OD1-N 2.93Å; D912-W914 VanDerWaalsContact OD1-N 3.1Å; D912-N915 HydrophobicContact CB-CB 4.07Å; D912-K916 WeakPolarHBondContact O-CG 3.12Å; D912-K916 PolarHBondContact O-N 3.3Å
913	V	83.3	Confident	82.2	Confident	82 Å²	82	76 Å²	76	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-72.3	-38.1	179.5	179.2	0	0	0	0	110.4	K916 F917	V913-K916 WeakPolarHBondContact O-CB 3.48Å; V913-K916 PolarHBondContact O-N 3.37Å; V913-F917 HydrophobicContact CG1-CD2 4.07Å; V913-F917 HydrophobicContact CG1-CE2 3.79Å; V913-F917 VanDerWaalsContact O-CD2 3.28Å; V913-F917 WeakPolarHBondContact O-CD2 3.41Å; V913-F917 PolarHBondContact O-N 3.48Å
914	W	84.8	Confident	83.3	Confident	72 Å²	72	67.9 Å²	67.9	27%	0.273	33%	0.327	S	S	.	.	H	α-helix	trans	-69.7	-40.9	-177.8	-61.5	109.3	0	0	0	111.6	D912 K916 F917 D918 I957 H958	D912-W914 PolarHBondContact OD1-N 2.93Å; D912-W914 VanDerWaalsContact OD1-N 3.1Å; W914-K916 PolarHBondContact O-N 3.33Å; W914-F917 WeakPolarHBondContact O-CA 3.27Å; W914-F917 WeakPolarHBondContact O-CB 3.35Å; W914-F917 PolarHBondContact O-N 3.48Å; W914-D918 PolarHBondContact O-N 3.44Å; W914-I957 HydrophobicContact CH2-CB 4.19Å; W914-I957 HydrophobicContact CH2-CG2 3.9Å; W914-H958 AromaticContact CD1-CD2 3.38Å; W914-H958 AromaticContact CD1-NE2 3.62Å; W914-H958 HydrophobicContact CD2-CB 3.82Å; W914-H958 AromaticContact CD2-CD2 3.54Å; W914-H958 AromaticContact CD2-CG 3.77Å; W914-H958 AromaticContact CE2-CD2 3.58Å; W914-H958 HydrophobicContact CE3-CB 3.66Å; W914-H958 HydrophobicContact CG-CB 4.38Å; W914-H958 AromaticContact CG-CD2 3.41Å; W914-H958 VanDerWaalsContact CG-CD2 3.41Å; W914-H958 AromaticContact CG-CG 3.82Å; W914-H958 AromaticContact CG-NE2 3.82Å; W914-H958 HydrophobicContact CH2-CB 4.3Å; W914-H958 HydrophobicContact CZ2-CB 4.44Å; W914-H958 HydrophobicContact CZ3-CB 3.91Å; W914-H958 AromaticContact NE1-CD2 3.47Å; W914-H958 PolarHBondContact NE1-CD2 3.46Å
915	N	85.7	Confident	84.5	Confident	15 Å²	15	64.5 Å²	64.5	8%	0.08	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-30.8	175.2	-63.4	-9.7	0	0	0	112.5	Y909 D912 D918 I919	Y909-N915 HydrophobicContact CD1-CB 4.25Å; Y909-N915 HydrophobicContact CD2-CB 4.46Å; Y909-N915 WeakPolarHBondContact CD2-ND2 3.45Å; Y909-N915 HydrophobicContact CE1-CB 3.88Å; Y909-N915 HydrophobicContact CE2-CB 4.12Å; Y909-N915 WeakPolarHBondContact O-CB 3.34Å; Y909-N915 PolarHBondContact O-ND2 3.11Å; D912-N915 HydrophobicContact CB-CB 4.07Å; N915-D918 PolarHBondContact O-N 2.87Å; N915-I919 VanDerWaalsContact O-CG1 3.31Å; N915-I919 WeakPolarHBondContact O-CG1 3.27Å; N915-I919 PolarHBondContact O-N 2.93Å
916	K	87.8	Confident	85.4	Confident	105 Å²	105	66.1 Å²	66.1	46%	0.457	32%	0.324	S	S	.	.	H	α-helix	trans	-65.9	-41.4	171.7	-68.2	170.6	-165.5	175.6	0	111.8	I910 D912 V913 W914 D918 I919 L920	I910-K916 WeakPolarHBondContact O-CE 3.46Å; D912-K916 WeakPolarHBondContact O-CG 3.12Å; D912-K916 PolarHBondContact O-N 3.3Å; V913-K916 WeakPolarHBondContact O-CB 3.48Å; V913-K916 PolarHBondContact O-N 3.37Å; W914-K916 PolarHBondContact O-N 3.33Å; K916-D918 VanDerWaalsContact C-N 3.3Å; K916-I919 PolarHBondContact O-N 3.46Å; K916-L920 WeakPolarHBondContact O-CB 3.23Å; K916-L920 PolarHBondContact O-N 3.4Å
917	F	87	Confident	86.3	Confident	88 Å²	88	66.4 Å²	66.4	39%	0.386	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-36.8	174.7	-81.2	-72.6	0	0	0	111.6	V913 W914 L920 A921	V913-F917 HydrophobicContact CG1-CD2 4.07Å; V913-F917 HydrophobicContact CG1-CE2 3.79Å; V913-F917 VanDerWaalsContact O-CD2 3.28Å; V913-F917 WeakPolarHBondContact O-CD2 3.41Å; V913-F917 PolarHBondContact O-N 3.48Å; W914-F917 WeakPolarHBondContact O-CA 3.27Å; W914-F917 WeakPolarHBondContact O-CB 3.35Å; W914-F917 PolarHBondContact O-N 3.48Å; F917-L920 HydrophobicContact CD1-CD2 4.47Å; F917-L920 WeakPolarHBondContact O-CB 3.2Å; F917-L920 PolarHBondContact O-N 3.48Å; F917-A921 WeakPolarHBondContact O-CB 3.33Å; F917-A921 PolarHBondContact O-N 3.49Å
918	D	87.4	Confident	86.9	Confident	7 Å²	7	58 Å²	58	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-69	-42.5	177	-69.9	-26.2	0	0	0	112.3	W914 N915 K916 L920 A921 I922 R955	W914-D918 PolarHBondContact O-N 3.44Å; N915-D918 PolarHBondContact O-N 2.87Å; K916-D918 VanDerWaalsContact C-N 3.3Å; D918-L920 VanDerWaalsContact C-N 3.33Å; D918-L920 PolarHBondContact O-N 3.38Å; D918-A921 PolarHBondContact O-N 3.16Å; D918-I922 WeakPolarHBondContact O-CD1 3.47Å; D918-I922 VanDerWaalsContact O-CG1 3.27Å; D918-I922 WeakPolarHBondContact O-CG1 3.3Å; D918-I922 PolarHBondContact O-N 2.92Å; D918-R955 WeakPolarHBondContact OD1-CD 3.42Å; D918-R955 IonicContact OD1-CZ 3.86Å; D918-R955 IonicContact OD1-NE 2.83Å; D918-R955 PolarHBondContact OD1-NE 3.21Å; D918-R955 VanDerWaalsContact OD1-NE 3.15Å; D918-R955 IonicContact OD1-NH1 3.76Å; D918-R955 PolarHBondContact OD1-NH1 3.11Å; D918-R955 IonicContact OD1-NH2 3.9Å; D918-R955 IonicContact OD2-CZ 2.79Å; D918-R955 IonicContact OD2-NE 3.53Å; D918-R955 IonicContact OD2-NH1 3.64Å; D918-R955 PolarHBondContact OD2-NH1 3.07Å; D918-R955 IonicContact OD2-NH2 3.57Å; D918-R955 PolarHBondContact OD2-NH2 3.31Å
919	I	89.1	Confident	87.5	Confident	68 Å²	68	56.3 Å²	56.3	35%	0.349	28%	0.282	S	S	.	.	H	α-helix	trans	-59.5	-46.3	169.9	-66.4	166.3	0	0	0	110	Y909 N915 K916 A921 I922 T923	Y909-I919 HydrophobicContact CD1-CD1 4.3Å; Y909-I919 HydrophobicContact CE1-CD1 3.8Å; Y909-I919 HydrophobicContact CE1-CG1 4.08Å; N915-I919 VanDerWaalsContact O-CG1 3.31Å; N915-I919 WeakPolarHBondContact O-CG1 3.27Å; N915-I919 PolarHBondContact O-N 2.93Å; K916-I919 PolarHBondContact O-N 3.46Å; I919-A921 PolarHBondContact O-N 3.11Å; I919-I922 PolarHBondContact O-N 2.92Å; I919-T923 HydrophobicContact CG2-CG2 4.11Å; I919-T923 VanDerWaalsContact O-CG2 3.29Å; I919-T923 WeakPolarHBondContact O-CG2 3.49Å; I919-T923 PolarHBondContact O-N 2.98Å; I919-T923 PolarHBondContact O-OG1 3.33Å; I919-T923 VanDerWaalsContact O-OG1 3.12Å
920	L	90.5	Very high	87.9	Confident	75 Å²	75	59 Å²	59	39%	0.393	30%	0.297	S	S	.	.	H	α-helix	trans	-58.1	-49.8	-179.7	178.5	64.5	0	0	0	111.1	K916 F917 D918 I922 T923 L924	K916-L920 WeakPolarHBondContact O-CB 3.23Å; K916-L920 PolarHBondContact O-N 3.4Å; F917-L920 HydrophobicContact CD1-CD2 4.47Å; F917-L920 WeakPolarHBondContact O-CB 3.2Å; F917-L920 PolarHBondContact O-N 3.48Å; D918-L920 VanDerWaalsContact C-N 3.33Å; D918-L920 PolarHBondContact O-N 3.38Å; L920-I922 PolarHBondContact O-N 3.45Å; L920-T923 WeakPolarHBondContact CA-OG1 3.5Å; L920-T923 PolarHBondContact O-N 2.74Å; L920-T923 PolarHBondContact O-OG1 3.28Å; L920-L924 HydrophobicContact CD1-CD1 4.02Å; L920-L924 HydrophobicContact CD1-CG 4.13Å; L920-L924 HydrophobicContact CG-CD1 3.95Å; L920-L924 HydrophobicContact CG-CG 4.44Å; L920-L924 WeakPolarHBondContact O-CB 3.26Å; L920-L924 WeakPolarHBondContact O-CG 3.39Å; L920-L924 PolarHBondContact O-N 3.05Å
921	A	90.8	Very high	88.3	Confident	2 Å²	2	56.4 Å²	56.4	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-56.9	-50.2	176.2	0	0	0	0	0	111.4	F917 D918 I919 T923 L924 F925 D948 V951 F952	F917-A921 WeakPolarHBondContact O-CB 3.33Å; F917-A921 PolarHBondContact O-N 3.49Å; D918-A921 PolarHBondContact O-N 3.16Å; I919-A921 PolarHBondContact O-N 3.11Å; A921-T923 VanDerWaalsContact C-N 3.3Å; A921-T923 PolarHBondContact O-N 3.04Å; A921-L924 PolarHBondContact O-N 3.29Å; A921-F925 WeakPolarHBondContact O-CB 3.31Å; A921-F925 PolarHBondContact O-N 3.17Å; A921-D948 WeakPolarHBondContact CA-OD1 3.41Å; A921-V951 HydrophobicContact CB-CB 4.38Å; A921-V951 HydrophobicContact CB-CG1 3.78Å; A921-F952 HydrophobicContact CB-CD1 4.42Å; A921-F952 HydrophobicContact CB-CD2 4.39Å; A921-F952 HydrophobicContact CB-CE1 4.11Å; A921-F952 HydrophobicContact CB-CE2 4.07Å; A921-F952 HydrophobicContact CB-CZ 3.93Å
922	I	91.1	Very high	88.6	Confident	24 Å²	24	50.4 Å²	50.4	12%	0.123	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-40.6	179.7	-67.4	164.5	0	0	0	111.3	V887 E890 D918 I919 L920 L926	V887-I922 HydrophobicContact CG2-CD1 4.05Å; V887-I922 HydrophobicContact CG2-CG1 4.08Å; V887-I922 HydrophobicContact CG2-CG2 3.78Å; E890-I922 HydrophobicContact CG-CD1 3.92Å; D918-I922 WeakPolarHBondContact O-CD1 3.47Å; D918-I922 VanDerWaalsContact O-CG1 3.27Å; D918-I922 WeakPolarHBondContact O-CG1 3.3Å; D918-I922 PolarHBondContact O-N 2.92Å; I919-I922 PolarHBondContact O-N 2.92Å; L920-I922 PolarHBondContact O-N 3.45Å; I922-L926 HydrophobicContact CG2-CD1 4.07Å; I922-L926 WeakPolarHBondContact O-CB 3.2Å; I922-L926 VanDerWaalsContact O-CG 3.26Å; I922-L926 WeakPolarHBondContact O-CG 3.41Å; I922-L926 PolarHBondContact O-N 3.45Å
923	T	91.3	Very high	88.6	Confident	69 Å²	69	51 Å²	51	42%	0.423	26%	0.26	S	S	.	.	H	α-helix	trans	-69.2	-39.7	178.6	57.5	0	0	0	0	113	I919 L920 A921 L926 L927	I919-T923 HydrophobicContact CG2-CG2 4.11Å; I919-T923 VanDerWaalsContact O-CG2 3.29Å; I919-T923 WeakPolarHBondContact O-CG2 3.49Å; I919-T923 PolarHBondContact O-N 2.98Å; I919-T923 PolarHBondContact O-OG1 3.33Å; I919-T923 VanDerWaalsContact O-OG1 3.12Å; L920-T923 WeakPolarHBondContact CA-OG1 3.5Å; L920-T923 PolarHBondContact O-N 2.74Å; L920-T923 PolarHBondContact O-OG1 3.28Å; A921-T923 VanDerWaalsContact C-N 3.3Å; A921-T923 PolarHBondContact O-N 3.04Å; T923-L926 PolarHBondContact O-N 3.4Å; T923-L927 WeakPolarHBondContact O-CB 3.45Å; T923-L927 PolarHBondContact O-N 2.91Å
924	L	92.6	Very high	88.6	Confident	32 Å²	32	52.3 Å²	52.3	17%	0.168	26%	0.259	C	S	.	.	H	α-helix	trans	-66.7	-41.9	176	-73.9	174.6	0	0	0	111	L920 A921 L927 G928 D948 V951	L920-L924 HydrophobicContact CD1-CD1 4.02Å; L920-L924 HydrophobicContact CD1-CG 4.13Å; L920-L924 HydrophobicContact CG-CD1 3.95Å; L920-L924 HydrophobicContact CG-CG 4.44Å; L920-L924 WeakPolarHBondContact O-CB 3.26Å; L920-L924 WeakPolarHBondContact O-CG 3.39Å; L920-L924 PolarHBondContact O-N 3.05Å; A921-L924 PolarHBondContact O-N 3.29Å; L924-L927 PolarHBondContact O-N 3.33Å; L924-G928 PolarHBondContact O-N 2.97Å; L924-D948 HydrophobicContact CB-CB 4.16Å; L924-D948 WeakPolarHBondContact CB-OD1 3.45Å; L924-V951 HydrophobicContact CD1-CG2 4.06Å
925	F	92.6	Very high	88.4	Confident	9 Å²	9	56.4 Å²	56.4	4%	0.039	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-47.1	174.3	-174	-97.4	0	0	0	112.3	Y856 Y880 V883 A921 G928 L929 L945 D948 F952	Y856-F925 HydrophobicContact CE2-CD2 4.01Å; Y856-F925 AromaticContact CE2-CE2 3.87Å; Y856-F925 HydrophobicContact CE2-CE2 3.87Å; Y880-F925 HydrophobicContact CD1-CE1 4.35Å; Y880-F925 AromaticContact CD1-CZ 3.76Å; Y880-F925 HydrophobicContact CD1-CZ 3.76Å; Y880-F925 HydrophobicContact CE1-CZ 4.11Å; V883-F925 HydrophobicContact CB-CD1 4.21Å; V883-F925 HydrophobicContact CB-CE1 3.73Å; V883-F925 HydrophobicContact CB-CZ 3.91Å; V883-F925 HydrophobicContact CG1-CD1 3.58Å; V883-F925 HydrophobicContact CG1-CE1 3.62Å; V883-F925 HydrophobicContact CG1-CG 4.12Å; V883-F925 HydrophobicContact CG1-CZ 4.19Å; V883-F925 HydrophobicContact CG2-CD1 4.4Å; V883-F925 HydrophobicContact CG2-CD2 4.33Å; V883-F925 HydrophobicContact CG2-CE1 3.91Å; V883-F925 HydrophobicContact CG2-CE2 3.84Å; V883-F925 HydrophobicContact CG2-CZ 3.58Å; A921-F925 WeakPolarHBondContact O-CB 3.31Å; A921-F925 PolarHBondContact O-N 3.17Å; F925-G928 PolarHBondContact O-N 3.22Å; F925-L929 HydrophobicContact CE1-CD1 4.14Å; F925-L929 VanDerWaalsContact O-CB 3.31Å; F925-L929 WeakPolarHBondContact O-CB 3.13Å; F925-L929 PolarHBondContact O-N 3.2Å; F925-L945 HydrophobicContact CD2-CD2 3.93Å; F925-L945 HydrophobicContact CE2-CD2 4.23Å; F925-D948 WeakPolarHBondContact CB-OD2 3.49Å; F925-D948 VanDerWaalsContact CD2-OD2 3.31Å; F925-D948 WeakPolarHBondContact CD2-OD2 3.35Å; F925-D948 PolarHBondContact N-OD1 3.1Å; F925-F952 HydrophobicContact CB-CE2 4.36Å; F925-F952 HydrophobicContact CD2-CE2 4.43Å
926	L	91.5	Very high	88.2	Confident	93 Å²	93	66.1 Å²	66.1	49%	0.487	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-43.3	177.1	-73.4	171.2	0	0	0	111.4	I922 T923 L929 I930	I922-L926 HydrophobicContact CG2-CD1 4.07Å; I922-L926 WeakPolarHBondContact O-CB 3.2Å; I922-L926 VanDerWaalsContact O-CG 3.26Å; I922-L926 WeakPolarHBondContact O-CG 3.41Å; I922-L926 PolarHBondContact O-N 3.45Å; T923-L926 PolarHBondContact O-N 3.4Å; L926-L929 PolarHBondContact O-N 2.92Å; L926-I930 WeakPolarHBondContact O-CD1 3.31Å; L926-I930 VanDerWaalsContact O-CG1 3.22Å; L926-I930 WeakPolarHBondContact O-CG1 3.4Å; L926-I930 PolarHBondContact O-N 3.42Å
927	L	92.3	Very high	88.2	Confident	83 Å²	83	61.8 Å²	61.8	44%	0.435	30%	0.299	S	S	.	.	H	α-helix	trans	-64.5	-44.9	177.2	-174.8	64.1	0	0	0	111.6	T923 L924 L929 I930 C931 L944	T923-L927 WeakPolarHBondContact O-CB 3.45Å; T923-L927 PolarHBondContact O-N 2.91Å; L924-L927 PolarHBondContact O-N 3.33Å; L927-L929 VanDerWaalsContact C-N 3.32Å; L927-L929 PolarHBondContact O-N 3.43Å; L927-I930 PolarHBondContact O-N 3.13Å; L927-C931 WeakPolarHBondContact O-CB 3.29Å; L927-C931 PolarHBondContact O-N 3.46Å; L927-C931 PolarHBondContact O-SG 3.49Å; L927-C931 VanDerWaalsContact O-SG 3.38Å; L927-L944 HydrophobicContact CD2-CD1 4.15Å; L927-L944 HydrophobicContact CG-CD1 4.05Å
928	G	90.5	Very high	88.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-41.1	175.2	0	0	0	0	0	112.1	L924 F925 C931 R932	L924-G928 PolarHBondContact O-N 2.97Å; F925-G928 PolarHBondContact O-N 3.22Å; G928-C931 PolarHBondContact O-N 2.79Å; G928-R932 WeakPolarHBondContact O-CB 3.15Å; G928-R932 PolarHBondContact O-N 3.41Å
929	L	88	Confident	87.9	Confident	43 Å²	43	66.2 Å²	66.2	23%	0.225	32%	0.32	C	S	.	.	H	α-helix	trans	-64.1	-43.5	174.9	-170.2	151.5	0	0	0	111.6	Y880 F925 L926 L927 R932 M933	Y880-L929 HydrophobicContact CD1-CD1 3.91Å; Y880-L929 HydrophobicContact CD2-CD1 4.21Å; Y880-L929 HydrophobicContact CE1-CD1 3.79Å; Y880-L929 HydrophobicContact CE2-CD1 4.1Å; Y880-L929 HydrophobicContact CG-CD1 4.12Å; F925-L929 HydrophobicContact CE1-CD1 4.14Å; F925-L929 VanDerWaalsContact O-CB 3.31Å; F925-L929 WeakPolarHBondContact O-CB 3.13Å; F925-L929 PolarHBondContact O-N 3.2Å; L926-L929 PolarHBondContact O-N 2.92Å; L927-L929 VanDerWaalsContact C-N 3.32Å; L927-L929 PolarHBondContact O-N 3.43Å; L929-R932 WeakPolarHBondContact O-CB 3.5Å; L929-R932 PolarHBondContact O-N 3.44Å; L929-M933 HydrophobicContact CD2-CG 4.45Å; L929-M933 VanDerWaalsContact O-CG 3.29Å; L929-M933 WeakPolarHBondContact O-CG 3.36Å; L929-M933 PolarHBondContact O-N 2.86Å
930	I	88.6	Confident	87.9	Confident	91 Å²	91	70.2 Å²	70.2	47%	0.467	33%	0.331	S	S	.	.	H	α-helix	trans	-62.4	-49.4	175.9	-67.7	163.3	0	0	0	110.4	L926 L927 R932 M933 F934	L926-I930 WeakPolarHBondContact O-CD1 3.31Å; L926-I930 VanDerWaalsContact O-CG1 3.22Å; L926-I930 WeakPolarHBondContact O-CG1 3.4Å; L926-I930 PolarHBondContact O-N 3.42Å; L927-I930 PolarHBondContact O-N 3.13Å; I930-R932 PolarHBondContact O-N 3.38Å; I930-M933 PolarHBondContact O-N 3.43Å; I930-F934 HydrophobicContact CG2-CE2 3.95Å; I930-F934 VanDerWaalsContact O-CD2 3.25Å; I930-F934 WeakPolarHBondContact O-CD2 3.28Å
931	C	87.9	Confident	87.7	Confident	24 Å²	24	66.6 Å²	66.6	16%	0.162	31%	0.313	C	S	.	.	H	α-helix	trans	-61.2	-32.9	178.5	-71.9	0	0	0	0	112.6	L927 G928 M933 F934 S937 L944	L927-C931 WeakPolarHBondContact O-CB 3.29Å; L927-C931 PolarHBondContact O-N 3.46Å; L927-C931 PolarHBondContact O-SG 3.49Å; L927-C931 VanDerWaalsContact O-SG 3.38Å; G928-C931 PolarHBondContact O-N 2.79Å; C931-M933 VanDerWaalsContact C-N 3.27Å; C931-M933 PolarHBondContact O-N 3.46Å; C931-F934 PolarHBondContact O-N 3.25Å; C931-S937 CarbonylContact O-C 3.44Å; C931-S937 PolarHBondContact O-OG 2.74Å; C931-L944 HydrophobicContact CB-CD1 4.45Å
932	R	85.2	Confident	87.7	Confident	7 Å²	7	72.5 Å²	72.5	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-65.8	-29.4	174.6	-167	-161.6	75.8	112.3	-9.9	112.6	F864 E876 Y880 G928 L929 I930 F934	F864-R932 HydrophobicContact CE2-CG 4.29Å; F864-R932 HydrophobicContact CZ-CG 4.07Å; E876-R932 IonicContact OE1-NH1 3.61Å; E876-R932 IonicContact OE2-CZ 3.94Å; E876-R932 IonicContact OE2-NH1 3.96Å; E876-R932 PolarHBondContact OE2-NH1 3.32Å; E876-R932 IonicContact OE2-NH2 2.75Å; Y880-R932 PolarHBondContact OH-NE 2.92Å; Y880-R932 PolarHBondContact OH-NH2 2.77Å; G928-R932 WeakPolarHBondContact O-CB 3.15Å; G928-R932 PolarHBondContact O-N 3.41Å; L929-R932 WeakPolarHBondContact O-CB 3.5Å; L929-R932 PolarHBondContact O-N 3.44Å; I930-R932 PolarHBondContact O-N 3.38Å; R932-F934 PolarHBondContact O-N 3.01Å
933	M	82.8	Confident	87.6	Confident	83 Å²	83	76.9 Å²	76.9	41%	0.409	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-12.4	-177.4	-61.8	-80.4	59	0	0	114.1	L929 I930 C931	L929-M933 HydrophobicContact CD2-CG 4.45Å; L929-M933 VanDerWaalsContact O-CG 3.29Å; L929-M933 WeakPolarHBondContact O-CG 3.36Å; L929-M933 PolarHBondContact O-N 2.86Å; I930-M933 PolarHBondContact O-N 3.43Å; C931-M933 VanDerWaalsContact C-N 3.27Å; C931-M933 PolarHBondContact O-N 3.46Å
934	F	84.1	Confident	87.6	Confident	109 Å²	109	75.8 Å²	75.8	48%	0.478	35%	0.346	S	S	.	.	S	Bend	trans	-111	132.1	176.3	-58.3	-82.2	0	0	0	111.3	I930 C931 R932 W936 S937 Y938	I930-F934 HydrophobicContact CG2-CE2 3.95Å; I930-F934 VanDerWaalsContact O-CD2 3.25Å; I930-F934 WeakPolarHBondContact O-CD2 3.28Å; C931-F934 PolarHBondContact O-N 3.25Å; R932-F934 PolarHBondContact O-N 3.01Å; F934-W936 VanDerWaalsContact C-N 3.28Å; F934-W936 HydrophobicContact CB-CG 4.37Å; F934-W936 AromaticContact CG-NE1 3.82Å; F934-W936 PolarHBondContact O-N 3.47Å; F934-S937 PolarHBondContact O-N 3.49Å; F934-S937 PolarHBondContact O-OG 3.14Å; F934-Y938 PolarHBondContact O-N 3.36Å
935	E	78.7	Confident	87.6	Confident	157 Å²	157	74.8 Å²	74.8	73%	0.734	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-59.6	-36.1	179.6	-73.7	-178.6	169.4	0	0	113.2	P867 S937	P867-E935 HydrophobicContact CG-CG 3.68Å; E935-S937 PolarHBondContact O-N 2.94Å; E935-S937 VanDerWaalsContact O-N 3.16Å
936	W	82.4	Confident	87.5	Confident	220 Å²	220	76.6 Å²	76.6	83%	0.833	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-66	-15.3	-178.2	71.8	-7.2	0	0	0	114.8	F934	F934-W936 VanDerWaalsContact C-N 3.28Å; F934-W936 HydrophobicContact CB-CG 4.37Å; F934-W936 AromaticContact CG-NE1 3.82Å; F934-W936 PolarHBondContact O-N 3.47Å
937	S	87.4	Confident	87.6	Confident	14 Å²	14	75.8 Å²	75.8	10%	0.098	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-132.2	15.7	-168.9	59.2	0	0	0	0	111.8	C931 F934 E935 E939 Y940 G941	C931-S937 CarbonylContact O-C 3.44Å; C931-S937 PolarHBondContact O-OG 2.74Å; F934-S937 PolarHBondContact O-N 3.49Å; F934-S937 PolarHBondContact O-OG 3.14Å; E935-S937 PolarHBondContact O-N 2.94Å; E935-S937 VanDerWaalsContact O-N 3.16Å; S937-E939 PolarHBondContact O-N 3.5Å; S937-Y940 PolarHBondContact O-N 3.32Å; S937-G941 PolarHBondContact O-N 2.93Å
938	Y	84.8	Confident	87.7	Confident	39 Å²	39	71.9 Å²	71.9	15%	0.153	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-42.9	-178.3	173.9	-101.8	0	0	0	112.5	F864 K865 K866 F934 G941 R942	F864-Y938 AromaticContact CD1-CE2 4Å; F864-Y938 HydrophobicContact CD1-CE2 4Å; F864-Y938 AromaticContact CD1-CZ 3.66Å; F864-Y938 WeakPolarHBondContact CD1-OH 3.49Å; F864-Y938 HydrophobicContact CE1-CD2 4.18Å; F864-Y938 HydrophobicContact CE1-CE1 4.15Å; F864-Y938 AromaticContact CE1-CE2 3.41Å; F864-Y938 HydrophobicContact CE1-CE2 3.41Å; F864-Y938 VanDerWaalsContact CE1-CE2 3.41Å; F864-Y938 AromaticContact CE1-CZ 3.41Å; F864-Y938 VanDerWaalsContact CE1-CZ 3.41Å; F864-Y938 WeakPolarHBondContact CE1-OH 3.42Å; F864-Y938 HydrophobicContact CZ-CE2 4.05Å; F864-Y938 PolarHBondContact O-OH 3.49Å; F864-Y938 VanDerWaalsContact O-OH 3.1Å; K865-Y938 VanDerWaalsContact C-OH 3.3Å; K865-Y938 WeakPolarHBondContact O-CE2 3.46Å; K865-Y938 PolarHBondContact O-OH 2.73Å; K866-Y938 HydrophobicContact CG-CE1 4.12Å; K866-Y938 PolarHBondContact N-OH 3.4Å; F934-Y938 PolarHBondContact O-N 3.36Å; Y938-G941 PolarHBondContact O-N 2.96Å; Y938-R942 PolarHBondContact O-N 3.05Å
939	E	84.6	Confident	87.8	Confident	149 Å²	149	74.2 Å²	74.2	70%	0.696	34%	0.342	S	S	*	.	H	α-helix	trans	-64.9	-45.9	178.6	-65.6	-175.6	167.6	0	0	111	S937 G941 R942 E943	S937-E939 PolarHBondContact O-N 3.5Å; E939-G941 VanDerWaalsContact C-N 3.3Å; E939-G941 PolarHBondContact O-N 2.61Å; E939-R942 WeakPolarHBondContact O-CB 3.13Å; E939-R942 PolarHBondContact O-N 2.72Å; E939-R942 VanDerWaalsContact O-N 3.14Å; E939-E943 WeakPolarHBondContact O-CG 3.39Å; E939-E943 PolarHBondContact O-N 2.98Å
940	Y	87.5	Confident	88	Confident	151 Å²	151	78 Å²	78	59%	0.592	36%	0.36	S	S	*	.	H	α-helix	trans	-61.9	-36.5	173.1	-65.2	-65.6	0	0	0	112.6	S937 R942 E943 L944	S937-Y940 PolarHBondContact O-N 3.32Å; Y940-R942 VanDerWaalsContact C-N 3.33Å; Y940-R942 PolarHBondContact O-N 3.16Å; Y940-E943 PolarHBondContact O-N 2.93Å; Y940-L944 WeakPolarHBondContact O-CB 3.37Å; Y940-L944 VanDerWaalsContact O-CG 3.28Å; Y940-L944 WeakPolarHBondContact O-CG 3.47Å; Y940-L944 PolarHBondContact O-N 3.32Å
941	G	87.8	Confident	88.1	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-39.9	174.2	0	0	0	0	0	112.3	S937 Y938 E939 L945	S937-G941 PolarHBondContact O-N 2.93Å; Y938-G941 PolarHBondContact O-N 2.96Å; E939-G941 VanDerWaalsContact C-N 3.3Å; E939-G941 PolarHBondContact O-N 2.61Å; G941-L945 WeakPolarHBondContact O-CB 3.47Å; G941-L945 VanDerWaalsContact O-CG 3.26Å; G941-L945 WeakPolarHBondContact O-CG 3.46Å; G941-L945 PolarHBondContact O-N 2.73Å
942	R	89	Confident	88.2	Confident	125 Å²	125	73.4 Å²	73.4	47%	0.472	34%	0.336	S	S	.	.	H	α-helix	trans	-64.5	-48.2	173.4	-168.3	-179.1	176.5	-169.3	-0.3	111.5	F864 Y938 E939 Y940 L944 L945 C946	F864-R942 HydrophobicContact CD1-CB 4.26Å; F864-R942 HydrophobicContact CD1-CG 3.97Å; F864-R942 HydrophobicContact CE1-CB 3.53Å; F864-R942 HydrophobicContact CE1-CG 3.74Å; F864-R942 HydrophobicContact CZ-CB 3.89Å; F864-R942 HydrophobicContact CZ-CG 4.26Å; Y938-R942 PolarHBondContact O-N 3.05Å; E939-R942 WeakPolarHBondContact O-CB 3.13Å; E939-R942 PolarHBondContact O-N 2.72Å; E939-R942 VanDerWaalsContact O-N 3.14Å; Y940-R942 VanDerWaalsContact C-N 3.33Å; Y940-R942 PolarHBondContact O-N 3.16Å; R942-L944 VanDerWaalsContact C-N 3.34Å; R942-L944 PolarHBondContact O-N 3.1Å; R942-L945 PolarHBondContact O-N 3.43Å; R942-C946 PolarHBondContact O-N 2.68Å; R942-C946 PolarHBondContact O-SG 3.23Å
943	E	90.1	Very high	88.5	Confident	117 Å²	117	75.2 Å²	75.2	55%	0.547	35%	0.348	S	S	.	.	H	α-helix	trans	-58.7	-45	178.3	-69.7	178	171.3	0	0	111.8	E939 Y940 C946 V947	E939-E943 WeakPolarHBondContact O-CG 3.39Å; E939-E943 PolarHBondContact O-N 2.98Å; Y940-E943 PolarHBondContact O-N 2.93Å; E943-C946 WeakPolarHBondContact O-CB 3.42Å; E943-C946 PolarHBondContact O-N 3.5Å; E943-V947 WeakPolarHBondContact O-CG2 3.32Å; E943-V947 PolarHBondContact O-N 3.02Å; E943-V947 VanDerWaalsContact O-N 3.08Å
944	L	92	Very high	88.8	Confident	45 Å²	45	75.6 Å²	75.6	24%	0.236	35%	0.351	C	S	.	.	H	α-helix	trans	-62.6	-43.5	176.4	-74.3	172.1	0	0	0	112.2	L927 C931 Y940 R942 C946 V947 D948	L927-L944 HydrophobicContact CD2-CD1 4.15Å; L927-L944 HydrophobicContact CG-CD1 4.05Å; C931-L944 HydrophobicContact CB-CD1 4.45Å; Y940-L944 WeakPolarHBondContact O-CB 3.37Å; Y940-L944 VanDerWaalsContact O-CG 3.28Å; Y940-L944 WeakPolarHBondContact O-CG 3.47Å; Y940-L944 PolarHBondContact O-N 3.32Å; R942-L944 VanDerWaalsContact C-N 3.34Å; R942-L944 PolarHBondContact O-N 3.1Å; L944-C946 VanDerWaalsContact C-N 3.32Å; L944-C946 PolarHBondContact O-N 2.97Å; L944-V947 PolarHBondContact O-N 3.4Å; L944-D948 VanDerWaalsContact O-CB 3.29Å; L944-D948 WeakPolarHBondContact O-CB 3.32Å; L944-D948 PolarHBondContact O-N 2.94Å
945	L	91	Very high	88.8	Confident	12 Å²	12	72 Å²	72	6%	0.063	33%	0.334	C	S	.	.	H	α-helix	trans	-69.4	-27.6	178	-70.9	169.6	0	0	0	113	Y856 L860 F864 F925 G941 R942 F949	Y856-L945 WeakPolarHBondContact OH-CD2 3.24Å; Y856-L945 PolarHBondContact OH-O 2.98Å; L860-L945 HydrophobicContact CD1-CB 3.96Å; F864-L945 HydrophobicContact CE2-CD1 3.67Å; F864-L945 HydrophobicContact CZ-CD1 4.21Å; F925-L945 HydrophobicContact CD2-CD2 3.93Å; F925-L945 HydrophobicContact CE2-CD2 4.23Å; G941-L945 WeakPolarHBondContact O-CB 3.47Å; G941-L945 VanDerWaalsContact O-CG 3.26Å; G941-L945 WeakPolarHBondContact O-CG 3.46Å; G941-L945 PolarHBondContact O-N 2.73Å; R942-L945 PolarHBondContact O-N 3.43Å; L945-F949 PolarHBondContact O-N 2.97Å
946	C	92.2	Very high	89.2	Confident	47 Å²	47	65.9 Å²	65.9	32%	0.318	31%	0.306	S	S	.	.	H	α-helix	trans	-66.4	-46.6	170.4	-70.3	0	0	0	0	111.4	L860 R942 E943 L944 D948 F949 M950	L860-C946 HydrophobicContact CD2-CB 4.44Å; R942-C946 PolarHBondContact O-N 2.68Å; R942-C946 PolarHBondContact O-SG 3.23Å; E943-C946 WeakPolarHBondContact O-CB 3.42Å; E943-C946 PolarHBondContact O-N 3.5Å; L944-C946 VanDerWaalsContact C-N 3.32Å; L944-C946 PolarHBondContact O-N 2.97Å; C946-D948 VanDerWaalsContact C-N 3.31Å; C946-F949 WeakPolarHBondContact O-CB 3.48Å; C946-F949 PolarHBondContact O-N 3.46Å; C946-M950 PolarHBondContact O-N 2.96Å
947	V	92.3	Very high	89.4	Confident	76 Å²	76	58.9 Å²	58.9	46%	0.461	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-41.6	175.5	174.3	0	0	0	0	110.2	E943 L944 F949 M950 V951	E943-V947 WeakPolarHBondContact O-CG2 3.32Å; E943-V947 PolarHBondContact O-N 3.02Å; E943-V947 VanDerWaalsContact O-N 3.08Å; L944-V947 PolarHBondContact O-N 3.4Å; V947-F949 PolarHBondContact O-N 3.05Å; V947-M950 WeakPolarHBondContact O-CA 3.47Å; V947-M950 VanDerWaalsContact O-CB 3.31Å; V947-M950 WeakPolarHBondContact O-CB 3.16Å; V947-M950 PolarHBondContact O-N 2.97Å; V947-V951 PolarHBondContact O-N 3.18Å; V947-V951 VanDerWaalsContact O-N 3.09Å
948	D	93.9	Very high	89.2	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-41.3	177.5	-173.8	57.2	0	0	0	112.6	Y856 A921 L924 F925 L944 C946 M950 V951 F952	Y856-D948 PolarHBondContact OH-OD2 3.16Å; Y856-D948 VanDerWaalsContact OH-OD2 3.05Å; A921-D948 WeakPolarHBondContact CA-OD1 3.41Å; L924-D948 HydrophobicContact CB-CB 4.16Å; L924-D948 WeakPolarHBondContact CB-OD1 3.45Å; F925-D948 WeakPolarHBondContact CB-OD2 3.49Å; F925-D948 VanDerWaalsContact CD2-OD2 3.31Å; F925-D948 WeakPolarHBondContact CD2-OD2 3.35Å; F925-D948 PolarHBondContact N-OD1 3.1Å; L944-D948 VanDerWaalsContact O-CB 3.29Å; L944-D948 WeakPolarHBondContact O-CB 3.32Å; L944-D948 PolarHBondContact O-N 2.94Å; C946-D948 VanDerWaalsContact C-N 3.31Å; D948-M950 VanDerWaalsContact C-N 3.26Å; D948-M950 PolarHBondContact O-N 2.74Å; D948-V951 PolarHBondContact O-N 3.29Å; D948-F952 WeakPolarHBondContact O-CD2 3.45Å; D948-F952 PolarHBondContact O-N 2.92Å; D948-F952 WeakPolarHBondContact OD2-CD2 3.46Å; D948-F952 WeakPolarHBondContact OD2-CE2 3.48Å
949	F	92.9	Very high	89.3	Confident	49 Å²	49	58 Å²	58	22%	0.215	28%	0.28	C	S	.	.	H	α-helix	trans	-56.5	-40.2	171.1	178.3	-110.1	0	0	0	112.3	L853 Y856 A857 L945 C946 V947 V951 F952 T953	L853-F949 HydrophobicContact CB-CE2 4.44Å; L853-F949 HydrophobicContact CD2-CD2 4.46Å; L853-F949 HydrophobicContact CD2-CE2 4.05Å; Y856-F949 HydrophobicContact CD1-CB 3.92Å; Y856-F949 AromaticContact CD1-CD2 3.41Å; Y856-F949 HydrophobicContact CD1-CD2 3.41Å; Y856-F949 VanDerWaalsContact CD1-CD2 3.41Å; Y856-F949 HydrophobicContact CD1-CE2 4.29Å; Y856-F949 AromaticContact CD1-CG 3.99Å; Y856-F949 HydrophobicContact CD1-CG 3.99Å; Y856-F949 HydrophobicContact CE1-CB 3.59Å; Y856-F949 HydrophobicContact CE1-CD2 4.02Å; Y856-F949 HydrophobicContact CE1-CG 4.19Å; Y856-F949 AromaticContact CG-CD2 3.84Å; Y856-F949 HydrophobicContact CG-CD2 3.84Å; A857-F949 HydrophobicContact CB-CE2 4.14Å; A857-F949 HydrophobicContact CB-CZ 4.01Å; L945-F949 PolarHBondContact O-N 2.97Å; C946-F949 WeakPolarHBondContact O-CB 3.48Å; C946-F949 PolarHBondContact O-N 3.46Å; V947-F949 PolarHBondContact O-N 3.05Å; F949-V951 VanDerWaalsContact C-N 3.33Å; F949-V951 PolarHBondContact O-N 3.35Å; F949-F952 PolarHBondContact O-N 3.33Å; F949-T953 HydrophobicContact CD1-CG2 4.35Å; F949-T953 HydrophobicContact CD2-CG2 4.34Å; F949-T953 HydrophobicContact CE1-CG2 3.9Å; F949-T953 HydrophobicContact CE2-CG2 3.91Å; F949-T953 HydrophobicContact CZ-CG2 3.67Å; F949-T953 WeakPolarHBondContact O-CG2 3.44Å; F949-T953 PolarHBondContact O-N 3.12Å; F949-T953 PolarHBondContact O-OG1 2.93Å
950	M	92.3	Very high	89.3	Confident	122 Å²	122	54.6 Å²	54.6	60%	0.601	26%	0.263	S	S	*	.	H	α-helix	trans	-62.8	-39.9	174.5	-64.9	-177.5	64.6	0	0	111.7	C946 V947 D948 T953 L954	C946-M950 PolarHBondContact O-N 2.96Å; V947-M950 WeakPolarHBondContact O-CA 3.47Å; V947-M950 VanDerWaalsContact O-CB 3.31Å; V947-M950 WeakPolarHBondContact O-CB 3.16Å; V947-M950 PolarHBondContact O-N 2.97Å; D948-M950 VanDerWaalsContact C-N 3.26Å; D948-M950 PolarHBondContact O-N 2.74Å; M950-T953 WeakPolarHBondContact CA-OG1 3.26Å; M950-T953 PolarHBondContact O-N 3.44Å; M950-T953 PolarHBondContact O-OG1 3.22Å; M950-L954 WeakPolarHBondContact O-CG 3.39Å; M950-L954 PolarHBondContact O-N 3.31Å
951	V	91.7	Very high	89.2	Confident	19 Å²	19	48 Å²	48	12%	0.115	24%	0.24	C	C	.	.	H	α-helix	trans	-65.9	-44.3	176.7	-174.5	0	0	0	0	111.1	A921 L924 V947 D948 F949 T953 L954 R955	A921-V951 HydrophobicContact CB-CB 4.38Å; A921-V951 HydrophobicContact CB-CG1 3.78Å; L924-V951 HydrophobicContact CD1-CG2 4.06Å; V947-V951 PolarHBondContact O-N 3.18Å; V947-V951 VanDerWaalsContact O-N 3.09Å; D948-V951 PolarHBondContact O-N 3.29Å; F949-V951 VanDerWaalsContact C-N 3.33Å; F949-V951 PolarHBondContact O-N 3.35Å; V951-T953 VanDerWaalsContact C-N 3.31Å; V951-T953 PolarHBondContact O-N 2.98Å; V951-L954 PolarHBondContact O-N 3.13Å; V951-R955 PolarHBondContact O-N 3.47Å
952	F	90.6	Very high	89.1	Confident	1 Å²	1	49 Å²	49	0%	0.004	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-35	174.8	-83.2	-67.8	0	0	0	112.8	Y849 F852 L853 Y856 A921 F925 D948 F949 R955	Y849-F952 PolarHBondContact OH-O 3.26Å; F852-F952 HydrophobicContact CE1-CB 4.38Å; F852-F952 AromaticContact CE1-CD1 3.93Å; F852-F952 HydrophobicContact CE1-CD1 3.93Å; F852-F952 HydrophobicContact CE1-CE1 4.42Å; F852-F952 HydrophobicContact CE1-CG 4.13Å; F852-F952 HydrophobicContact CZ-CD1 4.19Å; F852-F952 HydrophobicContact CZ-CE1 4.32Å; F852-F952 HydrophobicContact CZ-CG 4.32Å; L853-F952 HydrophobicContact CD2-CB 4.13Å; Y856-F952 HydrophobicContact CE2-CD2 4.28Å; A921-F952 HydrophobicContact CB-CD1 4.42Å; A921-F952 HydrophobicContact CB-CD2 4.39Å; A921-F952 HydrophobicContact CB-CE1 4.11Å; A921-F952 HydrophobicContact CB-CE2 4.07Å; A921-F952 HydrophobicContact CB-CZ 3.93Å; F925-F952 HydrophobicContact CB-CE2 4.36Å; F925-F952 HydrophobicContact CD2-CE2 4.43Å; D948-F952 WeakPolarHBondContact O-CD2 3.45Å; D948-F952 PolarHBondContact O-N 2.92Å; D948-F952 WeakPolarHBondContact OD2-CD2 3.46Å; D948-F952 WeakPolarHBondContact OD2-CE2 3.48Å; F949-F952 PolarHBondContact O-N 3.33Å; F952-R955 WeakPolarHBondContact O-CB 3.34Å; F952-R955 PolarHBondContact O-N 2.87Å
953	T	90.4	Very high	88.9	Confident	45 Å²	45	47.5 Å²	47.5	28%	0.276	24%	0.243	S	C	.	.	H	α-helix	trans	-70.5	-36.5	175	53.4	0	0	0	0	112.4	L853 F949 M950 V951 R955 L956	L853-T953 HydrophobicContact CD1-CG2 4.24Å; L853-T953 HydrophobicContact CD2-CG2 3.9Å; F949-T953 HydrophobicContact CD1-CG2 4.35Å; F949-T953 HydrophobicContact CD2-CG2 4.34Å; F949-T953 HydrophobicContact CE1-CG2 3.9Å; F949-T953 HydrophobicContact CE2-CG2 3.91Å; F949-T953 HydrophobicContact CZ-CG2 3.67Å; F949-T953 WeakPolarHBondContact O-CG2 3.44Å; F949-T953 PolarHBondContact O-N 3.12Å; F949-T953 PolarHBondContact O-OG1 2.93Å; M950-T953 WeakPolarHBondContact CA-OG1 3.26Å; M950-T953 PolarHBondContact O-N 3.44Å; M950-T953 PolarHBondContact O-OG1 3.22Å; V951-T953 VanDerWaalsContact C-N 3.31Å; V951-T953 PolarHBondContact O-N 2.98Å; T953-R955 PolarHBondContact O-N 3.06Å; T953-L956 VanDerWaalsContact O-CB 3.26Å; T953-L956 WeakPolarHBondContact O-CB 3.41Å; T953-L956 WeakPolarHBondContact O-CG 3.35Å; T953-L956 PolarHBondContact O-N 3.29Å
954	L	88.3	Confident	88.6	Confident	90 Å²	90	49.4 Å²	49.4	47%	0.471	25%	0.249	S	C	.	.	H	α-helix	trans	-59.8	-29.9	173.7	-72.8	174.1	0	0	0	112.8	M950 V951 L956 I957	M950-L954 WeakPolarHBondContact O-CG 3.39Å; M950-L954 PolarHBondContact O-N 3.31Å; V951-L954 PolarHBondContact O-N 3.13Å; L954-L956 PolarHBondContact O-N 3.08Å; L954-L956 VanDerWaalsContact O-N 3.14Å; L954-I957 HydrophobicContact CD2-CD1 4.02Å; L954-I957 WeakPolarHBondContact O-CB 3.38Å; L954-I957 WeakPolarHBondContact O-CG1 3.5Å; L954-I957 PolarHBondContact O-N 3.28Å
955	R	85.9	Confident	88.3	Confident	34 Å²	34	57 Å²	57	13%	0.128	28%	0.275	C	S	.	.	H	α-helix	trans	-58.8	-22.7	174.5	-169	177.4	-178.1	149.3	5.3	113.3	Y849 E890 D918 V951 F952 T953 I957 H958 I959	Y849-R955 WeakPolarHBondContact OH-CB 3.36Å; E890-R955 IonicContact OE1-CZ 2.76Å; E890-R955 VanDerWaalsContact OE1-CZ 3.28Å; E890-R955 IonicContact OE1-NH1 3.68Å; E890-R955 PolarHBondContact OE1-NH1 2.66Å; E890-R955 IonicContact OE1-NH2 2.66Å; E890-R955 PolarHBondContact OE1-NH2 3.32Å; D918-R955 WeakPolarHBondContact OD1-CD 3.42Å; D918-R955 IonicContact OD1-CZ 3.86Å; D918-R955 IonicContact OD1-NE 2.83Å; D918-R955 PolarHBondContact OD1-NE 3.21Å; D918-R955 VanDerWaalsContact OD1-NE 3.15Å; D918-R955 IonicContact OD1-NH1 3.76Å; D918-R955 PolarHBondContact OD1-NH1 3.11Å; D918-R955 IonicContact OD1-NH2 3.9Å; D918-R955 IonicContact OD2-CZ 2.79Å; D918-R955 IonicContact OD2-NE 3.53Å; D918-R955 IonicContact OD2-NH1 3.64Å; D918-R955 PolarHBondContact OD2-NH1 3.07Å; D918-R955 IonicContact OD2-NH2 3.57Å; D918-R955 PolarHBondContact OD2-NH2 3.31Å; V951-R955 PolarHBondContact O-N 3.47Å; F952-R955 WeakPolarHBondContact O-CB 3.34Å; F952-R955 PolarHBondContact O-N 2.87Å; T953-R955 PolarHBondContact O-N 3.06Å; R955-I957 PolarHBondContact O-N 3.38Å; R955-H958 WeakPolarHBondContact O-CB 3.4Å; R955-H958 PolarHBondContact O-N 3.04Å; R955-H958 VanDerWaalsContact O-N 3.12Å; R955-I959 PolarHBondContact O-N 2.67Å
956	L	86.3	Confident	88.1	Confident	28 Å²	28	60.1 Å²	60.1	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-58.6	-30.6	173.2	-72.5	174.4	0	0	0	112.8	Y849 F850 L853 T953 L954 H958 I959 F960	Y849-L956 HydrophobicContact CD1-CD2 3.51Å; Y849-L956 HydrophobicContact CD1-CG 4.32Å; Y849-L956 HydrophobicContact CE1-CD2 3.69Å; Y849-L956 HydrophobicContact CE1-CG 4Å; F850-L956 HydrophobicContact CE1-CD1 4.05Å; F850-L956 HydrophobicContact CE1-CD2 4.26Å; F850-L956 HydrophobicContact CE2-CD2 4.27Å; F850-L956 HydrophobicContact CZ-CD1 4.3Å; F850-L956 HydrophobicContact CZ-CD2 3.99Å; L853-L956 HydrophobicContact CD1-CD1 3.65Å; L853-L956 HydrophobicContact CD1-CD2 4.14Å; L853-L956 HydrophobicContact CD1-CG 3.94Å; T953-L956 VanDerWaalsContact O-CB 3.26Å; T953-L956 WeakPolarHBondContact O-CB 3.41Å; T953-L956 WeakPolarHBondContact O-CG 3.35Å; T953-L956 PolarHBondContact O-N 3.29Å; L954-L956 PolarHBondContact O-N 3.08Å; L954-L956 VanDerWaalsContact O-N 3.14Å; L956-H958 VanDerWaalsContact C-N 3.28Å; L956-H958 PolarHBondContact O-N 2.88Å; L956-I959 HydrophobicContact CD2-CD1 4.41Å; L956-I959 PolarHBondContact O-N 3.01Å; L956-F960 HydrophobicContact CB-CD2 4.44Å; L956-F960 HydrophobicContact CB-CE2 4.27Å; L956-F960 WeakPolarHBondContact O-CD2 3.43Å; L956-F960 PolarHBondContact O-N 2.82Å
957	I	87.1	Confident	87.9	Confident	73 Å²	73	58 Å²	58	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-41.2	178.3	-60.1	173.2	0	0	0	110.1	W914 L954 R955 F960 A961 I970	W914-I957 HydrophobicContact CH2-CB 4.19Å; W914-I957 HydrophobicContact CH2-CG2 3.9Å; L954-I957 HydrophobicContact CD2-CD1 4.02Å; L954-I957 WeakPolarHBondContact O-CB 3.38Å; L954-I957 WeakPolarHBondContact O-CG1 3.5Å; L954-I957 PolarHBondContact O-N 3.28Å; R955-I957 PolarHBondContact O-N 3.38Å; I957-F960 PolarHBondContact O-N 2.69Å; I957-A961 PolarHBondContact O-N 3.29Å; I957-I970 HydrophobicContact CG2-CD1 4.06Å; I957-I970 HydrophobicContact CG2-CG1 4.02Å; I957-I970 HydrophobicContact CG2-CG2 3.85Å; I957-I970 WeakPolarHBondContact O-CD1 3.49Å
958	H	83.6	Confident	87.8	Confident	22 Å²	22	55.1 Å²	55.1	10%	0.102	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-43.7	177	-173.5	-126.9	0	0	0	111.7	W914 R955 L956 F960 A961	W914-H958 AromaticContact CD1-CD2 3.38Å; W914-H958 AromaticContact CD1-NE2 3.62Å; W914-H958 HydrophobicContact CD2-CB 3.82Å; W914-H958 AromaticContact CD2-CD2 3.54Å; W914-H958 AromaticContact CD2-CG 3.77Å; W914-H958 AromaticContact CE2-CD2 3.58Å; W914-H958 HydrophobicContact CE3-CB 3.66Å; W914-H958 HydrophobicContact CG-CB 4.38Å; W914-H958 AromaticContact CG-CD2 3.41Å; W914-H958 VanDerWaalsContact CG-CD2 3.41Å; W914-H958 AromaticContact CG-CG 3.82Å; W914-H958 AromaticContact CG-NE2 3.82Å; W914-H958 HydrophobicContact CH2-CB 4.3Å; W914-H958 HydrophobicContact CZ2-CB 4.44Å; W914-H958 HydrophobicContact CZ3-CB 3.91Å; W914-H958 AromaticContact NE1-CD2 3.47Å; W914-H958 PolarHBondContact NE1-CD2 3.46Å; R955-H958 WeakPolarHBondContact O-CB 3.4Å; R955-H958 PolarHBondContact O-N 3.04Å; R955-H958 VanDerWaalsContact O-N 3.12Å; L956-H958 VanDerWaalsContact C-N 3.28Å; L956-H958 PolarHBondContact O-N 2.88Å; H958-F960 VanDerWaalsContact C-N 3.34Å; H958-F960 PolarHBondContact O-N 2.85Å; H958-A961 WeakPolarHBondContact O-CB 3.46Å; H958-A961 PolarHBondContact O-N 3.38Å; H958-A961 VanDerWaalsContact O-N 3.14Å
959	I	85.3	Confident	87.5	Confident	14 Å²	14	61.5 Å²	61.5	7%	0.072	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-42	178.9	-62.7	173.7	0	0	0	111	F842 V846 Y849 R955 L956 A961 I962	F842-I959 HydrophobicContact CE2-CG2 3.85Å; F842-I959 HydrophobicContact CZ-CG2 3.99Å; V846-I959 HydrophobicContact CG2-CG2 3.45Å; V846-I959 VanDerWaalsContact CG2-CG2 3.45Å; Y849-I959 HydrophobicContact CD1-CD1 3.92Å; Y849-I959 HydrophobicContact CE1-CD1 4.29Å; Y849-I959 HydrophobicContact CG-CD1 4.11Å; R955-I959 PolarHBondContact O-N 2.67Å; L956-I959 HydrophobicContact CD2-CD1 4.41Å; L956-I959 PolarHBondContact O-N 3.01Å; I959-A961 PolarHBondContact O-N 3.24Å; I959-I962 WeakPolarHBondContact O-CG2 3.08Å
960	F	85.8	Confident	87.3	Confident	77 Å²	77	60.8 Å²	60.8	34%	0.338	29%	0.286	S	S	.	.	H	α-helix	trans	-74.8	-9.3	178.8	-68.8	-50.7	0	0	0	114.5	F850 L956 I957 H958 I962 H963 L966 I970	F850-F960 HydrophobicContact CE2-CZ 4.08Å; F850-F960 HydrophobicContact CZ-CE2 4.34Å; F850-F960 AromaticContact CZ-CZ 3.85Å; F850-F960 HydrophobicContact CZ-CZ 3.85Å; L956-F960 HydrophobicContact CB-CD2 4.44Å; L956-F960 HydrophobicContact CB-CE2 4.27Å; L956-F960 WeakPolarHBondContact O-CD2 3.43Å; L956-F960 PolarHBondContact O-N 2.82Å; I957-F960 PolarHBondContact O-N 2.69Å; H958-F960 VanDerWaalsContact C-N 3.34Å; H958-F960 PolarHBondContact O-N 2.85Å; F960-I962 PolarHBondContact O-N 3.13Å; F960-H963 WeakPolarHBondContact O-CB 3.46Å; F960-H963 PolarHBondContact O-N 3.31Å; F960-L966 HydrophobicContact CB-CD1 4.3Å; F960-I970 HydrophobicContact CB-CD1 4.47Å
961	A	84.4	Confident	87	Confident	12 Å²	12	55.9 Å²	55.9	10%	0.099	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.3	177.2	0	0	0	0	0	113.1	I957 H958 I959 H963 G967 I970 W1104 L1111	I957-A961 PolarHBondContact O-N 3.29Å; H958-A961 WeakPolarHBondContact O-CB 3.46Å; H958-A961 PolarHBondContact O-N 3.38Å; H958-A961 VanDerWaalsContact O-N 3.14Å; I959-A961 PolarHBondContact O-N 3.24Å; A961-H963 VanDerWaalsContact C-N 3.25Å; A961-H963 PolarHBondContact O-N 3.34Å; A961-G967 VanDerWaalsContact O-CA 3.24Å; A961-G967 WeakPolarHBondContact O-CA 3.36Å; A961-I970 HydrophobicContact CB-CD1 4.19Å; A961-W1104 PolarHBondContact O-NE1 2.91Å; A961-L1111 HydrophobicContact CB-CD1 4.47Å
962	I	85.3	Confident	86.8	Confident	20 Å²	20	55.2 Å²	55.2	10%	0.103	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-18.5	176.6	-159.1	161.9	0	0	0	113.4	W728 F842 I959 F960 W1104 L1111 Y1115	W728-I962 HydrophobicContact CE3-CD1 4.28Å; W728-I962 HydrophobicContact CH2-CD1 3.35Å; W728-I962 HydrophobicContact CZ2-CD1 3.99Å; W728-I962 HydrophobicContact CZ3-CD1 3.54Å; F842-I962 HydrophobicContact CE1-CG2 4.1Å; F842-I962 HydrophobicContact CE2-CG2 3.68Å; F842-I962 HydrophobicContact CZ-CG2 3.41Å; F842-I962 VanDerWaalsContact CZ-CG2 3.41Å; I959-I962 WeakPolarHBondContact O-CG2 3.08Å; F960-I962 PolarHBondContact O-N 3.13Å; I962-W1104 WeakPolarHBondContact O-CZ2 3.4Å; I962-L1111 HydrophobicContact CB-CD1 4.46Å; I962-L1111 HydrophobicContact CD1-CB 4.42Å; I962-Y1115 HydrophobicContact CD1-CD2 4.26Å
963	H	85.6	Confident	86.6	Confident	94 Å²	94	59.5 Å²	59.5	44%	0.435	28%	0.284	S	S	.	.	S	Bend	trans	-76	132.4	-174.4	-177.5	-97.9	0	0	0	111.9	F960 A961 R965 L966 G967	F960-H963 WeakPolarHBondContact O-CB 3.46Å; F960-H963 PolarHBondContact O-N 3.31Å; A961-H963 VanDerWaalsContact C-N 3.25Å; A961-H963 PolarHBondContact O-N 3.34Å; H963-R965 VanDerWaalsContact C-N 3.27Å; H963-R965 PolarHBondContact ND1-N 3.4Å; H963-R965 PolarHBondContact O-N 3.31Å; H963-R965 VanDerWaalsContact O-N 3.07Å; H963-L966 HydrophobicContact CB-CB 4.29Å; H963-L966 PolarHBondContact O-N 2.86Å; H963-L966 VanDerWaalsContact O-N 3.12Å; H963-G967 PolarHBondContact O-N 3.02Å
964	K	84.2	Confident	86.4	Confident	157 Å²	157	59.7 Å²	59.7	68%	0.683	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-37	-173.8	-171.8	175.8	-178.4	178	0	114.9	W1104	K964-W1104 HydrophobicContact CB-CH2 3.96Å; K964-W1104 HydrophobicContact CB-CZ2 4.34Å; K964-W1104 HydrophobicContact CG-CH2 3.96Å; K964-W1104 HydrophobicContact CG-CZ3 4.24Å
965	R	85.3	Confident	86.2	Confident	206 Å²	206	58.9 Å²	58.9	78%	0.777	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-23.2	-178.1	-61	-173.9	177.8	-178.1	-0.6	114.6	H963	H963-R965 VanDerWaalsContact C-N 3.27Å; H963-R965 PolarHBondContact ND1-N 3.4Å; H963-R965 PolarHBondContact O-N 3.31Å; H963-R965 VanDerWaalsContact O-N 3.07Å
966	L	86.7	Confident	86.2	Confident	77 Å²	77	58.6 Å²	58.6	40%	0.403	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-33.2	-174.3	-67.3	174.7	0	0	0	111.9	F960 H963 K969 I970	F960-L966 HydrophobicContact CB-CD1 4.3Å; H963-L966 HydrophobicContact CB-CB 4.29Å; H963-L966 PolarHBondContact O-N 2.86Å; H963-L966 VanDerWaalsContact O-N 3.12Å; L966-K969 WeakPolarHBondContact O-CB 3.24Å; L966-K969 PolarHBondContact O-N 3.49Å; L966-K969 VanDerWaalsContact O-N 3.17Å; L966-I970 HydrophobicContact CB-CD1 4.5Å; L966-I970 WeakPolarHBondContact O-CG1 3.49Å; L966-I970 PolarHBondContact O-N 3.32Å; L966-I970 VanDerWaalsContact O-N 3.07Å
967	G	87.6	Confident	86.2	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-55	-53.5	-178.2	0	0	0	0	0	114.7	A961 H963 K969 I970 I971 W1104	A961-G967 VanDerWaalsContact O-CA 3.24Å; A961-G967 WeakPolarHBondContact O-CA 3.36Å; H963-G967 PolarHBondContact O-N 3.02Å; G967-K969 PolarHBondContact O-N 3.3Å; G967-I970 PolarHBondContact O-N 3.48Å; G967-I971 PolarHBondContact O-N 2.98Å; G967-I971 VanDerWaalsContact O-N 3.12Å; G967-W1104 VanDerWaalsContact CA-CD1 3.47Å
968	P	89.8	Confident	86.1	Confident	17 Å²	17	66.4 Å²	66.4	11%	0.11	32%	0.321	C	S	.	.	H	α-helix	trans	-57.1	-36.8	178.1	-25.4	33.8	0	0	0	113	I971 I972 W1104	P968-I971 PolarHBondContact O-N 3.2Å; P968-I972 WeakPolarHBondContact O-CD1 3.48Å; P968-I972 VanDerWaalsContact O-CG1 3.29Å; P968-I972 WeakPolarHBondContact O-CG1 3.32Å; P968-I972 PolarHBondContact O-N 3.2Å; P968-I972 VanDerWaalsContact O-N 3.09Å; P968-W1104 HydrophobicContact CB-CB 4.43Å; P968-W1104 HydrophobicContact CG-CB 3.86Å; P968-W1104 HydrophobicContact CG-CD2 4.14Å; P968-W1104 HydrophobicContact CG-CE3 4.47Å; P968-W1104 HydrophobicContact CG-CG 3.84Å
969	K	88.6	Confident	86.2	Confident	133 Å²	133	67 Å²	67	58%	0.578	33%	0.325	S	S	*	.	H	α-helix	trans	-65.9	-39.3	177.2	-61.9	-175.3	177.4	-172.5	0	112.2	L966 G967 I971 I972 V973	L966-K969 WeakPolarHBondContact O-CB 3.24Å; L966-K969 PolarHBondContact O-N 3.49Å; L966-K969 VanDerWaalsContact O-N 3.17Å; G967-K969 PolarHBondContact O-N 3.3Å; K969-I971 VanDerWaalsContact C-N 3.33Å; K969-I972 WeakPolarHBondContact O-CB 3.49Å; K969-I972 PolarHBondContact O-N 3.43Å; K969-V973 WeakPolarHBondContact O-CG2 3.22Å; K969-V973 PolarHBondContact O-N 2.99Å
970	I	88.3	Confident	86.4	Confident	35 Å²	35	67.9 Å²	67.9	18%	0.179	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-39.1	176.7	-67.3	161.7	0	0	0	110.8	I957 F960 A961 L966 G967 I972 V973 G974	I957-I970 HydrophobicContact CG2-CD1 4.06Å; I957-I970 HydrophobicContact CG2-CG1 4.02Å; I957-I970 HydrophobicContact CG2-CG2 3.85Å; I957-I970 WeakPolarHBondContact O-CD1 3.49Å; F960-I970 HydrophobicContact CB-CD1 4.47Å; A961-I970 HydrophobicContact CB-CD1 4.19Å; L966-I970 HydrophobicContact CB-CD1 4.5Å; L966-I970 WeakPolarHBondContact O-CG1 3.49Å; L966-I970 PolarHBondContact O-N 3.32Å; L966-I970 VanDerWaalsContact O-N 3.07Å; G967-I970 PolarHBondContact O-N 3.48Å; I970-I972 VanDerWaalsContact C-N 3.34Å; I970-I972 PolarHBondContact O-N 3Å; I970-V973 PolarHBondContact O-N 2.82Å; I970-G974 PolarHBondContact O-N 3.19Å
971	I	85.5	Confident	86.5	Confident	19 Å²	19	71.1 Å²	71.1	10%	0.097	35%	0.345	C	S	.	.	H	α-helix	trans	-64.2	-40.2	175.9	-62.5	174.3	0	0	0	111.3	G967 P968 K969 G974 K975 W1104	G967-I971 PolarHBondContact O-N 2.98Å; G967-I971 VanDerWaalsContact O-N 3.12Å; P968-I971 PolarHBondContact O-N 3.2Å; K969-I971 VanDerWaalsContact C-N 3.33Å; I971-G974 PolarHBondContact O-N 2.97Å; I971-K975 PolarHBondContact O-N 3.31Å; I971-K975 VanDerWaalsContact O-N 3.15Å; I971-W1104 VanDerWaalsContact CD1-CA 3.41Å; I971-W1104 HydrophobicContact CD1-CB 3.64Å; I971-W1104 HydrophobicContact CD1-CG 4.44Å
972	I	87.8	Confident	86.6	Confident	5 Å²	5	76.9 Å²	76.9	3%	0.026	37%	0.368	C	S	.	.	H	α-helix	trans	-60.8	-50.7	176.2	-68.3	160.8	0	0	0	110.3	P968 K969 I970 G974 K975 M976 F1093 V1096	P968-I972 WeakPolarHBondContact O-CD1 3.48Å; P968-I972 VanDerWaalsContact O-CG1 3.29Å; P968-I972 WeakPolarHBondContact O-CG1 3.32Å; P968-I972 PolarHBondContact O-N 3.2Å; P968-I972 VanDerWaalsContact O-N 3.09Å; K969-I972 WeakPolarHBondContact O-CB 3.49Å; K969-I972 PolarHBondContact O-N 3.43Å; I970-I972 VanDerWaalsContact C-N 3.34Å; I970-I972 PolarHBondContact O-N 3Å; I972-G974 VanDerWaalsContact C-N 3.28Å; I972-G974 PolarHBondContact O-N 3.33Å; I972-K975 PolarHBondContact O-N 3.41Å; I972-K975 VanDerWaalsContact O-N 3.08Å; I972-M976 HydrophobicContact CG2-CG 4.29Å; I972-M976 HydrophobicContact CG2-SD 3.58Å; I972-M976 VanDerWaalsContact CG2-SD 3.58Å; I972-M976 WeakPolarHBondContact O-CG 3.27Å; I972-M976 PolarHBondContact O-N 3.43Å; I972-F1093 HydrophobicContact CD1-CE2 4.19Å; I972-F1093 HydrophobicContact CG2-CD2 3.71Å; I972-F1093 HydrophobicContact CG2-CE2 4.07Å; I972-V1096 HydrophobicContact CB-CG1 4.44Å; I972-V1096 HydrophobicContact CG1-CG1 3.83Å
973	V	87.7	Confident	86.7	Confident	90 Å²	90	76.9 Å²	76.9	55%	0.545	37%	0.367	S	S	.	.	H	α-helix	trans	-55.1	-46.2	176.6	172.8	0	0	0	0	110.8	K969 I970 K975 M976 M977	K969-V973 WeakPolarHBondContact O-CG2 3.22Å; K969-V973 PolarHBondContact O-N 2.99Å; I970-V973 PolarHBondContact O-N 2.82Å; V973-K975 VanDerWaalsContact C-N 3.29Å; V973-K975 PolarHBondContact O-N 3.28Å; V973-M976 PolarHBondContact O-N 3.12Å; V973-M977 WeakPolarHBondContact O-CG 3.22Å; V973-M977 PolarHBondContact O-N 2.76Å; V973-M977 VanDerWaalsContact O-N 3.17Å
974	G	84.9	Confident	86.9	Confident	49 Å²	49	77 Å²	77	51%	0.505	37%	0.37	S	S	.	.	H	α-helix	trans	-59.4	-34.4	178.9	0	0	0	0	0	114.3	I970 I971 I972	I970-G974 PolarHBondContact O-N 3.19Å; I971-G974 PolarHBondContact O-N 2.97Å; I972-G974 VanDerWaalsContact C-N 3.28Å; I972-G974 PolarHBondContact O-N 3.33Å
975	K	84.4	Confident	87.2	Confident	73 Å²	73	75.6 Å²	75.6	32%	0.317	37%	0.365	S	S	.	.	H	α-helix	trans	-78.6	-37	176.7	-73.4	-171.7	179.8	177.8	0	112.9	I971 I972 V973 M977 K978 V1096 Y1103	I971-K975 PolarHBondContact O-N 3.31Å; I971-K975 VanDerWaalsContact O-N 3.15Å; I972-K975 PolarHBondContact O-N 3.41Å; I972-K975 VanDerWaalsContact O-N 3.08Å; V973-K975 VanDerWaalsContact C-N 3.29Å; V973-K975 PolarHBondContact O-N 3.28Å; K975-M977 PolarHBondContact O-N 2.79Å; K975-K978 PolarHBondContact O-N 3.26Å; K975-V1096 HydrophobicContact CB-CG2 4.3Å; K975-V1096 HydrophobicContact CD-CG1 3.8Å; K975-V1096 HydrophobicContact CD-CG2 3.93Å; K975-Y1103 VanDerWaalsContact NZ-CE2 3.28Å; K975-Y1103 PolarHBondContact NZ-OH 3.27Å
976	M	87.1	Confident	87.4	Confident	28 Å²	28	71.9 Å²	71.9	14%	0.138	36%	0.355	C	S	.	.	H	α-helix	trans	-67.2	-21.1	177.7	-65.2	175.2	78.2	0	0	113	I972 V973 K978 D979 V980 F1089	I972-M976 HydrophobicContact CG2-CG 4.29Å; I972-M976 HydrophobicContact CG2-SD 3.58Å; I972-M976 VanDerWaalsContact CG2-SD 3.58Å; I972-M976 WeakPolarHBondContact O-CG 3.27Å; I972-M976 PolarHBondContact O-N 3.43Å; V973-M976 PolarHBondContact O-N 3.12Å; M976-K978 PolarHBondContact O-N 3.16Å; M976-K978 VanDerWaalsContact O-N 3.15Å; M976-D979 PolarHBondContact O-N 3.18Å; M976-D979 VanDerWaalsContact O-N 3.09Å; M976-V980 WeakPolarHBondContact O-CG2 3.44Å; M976-V980 PolarHBondContact O-N 3.37Å; M976-V980 VanDerWaalsContact O-N 3.15Å; M976-F1089 HydrophobicContact CB-CE1 4.49Å; M976-F1089 HydrophobicContact CE-CB 3.38Å; M976-F1089 HydrophobicContact CE-CD1 3.55Å; M976-F1089 HydrophobicContact CE-CD2 3.9Å; M976-F1089 HydrophobicContact CE-CE1 4.29Å; M976-F1089 HydrophobicContact CE-CG 3.33Å
977	M	85.3	Confident	87.6	Confident	110 Å²	110	69 Å²	69	54%	0.542	34%	0.339	S	S	.	.	H	α-helix	trans	-58.5	-25.3	176.4	-75.1	-58.6	-65.6	0	0	114.2	V973 K975 V980 F981	V973-M977 WeakPolarHBondContact O-CG 3.22Å; V973-M977 PolarHBondContact O-N 2.76Å; V973-M977 VanDerWaalsContact O-N 3.17Å; K975-M977 PolarHBondContact O-N 2.79Å; M977-V980 HydrophobicContact SD-CG2 4.24Å; M977-F981 PolarHBondContact O-N 2.97Å; M977-F981 VanDerWaalsContact O-N 3.12Å
978	K	84.3	Confident	87.8	Confident	155 Å²	155	70.6 Å²	70.6	67%	0.674	36%	0.356	S	S	*	.	H	α-helix	trans	-67.3	-43.1	175.1	-69.4	-174.4	-180	179.4	0	111.5	K975 M976 V980 F981 F982	K975-K978 PolarHBondContact O-N 3.26Å; M976-K978 PolarHBondContact O-N 3.16Å; M976-K978 VanDerWaalsContact O-N 3.15Å; K978-V980 VanDerWaalsContact C-N 3.35Å; K978-F981 PolarHBondContact O-N 2.99Å; K978-F982 WeakPolarHBondContact O-CD2 3.48Å; K978-F982 PolarHBondContact O-N 3.49Å
979	D	87.2	Confident	88	Confident	36 Å²	36	73.1 Å²	73.1	19%	0.193	37%	0.371	C	S	.	.	H	α-helix	trans	-67.2	-39.6	178.1	-51.8	-27.7	0	0	0	110.6	M976 F981 F982 F983 F1089 T1092	M976-D979 PolarHBondContact O-N 3.18Å; M976-D979 VanDerWaalsContact O-N 3.09Å; D979-F981 VanDerWaalsContact C-N 3.27Å; D979-F981 PolarHBondContact O-N 3.44Å; D979-F982 PolarHBondContact O-N 3.41Å; D979-F983 WeakPolarHBondContact O-CB 3.23Å; D979-F983 PolarHBondContact O-N 3Å; D979-F1089 HydrophobicContact CB-CD1 4.4Å; D979-F1089 HydrophobicContact CB-CE1 4.12Å; D979-T1092 WeakPolarHBondContact OD2-CB 3.46Å; D979-T1092 WeakPolarHBondContact OD2-CG2 3.26Å; D979-T1092 PolarHBondContact OD2-OG1 3.46Å
980	V	87.9	Confident	88.2	Confident	32 Å²	32	71.1 Å²	71.1	19%	0.194	36%	0.36	C	S	.	.	H	α-helix	trans	-55.4	-43.8	173.3	178.5	0	0	0	0	110.8	M976 M977 K978 F983 L984 F1089	M976-V980 WeakPolarHBondContact O-CG2 3.44Å; M976-V980 PolarHBondContact O-N 3.37Å; M976-V980 VanDerWaalsContact O-N 3.15Å; M977-V980 HydrophobicContact SD-CG2 4.24Å; K978-V980 VanDerWaalsContact C-N 3.35Å; V980-F983 PolarHBondContact O-N 3.31Å; V980-L984 HydrophobicContact CG1-CD1 3.83Å; V980-L984 HydrophobicContact CG1-CG 4.1Å; V980-L984 WeakPolarHBondContact O-CB 3.25Å; V980-L984 WeakPolarHBondContact O-CG 3.41Å; V980-L984 PolarHBondContact O-N 3.42Å; V980-F1089 HydrophobicContact CG2-CE1 3.77Å; V980-F1089 HydrophobicContact CG2-CZ 3.44Å; V980-F1089 VanDerWaalsContact CG2-CZ 3.44Å
981	F	88.1	Confident	88.4	Confident	145 Å²	145	70.1 Å²	70.1	64%	0.636	35%	0.354	S	S	*	.	H	α-helix	trans	-64.7	-44.7	-177.8	-176.6	-95.4	0	0	0	112.2	M977 K978 D979 F983 L984 F985	M977-F981 PolarHBondContact O-N 2.97Å; M977-F981 VanDerWaalsContact O-N 3.12Å; K978-F981 PolarHBondContact O-N 2.99Å; D979-F981 VanDerWaalsContact C-N 3.27Å; D979-F981 PolarHBondContact O-N 3.44Å; F981-F983 VanDerWaalsContact C-N 3.31Å; F981-F983 PolarHBondContact O-N 2.96Å; F981-L984 PolarHBondContact O-N 3.13Å; F981-F985 PolarHBondContact O-N 3.31Å; F981-F985 VanDerWaalsContact O-N 3.11Å
982	F	86.6	Confident	88.8	Confident	133 Å²	133	73.5 Å²	73.5	58%	0.583	37%	0.371	S	S	*	.	H	α-helix	trans	-62.7	-39.7	175.2	-71.8	-68.5	0	0	0	111.9	K978 D979 F985 F986	K978-F982 WeakPolarHBondContact O-CD2 3.48Å; K978-F982 PolarHBondContact O-N 3.49Å; D979-F982 PolarHBondContact O-N 3.41Å; F982-F985 WeakPolarHBondContact O-CB 3.45Å; F982-F985 PolarHBondContact O-N 3.45Å; F982-F986 VanDerWaalsContact O-CD2 3.22Å; F982-F986 WeakPolarHBondContact O-CD2 3.41Å; F982-F986 PolarHBondContact O-N 2.94Å
983	F	88.7	Confident	89.1	Confident	19 Å²	19	75.9 Å²	75.9	8%	0.083	39%	0.391	C	S	.	.	H	α-helix	trans	-63.9	-48.4	175.3	172.9	-96.5	0	0	0	112.7	D979 V980 F981 F985 F986 L987 L1081 L1085	D979-F983 WeakPolarHBondContact O-CB 3.23Å; D979-F983 PolarHBondContact O-N 3Å; V980-F983 PolarHBondContact O-N 3.31Å; F981-F983 VanDerWaalsContact C-N 3.31Å; F981-F983 PolarHBondContact O-N 2.96Å; F983-F985 PolarHBondContact O-N 3.37Å; F983-F986 PolarHBondContact O-N 3.2Å; F983-F986 VanDerWaalsContact O-N 3.12Å; F983-L987 HydrophobicContact CE1-CB 4.31Å; F983-L987 HydrophobicContact CE1-CD2 3.9Å; F983-L987 HydrophobicContact CZ-CB 4.49Å; F983-L987 HydrophobicContact CZ-CD2 4.31Å; F983-L987 WeakPolarHBondContact O-CB 3.43Å; F983-L987 PolarHBondContact O-N 3.41Å; F983-L1081 HydrophobicContact CE2-CB 3.91Å; F983-L1081 WeakPolarHBondContact CE2-O 2.72Å; F983-L1081 HydrophobicContact CZ-CB 4.48Å; F983-L1085 HydrophobicContact CB-CD1 3.81Å; F983-L1085 HydrophobicContact CD1-CD1 4.16Å; F983-L1085 HydrophobicContact CD1-CD2 3.93Å; F983-L1085 HydrophobicContact CD2-CB 3.97Å; F983-L1085 HydrophobicContact CD2-CD1 4.01Å; F983-L1085 HydrophobicContact CD2-CD2 4.43Å; F983-L1085 HydrophobicContact CD2-CG 4.37Å; F983-L1085 HydrophobicContact CE1-CD2 3.86Å; F983-L1085 HydrophobicContact CE2-CB 3.94Å; F983-L1085 HydrophobicContact CE2-CD2 4.35Å; F983-L1085 HydrophobicContact CG-CB 4.45Å; F983-L1085 HydrophobicContact CG-CD1 3.72Å; F983-L1085 HydrophobicContact CG-CD2 4.22Å; F983-L1085 HydrophobicContact CG-CG 4.35Å; F983-L1085 HydrophobicContact CZ-CB 4.42Å; F983-L1085 HydrophobicContact CZ-CD2 4.08Å
984	L	88.8	Confident	89.4	Confident	96 Å²	96	72.1 Å²	72.1	50%	0.503	37%	0.367	S	S	.	.	H	α-helix	trans	-58.6	-33.2	178.6	-76.5	175.9	0	0	0	111.8	V980 F981 G988	V980-L984 HydrophobicContact CG1-CD1 3.83Å; V980-L984 HydrophobicContact CG1-CG 4.1Å; V980-L984 WeakPolarHBondContact O-CB 3.25Å; V980-L984 WeakPolarHBondContact O-CG 3.41Å; V980-L984 PolarHBondContact O-N 3.42Å; F981-L984 PolarHBondContact O-N 3.13Å; L984-G988 PolarHBondContact O-N 2.99Å
985	F	90.8	Very high	89.7	Confident	128 Å²	128	69.9 Å²	69.9	56%	0.561	34%	0.344	S	S	*	.	H	α-helix	trans	-62.6	-51.5	173.4	176.7	-98.5	0	0	0	112.1	F981 F982 F983 L987 G988 V989	F981-F985 PolarHBondContact O-N 3.31Å; F981-F985 VanDerWaalsContact O-N 3.11Å; F982-F985 WeakPolarHBondContact O-CB 3.45Å; F982-F985 PolarHBondContact O-N 3.45Å; F983-F985 PolarHBondContact O-N 3.37Å; F985-L987 PolarHBondContact O-N 3.31Å; F985-G988 PolarHBondContact O-N 3.01Å; F985-V989 HydrophobicContact CE1-CG2 4.41Å; F985-V989 HydrophobicContact CE2-CG2 4.44Å; F985-V989 HydrophobicContact CZ-CG2 4.24Å; F985-V989 WeakPolarHBondContact O-CG2 3.35Å; F985-V989 PolarHBondContact O-N 3.33Å
986	F	89.9	Confident	90	Very high	129 Å²	129	70.2 Å²	70.2	57%	0.566	35%	0.352	S	S	*	.	H	α-helix	trans	-63.2	-41.6	177.2	-74.7	-67.4	0	0	0	112.3	F982 F983 V989 W990	F982-F986 VanDerWaalsContact O-CD2 3.22Å; F982-F986 WeakPolarHBondContact O-CD2 3.41Å; F982-F986 PolarHBondContact O-N 2.94Å; F983-F986 PolarHBondContact O-N 3.2Å; F983-F986 VanDerWaalsContact O-N 3.12Å; F986-V989 PolarHBondContact O-N 2.78Å; F986-W990 WeakPolarHBondContact O-CB 3.38Å; F986-W990 PolarHBondContact O-N 3.27Å; F986-W990 VanDerWaalsContact O-N 3.07Å
987	L	90.9	Very high	90.2	Very high	16 Å²	16	70.5 Å²	70.5	8%	0.084	36%	0.359	C	S	.	.	H	α-helix	trans	-62.3	-43.4	176.6	-173.7	67	0	0	0	111.4	F983 F985 W990 I991 I1024 T1077 L1081	F983-L987 HydrophobicContact CE1-CB 4.31Å; F983-L987 HydrophobicContact CE1-CD2 3.9Å; F983-L987 HydrophobicContact CZ-CB 4.49Å; F983-L987 HydrophobicContact CZ-CD2 4.31Å; F983-L987 WeakPolarHBondContact O-CB 3.43Å; F983-L987 PolarHBondContact O-N 3.41Å; F985-L987 PolarHBondContact O-N 3.31Å; L987-W990 PolarHBondContact O-N 2.88Å; L987-I991 HydrophobicContact CD1-CD1 4.37Å; L987-I991 HydrophobicContact CD2-CD1 4.28Å; L987-I991 HydrophobicContact CG-CD1 3.82Å; L987-I991 HydrophobicContact CG-CG1 4.37Å; L987-I991 WeakPolarHBondContact O-CB 2.98Å; L987-I991 VanDerWaalsContact O-CG1 3.29Å; L987-I991 WeakPolarHBondContact O-CG1 3.11Å; L987-I991 PolarHBondContact O-N 3.01Å; L987-I1024 HydrophobicContact CD1-CD1 3.77Å; L987-I1024 HydrophobicContact CD2-CD1 4.12Å; L987-I1024 HydrophobicContact CG-CD1 4.25Å; L987-T1077 HydrophobicContact CD1-CG2 4.29Å; L987-L1081 HydrophobicContact CD1-CD1 4.31Å
988	G	91.5	Very high	90.3	Very high	34 Å²	34	66.1 Å²	66.1	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-44.4	178.8	0	0	0	0	0	112.9	L984 F985 W990 I991 M992	L984-G988 PolarHBondContact O-N 2.99Å; F985-G988 PolarHBondContact O-N 3.01Å; G988-W990 VanDerWaalsContact C-N 3.3Å; G988-W990 PolarHBondContact O-N 3.13Å; G988-I991 PolarHBondContact O-N 3.32Å; G988-M992 WeakPolarHBondContact O-CB 3.45Å; G988-M992 PolarHBondContact O-N 3.04Å
989	V	93.5	Very high	90.5	Very high	71 Å²	71	59.9 Å²	59.9	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-60.6	-42.2	174.9	172.5	0	0	0	0	110.9	F985 F986 M992 A993	F985-V989 HydrophobicContact CE1-CG2 4.41Å; F985-V989 HydrophobicContact CE2-CG2 4.44Å; F985-V989 HydrophobicContact CZ-CG2 4.24Å; F985-V989 WeakPolarHBondContact O-CG2 3.35Å; F985-V989 PolarHBondContact O-N 3.33Å; F986-V989 PolarHBondContact O-N 2.78Å; V989-M992 PolarHBondContact O-N 3.06Å; V989-A993 WeakPolarHBondContact O-CB 3.37Å; V989-A993 PolarHBondContact O-N 3.01Å
990	W	93	Very high	90.5	Very high	91 Å²	91	61.7 Å²	61.7	35%	0.345	33%	0.331	S	S	.	.	H	α-helix	trans	-70.8	-41.5	-179.9	-166	-110.3	0	0	0	113	F986 L987 G988 M992 A993 Y994 Y1073 V1076	F986-W990 WeakPolarHBondContact O-CB 3.38Å; F986-W990 PolarHBondContact O-N 3.27Å; F986-W990 VanDerWaalsContact O-N 3.07Å; L987-W990 PolarHBondContact O-N 2.88Å; G988-W990 VanDerWaalsContact C-N 3.3Å; G988-W990 PolarHBondContact O-N 3.13Å; W990-M992 VanDerWaalsContact C-N 3.32Å; W990-M992 PolarHBondContact O-N 3.44Å; W990-A993 PolarHBondContact O-N 3.13Å; W990-Y994 PolarHBondContact O-N 2.93Å; W990-Y1073 AromaticContact CD1-CD2 3.68Å; W990-Y1073 AromaticContact CD1-CE2 3.71Å; W990-Y1073 AromaticContact NE1-CD2 3.51Å; W990-V1076 HydrophobicContact CD2-CG1 4.29Å; W990-V1076 HydrophobicContact CZ2-CB 3.95Å; W990-V1076 HydrophobicContact CZ2-CG1 3.85Å; W990-V1076 HydrophobicContact CZ2-CG2 3.95Å
991	I	93.6	Very high	90.4	Very high	13 Å²	13	62.5 Å²	62.5	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-57.5	-46.9	172.5	-76.3	169.4	0	0	0	110.2	L987 G988 G995 F1017 P1020 Y1021 I1024	L987-I991 HydrophobicContact CD1-CD1 4.37Å; L987-I991 HydrophobicContact CD2-CD1 4.28Å; L987-I991 HydrophobicContact CG-CD1 3.82Å; L987-I991 HydrophobicContact CG-CG1 4.37Å; L987-I991 WeakPolarHBondContact O-CB 2.98Å; L987-I991 VanDerWaalsContact O-CG1 3.29Å; L987-I991 WeakPolarHBondContact O-CG1 3.11Å; L987-I991 PolarHBondContact O-N 3.01Å; G988-I991 PolarHBondContact O-N 3.32Å; I991-G995 WeakPolarHBondContact O-CA 3.48Å; I991-G995 PolarHBondContact O-N 3.36Å; I991-F1017 HydrophobicContact CG2-CD1 4.31Å; I991-P1020 HydrophobicContact CG2-CB 4.2Å; I991-Y1021 HydrophobicContact CD1-CD2 4.09Å; I991-I1024 HydrophobicContact CD1-CD1 3.84Å; I991-I1024 HydrophobicContact CG1-CD1 4.2Å
992	M	93.6	Very high	90.1	Very high	90 Å²	90	56.2 Å²	56.2	44%	0.443	31%	0.307	S	S	.	.	H	α-helix	trans	-62.8	-45.4	179.9	-174.4	171.2	62.5	0	0	111.6	G988 V989 W990 G995 V996 F1017	G988-M992 WeakPolarHBondContact O-CB 3.45Å; G988-M992 PolarHBondContact O-N 3.04Å; V989-M992 PolarHBondContact O-N 3.06Å; W990-M992 VanDerWaalsContact C-N 3.32Å; W990-M992 PolarHBondContact O-N 3.44Å; M992-G995 PolarHBondContact O-N 2.94Å; M992-V996 HydrophobicContact CG-CG2 4.41Å; M992-V996 WeakPolarHBondContact O-CB 3.35Å; M992-V996 VanDerWaalsContact O-CG2 3.29Å; M992-V996 WeakPolarHBondContact O-CG2 3.37Å; M992-V996 PolarHBondContact O-N 3.44Å; M992-F1017 HydrophobicContact CB-CE1 3.93Å; M992-F1017 HydrophobicContact CB-CZ 4.5Å; M992-F1017 HydrophobicContact CG-CE1 3.97Å; M992-F1017 HydrophobicContact CG-CZ 4.03Å; M992-F1017 HydrophobicContact SD-CE1 4.35Å; M992-F1017 HydrophobicContact SD-CZ 4.2Å
993	A	93.8	Very high	89.9	Confident	55 Å²	55	50.5 Å²	50.5	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-61.1	-48.2	179.3	0	0	0	0	0	112.1	V989 W990 A997	V989-A993 WeakPolarHBondContact O-CB 3.37Å; V989-A993 PolarHBondContact O-N 3.01Å; W990-A993 PolarHBondContact O-N 3.13Å; A993-A997 WeakPolarHBondContact O-CB 3.32Å; A993-A997 PolarHBondContact O-N 3.37Å
994	Y	93	Very high	89.3	Confident	12 Å²	12	60.3 Å²	60.3	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-67.9	-43.7	177.1	167.9	-99.2	0	0	0	112.2	W990 V996 A997 N998 P1020 H1023 L1069 L1070 Y1073	W990-Y994 PolarHBondContact O-N 2.93Å; Y994-V996 PolarHBondContact O-N 3.18Å; Y994-A997 PolarHBondContact O-N 2.93Å; Y994-N998 HydrophobicContact CE2-CB 4.39Å; Y994-N998 VanDerWaalsContact O-CB 3.24Å; Y994-N998 WeakPolarHBondContact O-CB 3.08Å; Y994-N998 PolarHBondContact O-N 3.21Å; Y994-N998 PolarHBondContact OH-ND2 3.02Å; Y994-P1020 HydrophobicContact CD1-CB 3.68Å; Y994-P1020 HydrophobicContact CD1-CG 3.79Å; Y994-P1020 HydrophobicContact CE1-CB 3.83Å; Y994-P1020 HydrophobicContact CE1-CG 3.82Å; Y994-H1023 AromaticContact CE1-ND1 3.86Å; Y994-L1069 HydrophobicContact CD2-CB 4.49Å; Y994-L1069 HydrophobicContact CE2-CB 4.33Å; Y994-L1070 WeakPolarHBondContact OH-CD1 3.19Å; Y994-Y1073 HydrophobicContact CD1-CD1 4.23Å; Y994-Y1073 AromaticContact CD1-CD2 3.73Å; Y994-Y1073 HydrophobicContact CD1-CD2 3.73Å; Y994-Y1073 HydrophobicContact CD1-CE1 4.35Å; Y994-Y1073 AromaticContact CD1-CE2 3.85Å; Y994-Y1073 HydrophobicContact CD1-CE2 3.85Å; Y994-Y1073 AromaticContact CD1-CG 3.92Å; Y994-Y1073 HydrophobicContact CD1-CG 3.92Å; Y994-Y1073 AromaticContact CD2-CD2 3.98Å; Y994-Y1073 HydrophobicContact CD2-CD2 3.98Å; Y994-Y1073 AromaticContact CD2-CG 3.86Å; Y994-Y1073 HydrophobicContact CD2-CG 3.86Å; Y994-Y1073 HydrophobicContact CE1-CD1 4.15Å; Y994-Y1073 HydrophobicContact CE1-CD2 4.43Å; Y994-Y1073 HydrophobicContact CE1-CE1 4.34Å; Y994-Y1073 HydrophobicContact CE1-CG 4.19Å; Y994-Y1073 HydrophobicContact CE2-CG 4.16Å; Y994-Y1073 HydrophobicContact CG-CD1 4.47Å; Y994-Y1073 AromaticContact CG-CD2 3.45Å; Y994-Y1073 HydrophobicContact CG-CD2 3.45Å; Y994-Y1073 VanDerWaalsContact CG-CD2 3.45Å; Y994-Y1073 AromaticContact CG-CE2 3.97Å; Y994-Y1073 HydrophobicContact CG-CE2 3.97Å; Y994-Y1073 AromaticContact CG-CG 3.73Å; Y994-Y1073 HydrophobicContact CG-CG 3.73Å
995	G	91.4	Very high	88.7	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-61.7	-44.7	-178.2	0	0	0	0	0	113.1	I991 M992 N998 Q999 V1016	I991-G995 WeakPolarHBondContact O-CA 3.48Å; I991-G995 PolarHBondContact O-N 3.36Å; M992-G995 PolarHBondContact O-N 2.94Å; G995-N998 PolarHBondContact O-N 2.91Å; G995-Q999 VanDerWaalsContact O-CB 3.31Å; G995-Q999 WeakPolarHBondContact O-CB 3.44Å; G995-Q999 PolarHBondContact O-N 3.43Å; G995-V1016 WeakPolarHBondContact CA-O 3.39Å
996	V	92.1	Very high	87.9	Confident	80 Å²	80	55 Å²	55	49%	0.485	29%	0.293	S	S	.	.	H	α-helix	trans	-66.6	-44	176.4	173.9	0	0	0	0	110.8	M992 Y994 N998 Q999 A1000 V1016	M992-V996 HydrophobicContact CG-CG2 4.41Å; M992-V996 WeakPolarHBondContact O-CB 3.35Å; M992-V996 VanDerWaalsContact O-CG2 3.29Å; M992-V996 WeakPolarHBondContact O-CG2 3.37Å; M992-V996 PolarHBondContact O-N 3.44Å; Y994-V996 PolarHBondContact O-N 3.18Å; V996-N998 PolarHBondContact O-N 3.28Å; V996-Q999 PolarHBondContact O-N 3.29Å; V996-A1000 VanDerWaalsContact O-CB 3.29Å; V996-A1000 WeakPolarHBondContact O-CB 3.43Å; V996-A1000 PolarHBondContact O-N 2.9Å; V996-V1016 HydrophobicContact CG2-CG1 3.77Å
997	A	90.6	Very high	87.3	Confident	35 Å²	35	51.4 Å²	51.4	29%	0.289	28%	0.282	S	S	.	.	H	α-helix	trans	-62.2	-43	177.4	0	0	0	0	0	112	A993 Y994 A1000 L1001	A993-A997 WeakPolarHBondContact O-CB 3.32Å; A993-A997 PolarHBondContact O-N 3.37Å; Y994-A997 PolarHBondContact O-N 2.93Å; A997-A1000 PolarHBondContact O-N 3.39Å; A997-L1001 WeakPolarHBondContact O-CB 3.48Å; A997-L1001 VanDerWaalsContact O-CG 3.28Å; A997-L1001 WeakPolarHBondContact O-CG 3.5Å; A997-L1001 PolarHBondContact O-N 3.19Å; A997-L1001 VanDerWaalsContact O-N 3.09Å
998	N	87.5	Confident	86.9	Confident	17 Å²	17	53.3 Å²	53.3	9%	0.091	29%	0.293	C	S	.	.	H	α-helix	trans	-67.7	-43.4	179.9	-164.9	25.9	0	0	0	111.7	Y994 G995 V996 A1000 L1001 L1002 V1066	Y994-N998 HydrophobicContact CE2-CB 4.39Å; Y994-N998 VanDerWaalsContact O-CB 3.24Å; Y994-N998 WeakPolarHBondContact O-CB 3.08Å; Y994-N998 PolarHBondContact O-N 3.21Å; Y994-N998 PolarHBondContact OH-ND2 3.02Å; G995-N998 PolarHBondContact O-N 2.91Å; V996-N998 PolarHBondContact O-N 3.28Å; N998-A1000 PolarHBondContact O-N 2.88Å; N998-L1001 PolarHBondContact O-N 3.2Å; N998-L1002 WeakPolarHBondContact O-CB 3.28Å; N998-L1002 WeakPolarHBondContact O-CG 3.48Å; N998-L1002 PolarHBondContact O-N 3.22Å; N998-L1002 WeakPolarHBondContact OD1-CD1 3.44Å; N998-V1066 VanDerWaalsContact OD1-CG1 3.3Å; N998-V1066 WeakPolarHBondContact OD1-CG1 3.24Å
999	Q	87.6	Confident	86.5	Confident	24 Å²	24	59.4 Å²	59.4	11%	0.112	31%	0.31	C	S	.	.	H	α-helix	trans	-61.7	-43.1	175.6	-179.8	65.6	15.8	0	0	111.7	G995 V996 L1001 Y1003 D1006 R1015 V1016	G995-Q999 VanDerWaalsContact O-CB 3.31Å; G995-Q999 WeakPolarHBondContact O-CB 3.44Å; G995-Q999 PolarHBondContact O-N 3.43Å; V996-Q999 PolarHBondContact O-N 3.29Å; Q999-L1001 VanDerWaalsContact C-N 3.33Å; Q999-L1001 PolarHBondContact O-N 3.42Å; Q999-Y1003 PolarHBondContact O-N 2.87Å; Q999-Y1003 VanDerWaalsContact O-N 3.07Å; Q999-D1006 PolarHBondContact NE2-OD2 3.01Å; Q999-R1015 VanDerWaalsContact OE1-CB 3.27Å; Q999-R1015 VanDerWaalsContact OE1-CD 3.31Å; Q999-V1016 HydrophobicContact CB-CG2 3.83Å; Q999-V1016 HydrophobicContact CG-CG2 4.03Å
1000	A	87.1	Confident	86	Confident	75 Å²	75	61.7 Å²	61.7	62%	0.62	32%	0.32	S	S	*	.	H	α-helix	trans	-69.2	-27.6	-179.8	0	0	0	0	0	113.7	V996 A997 N998	V996-A1000 VanDerWaalsContact O-CB 3.29Å; V996-A1000 WeakPolarHBondContact O-CB 3.43Å; V996-A1000 PolarHBondContact O-N 2.9Å; A997-A1000 PolarHBondContact O-N 3.39Å; N998-A1000 PolarHBondContact O-N 2.88Å
1001	L	86.3	Confident	85.4	Confident	48 Å²	48	60.7 Å²	60.7	25%	0.251	32%	0.316	S	S	.	.	H	α-helix	trans	-83.1	-35.8	177.1	-72.3	171.7	0	0	0	112.6	A997 N998 Q999 L1065 V1066 L1069	A997-L1001 WeakPolarHBondContact O-CB 3.48Å; A997-L1001 VanDerWaalsContact O-CG 3.28Å; A997-L1001 WeakPolarHBondContact O-CG 3.5Å; A997-L1001 PolarHBondContact O-N 3.19Å; A997-L1001 VanDerWaalsContact O-N 3.09Å; N998-L1001 PolarHBondContact O-N 3.2Å; Q999-L1001 VanDerWaalsContact C-N 3.33Å; Q999-L1001 PolarHBondContact O-N 3.42Å; L1001-L1065 HydrophobicContact CD1-CD2 3.96Å; L1001-L1065 HydrophobicContact CD1-CG 4.14Å; L1001-L1065 HydrophobicContact CD2-CD2 4.12Å; L1001-V1066 HydrophobicContact CB-CG2 3.64Å; L1001-V1066 HydrophobicContact CD1-CG2 3.95Å; L1001-V1066 HydrophobicContact CG-CG2 4.43Å; L1001-L1069 HydrophobicContact CD1-CD1 3.48Å; L1001-L1069 VanDerWaalsContact CD1-CD1 3.48Å
1002	L	82.4	Confident	85.1	Confident	13 Å²	13	62.6 Å²	62.6	7%	0.068	33%	0.325	C	S	.	.	H	α-helix	trans	-82.3	-38	-176.8	-74.4	170.4	0	0	0	113.5	N998 R1058 N1059 V1066	N998-L1002 WeakPolarHBondContact O-CB 3.28Å; N998-L1002 WeakPolarHBondContact O-CG 3.48Å; N998-L1002 PolarHBondContact O-N 3.22Å; N998-L1002 WeakPolarHBondContact OD1-CD1 3.44Å; L1002-R1058 WeakPolarHBondContact O-CA 3.24Å; L1002-N1059 PolarHBondContact O-N 2.69Å; L1002-V1066 HydrophobicContact CD2-CG1 4.38Å; L1002-V1066 HydrophobicContact CD2-CG2 4.39Å; L1002-V1066 HydrophobicContact CG-CG1 4.5Å; L1002-V1066 HydrophobicContact CG-CG2 4.38Å
1003	Y	81.6	Confident	84.8	Confident	14 Å²	14	63.5 Å²	63.5	6%	0.055	33%	0.327	C	S	.	.			trans	-120.9	138.4	-174.4	-60.9	-76.6	0	0	0	111.2	Q999 R1015 Q1056 R1058	Q999-Y1003 PolarHBondContact O-N 2.87Å; Q999-Y1003 VanDerWaalsContact O-N 3.07Å; Y1003-R1015 VanDerWaalsContact CZ-CZ 3.48Å; Y1003-R1015 VanDerWaalsContact CZ-NH1 3.26Å; Y1003-Q1056 HydrophobicContact CD1-CB 4.31Å; Y1003-Q1056 WeakPolarHBondContact CE1-O 3.46Å; Y1003-R1058 HydrophobicContact CE1-CG 4.36Å
1004	R	75.6	Confident	84.4	Confident	224 Å²	224	68.1 Å²	68.1	85%	0.845	33%	0.333	S	S	*	.	S	Bend	trans	-84.2	-36.6	-178.8	-167.7	173.7	-172.1	170.7	1.7	111.7
1005	H	77.1	Confident	84.1	Confident	94 Å²	94	68.6 Å²	68.6	44%	0.435	34%	0.335	S	S	.	.			trans	-163	111.8	-178.5	-173	66.1	0	0	0	111.6	Q1056	H1005-Q1056 VanDerWaalsContact C-OE1 3.29Å; H1005-Q1056 PolarHBondContact O-NE2 3.47Å; H1005-Q1056 PolarHBondContact O-OE1 3.35Å
1006	D	74.8	Confident	84	Confident	18 Å²	18	69 Å²	69	10%	0.096	34%	0.337	C	S	.	.			trans	-115.8	121	170.1	-84.4	-38.5	0	0	0	109	Q999 I1012 R1015	Q999-D1006 PolarHBondContact NE2-OD2 3.01Å; D1006-I1012 HydrophobicContact CB-CD1 4.17Å; D1006-I1012 HydrophobicContact CB-CG1 3.92Å; D1006-I1012 WeakPolarHBondContact O-CD1 3.41Å; D1006-R1015 IonicContact OD1-NH1 3.66Å; D1006-R1015 IonicContact OD2-CZ 2.73Å; D1006-R1015 IonicContact OD2-NH1 3.64Å; D1006-R1015 PolarHBondContact OD2-NH1 3.5Å
1007	P	76.9	Confident	83.9	Confident	54 Å²	54	68.7 Å²	68.7	35%	0.351	33%	0.329	S	S	.	.			trans	-85.3	-18.8	179.4	32.1	-35.5	0	0	0	113.2	F1009 V1050 D1051	P1007-F1009 PolarHBondContact O-N 3.09Å; P1007-V1050 HydrophobicContact CG-CG1 4.26Å; P1007-D1051 WeakPolarHBondContact CG-OD1 3.4Å
1008	N	82.2	Confident	83.9	Confident	57 Å²	57	72.9 Å²	72.9	31%	0.305	34%	0.338	S	S	.	.			trans	-82.5	105.2	-175.3	-74.3	-46.3	0	0	0	112	D1010 R1011 I1012	N1008-D1010 VanDerWaalsContact C-N 3.32Å; N1008-D1010 PolarHBondContact O-N 3.03Å; N1008-R1011 HydrophobicContact CB-CB 4.16Å; N1008-R1011 HydrophobicContact CB-CG 4.1Å; N1008-R1011 PolarHBondContact O-N 3.36Å; N1008-I1012 WeakPolarHBondContact O-CG1 3.45Å; N1008-I1012 PolarHBondContact O-N 2.82Å; N1008-I1012 VanDerWaalsContact O-N 3.12Å
1009	F	82.7	Confident	83.8	Confident	162 Å²	162	75.2 Å²	75.2	71%	0.711	35%	0.346	S	S	*	.	H	α-helix	trans	-56.1	-41.2	-179.9	-178.3	-95.2	0	0	0	113.5	P1007 R1011 I1012 F1013	P1007-F1009 PolarHBondContact O-N 3.09Å; F1009-R1011 PolarHBondContact O-N 3.1Å; F1009-I1012 PolarHBondContact O-N 2.66Å; F1009-F1013 HydrophobicContact CE1-CB 4.46Å; F1009-F1013 WeakPolarHBondContact O-CB 3.26Å; F1009-F1013 PolarHBondContact O-N 3.34Å
1010	D	82.4	Confident	84	Confident	118 Å²	118	74.1 Å²	74.1	63%	0.631	34%	0.341	S	S	*	.	H	α-helix	trans	-60.4	-44.4	178.9	178.7	69.5	0	0	0	112.4	N1008 F1013 R1014	N1008-D1010 VanDerWaalsContact C-N 3.32Å; N1008-D1010 PolarHBondContact O-N 3.03Å; D1010-F1013 PolarHBondContact O-N 3.23Å; D1010-R1014 WeakPolarHBondContact O-CB 3.23Å; D1010-R1014 PolarHBondContact O-N 3.1Å
1011	R	81.9	Confident	84.2	Confident	71 Å²	71	75 Å²	75	27%	0.268	33%	0.329	S	S	.	.	H	α-helix	trans	-65	-41.9	176.7	-68.5	-173.8	-179.2	168.9	2.2	111.5	N1008 F1009 R1014 R1015 G1053 A1054	N1008-R1011 HydrophobicContact CB-CB 4.16Å; N1008-R1011 HydrophobicContact CB-CG 4.1Å; N1008-R1011 PolarHBondContact O-N 3.36Å; F1009-R1011 PolarHBondContact O-N 3.1Å; R1011-R1014 PolarHBondContact O-N 3.26Å; R1011-R1015 WeakPolarHBondContact O-CB 3.26Å; R1011-R1015 VanDerWaalsContact O-CG 3.28Å; R1011-R1015 WeakPolarHBondContact O-CG 3.4Å; R1011-R1015 PolarHBondContact O-N 3.45Å; R1011-G1053 VanDerWaalsContact CZ-O 3.3Å; R1011-G1053 PolarHBondContact NH1-O 2.91Å; R1011-G1053 PolarHBondContact NH2-O 2.95Å; R1011-A1054 PolarHBondContact NH1-O 3.24Å
1012	I	86.6	Confident	84.3	Confident	52 Å²	52	74.5 Å²	74.5	27%	0.267	33%	0.326	S	S	.	.	H	α-helix	trans	-61.9	-48.8	176.7	-66	165.8	0	0	0	110.1	D1006 N1008 F1009 R1014 R1015 V1016	D1006-I1012 HydrophobicContact CB-CD1 4.17Å; D1006-I1012 HydrophobicContact CB-CG1 3.92Å; D1006-I1012 WeakPolarHBondContact O-CD1 3.41Å; N1008-I1012 WeakPolarHBondContact O-CG1 3.45Å; N1008-I1012 PolarHBondContact O-N 2.82Å; N1008-I1012 VanDerWaalsContact O-N 3.12Å; F1009-I1012 PolarHBondContact O-N 2.66Å; I1012-R1014 VanDerWaalsContact C-N 3.34Å; I1012-R1014 PolarHBondContact O-N 3.28Å; I1012-R1015 PolarHBondContact O-N 2.91Å; I1012-V1016 HydrophobicContact CG2-CG2 3.99Å; I1012-V1016 WeakPolarHBondContact O-CB 3.44Å; I1012-V1016 VanDerWaalsContact O-CG2 3.28Å; I1012-V1016 WeakPolarHBondContact O-CG2 3.49Å; I1012-V1016 PolarHBondContact O-N 2.94Å
1013	F	87.8	Confident	84.6	Confident	109 Å²	109	74.1 Å²	74.1	48%	0.478	32%	0.324	S	S	.	.	H	α-helix	trans	-60	-44.9	-179.7	-173.6	-96	0	0	0	111.6	F1009 D1010 R1015 V1016 F1017	F1009-F1013 HydrophobicContact CE1-CB 4.46Å; F1009-F1013 WeakPolarHBondContact O-CB 3.26Å; F1009-F1013 PolarHBondContact O-N 3.34Å; D1010-F1013 PolarHBondContact O-N 3.23Å; F1013-R1015 PolarHBondContact O-N 2.93Å; F1013-V1016 PolarHBondContact O-N 3Å; F1013-F1017 AromaticContact CD2-CD2 3.62Å; F1013-F1017 HydrophobicContact CD2-CD2 3.62Å; F1013-F1017 AromaticContact CD2-CE2 3.91Å; F1013-F1017 HydrophobicContact CD2-CE2 3.91Å; F1013-F1017 AromaticContact CE2-CD2 3.51Å; F1013-F1017 HydrophobicContact CE2-CD2 3.51Å; F1013-F1017 AromaticContact CE2-CE2 3.79Å; F1013-F1017 HydrophobicContact CE2-CE2 3.79Å; F1013-F1017 HydrophobicContact CE2-CG 4.35Å; F1013-F1017 HydrophobicContact CG-CD2 4.3Å; F1013-F1017 HydrophobicContact CZ-CD2 4.12Å; F1013-F1017 PolarHBondContact O-N 3.26Å
1014	R	85.8	Confident	84.9	Confident	153 Å²	153	74.5 Å²	74.5	58%	0.577	33%	0.327	S	S	*	.	I	π-helix	trans	-63.1	-39	175.9	-170.3	175.1	179.5	-170.6	-1.8	112.5	D1010 R1011 I1012 Y1018 R1019	D1010-R1014 WeakPolarHBondContact O-CB 3.23Å; D1010-R1014 PolarHBondContact O-N 3.1Å; R1011-R1014 PolarHBondContact O-N 3.26Å; I1012-R1014 VanDerWaalsContact C-N 3.34Å; I1012-R1014 PolarHBondContact O-N 3.28Å; R1014-Y1018 HydrophobicContact CG-CD1 4.13Å; R1014-Y1018 VanDerWaalsContact O-CB 3.32Å; R1014-Y1018 WeakPolarHBondContact O-CB 3.47Å; R1014-Y1018 PolarHBondContact O-N 3.47Å; R1014-R1019 PolarHBondContact O-N 3.08Å
1015	R	85.2	Confident	85.5	Confident	22 Å²	22	71 Å²	71	8%	0.083	31%	0.314	C	S	.	.	I	π-helix	trans	-74.5	-37.2	179	-72.4	174.8	177.7	174.8	-3.8	112.9	Q999 Y1003 D1006 R1011 I1012 F1013 P1020	Q999-R1015 VanDerWaalsContact OE1-CB 3.27Å; Q999-R1015 VanDerWaalsContact OE1-CD 3.31Å; Y1003-R1015 VanDerWaalsContact CZ-CZ 3.48Å; Y1003-R1015 VanDerWaalsContact CZ-NH1 3.26Å; D1006-R1015 IonicContact OD1-NH1 3.66Å; D1006-R1015 IonicContact OD2-CZ 2.73Å; D1006-R1015 IonicContact OD2-NH1 3.64Å; D1006-R1015 PolarHBondContact OD2-NH1 3.5Å; R1011-R1015 WeakPolarHBondContact O-CB 3.26Å; R1011-R1015 VanDerWaalsContact O-CG 3.28Å; R1011-R1015 WeakPolarHBondContact O-CG 3.4Å; R1011-R1015 PolarHBondContact O-N 3.45Å; I1012-R1015 PolarHBondContact O-N 2.91Å; F1013-R1015 PolarHBondContact O-N 2.93Å; R1015-P1020 VanDerWaalsContact O-CD 3.26Å; R1015-P1020 WeakPolarHBondContact O-CD 3.4Å
1016	V	90.2	Very high	85.9	Confident	8 Å²	8	69 Å²	69	5%	0.048	32%	0.32	C	S	.	.	I	π-helix	trans	-77.8	-42.2	-176.9	170.7	0	0	0	0	112.5	G995 V996 Q999 I1012 F1013 P1020	G995-V1016 WeakPolarHBondContact CA-O 3.39Å; V996-V1016 HydrophobicContact CG2-CG1 3.77Å; Q999-V1016 HydrophobicContact CB-CG2 3.83Å; Q999-V1016 HydrophobicContact CG-CG2 4.03Å; I1012-V1016 HydrophobicContact CG2-CG2 3.99Å; I1012-V1016 WeakPolarHBondContact O-CB 3.44Å; I1012-V1016 VanDerWaalsContact O-CG2 3.28Å; I1012-V1016 WeakPolarHBondContact O-CG2 3.49Å; I1012-V1016 PolarHBondContact O-N 2.94Å; F1013-V1016 PolarHBondContact O-N 3Å; V1016-P1020 WeakPolarHBondContact O-CD 3.46Å; V1016-P1020 VanDerWaalsContact O-CG 3.3Å; V1016-P1020 WeakPolarHBondContact O-CG 3.5Å
1017	F	90.7	Very high	86.4	Confident	75 Å²	75	73.9 Å²	73.9	33%	0.329	34%	0.342	S	S	.	.	I	π-helix	trans	-103.7	-51.7	-174.4	-68.8	-76.7	0	0	0	113.1	I991 M992 F1013 Y1021	I991-F1017 HydrophobicContact CG2-CD1 4.31Å; M992-F1017 HydrophobicContact CB-CE1 3.93Å; M992-F1017 HydrophobicContact CB-CZ 4.5Å; M992-F1017 HydrophobicContact CG-CE1 3.97Å; M992-F1017 HydrophobicContact CG-CZ 4.03Å; M992-F1017 HydrophobicContact SD-CE1 4.35Å; M992-F1017 HydrophobicContact SD-CZ 4.2Å; F1013-F1017 AromaticContact CD2-CD2 3.62Å; F1013-F1017 HydrophobicContact CD2-CD2 3.62Å; F1013-F1017 AromaticContact CD2-CE2 3.91Å; F1013-F1017 HydrophobicContact CD2-CE2 3.91Å; F1013-F1017 AromaticContact CE2-CD2 3.51Å; F1013-F1017 HydrophobicContact CE2-CD2 3.51Å; F1013-F1017 AromaticContact CE2-CE2 3.79Å; F1013-F1017 HydrophobicContact CE2-CE2 3.79Å; F1013-F1017 HydrophobicContact CE2-CG 4.35Å; F1013-F1017 HydrophobicContact CG-CD2 4.3Å; F1013-F1017 HydrophobicContact CZ-CD2 4.12Å; F1013-F1017 PolarHBondContact O-N 3.26Å; F1017-Y1021 WeakPolarHBondContact O-CB 3.28Å; F1017-Y1021 PolarHBondContact O-N 3.01Å
1018	Y	89.4	Confident	86.8	Confident	123 Å²	123	73.7 Å²	73.7	48%	0.482	34%	0.337	S	S	.	.	I	π-helix	trans	-71	-42.2	-170.6	178.4	-99.6	0	0	0	112.7	R1014 Y1021 L1022	R1014-Y1018 HydrophobicContact CG-CD1 4.13Å; R1014-Y1018 VanDerWaalsContact O-CB 3.32Å; R1014-Y1018 WeakPolarHBondContact O-CB 3.47Å; R1014-Y1018 PolarHBondContact O-N 3.47Å; Y1018-Y1021 PolarHBondContact O-N 3.49Å; Y1018-L1022 HydrophobicContact CD1-CD1 4.09Å; Y1018-L1022 HydrophobicContact CE1-CD1 3.47Å; Y1018-L1022 VanDerWaalsContact CE1-CD1 3.47Å; Y1018-L1022 HydrophobicContact CE1-CG 4.3Å; Y1018-L1022 PolarHBondContact O-N 3.42Å
1019	R	86.3	Confident	86.4	Confident	65 Å²	65	73.2 Å²	73.2	25%	0.245	34%	0.337	C	S	.	.	H	α-helix	trans	-66.3	-51.6	-179.8	-69.8	-176	175.8	-146.7	-15.9	113.4	R1014 Y1021 L1022 H1023 E1032	R1014-R1019 PolarHBondContact O-N 3.08Å; R1019-Y1021 PolarHBondContact O-N 3.42Å; R1019-L1022 WeakPolarHBondContact O-CB 3.43Å; R1019-L1022 PolarHBondContact O-N 3.17Å; R1019-H1023 PolarHBondContact O-CD2 2.83Å; R1019-H1023 VanDerWaalsContact O-CD2 3.25Å; R1019-H1023 PolarHBondContact O-N 3.45Å; R1019-E1032 IonicContact CZ-OE1 3.45Å; R1019-E1032 IonicContact CZ-OE2 3.05Å; R1019-E1032 IonicContact NE-OE2 2.88Å; R1019-E1032 IonicContact NH1-OE1 3.35Å; R1019-E1032 PolarHBondContact NH1-OE1 3.34Å; R1019-E1032 IonicContact NH1-OE2 2.65Å; R1019-E1032 PolarHBondContact NH1-OE2 3.17Å; R1019-E1032 IonicContact NH2-OE1 2.78Å; R1019-E1032 PolarHBondContact NH2-OE1 3.07Å; R1019-E1032 IonicContact NH2-OE2 3.19Å; R1019-E1032 PolarHBondContact NH2-OE2 3.21Å
1020	P	91.1	Very high	85.8	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-58.3	-35.8	175	-31.1	39.7	0	0	0	114	I991 Y994 R1015 V1016 L1022 H1023 Y1073	I991-P1020 HydrophobicContact CG2-CB 4.2Å; Y994-P1020 HydrophobicContact CD1-CB 3.68Å; Y994-P1020 HydrophobicContact CD1-CG 3.79Å; Y994-P1020 HydrophobicContact CE1-CB 3.83Å; Y994-P1020 HydrophobicContact CE1-CG 3.82Å; R1015-P1020 VanDerWaalsContact O-CD 3.26Å; R1015-P1020 WeakPolarHBondContact O-CD 3.4Å; V1016-P1020 WeakPolarHBondContact O-CD 3.46Å; V1016-P1020 VanDerWaalsContact O-CG 3.3Å; V1016-P1020 WeakPolarHBondContact O-CG 3.5Å; P1020-L1022 VanDerWaalsContact C-N 3.3Å; P1020-L1022 PolarHBondContact O-N 2.93Å; P1020-H1023 WeakPolarHBondContact O-CB 3.36Å; P1020-H1023 PolarHBondContact O-N 3.48Å; P1020-H1023 VanDerWaalsContact O-N 3.12Å; P1020-Y1073 PolarHBondContact O-OH 2.95Å
1021	Y	90.9	Very high	85.2	Confident	95 Å²	95	68.8 Å²	68.8	37%	0.373	32%	0.319	S	S	.	.	H	α-helix	trans	-59	-41	174.8	175.9	-102.5	0	0	0	112.3	I991 F1017 Y1018 R1019 H1023 I1024 Y1025	I991-Y1021 HydrophobicContact CD1-CD2 4.09Å; F1017-Y1021 WeakPolarHBondContact O-CB 3.28Å; F1017-Y1021 PolarHBondContact O-N 3.01Å; Y1018-Y1021 PolarHBondContact O-N 3.49Å; R1019-Y1021 PolarHBondContact O-N 3.42Å; Y1021-H1023 VanDerWaalsContact C-N 3.33Å; Y1021-H1023 PolarHBondContact O-N 3.21Å; Y1021-I1024 WeakPolarHBondContact O-CB 3.33Å; Y1021-I1024 PolarHBondContact O-N 3.46Å; Y1021-Y1025 HydrophobicContact CD1-CE2 4.28Å; Y1021-Y1025 HydrophobicContact CE1-CD2 4.4Å; Y1021-Y1025 AromaticContact CE1-CE2 3.66Å; Y1021-Y1025 HydrophobicContact CE1-CE2 3.66Å; Y1021-Y1025 AromaticContact CE2-CE2 3.91Å; Y1021-Y1025 HydrophobicContact CE2-CE2 3.91Å; Y1021-Y1025 AromaticContact CZ-CE2 3.45Å; Y1021-Y1025 VanDerWaalsContact CZ-CE2 3.45Å; Y1021-Y1025 WeakPolarHBondContact O-CD2 3.31Å; Y1021-Y1025 PolarHBondContact OH-OH 2.97Å
1022	L	88.7	Confident	84.5	Confident	37 Å²	37	67.5 Å²	67.5	19%	0.194	32%	0.316	C	S	.	.	H	α-helix	trans	-68	-28.9	175.1	-68.4	178.8	0	0	0	113.5	Y1018 R1019 P1020 I1024 Y1025 Q1027	Y1018-L1022 HydrophobicContact CD1-CD1 4.09Å; Y1018-L1022 HydrophobicContact CE1-CD1 3.47Å; Y1018-L1022 VanDerWaalsContact CE1-CD1 3.47Å; Y1018-L1022 HydrophobicContact CE1-CG 4.3Å; Y1018-L1022 PolarHBondContact O-N 3.42Å; R1019-L1022 WeakPolarHBondContact O-CB 3.43Å; R1019-L1022 PolarHBondContact O-N 3.17Å; P1020-L1022 VanDerWaalsContact C-N 3.3Å; P1020-L1022 PolarHBondContact O-N 2.93Å; L1022-I1024 PolarHBondContact O-N 3.25Å; L1022-Y1025 PolarHBondContact O-N 2.98Å; L1022-Q1027 HydrophobicContact CB-CB 4.31Å; L1022-Q1027 PolarHBondContact O-N 3.17Å
1023	H	88	Confident	83.7	Confident	5 Å²	5	65.4 Å²	65.4	2%	0.023	31%	0.306	C	S	.	.	H	α-helix	trans	-60.6	-32.1	176.4	-64	178	0	0	0	112.1	Y994 R1019 P1020 Y1021 Y1025 G1026 Q1027 I1028 Y1073	Y994-H1023 AromaticContact CE1-ND1 3.86Å; R1019-H1023 PolarHBondContact O-CD2 2.83Å; R1019-H1023 VanDerWaalsContact O-CD2 3.25Å; R1019-H1023 PolarHBondContact O-N 3.45Å; P1020-H1023 WeakPolarHBondContact O-CB 3.36Å; P1020-H1023 PolarHBondContact O-N 3.48Å; P1020-H1023 VanDerWaalsContact O-N 3.12Å; Y1021-H1023 VanDerWaalsContact C-N 3.33Å; Y1021-H1023 PolarHBondContact O-N 3.21Å; H1023-Y1025 VanDerWaalsContact C-N 3.26Å; H1023-Y1025 PolarHBondContact O-N 3.43Å; H1023-G1026 PolarHBondContact O-N 3.15Å; H1023-Q1027 PolarHBondContact CD2-O 3.29Å; H1023-I1028 HydrophobicContact CB-CG1 4.34Å; H1023-Y1073 HydrophobicContact CB-CE1 3.99Å
1024	I	89.5	Confident	82.9	Confident	22 Å²	22	62.1 Å²	62.1	11%	0.113	29%	0.293	C	S	.	.	H	α-helix	trans	-62	-36.5	176.6	-59	163.7	0	0	0	110.9	L987 I991 Y1021 L1022 G1026 Y1073 T1077 I1082	L987-I1024 HydrophobicContact CD1-CD1 3.77Å; L987-I1024 HydrophobicContact CD2-CD1 4.12Å; L987-I1024 HydrophobicContact CG-CD1 4.25Å; I991-I1024 HydrophobicContact CD1-CD1 3.84Å; I991-I1024 HydrophobicContact CG1-CD1 4.2Å; Y1021-I1024 WeakPolarHBondContact O-CB 3.33Å; Y1021-I1024 PolarHBondContact O-N 3.46Å; L1022-I1024 PolarHBondContact O-N 3.25Å; I1024-G1026 PolarHBondContact O-N 3.42Å; I1024-Y1073 WeakPolarHBondContact CD1-OH 3.45Å; I1024-Y1073 HydrophobicContact CG1-CE1 4.33Å; I1024-Y1073 VanDerWaalsContact CG1-OH 3.28Å; I1024-Y1073 WeakPolarHBondContact CG1-OH 3.27Å; I1024-T1077 HydrophobicContact CG1-CG2 4.47Å; I1024-I1082 HydrophobicContact CG2-CD1 4.05Å
1025	Y	87.1	Confident	81.9	Confident	150 Å²	150	56.7 Å²	56.7	59%	0.588	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	7.7	177.5	-65	-80.1	0	0	0	113.5	Y1021 L1022 H1023 Q1027	Y1021-Y1025 HydrophobicContact CD1-CE2 4.28Å; Y1021-Y1025 HydrophobicContact CE1-CD2 4.4Å; Y1021-Y1025 AromaticContact CE1-CE2 3.66Å; Y1021-Y1025 HydrophobicContact CE1-CE2 3.66Å; Y1021-Y1025 AromaticContact CE2-CE2 3.91Å; Y1021-Y1025 HydrophobicContact CE2-CE2 3.91Å; Y1021-Y1025 AromaticContact CZ-CE2 3.45Å; Y1021-Y1025 VanDerWaalsContact CZ-CE2 3.45Å; Y1021-Y1025 WeakPolarHBondContact O-CD2 3.31Å; Y1021-Y1025 PolarHBondContact OH-OH 2.97Å; L1022-Y1025 PolarHBondContact O-N 2.98Å; H1023-Y1025 VanDerWaalsContact C-N 3.26Å; H1023-Y1025 PolarHBondContact O-N 3.43Å; Y1025-Q1027 VanDerWaalsContact C-N 3.31Å; Y1025-Q1027 PolarHBondContact O-N 3.38Å
1026	G	85	Confident	80.9	Confident	53 Å²	53	64.6 Å²	64.6	55%	0.546	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	5.4	178.9	0	0	0	0	0	114.6	H1023 I1024 I1028	H1023-G1026 PolarHBondContact O-N 3.15Å; I1024-G1026 PolarHBondContact O-N 3.42Å; G1026-I1028 PolarHBondContact O-N 2.99Å; G1026-I1028 VanDerWaalsContact O-N 3.12Å
1027	Q	86.3	Confident	79.7	Confident	120 Å²	120	69.1 Å²	69.1	56%	0.561	33%	0.331	S	S	*	.			trans	-84.4	81.1	172.2	-68.3	-174.9	-5.8	0	0	109.6	L1022 H1023 Y1025 P1029	L1022-Q1027 HydrophobicContact CB-CB 4.31Å; L1022-Q1027 PolarHBondContact O-N 3.17Å; H1023-Q1027 PolarHBondContact CD2-O 3.29Å; Y1025-Q1027 VanDerWaalsContact C-N 3.31Å; Y1025-Q1027 PolarHBondContact O-N 3.38Å; Q1027-P1029 VanDerWaalsContact O-CD 3.28Å; Q1027-P1029 WeakPolarHBondContact O-CD 3.47Å
1028	I	84.1	Confident	78.3	Confident	50 Å²	50	71.2 Å²	71.2	26%	0.256	35%	0.35	S	S	.	.			trans	-102	103.1	178.9	-56.3	163.9	0	0	0	107.8	H1023 G1026 V1030 L1070 L1074	H1023-I1028 HydrophobicContact CB-CG1 4.34Å; G1026-I1028 PolarHBondContact O-N 2.99Å; G1026-I1028 VanDerWaalsContact O-N 3.12Å; I1028-V1030 HydrophobicContact CG2-CG2 4.15Å; I1028-V1030 WeakPolarHBondContact O-CG2 3.42Å; I1028-V1030 PolarHBondContact O-N 3.12Å; I1028-L1070 HydrophobicContact CG2-CD1 4.5Å; I1028-L1070 HydrophobicContact CG2-CD2 3.98Å; I1028-L1074 HydrophobicContact CD1-CD1 3.58Å; I1028-L1074 HydrophobicContact CD1-CD2 4.08Å; I1028-L1074 HydrophobicContact CD1-CG 4.46Å
1029	P	74.9	Confident	77.2	Confident	46 Å²	46	67.9 Å²	67.9	30%	0.299	34%	0.337	S	S	.	.			trans	-71.2	84.3	173.7	29.9	-33.4	0	0	0	109.1	Q1027 E1031 E1032 V1033	Q1027-P1029 VanDerWaalsContact O-CD 3.28Å; Q1027-P1029 WeakPolarHBondContact O-CD 3.47Å; P1029-E1031 PolarHBondContact O-N 3.07Å; P1029-E1031 VanDerWaalsContact O-N 3.16Å; P1029-E1032 HydrophobicContact CB-CB 4.12Å; P1029-E1032 HydrophobicContact CB-CG 4.06Å; P1029-E1032 HydrophobicContact CG-CB 4.24Å; P1029-E1032 HydrophobicContact CG-CG 4.5Å; P1029-E1032 WeakPolarHBondContact CG-OE2 3.3Å; P1029-E1032 WeakPolarHBondContact O-CB 3.17Å; P1029-E1032 PolarHBondContact O-N 3.47Å; P1029-V1033 PolarHBondContact O-N 3.09Å
1030	V	71.1	Confident	76	Confident	65 Å²	65	72.1 Å²	72.1	39%	0.394	36%	0.364	S	S	.	.	H	α-helix	trans	-59.4	-29.2	-177.5	-172.4	0	0	0	0	111.4	I1028 E1032 V1033 D1034 K1037	I1028-V1030 HydrophobicContact CG2-CG2 4.15Å; I1028-V1030 WeakPolarHBondContact O-CG2 3.42Å; I1028-V1030 PolarHBondContact O-N 3.12Å; V1030-E1032 PolarHBondContact O-N 2.99Å; V1030-V1033 PolarHBondContact O-N 3.33Å; V1030-D1034 PolarHBondContact O-N 3.05Å; V1030-K1037 HydrophobicContact CG1-CD 4.36Å
1031	E	68.3	Low	74.9	Confident	123 Å²	123	75 Å²	75	58%	0.575	38%	0.381	S	S	*	.	H	α-helix	trans	-64.5	-25.8	174.9	-68.1	163.5	-165.2	0	0	112.8	P1029 K1037 R1058	P1029-E1031 PolarHBondContact O-N 3.07Å; P1029-E1031 VanDerWaalsContact O-N 3.16Å; E1031-K1037 HydrophobicContact CG-CD 4.2Å; E1031-R1058 VanDerWaalsContact O-CZ 3.25Å; E1031-R1058 PolarHBondContact O-NH1 2.89Å; E1031-R1058 PolarHBondContact O-NH2 2.96Å
1032	E	67.8	Low	74	Confident	43 Å²	43	79.6 Å²	79.6	20%	0.201	41%	0.406	C	S	.	.	H	α-helix	trans	-90	-22.8	178.3	-65.7	-172.5	140.6	0	0	114.1	R1019 P1029 V1030 R1058	R1019-E1032 IonicContact CZ-OE1 3.45Å; R1019-E1032 IonicContact CZ-OE2 3.05Å; R1019-E1032 IonicContact NE-OE2 2.88Å; R1019-E1032 IonicContact NH1-OE1 3.35Å; R1019-E1032 PolarHBondContact NH1-OE1 3.34Å; R1019-E1032 IonicContact NH1-OE2 2.65Å; R1019-E1032 PolarHBondContact NH1-OE2 3.17Å; R1019-E1032 IonicContact NH2-OE1 2.78Å; R1019-E1032 PolarHBondContact NH2-OE1 3.07Å; R1019-E1032 IonicContact NH2-OE2 3.19Å; R1019-E1032 PolarHBondContact NH2-OE2 3.21Å; P1029-E1032 HydrophobicContact CB-CB 4.12Å; P1029-E1032 HydrophobicContact CB-CG 4.06Å; P1029-E1032 HydrophobicContact CG-CB 4.24Å; P1029-E1032 HydrophobicContact CG-CG 4.5Å; P1029-E1032 WeakPolarHBondContact CG-OE2 3.3Å; P1029-E1032 WeakPolarHBondContact O-CB 3.17Å; P1029-E1032 PolarHBondContact O-N 3.47Å; V1030-E1032 PolarHBondContact O-N 2.99Å; E1032-R1058 VanDerWaalsContact C-CZ 3.48Å; E1032-R1058 VanDerWaalsContact CA-CZ 3.46Å; E1032-R1058 VanDerWaalsContact CA-NH2 3.28Å; E1032-R1058 PolarHBondContact O-NE 3.4Å; E1032-R1058 PolarHBondContact O-NH1 3.05Å
1033	V	69.7	Low	73.3	Confident	9 Å²	9	80.4 Å²	80.4	6%	0.055	41%	0.414	C	S	.	.	H	α-helix	trans	-99.5	-38.2	-174.1	-176.7	0	0	0	0	111.9	P1029 V1030 N1063 V1066 L1070	P1029-V1033 PolarHBondContact O-N 3.09Å; V1030-V1033 PolarHBondContact O-N 3.33Å; V1033-N1063 PolarHBondContact O-OD1 3.12Å; V1033-V1066 HydrophobicContact CG1-CG1 3.59Å; V1033-L1070 HydrophobicContact CG1-CD2 4.23Å
1034	D	71.6	Confident	72.7	Confident	39 Å²	39	81.8 Å²	81.8	21%	0.209	42%	0.423	C	S	.	.			trans	-95.6	124.9	179.6	-168.5	2.2	0	0	0	111.4	V1030 K1036 K1037 R1058 N1063	V1030-D1034 PolarHBondContact O-N 3.05Å; D1034-K1036 PolarHBondContact O-N 2.81Å; D1034-K1036 PolarHBondContact OD1-N 3.43Å; D1034-K1036 VanDerWaalsContact OD1-N 3.14Å; D1034-K1037 PolarHBondContact O-N 3.35Å; D1034-R1058 PolarHBondContact O-NH1 2.82Å; D1034-N1063 PolarHBondContact OD1-ND2 2.94Å
1035	V	64.7	Low	71.9	Confident	40 Å²	40	86.5 Å²	86.5	24%	0.242	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-13	-179.6	-168.9	0	0	0	0	112.4	K1037 L1060 N1063	V1035-K1037 VanDerWaalsContact C-N 3.31Å; V1035-L1060 HydrophobicContact CB-CD2 4.41Å; V1035-L1060 HydrophobicContact CG1-CD2 3.33Å; V1035-L1060 HydrophobicContact CG1-CG 4.15Å; V1035-N1063 HydrophobicContact CG2-CB 3.99Å; V1035-N1063 PolarHBondContact N-ND2 3.17Å
1036	K	64.4	Low	71.5	Confident	187 Å²	187	84 Å²	84	81%	0.813	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-10.8	177.2	-70.7	-175.9	178	178.8	0	114.3	D1034	D1034-K1036 PolarHBondContact O-N 2.81Å; D1034-K1036 PolarHBondContact OD1-N 3.43Å; D1034-K1036 VanDerWaalsContact OD1-N 3.14Å
1037	K	64.5	Low	70.9	Confident	103 Å²	103	87.8 Å²	87.8	45%	0.448	45%	0.449	S	S	.	.	S	Bend	trans	-100.4	142	175.4	-71.8	-173.6	174.5	-174.2	0	110	V1030 E1031 D1034 V1035 W1039	V1030-K1037 HydrophobicContact CG1-CD 4.36Å; E1031-K1037 HydrophobicContact CG-CD 4.2Å; D1034-K1037 PolarHBondContact O-N 3.35Å; V1035-K1037 VanDerWaalsContact C-N 3.31Å; K1037-W1039 PolarHBondContact O-N 3.48Å
1038	V	60.4	Low	70.3	Confident	120 Å²	120	87.2 Å²	87.2	73%	0.727	45%	0.454	S	S	*	.			trans	-65.3	130.8	-179.7	-178.7	0	0	0	0	109.2
1039	W	67	Low	69.8	Low	53 Å²	53	89.1 Å²	89.1	20%	0.201	46%	0.464	C	S	.	.			trans	-102.3	114.5	173.1	-166.4	24.6	0	0	0	108.6	K1037 V1041 R1058	K1037-W1039 PolarHBondContact O-N 3.48Å; W1039-V1041 HydrophobicContact CD2-CB 4.33Å; W1039-V1041 HydrophobicContact CG-CG2 4.49Å; W1039-V1041 PolarHBondContact O-N 3.34Å; W1039-R1058 VanDerWaalsContact CB-NH2 3.31Å; W1039-R1058 HydrophobicContact CE3-CG 4.12Å; W1039-R1058 VanDerWaalsContact CE3-NE 3.3Å; W1039-R1058 HydrophobicContact CZ3-CG 3.78Å
1040	D	60.8	Low	69.8	Low	154 Å²	154	87 Å²	87	82%	0.824	45%	0.45	S	S	*	.			trans	-76.4	25.9	-174.6	-70.1	-22.3	0	0	0	114.1
1041	V	68.9	Low	69.8	Low	60 Å²	60	88.5 Å²	88.5	36%	0.364	46%	0.456	S	S	.	.	S	Bend	trans	-115.3	129.7	-178.2	-172.3	0	0	0	0	110.7	W1039 C1043 E1055	W1039-V1041 HydrophobicContact CD2-CB 4.33Å; W1039-V1041 HydrophobicContact CG-CG2 4.49Å; W1039-V1041 PolarHBondContact O-N 3.34Å; V1041-C1043 PolarHBondContact O-N 2.89Å; V1041-C1043 VanDerWaalsContact O-N 3.11Å; V1041-E1055 HydrophobicContact CG1-CG 4.44Å; V1041-E1055 WeakPolarHBondContact CG1-OE2 3.45Å
1042	E	70.5	Confident	70	Confident	192 Å²	192	86.1 Å²	86.1	90%	0.897	46%	0.464	S	S	*	.			trans	-64.2	107.4	174.4	-69	-177	175.1	0	0	110.3
1043	C	74.3	Confident	70.2	Confident	54 Å²	54	85.2 Å²	85.2	37%	0.365	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	154.2	-178.5	75.6	0	0	0	0	112	V1041 E1055 C1057	V1041-C1043 PolarHBondContact O-N 2.89Å; V1041-C1043 VanDerWaalsContact O-N 3.11Å; C1043-E1055 CarbonylContact C-O 3.6Å; C1043-E1055 VanDerWaalsContact CA-O 3.31Å; C1043-E1055 WeakPolarHBondContact CA-O 3.38Å; C1043-C1057 HydrophobicContact CB-CB 3.95Å; C1043-C1057 WeakPolarHBondContact CB-SG 3.29Å; C1043-C1057 PolarHBondContact O-SG 3.3Å; C1043-C1057 VanDerWaalsContact SG-CA 3.54Å; C1043-C1057 WeakPolarHBondContact SG-CB 3.44Å; C1043-C1057 CovalentContact SG-SG 2.04Å; C1043-C1057 PolarHBondContact SG-SG 3.39Å
1044	T	76.7	Confident	70.4	Confident	35 Å²	35	86.6 Å²	86.6	22%	0.215	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	142.1	177.8	-167.1	0	0	0	0	111.9	N1046 L1049 V1050 A1054 E1055 Q1056 C1057	T1044-N1046 PolarHBondContact OG1-N 3.49Å; T1044-L1049 HydrophobicContact CG2-CB 3.82Å; T1044-L1049 HydrophobicContact CG2-CD1 4.47Å; T1044-V1050 HydrophobicContact CG2-CG2 4.05Å; T1044-A1054 HydrophobicContact CG2-CB 3.61Å; T1044-E1055 PolarHBondContact N-O 3.49Å; T1044-Q1056 WeakPolarHBondContact O-CA 3.34Å; T1044-C1057 PolarHBondContact N-SG 3Å
1045	D	71.8	Confident	70.4	Confident	120 Å²	120	87.7 Å²	87.7	64%	0.642	48%	0.483	S	S	*	.			trans	-91.3	-0.9	174.4	-76.4	-33.6	0	0	0	113	Q1047 C1057	D1045-Q1047 PolarHBondContact O-N 3.24Å; D1045-C1057 WeakPolarHBondContact OD1-CB 3.46Å
1046	N	78.5	Confident	71	Confident	98 Å²	98	86.4 Å²	86.4	52%	0.524	47%	0.474	S	S	.	.			trans	-82.9	116	-171.7	-135.9	-9	0	0	0	111.4	T1044 T1048 L1049 V1050	T1044-N1046 PolarHBondContact OG1-N 3.49Å; N1046-T1048 VanDerWaalsContact C-N 3.32Å; N1046-T1048 PolarHBondContact O-N 3.49Å; N1046-L1049 HydrophobicContact CB-CB 4.41Å; N1046-L1049 HydrophobicContact CB-CD1 4.03Å; N1046-L1049 HydrophobicContact CB-CG 4.37Å; N1046-L1049 PolarHBondContact O-N 2.88Å; N1046-V1050 WeakPolarHBondContact O-CG2 3.4Å; N1046-V1050 PolarHBondContact O-N 3Å
1047	Q	71.9	Confident	71.5	Confident	133 Å²	133	78.7 Å²	78.7	62%	0.621	44%	0.444	S	S	*	.	H	α-helix	trans	-55.1	-41.2	-171.5	-74.1	178.4	-21.3	0	0	113.8	D1045 L1049 V1050 D1051	D1045-Q1047 PolarHBondContact O-N 3.24Å; Q1047-L1049 VanDerWaalsContact C-N 3.32Å; Q1047-L1049 PolarHBondContact O-N 3.44Å; Q1047-V1050 PolarHBondContact O-N 3.14Å; Q1047-D1051 VanDerWaalsContact O-CG 3.31Å; Q1047-D1051 PolarHBondContact O-N 3.42Å
1048	T	74	Confident	72.1	Confident	107 Å²	107	75.1 Å²	75.1	66%	0.656	43%	0.427	S	S	*	.	H	α-helix	trans	-68	-29.5	-179.3	52.1	0	0	0	0	113.7	N1046 G1052	N1046-T1048 VanDerWaalsContact C-N 3.32Å; N1046-T1048 PolarHBondContact O-N 3.49Å; T1048-G1052 PolarHBondContact O-N 3.37Å
1049	L	74.1	Confident	72.9	Confident	91 Å²	91	72.3 Å²	72.3	48%	0.476	41%	0.409	S	S	.	.	H	α-helix	trans	-80.9	-32.8	175.7	-67.2	173.9	0	0	0	111.2	T1044 N1046 Q1047 G1052 G1053 A1054	T1044-L1049 HydrophobicContact CG2-CB 3.82Å; T1044-L1049 HydrophobicContact CG2-CD1 4.47Å; N1046-L1049 HydrophobicContact CB-CB 4.41Å; N1046-L1049 HydrophobicContact CB-CD1 4.03Å; N1046-L1049 HydrophobicContact CB-CG 4.37Å; N1046-L1049 PolarHBondContact O-N 2.88Å; Q1047-L1049 VanDerWaalsContact C-N 3.32Å; Q1047-L1049 PolarHBondContact O-N 3.44Å; L1049-G1052 CarbonylContact O-C 3.56Å; L1049-G1052 PolarHBondContact O-N 3.05Å; L1049-G1053 PolarHBondContact O-N 3.24Å; L1049-A1054 HydrophobicContact CB-CB 4.27Å; L1049-A1054 WeakPolarHBondContact O-CB 3.21Å; L1049-A1054 PolarHBondContact O-N 3.12Å
1050	V	74	Confident	73.2	Confident	2 Å²	2	75.8 Å²	75.8	1%	0.012	43%	0.43	C	S	.	.	H	α-helix	trans	-67.5	-41.6	173.9	176	0	0	0	0	110.9	P1007 T1044 N1046 Q1047 G1052 G1053 Q1056	P1007-V1050 HydrophobicContact CG-CG1 4.26Å; T1044-V1050 HydrophobicContact CG2-CG2 4.05Å; N1046-V1050 WeakPolarHBondContact O-CG2 3.4Å; N1046-V1050 PolarHBondContact O-N 3Å; Q1047-V1050 PolarHBondContact O-N 3.14Å; V1050-G1052 PolarHBondContact O-N 3.2Å; V1050-G1053 PolarHBondContact O-N 3.45Å; V1050-Q1056 HydrophobicContact CG1-CB 4.38Å; V1050-Q1056 HydrophobicContact CG2-CB 4.2Å; V1050-Q1056 HydrophobicContact CG2-CG 4.49Å
1051	D	71.5	Confident	73.7	Confident	96 Å²	96	75.4 Å²	75.4	51%	0.513	43%	0.428	S	S	.	.	H	α-helix	trans	-63.7	-29.9	172.2	-69.1	-18.7	0	0	0	112.2	P1007 Q1047 G1053	P1007-D1051 WeakPolarHBondContact CG-OD1 3.4Å; Q1047-D1051 VanDerWaalsContact O-CG 3.31Å; Q1047-D1051 PolarHBondContact O-N 3.42Å; D1051-G1053 VanDerWaalsContact C-N 3.26Å; D1051-G1053 PolarHBondContact O-N 3.42Å
1052	G	73.4	Confident	74	Confident	72 Å²	72	73 Å²	73	74%	0.742	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-0.1	171.9	0	0	0	0	0	115.1	T1048 L1049 V1050	T1048-G1052 PolarHBondContact O-N 3.37Å; L1049-G1052 CarbonylContact O-C 3.56Å; L1049-G1052 PolarHBondContact O-N 3.05Å; V1050-G1052 PolarHBondContact O-N 3.2Å
1053	G	71.4	Confident	74.5	Confident	25 Å²	25	65.1 Å²	65.1	26%	0.258	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.8	3.6	175.2	0	0	0	0	0	116.2	R1011 L1049 V1050 D1051	R1011-G1053 VanDerWaalsContact CZ-O 3.3Å; R1011-G1053 PolarHBondContact NH1-O 2.91Å; R1011-G1053 PolarHBondContact NH2-O 2.95Å; L1049-G1053 PolarHBondContact O-N 3.24Å; V1050-G1053 PolarHBondContact O-N 3.45Å; D1051-G1053 VanDerWaalsContact C-N 3.26Å; D1051-G1053 PolarHBondContact O-N 3.42Å
1054	A	74.2	Confident	75	Confident	38 Å²	38	71 Å²	71	31%	0.314	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-66.2	156.9	173.1	0	0	0	0	0	112	R1011 T1044 L1049	R1011-A1054 PolarHBondContact NH1-O 3.24Å; T1044-A1054 HydrophobicContact CG2-CB 3.61Å; L1049-A1054 HydrophobicContact CB-CB 4.27Å; L1049-A1054 WeakPolarHBondContact O-CB 3.21Å; L1049-A1054 PolarHBondContact O-N 3.12Å
1055	E	71.3	Confident	75.5	Confident	61 Å²	61	72.4 Å²	72.4	29%	0.285	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130	177.7	-63.6	-153.1	171.7	0	0	111.5	V1041 C1043 T1044	V1041-E1055 HydrophobicContact CG1-CG 4.44Å; V1041-E1055 WeakPolarHBondContact CG1-OE2 3.45Å; C1043-E1055 CarbonylContact C-O 3.6Å; C1043-E1055 VanDerWaalsContact CA-O 3.31Å; C1043-E1055 WeakPolarHBondContact CA-O 3.38Å; T1044-E1055 PolarHBondContact N-O 3.49Å
1056	Q	76.3	Confident	76.2	Confident	13 Å²	13	66.7 Å²	66.7	6%	0.061	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	138.6	175.5	-171.6	173.9	58.9	0	0	111.3	Y1003 H1005 T1044 V1050	Y1003-Q1056 HydrophobicContact CD1-CB 4.31Å; Y1003-Q1056 WeakPolarHBondContact CE1-O 3.46Å; H1005-Q1056 VanDerWaalsContact C-OE1 3.29Å; H1005-Q1056 PolarHBondContact O-NE2 3.47Å; H1005-Q1056 PolarHBondContact O-OE1 3.35Å; T1044-Q1056 WeakPolarHBondContact O-CA 3.34Å; V1050-Q1056 HydrophobicContact CG1-CB 4.38Å; V1050-Q1056 HydrophobicContact CG2-CB 4.2Å; V1050-Q1056 HydrophobicContact CG2-CG 4.49Å
1057	C	76.9	Confident	76.6	Confident	26 Å²	26	64.7 Å²	64.7	18%	0.176	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-70.3	154.5	173	-60.1	0	0	0	0	111.9	C1043 T1044 D1045	C1043-C1057 HydrophobicContact CB-CB 3.95Å; C1043-C1057 WeakPolarHBondContact CB-SG 3.29Å; C1043-C1057 PolarHBondContact O-SG 3.3Å; C1043-C1057 VanDerWaalsContact SG-CA 3.54Å; C1043-C1057 WeakPolarHBondContact SG-CB 3.44Å; C1043-C1057 CovalentContact SG-SG 2.04Å; C1043-C1057 PolarHBondContact SG-SG 3.39Å; T1044-C1057 PolarHBondContact N-SG 3Å; D1045-C1057 WeakPolarHBondContact OD1-CB 3.46Å
1058	R	76.5	Confident	77.5	Confident	27 Å²	27	61.9 Å²	61.9	10%	0.102	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-76.8	145.1	-177.9	-55.4	-177.1	-151	157.6	7.3	111.5	L1002 Y1003 E1031 E1032 D1034 W1039	L1002-R1058 WeakPolarHBondContact O-CA 3.24Å; Y1003-R1058 HydrophobicContact CE1-CG 4.36Å; E1031-R1058 VanDerWaalsContact O-CZ 3.25Å; E1031-R1058 PolarHBondContact O-NH1 2.89Å; E1031-R1058 PolarHBondContact O-NH2 2.96Å; E1032-R1058 VanDerWaalsContact C-CZ 3.48Å; E1032-R1058 VanDerWaalsContact CA-CZ 3.46Å; E1032-R1058 VanDerWaalsContact CA-NH2 3.28Å; E1032-R1058 PolarHBondContact O-NE 3.4Å; E1032-R1058 PolarHBondContact O-NH1 3.05Å; D1034-R1058 PolarHBondContact O-NH1 2.82Å; W1039-R1058 VanDerWaalsContact CB-NH2 3.31Å; W1039-R1058 HydrophobicContact CE3-CG 4.12Å; W1039-R1058 VanDerWaalsContact CE3-NE 3.3Å; W1039-R1058 HydrophobicContact CZ3-CG 3.78Å
1059	N	76.4	Confident	78.2	Confident	62 Å²	62	59.1 Å²	59.1	33%	0.332	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-76.8	130.6	173.2	-169.4	-3.5	0	0	0	111.4	L1002 N1061	L1002-N1059 PolarHBondContact O-N 2.69Å; N1059-N1061 WeakPolarHBondContact OD1-CB 3.29Å; N1059-N1061 PolarHBondContact OD1-N 3.15Å
1060	L	73.4	Confident	78.9	Confident	125 Å²	125	55.4 Å²	55.4	65%	0.654	31%	0.311	S	S	*	.	S	Bend	trans	-78.5	-21.3	179	-72.4	145.7	0	0	0	113	V1035 G1062	V1035-L1060 HydrophobicContact CB-CD2 4.41Å; V1035-L1060 HydrophobicContact CG1-CD2 3.33Å; V1035-L1060 HydrophobicContact CG1-CG 4.15Å; L1060-G1062 VanDerWaalsContact C-N 3.26Å; L1060-G1062 PolarHBondContact O-N 3.35Å
1061	N	72.3	Confident	79.7	Confident	147 Å²	147	60.5 Å²	60.5	79%	0.786	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	15.3	-163.1	-68	-16.6	0	0	0	116.1	N1059	N1059-N1061 WeakPolarHBondContact OD1-CB 3.29Å; N1059-N1061 PolarHBondContact OD1-N 3.15Å
1062	G	74	Confident	80.7	Confident	9 Å²	9	59.8 Å²	59.8	9%	0.093	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-155.9	12.3	-177.4	0	0	0	0	0	115.7	L1060 W1064 L1065 V1066	L1060-G1062 VanDerWaalsContact C-N 3.26Å; L1060-G1062 PolarHBondContact O-N 3.35Å; G1062-W1064 VanDerWaalsContact C-N 3.32Å; G1062-W1064 PolarHBondContact O-N 3.15Å; G1062-L1065 WeakPolarHBondContact O-CB 3.36Å; G1062-L1065 PolarHBondContact O-N 2.59Å; G1062-V1066 PolarHBondContact O-N 3.28Å; G1062-V1066 VanDerWaalsContact O-N 3.17Å
1063	N	81.6	Confident	81.6	Confident	26 Å²	26	56.5 Å²	56.5	14%	0.139	30%	0.296	C	S	.	.	H	α-helix	trans	-57	-41.1	-172	-173.1	23.9	0	0	0	113.1	V1033 D1034 V1035 L1065 V1066 V1067	V1033-N1063 PolarHBondContact O-OD1 3.12Å; D1034-N1063 PolarHBondContact OD1-ND2 2.94Å; V1035-N1063 HydrophobicContact CG2-CB 3.99Å; V1035-N1063 PolarHBondContact N-ND2 3.17Å; N1063-L1065 VanDerWaalsContact C-N 3.26Å; N1063-L1065 PolarHBondContact O-N 3.32Å; N1063-V1066 PolarHBondContact O-N 2.95Å; N1063-V1066 VanDerWaalsContact O-N 3.16Å; N1063-V1067 WeakPolarHBondContact O-CG2 3.29Å; N1063-V1067 PolarHBondContact O-N 3.41Å
1064	W	85.7	Confident	82.5	Confident	179 Å²	179	56.6 Å²	56.6	68%	0.678	29%	0.29	S	S	*	.	H	α-helix	trans	-59.1	-37.5	178.5	72.7	-86.4	0	0	0	112.5	G1062 I1068	G1062-W1064 VanDerWaalsContact C-N 3.32Å; G1062-W1064 PolarHBondContact O-N 3.15Å; W1064-I1068 HydrophobicContact CE3-CD1 3.49Å; W1064-I1068 VanDerWaalsContact CE3-CD1 3.49Å; W1064-I1068 HydrophobicContact CZ3-CD1 3.64Å; W1064-I1068 WeakPolarHBondContact O-CG1 3.07Å; W1064-I1068 PolarHBondContact O-N 3.13Å; W1064-I1068 VanDerWaalsContact O-N 3.12Å
1065	L	86.4	Confident	83.3	Confident	63 Å²	63	59.5 Å²	59.5	33%	0.33	30%	0.3	S	S	.	.	H	α-helix	trans	-73.2	-37.8	178.7	-176.6	63.2	0	0	0	111.2	L1001 G1062 N1063 I1068 L1069	L1001-L1065 HydrophobicContact CD1-CD2 3.96Å; L1001-L1065 HydrophobicContact CD1-CG 4.14Å; L1001-L1065 HydrophobicContact CD2-CD2 4.12Å; G1062-L1065 WeakPolarHBondContact O-CB 3.36Å; G1062-L1065 PolarHBondContact O-N 2.59Å; N1063-L1065 VanDerWaalsContact C-N 3.26Å; N1063-L1065 PolarHBondContact O-N 3.32Å; L1065-I1068 PolarHBondContact O-N 3.42Å; L1065-L1069 HydrophobicContact CD1-CG 4.43Å; L1065-L1069 HydrophobicContact CG-CD1 4.08Å; L1065-L1069 HydrophobicContact CG-CG 4.41Å; L1065-L1069 WeakPolarHBondContact O-CB 3.18Å; L1065-L1069 VanDerWaalsContact O-CG 3.3Å; L1065-L1069 WeakPolarHBondContact O-CG 3.22Å; L1065-L1069 PolarHBondContact O-N 3.49Å
1066	V	86.6	Confident	84.2	Confident	1 Å²	1	58 Å²	58	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-44.7	175	172	0	0	0	0	111.1	N998 L1001 L1002 V1033 G1062 N1063 L1069 L1070	N998-V1066 VanDerWaalsContact OD1-CG1 3.3Å; N998-V1066 WeakPolarHBondContact OD1-CG1 3.24Å; L1001-V1066 HydrophobicContact CB-CG2 3.64Å; L1001-V1066 HydrophobicContact CD1-CG2 3.95Å; L1001-V1066 HydrophobicContact CG-CG2 4.43Å; L1002-V1066 HydrophobicContact CD2-CG1 4.38Å; L1002-V1066 HydrophobicContact CD2-CG2 4.39Å; L1002-V1066 HydrophobicContact CG-CG1 4.5Å; L1002-V1066 HydrophobicContact CG-CG2 4.38Å; V1033-V1066 HydrophobicContact CG1-CG1 3.59Å; G1062-V1066 PolarHBondContact O-N 3.28Å; G1062-V1066 VanDerWaalsContact O-N 3.17Å; N1063-V1066 PolarHBondContact O-N 2.95Å; N1063-V1066 VanDerWaalsContact O-N 3.16Å; V1066-L1069 PolarHBondContact O-N 2.94Å; V1066-L1070 WeakPolarHBondContact O-CB 3.44Å; V1066-L1070 PolarHBondContact O-N 3.41Å
1067	V	87.1	Confident	84.9	Confident	56 Å²	56	57.4 Å²	57.4	34%	0.339	29%	0.293	S	S	.	.	H	α-helix	trans	-64.3	-41.8	176.4	176.5	0	0	0	0	111.4	N1063 L1070 M1071	N1063-V1067 WeakPolarHBondContact O-CG2 3.29Å; N1063-V1067 PolarHBondContact O-N 3.41Å; V1067-L1070 PolarHBondContact O-N 3.38Å; V1067-M1071 WeakPolarHBondContact O-CG 3.13Å; V1067-M1071 PolarHBondContact O-N 3.4Å
1068	I	89.7	Confident	85.4	Confident	74 Å²	74	58.7 Å²	58.7	38%	0.379	30%	0.298	S	S	.	.	H	α-helix	trans	-64.4	-45	175.6	-71.5	174.3	0	0	0	111.3	W1064 L1065 L1070 M1071 I1072	W1064-I1068 HydrophobicContact CE3-CD1 3.49Å; W1064-I1068 VanDerWaalsContact CE3-CD1 3.49Å; W1064-I1068 HydrophobicContact CZ3-CD1 3.64Å; W1064-I1068 WeakPolarHBondContact O-CG1 3.07Å; W1064-I1068 PolarHBondContact O-N 3.13Å; W1064-I1068 VanDerWaalsContact O-N 3.12Å; L1065-I1068 PolarHBondContact O-N 3.42Å; I1068-L1070 VanDerWaalsContact C-N 3.29Å; I1068-L1070 PolarHBondContact O-N 3.49Å; I1068-M1071 PolarHBondContact O-N 2.98Å; I1068-M1071 VanDerWaalsContact O-N 3.15Å; I1068-I1072 HydrophobicContact CG2-CD1 3.74Å; I1068-I1072 HydrophobicContact CG2-CG1 4.35Å; I1068-I1072 WeakPolarHBondContact O-CG1 3.16Å; I1068-I1072 PolarHBondContact O-N 3.4Å
1069	L	89.9	Confident	86	Confident	49 Å²	49	62.7 Å²	62.7	26%	0.257	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-37.7	177.3	-76.6	171	0	0	0	111.6	Y994 L1001 L1065 V1066 Y1073	Y994-L1069 HydrophobicContact CD2-CB 4.49Å; Y994-L1069 HydrophobicContact CE2-CB 4.33Å; L1001-L1069 HydrophobicContact CD1-CD1 3.48Å; L1001-L1069 VanDerWaalsContact CD1-CD1 3.48Å; L1065-L1069 HydrophobicContact CD1-CG 4.43Å; L1065-L1069 HydrophobicContact CG-CD1 4.08Å; L1065-L1069 HydrophobicContact CG-CG 4.41Å; L1065-L1069 WeakPolarHBondContact O-CB 3.18Å; L1065-L1069 VanDerWaalsContact O-CG 3.3Å; L1065-L1069 WeakPolarHBondContact O-CG 3.22Å; L1065-L1069 PolarHBondContact O-N 3.49Å; V1066-L1069 PolarHBondContact O-N 2.94Å; L1069-Y1073 WeakPolarHBondContact O-CB 3.47Å; L1069-Y1073 PolarHBondContact O-N 2.94Å
1070	L	89	Confident	86.6	Confident	13 Å²	13	64.6 Å²	64.6	7%	0.068	33%	0.33	C	S	.	.	H	α-helix	trans	-62.5	-44.8	172.6	177.1	67.1	0	0	0	111.6	Y994 I1028 V1033 V1066 V1067 I1068 Y1073 L1074	Y994-L1070 WeakPolarHBondContact OH-CD1 3.19Å; I1028-L1070 HydrophobicContact CG2-CD1 4.5Å; I1028-L1070 HydrophobicContact CG2-CD2 3.98Å; V1033-L1070 HydrophobicContact CG1-CD2 4.23Å; V1066-L1070 WeakPolarHBondContact O-CB 3.44Å; V1066-L1070 PolarHBondContact O-N 3.41Å; V1067-L1070 PolarHBondContact O-N 3.38Å; I1068-L1070 VanDerWaalsContact C-N 3.29Å; I1068-L1070 PolarHBondContact O-N 3.49Å; L1070-Y1073 PolarHBondContact O-N 3.48Å; L1070-L1074 HydrophobicContact CD1-CD1 4.13Å; L1070-L1074 HydrophobicContact CD1-CG 4.23Å; L1070-L1074 HydrophobicContact CG-CD1 4.11Å; L1070-L1074 VanDerWaalsContact O-CG 3.3Å; L1070-L1074 WeakPolarHBondContact O-CG 3.35Å; L1070-L1074 PolarHBondContact O-N 3.24Å
1071	M	89.7	Confident	87.4	Confident	108 Å²	108	59.6 Å²	59.6	53%	0.532	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-45.3	177	-70.3	-62.9	112.8	0	0	112.2	V1067 I1068 Y1073 L1074 L1075	V1067-M1071 WeakPolarHBondContact O-CG 3.13Å; V1067-M1071 PolarHBondContact O-N 3.4Å; I1068-M1071 PolarHBondContact O-N 2.98Å; I1068-M1071 VanDerWaalsContact O-N 3.15Å; M1071-Y1073 VanDerWaalsContact C-N 3.33Å; M1071-Y1073 PolarHBondContact O-N 3.3Å; M1071-L1074 HydrophobicContact CE-CD1 4.19Å; M1071-L1074 PolarHBondContact O-N 3.29Å; M1071-L1075 WeakPolarHBondContact O-CB 3.42Å; M1071-L1075 PolarHBondContact O-N 3.48Å
1072	I	92.3	Very high	88.2	Confident	82 Å²	82	55.4 Å²	55.4	42%	0.421	28%	0.28	S	S	.	.	H	α-helix	trans	-62.1	-44	176	-67.7	170.2	0	0	0	110.1	I1068 L1075 V1076	I1068-I1072 HydrophobicContact CG2-CD1 3.74Å; I1068-I1072 HydrophobicContact CG2-CG1 4.35Å; I1068-I1072 WeakPolarHBondContact O-CG1 3.16Å; I1068-I1072 PolarHBondContact O-N 3.4Å; I1072-L1075 PolarHBondContact O-N 2.87Å; I1072-V1076 HydrophobicContact CG2-CG2 4.32Å; I1072-V1076 WeakPolarHBondContact O-CB 3.43Å; I1072-V1076 WeakPolarHBondContact O-CG2 3.22Å; I1072-V1076 PolarHBondContact O-N 2.89Å
1073	Y	92.2	Very high	88.9	Confident	2 Å²	2	59 Å²	59	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-48.7	177.9	174.2	-99.7	0	0	0	111.7	W990 Y994 P1020 H1023 I1024 L1069 L1070 M1071 V1076 T1077	W990-Y1073 AromaticContact CD1-CD2 3.68Å; W990-Y1073 AromaticContact CD1-CE2 3.71Å; W990-Y1073 AromaticContact NE1-CD2 3.51Å; Y994-Y1073 HydrophobicContact CD1-CD1 4.23Å; Y994-Y1073 AromaticContact CD1-CD2 3.73Å; Y994-Y1073 HydrophobicContact CD1-CD2 3.73Å; Y994-Y1073 HydrophobicContact CD1-CE1 4.35Å; Y994-Y1073 AromaticContact CD1-CE2 3.85Å; Y994-Y1073 HydrophobicContact CD1-CE2 3.85Å; Y994-Y1073 AromaticContact CD1-CG 3.92Å; Y994-Y1073 HydrophobicContact CD1-CG 3.92Å; Y994-Y1073 AromaticContact CD2-CD2 3.98Å; Y994-Y1073 HydrophobicContact CD2-CD2 3.98Å; Y994-Y1073 AromaticContact CD2-CG 3.86Å; Y994-Y1073 HydrophobicContact CD2-CG 3.86Å; Y994-Y1073 HydrophobicContact CE1-CD1 4.15Å; Y994-Y1073 HydrophobicContact CE1-CD2 4.43Å; Y994-Y1073 HydrophobicContact CE1-CE1 4.34Å; Y994-Y1073 HydrophobicContact CE1-CG 4.19Å; Y994-Y1073 HydrophobicContact CE2-CG 4.16Å; Y994-Y1073 HydrophobicContact CG-CD1 4.47Å; Y994-Y1073 AromaticContact CG-CD2 3.45Å; Y994-Y1073 HydrophobicContact CG-CD2 3.45Å; Y994-Y1073 VanDerWaalsContact CG-CD2 3.45Å; Y994-Y1073 AromaticContact CG-CE2 3.97Å; Y994-Y1073 HydrophobicContact CG-CE2 3.97Å; Y994-Y1073 AromaticContact CG-CG 3.73Å; Y994-Y1073 HydrophobicContact CG-CG 3.73Å; P1020-Y1073 PolarHBondContact O-OH 2.95Å; H1023-Y1073 HydrophobicContact CB-CE1 3.99Å; I1024-Y1073 WeakPolarHBondContact CD1-OH 3.45Å; I1024-Y1073 HydrophobicContact CG1-CE1 4.33Å; I1024-Y1073 VanDerWaalsContact CG1-OH 3.28Å; I1024-Y1073 WeakPolarHBondContact CG1-OH 3.27Å; L1069-Y1073 WeakPolarHBondContact O-CB 3.47Å; L1069-Y1073 PolarHBondContact O-N 2.94Å; L1070-Y1073 PolarHBondContact O-N 3.48Å; M1071-Y1073 VanDerWaalsContact C-N 3.33Å; M1071-Y1073 PolarHBondContact O-N 3.3Å; Y1073-V1076 PolarHBondContact O-N 2.79Å; Y1073-T1077 HydrophobicContact CD2-CG2 4.04Å; Y1073-T1077 HydrophobicContact CE1-CG2 4.24Å; Y1073-T1077 HydrophobicContact CE2-CG2 3.66Å; Y1073-T1077 HydrophobicContact CG-CG2 4.49Å; Y1073-T1077 WeakPolarHBondContact O-CB 3.35Å; Y1073-T1077 WeakPolarHBondContact O-CG2 3.38Å; Y1073-T1077 PolarHBondContact O-N 3.25Å; Y1073-T1077 PolarHBondContact O-OG1 2.88Å
1074	L	90.3	Very high	89.2	Confident	27 Å²	27	61.9 Å²	61.9	14%	0.141	31%	0.312	C	S	.	.	H	α-helix	trans	-65.9	-38.8	178.3	-68.8	172	0	0	0	112.4	I1028 L1070 M1071 T1077 N1078	I1028-L1074 HydrophobicContact CD1-CD1 3.58Å; I1028-L1074 HydrophobicContact CD1-CD2 4.08Å; I1028-L1074 HydrophobicContact CD1-CG 4.46Å; L1070-L1074 HydrophobicContact CD1-CD1 4.13Å; L1070-L1074 HydrophobicContact CD1-CG 4.23Å; L1070-L1074 HydrophobicContact CG-CD1 4.11Å; L1070-L1074 VanDerWaalsContact O-CG 3.3Å; L1070-L1074 WeakPolarHBondContact O-CG 3.35Å; L1070-L1074 PolarHBondContact O-N 3.24Å; M1071-L1074 HydrophobicContact CE-CD1 4.19Å; M1071-L1074 PolarHBondContact O-N 3.29Å; L1074-T1077 WeakPolarHBondContact CA-OG1 3.34Å; L1074-T1077 PolarHBondContact O-OG1 2.86Å; L1074-N1078 VanDerWaalsContact O-CB 3.28Å; L1074-N1078 WeakPolarHBondContact O-CB 3.46Å; L1074-N1078 PolarHBondContact O-N 3.31Å
1075	L	90.8	Very high	89.4	Confident	99 Å²	99	54.8 Å²	54.8	52%	0.518	29%	0.288	S	S	.	.	I	π-helix	trans	-62.6	-49.7	175.8	-178.2	146	0	0	0	110.9	M1071 I1072 I1079 L1080	M1071-L1075 WeakPolarHBondContact O-CB 3.42Å; M1071-L1075 PolarHBondContact O-N 3.48Å; I1072-L1075 PolarHBondContact O-N 2.87Å; L1075-I1079 HydrophobicContact CG-CD1 4.23Å; L1075-I1079 WeakPolarHBondContact O-CA 3.49Å; L1075-I1079 VanDerWaalsContact O-CB 3.24Å; L1075-I1079 WeakPolarHBondContact O-CB 3.36Å; L1075-I1079 PolarHBondContact O-N 2.91Å; L1075-L1080 PolarHBondContact O-N 3.34Å
1076	V	91.5	Very high	89.6	Confident	30 Å²	30	56.5 Å²	56.5	18%	0.182	30%	0.296	C	S	.	.	I	π-helix	trans	-67.2	-43.2	-178.9	173.5	0	0	0	0	111	W990 I1072 Y1073 L1080 L1081	W990-V1076 HydrophobicContact CD2-CG1 4.29Å; W990-V1076 HydrophobicContact CZ2-CB 3.95Å; W990-V1076 HydrophobicContact CZ2-CG1 3.85Å; W990-V1076 HydrophobicContact CZ2-CG2 3.95Å; I1072-V1076 HydrophobicContact CG2-CG2 4.32Å; I1072-V1076 WeakPolarHBondContact O-CB 3.43Å; I1072-V1076 WeakPolarHBondContact O-CG2 3.22Å; I1072-V1076 PolarHBondContact O-N 2.89Å; Y1073-V1076 PolarHBondContact O-N 2.79Å; V1076-L1080 WeakPolarHBondContact O-CB 3.45Å; V1076-L1080 PolarHBondContact O-N 2.95Å; V1076-L1081 HydrophobicContact CG1-CD1 4.32Å; V1076-L1081 HydrophobicContact CG1-CG 4.4Å; V1076-L1081 WeakPolarHBondContact O-CG 3.46Å; V1076-L1081 PolarHBondContact O-N 3.38Å
1077	T	89.6	Confident	89.8	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.006	32%	0.32	C	S	.	.	I	π-helix	trans	-70.9	-54.8	-179.1	50.8	0	0	0	0	112.1	L987 I1024 Y1073 L1074 L1081 I1082	L987-T1077 HydrophobicContact CD1-CG2 4.29Å; I1024-T1077 HydrophobicContact CG1-CG2 4.47Å; Y1073-T1077 HydrophobicContact CD2-CG2 4.04Å; Y1073-T1077 HydrophobicContact CE1-CG2 4.24Å; Y1073-T1077 HydrophobicContact CE2-CG2 3.66Å; Y1073-T1077 HydrophobicContact CG-CG2 4.49Å; Y1073-T1077 WeakPolarHBondContact O-CB 3.35Å; Y1073-T1077 WeakPolarHBondContact O-CG2 3.38Å; Y1073-T1077 PolarHBondContact O-N 3.25Å; Y1073-T1077 PolarHBondContact O-OG1 2.88Å; L1074-T1077 WeakPolarHBondContact CA-OG1 3.34Å; L1074-T1077 PolarHBondContact O-OG1 2.86Å; T1077-L1081 HydrophobicContact CG2-CD1 4.43Å; T1077-L1081 WeakPolarHBondContact O-CB 3.43Å; T1077-L1081 PolarHBondContact O-N 3.12Å; T1077-I1082 WeakPolarHBondContact O-CG1 3.29Å; T1077-I1082 PolarHBondContact O-N 2.94Å
1078	N	87.6	Confident	89.9	Confident	53 Å²	53	59.7 Å²	59.7	28%	0.283	32%	0.318	S	S	.	.	I	π-helix	trans	-83.7	-36.6	-170.2	-65.3	-15.2	0	0	0	113.5	L1074 I1082	L1074-N1078 VanDerWaalsContact O-CB 3.28Å; L1074-N1078 WeakPolarHBondContact O-CB 3.46Å; L1074-N1078 PolarHBondContact O-N 3.31Å; N1078-I1082 HydrophobicContact CB-CD1 4.48Å; N1078-I1082 WeakPolarHBondContact OD1-CD1 3.47Å
1079	I	89.8	Confident	89.9	Confident	111 Å²	111	58.8 Å²	58.8	57%	0.569	31%	0.312	S	S	*	.	I	π-helix	trans	-88.8	-39.9	-177.9	-54.5	-177.7	0	0	0	111.2	L1075 N1083	L1075-I1079 HydrophobicContact CG-CD1 4.23Å; L1075-I1079 WeakPolarHBondContact O-CA 3.49Å; L1075-I1079 VanDerWaalsContact O-CB 3.24Å; L1075-I1079 WeakPolarHBondContact O-CB 3.36Å; L1075-I1079 PolarHBondContact O-N 2.91Å; I1079-N1083 WeakPolarHBondContact O-CB 3.32Å; I1079-N1083 PolarHBondContact O-ND2 3.09Å
1080	L	89.4	Confident	90	Very high	102 Å²	102	59.9 Å²	59.9	53%	0.534	32%	0.324	S	S	.	.	I	π-helix	trans	-92.4	-60.2	-177.1	-175.3	144.2	0	0	0	112	L1075 V1076 L1084	L1075-L1080 PolarHBondContact O-N 3.34Å; V1076-L1080 WeakPolarHBondContact O-CB 3.45Å; V1076-L1080 PolarHBondContact O-N 2.95Å; L1080-L1084 VanDerWaalsContact O-CB 3.27Å; L1080-L1084 WeakPolarHBondContact O-CB 3.45Å; L1080-L1084 PolarHBondContact O-N 3.18Å
1081	L	89.2	Confident	90	Very high	19 Å²	19	64.1 Å²	64.1	10%	0.099	35%	0.346	C	S	.	.	I	π-helix	trans	-70.2	-47.4	-170.7	-67.7	176.5	0	0	0	112.7	F983 L987 V1076 T1077 N1083 L1084 L1085	F983-L1081 HydrophobicContact CE2-CB 3.91Å; F983-L1081 WeakPolarHBondContact CE2-O 2.72Å; F983-L1081 HydrophobicContact CZ-CB 4.48Å; L987-L1081 HydrophobicContact CD1-CD1 4.31Å; V1076-L1081 HydrophobicContact CG1-CD1 4.32Å; V1076-L1081 HydrophobicContact CG1-CG 4.4Å; V1076-L1081 WeakPolarHBondContact O-CG 3.46Å; V1076-L1081 PolarHBondContact O-N 3.38Å; T1077-L1081 HydrophobicContact CG2-CD1 4.43Å; T1077-L1081 WeakPolarHBondContact O-CB 3.43Å; T1077-L1081 PolarHBondContact O-N 3.12Å; L1081-N1083 PolarHBondContact O-N 3.46Å; L1081-L1084 WeakPolarHBondContact O-CB 3.26Å; L1081-L1084 PolarHBondContact O-N 2.92Å; L1081-L1085 PolarHBondContact O-N 3.09Å
1082	I	89.1	Confident	89.9	Confident	59 Å²	59	60.2 Å²	60.2	30%	0.303	33%	0.329	S	S	.	.	H	α-helix	trans	-63.4	-43.3	179.1	-67.5	178.9	0	0	0	111.4	I1024 T1077 N1078 L1084 L1085 I1086	I1024-I1082 HydrophobicContact CG2-CD1 4.05Å; T1077-I1082 WeakPolarHBondContact O-CG1 3.29Å; T1077-I1082 PolarHBondContact O-N 2.94Å; N1078-I1082 HydrophobicContact CB-CD1 4.48Å; N1078-I1082 WeakPolarHBondContact OD1-CD1 3.47Å; I1082-L1084 VanDerWaalsContact C-N 3.34Å; I1082-L1084 PolarHBondContact O-N 3.01Å; I1082-L1085 WeakPolarHBondContact O-CB 3.48Å; I1082-L1085 PolarHBondContact O-N 3.46Å; I1082-L1085 VanDerWaalsContact O-N 3.15Å; I1082-I1086 HydrophobicContact CG2-CD1 4.13Å; I1082-I1086 WeakPolarHBondContact O-CG1 3.47Å; I1082-I1086 PolarHBondContact O-N 3.34Å
1083	N	89.4	Confident	89.7	Confident	84 Å²	84	60.7 Å²	60.7	45%	0.449	33%	0.328	S	S	.	.	H	α-helix	trans	-67.8	-34.5	178.3	-71.5	-32	0	0	0	112.5	I1079 L1081 L1085 I1086 A1087	I1079-N1083 WeakPolarHBondContact O-CB 3.32Å; I1079-N1083 PolarHBondContact O-ND2 3.09Å; L1081-N1083 PolarHBondContact O-N 3.46Å; N1083-L1085 VanDerWaalsContact C-N 3.32Å; N1083-I1086 PolarHBondContact O-N 3.25Å; N1083-A1087 WeakPolarHBondContact O-CB 3.36Å; N1083-A1087 PolarHBondContact O-N 3.02Å
1084	L	88.8	Confident	89.5	Confident	87 Å²	87	64.6 Å²	64.6	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-42.5	170.3	-172.7	102.1	0	0	0	110.9	L1080 L1081 I1082 A1087 M1088	L1080-L1084 VanDerWaalsContact O-CB 3.27Å; L1080-L1084 WeakPolarHBondContact O-CB 3.45Å; L1080-L1084 PolarHBondContact O-N 3.18Å; L1081-L1084 WeakPolarHBondContact O-CB 3.26Å; L1081-L1084 PolarHBondContact O-N 2.92Å; I1082-L1084 VanDerWaalsContact C-N 3.34Å; I1082-L1084 PolarHBondContact O-N 3.01Å; L1084-A1087 PolarHBondContact O-N 3.22Å; L1084-M1088 HydrophobicContact CD2-CE 3.68Å; L1084-M1088 HydrophobicContact CD2-SD 4.12Å; L1084-M1088 HydrophobicContact CG-CE 4.14Å; L1084-M1088 HydrophobicContact CG-SD 4.44Å; L1084-M1088 WeakPolarHBondContact O-CG 2.98Å; L1084-M1088 PolarHBondContact O-N 3.02Å
1085	L	89.1	Confident	89.3	Confident	30 Å²	30	69.4 Å²	69.4	16%	0.157	37%	0.374	C	S	.	.	H	α-helix	trans	-61.2	-44.6	175.9	-174.5	65.2	0	0	0	111.7	F983 L1081 I1082 N1083 A1087 M1088 F1089	F983-L1085 HydrophobicContact CB-CD1 3.81Å; F983-L1085 HydrophobicContact CD1-CD1 4.16Å; F983-L1085 HydrophobicContact CD1-CD2 3.93Å; F983-L1085 HydrophobicContact CD2-CB 3.97Å; F983-L1085 HydrophobicContact CD2-CD1 4.01Å; F983-L1085 HydrophobicContact CD2-CD2 4.43Å; F983-L1085 HydrophobicContact CD2-CG 4.37Å; F983-L1085 HydrophobicContact CE1-CD2 3.86Å; F983-L1085 HydrophobicContact CE2-CB 3.94Å; F983-L1085 HydrophobicContact CE2-CD2 4.35Å; F983-L1085 HydrophobicContact CG-CB 4.45Å; F983-L1085 HydrophobicContact CG-CD1 3.72Å; F983-L1085 HydrophobicContact CG-CD2 4.22Å; F983-L1085 HydrophobicContact CG-CG 4.35Å; F983-L1085 HydrophobicContact CZ-CB 4.42Å; F983-L1085 HydrophobicContact CZ-CD2 4.08Å; L1081-L1085 PolarHBondContact O-N 3.09Å; I1082-L1085 WeakPolarHBondContact O-CB 3.48Å; I1082-L1085 PolarHBondContact O-N 3.46Å; I1082-L1085 VanDerWaalsContact O-N 3.15Å; N1083-L1085 VanDerWaalsContact C-N 3.32Å; L1085-A1087 VanDerWaalsContact C-N 3.31Å; L1085-A1087 PolarHBondContact O-N 3.06Å; L1085-M1088 HydrophobicContact CD1-CE 4.15Å; L1085-M1088 PolarHBondContact O-N 3.47Å; L1085-F1089 HydrophobicContact CD1-CD1 4.13Å; L1085-F1089 HydrophobicContact CD1-CD2 4.4Å; L1085-F1089 HydrophobicContact CD1-CE1 3.57Å; L1085-F1089 HydrophobicContact CD1-CE2 3.88Å; L1085-F1089 HydrophobicContact CD1-CZ 3.41Å; L1085-F1089 VanDerWaalsContact CD1-CZ 3.41Å; L1085-F1089 HydrophobicContact CD2-CE2 3.95Å; L1085-F1089 HydrophobicContact CD2-CZ 4.11Å; L1085-F1089 HydrophobicContact CG-CD2 4.09Å; L1085-F1089 HydrophobicContact CG-CE1 4.28Å; L1085-F1089 HydrophobicContact CG-CE2 3.7Å; L1085-F1089 HydrophobicContact CG-CZ 3.79Å; L1085-F1089 WeakPolarHBondContact O-CB 3.39Å; L1085-F1089 WeakPolarHBondContact O-CG 3.32Å; L1085-F1089 PolarHBondContact O-N 2.78Å
1086	I	90.6	Very high	89.1	Confident	100 Å²	100	65.7 Å²	65.7	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-59.5	-43.9	175.7	-65.1	167.4	0	0	0	110.4	I1082 N1083 F1089 S1090	I1082-I1086 HydrophobicContact CG2-CD1 4.13Å; I1082-I1086 WeakPolarHBondContact O-CG1 3.47Å; I1082-I1086 PolarHBondContact O-N 3.34Å; N1083-I1086 PolarHBondContact O-N 3.25Å; I1086-F1089 PolarHBondContact O-N 2.98Å; I1086-S1090 WeakPolarHBondContact O-CB 3.22Å; I1086-S1090 PolarHBondContact O-N 2.91Å
1087	A	90.6	Very high	88.9	Confident	61 Å²	61	68.4 Å²	68.4	50%	0.504	37%	0.366	S	S	.	.	H	α-helix	trans	-65.3	-46	178.5	0	0	0	0	0	112.4	N1083 L1084 L1085 S1090 N1091	N1083-A1087 WeakPolarHBondContact O-CB 3.36Å; N1083-A1087 PolarHBondContact O-N 3.02Å; L1084-A1087 PolarHBondContact O-N 3.22Å; L1085-A1087 VanDerWaalsContact C-N 3.31Å; L1085-A1087 PolarHBondContact O-N 3.06Å; A1087-S1090 PolarHBondContact O-N 3.13Å; A1087-N1091 PolarHBondContact O-N 2.93Å
1088	M	89	Confident	88.5	Confident	62 Å²	62	72.3 Å²	72.3	31%	0.305	40%	0.398	S	S	.	.	H	α-helix	trans	-59.8	-47.7	176	-71.9	-173.4	-60.8	0	0	111	L1084 L1085 S1090 N1091 T1092	L1084-M1088 HydrophobicContact CD2-CE 3.68Å; L1084-M1088 HydrophobicContact CD2-SD 4.12Å; L1084-M1088 HydrophobicContact CG-CE 4.14Å; L1084-M1088 HydrophobicContact CG-SD 4.44Å; L1084-M1088 WeakPolarHBondContact O-CG 2.98Å; L1084-M1088 PolarHBondContact O-N 3.02Å; L1085-M1088 HydrophobicContact CD1-CE 4.15Å; L1085-M1088 PolarHBondContact O-N 3.47Å; M1088-S1090 PolarHBondContact O-N 3.08Å; M1088-N1091 PolarHBondContact O-N 3.32Å; M1088-T1092 PolarHBondContact O-N 3.29Å; M1088-T1092 PolarHBondContact O-OG1 3.31Å; M1088-T1092 VanDerWaalsContact O-OG1 3.13Å
1089	F	90.3	Very high	88.4	Confident	55 Å²	55	74.1 Å²	74.1	24%	0.241	41%	0.408	C	S	.	.	H	α-helix	trans	-62.7	-38.9	176	-77.2	-5.5	0	0	0	113.2	M976 D979 V980 L1085 I1086 N1091 F1093	M976-F1089 HydrophobicContact CB-CE1 4.49Å; M976-F1089 HydrophobicContact CE-CB 3.38Å; M976-F1089 HydrophobicContact CE-CD1 3.55Å; M976-F1089 HydrophobicContact CE-CD2 3.9Å; M976-F1089 HydrophobicContact CE-CE1 4.29Å; M976-F1089 HydrophobicContact CE-CG 3.33Å; D979-F1089 HydrophobicContact CB-CD1 4.4Å; D979-F1089 HydrophobicContact CB-CE1 4.12Å; V980-F1089 HydrophobicContact CG2-CE1 3.77Å; V980-F1089 HydrophobicContact CG2-CZ 3.44Å; V980-F1089 VanDerWaalsContact CG2-CZ 3.44Å; L1085-F1089 HydrophobicContact CD1-CD1 4.13Å; L1085-F1089 HydrophobicContact CD1-CD2 4.4Å; L1085-F1089 HydrophobicContact CD1-CE1 3.57Å; L1085-F1089 HydrophobicContact CD1-CE2 3.88Å; L1085-F1089 HydrophobicContact CD1-CZ 3.41Å; L1085-F1089 VanDerWaalsContact CD1-CZ 3.41Å; L1085-F1089 HydrophobicContact CD2-CE2 3.95Å; L1085-F1089 HydrophobicContact CD2-CZ 4.11Å; L1085-F1089 HydrophobicContact CG-CD2 4.09Å; L1085-F1089 HydrophobicContact CG-CE1 4.28Å; L1085-F1089 HydrophobicContact CG-CE2 3.7Å; L1085-F1089 HydrophobicContact CG-CZ 3.79Å; L1085-F1089 WeakPolarHBondContact O-CB 3.39Å; L1085-F1089 WeakPolarHBondContact O-CG 3.32Å; L1085-F1089 PolarHBondContact O-N 2.78Å; I1086-F1089 PolarHBondContact O-N 2.98Å; F1089-N1091 VanDerWaalsContact C-N 3.33Å; F1089-N1091 PolarHBondContact O-N 3.5Å; F1089-F1093 WeakPolarHBondContact O-CA 3.42Å; F1089-F1093 WeakPolarHBondContact O-CB 3.5Å; F1089-F1093 PolarHBondContact O-N 3.5Å
1090	S	90.9	Very high	88.2	Confident	72 Å²	72	68.9 Å²	68.9	50%	0.503	38%	0.381	S	S	.	.	H	α-helix	trans	-62.9	-43	177.3	-172.7	0	0	0	0	111	I1086 A1087 M1088 T1094	I1086-S1090 WeakPolarHBondContact O-CB 3.22Å; I1086-S1090 PolarHBondContact O-N 2.91Å; A1087-S1090 PolarHBondContact O-N 3.13Å; M1088-S1090 PolarHBondContact O-N 3.08Å; S1090-T1094 WeakPolarHBondContact O-CG2 3.34Å; S1090-T1094 PolarHBondContact O-N 3.28Å; S1090-T1094 VanDerWaalsContact O-N 3.09Å; S1090-T1094 PolarHBondContact O-OG1 3.37Å
1091	N	90	Very high	88.1	Confident	102 Å²	102	68.9 Å²	68.9	55%	0.545	38%	0.378	S	S	.	.	H	α-helix	trans	-68.8	-45.2	179	-172.7	51.9	0	0	0	112	A1087 M1088 F1089 F1093 T1094 E1095	A1087-N1091 PolarHBondContact O-N 2.93Å; M1088-N1091 PolarHBondContact O-N 3.32Å; F1089-N1091 VanDerWaalsContact C-N 3.33Å; F1089-N1091 PolarHBondContact O-N 3.5Å; N1091-F1093 VanDerWaalsContact C-N 3.33Å; N1091-F1093 PolarHBondContact O-N 2.81Å; N1091-T1094 PolarHBondContact O-N 2.91Å; N1091-T1094 PolarHBondContact O-OG1 2.98Å; N1091-E1095 PolarHBondContact O-N 3.05Å
1092	T	87.6	Confident	88	Confident	26 Å²	26	69.4 Å²	69.4	16%	0.16	38%	0.384	C	S	.	.	H	α-helix	trans	-71.7	-30.8	178.7	59.6	0	0	0	0	112.1	D979 M1088 V1096	D979-T1092 WeakPolarHBondContact OD2-CB 3.46Å; D979-T1092 WeakPolarHBondContact OD2-CG2 3.26Å; D979-T1092 PolarHBondContact OD2-OG1 3.46Å; M1088-T1092 PolarHBondContact O-N 3.29Å; M1088-T1092 PolarHBondContact O-OG1 3.31Å; M1088-T1092 VanDerWaalsContact O-OG1 3.13Å; T1092-V1096 WeakPolarHBondContact O-CB 3.45Å; T1092-V1096 WeakPolarHBondContact O-CG2 3.41Å; T1092-V1096 PolarHBondContact O-N 3.25Å
1093	F	88.9	Confident	87.9	Confident	93 Å²	93	69.2 Å²	69.2	41%	0.408	38%	0.379	S	S	.	.	H	α-helix	trans	-63.9	-48.2	172.4	-179.5	-95.2	0	0	0	111.9	I972 F1089 N1091 E1095 V1096 Q1097	I972-F1093 HydrophobicContact CD1-CE2 4.19Å; I972-F1093 HydrophobicContact CG2-CD2 3.71Å; I972-F1093 HydrophobicContact CG2-CE2 4.07Å; F1089-F1093 WeakPolarHBondContact O-CA 3.42Å; F1089-F1093 WeakPolarHBondContact O-CB 3.5Å; F1089-F1093 PolarHBondContact O-N 3.5Å; N1091-F1093 VanDerWaalsContact C-N 3.33Å; N1091-F1093 PolarHBondContact O-N 2.81Å; F1093-E1095 PolarHBondContact O-N 3.14Å; F1093-V1096 PolarHBondContact O-N 3.39Å; F1093-Q1097 HydrophobicContact CE1-CB 4.37Å; F1093-Q1097 HydrophobicContact CE1-CG 4.47Å; F1093-Q1097 HydrophobicContact CZ-CB 4.47Å; F1093-Q1097 HydrophobicContact CZ-CG 4.45Å; F1093-Q1097 WeakPolarHBondContact O-CB 3.39Å; F1093-Q1097 PolarHBondContact O-N 3.29Å
1094	T	87.8	Confident	88	Confident	83 Å²	83	65.8 Å²	65.8	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-42.6	-179.7	50.7	0	0	0	0	111.8	S1090 N1091	S1090-T1094 WeakPolarHBondContact O-CG2 3.34Å; S1090-T1094 PolarHBondContact O-N 3.28Å; S1090-T1094 VanDerWaalsContact O-N 3.09Å; S1090-T1094 PolarHBondContact O-OG1 3.37Å; N1091-T1094 PolarHBondContact O-N 2.91Å; N1091-T1094 PolarHBondContact O-OG1 2.98Å
1095	E	86.1	Confident	88	Confident	129 Å²	129	63.2 Å²	63.2	60%	0.603	35%	0.345	S	S	*	.	H	α-helix	trans	-65.4	-45.3	177.7	-169.6	-173.2	164.4	0	0	112.1	N1091 F1093	N1091-E1095 PolarHBondContact O-N 3.05Å; F1093-E1095 PolarHBondContact O-N 3.14Å
1096	V	85.4	Confident	88.1	Confident	20 Å²	20	62.9 Å²	62.9	12%	0.121	34%	0.343	C	S	.	.	H	α-helix	trans	-74.7	-36.5	-177.4	177.3	0	0	0	0	111.6	I972 K975 T1092 F1093 A1098 N1099 S1100	I972-V1096 HydrophobicContact CB-CG1 4.44Å; I972-V1096 HydrophobicContact CG1-CG1 3.83Å; K975-V1096 HydrophobicContact CB-CG2 4.3Å; K975-V1096 HydrophobicContact CD-CG1 3.8Å; K975-V1096 HydrophobicContact CD-CG2 3.93Å; T1092-V1096 WeakPolarHBondContact O-CB 3.45Å; T1092-V1096 WeakPolarHBondContact O-CG2 3.41Å; T1092-V1096 PolarHBondContact O-N 3.25Å; F1093-V1096 PolarHBondContact O-N 3.39Å; V1096-A1098 VanDerWaalsContact C-N 3.3Å; V1096-A1098 PolarHBondContact O-N 3.03Å; V1096-N1099 PolarHBondContact O-N 3.23Å; V1096-S1100 WeakPolarHBondContact O-CA 3.37Å; V1096-S1100 VanDerWaalsContact O-CB 3.29Å; V1096-S1100 WeakPolarHBondContact O-CB 3.37Å; V1096-S1100 PolarHBondContact O-N 3.15Å
1097	Q	86.8	Confident	87.8	Confident	88 Å²	88	62.3 Å²	62.3	41%	0.411	34%	0.338	S	S	.	.	H	α-helix	trans	-58	-42.8	-178.4	178.1	63.7	31.5	0	0	111.5	F1093 N1099 S1100	F1093-Q1097 HydrophobicContact CE1-CB 4.37Å; F1093-Q1097 HydrophobicContact CE1-CG 4.47Å; F1093-Q1097 HydrophobicContact CZ-CB 4.47Å; F1093-Q1097 HydrophobicContact CZ-CG 4.45Å; F1093-Q1097 WeakPolarHBondContact O-CB 3.39Å; F1093-Q1097 PolarHBondContact O-N 3.29Å; Q1097-N1099 PolarHBondContact O-N 3.17Å; Q1097-S1100 PolarHBondContact O-N 3.15Å; Q1097-S1100 PolarHBondContact O-OG 3.09Å
1098	A	82.5	Confident	87.8	Confident	83 Å²	83	61.1 Å²	61.1	69%	0.686	32%	0.32	S	S	*	.	H	α-helix	trans	-56.6	-36.1	-179.5	0	0	0	0	0	113	V1096	V1096-A1098 VanDerWaalsContact C-N 3.3Å; V1096-A1098 PolarHBondContact O-N 3.03Å
1099	N	84.3	Confident	87.7	Confident	91 Å²	91	59 Å²	59	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-101.9	-13.7	-177.4	-65.8	-43.5	0	0	0	113.5	V1096 Q1097 E1101 S1102 Y1103	V1096-N1099 PolarHBondContact O-N 3.23Å; Q1097-N1099 PolarHBondContact O-N 3.17Å; N1099-E1101 VanDerWaalsContact C-N 3.3Å; N1099-E1101 PolarHBondContact O-N 3.24Å; N1099-S1102 PolarHBondContact O-N 3.04Å; N1099-S1102 VanDerWaalsContact O-N 3.13Å; N1099-Y1103 HydrophobicContact CB-CD2 3.98Å; N1099-Y1103 HydrophobicContact CB-CE2 3.75Å; N1099-Y1103 VanDerWaalsContact O-CD2 3.24Å; N1099-Y1103 WeakPolarHBondContact O-CD2 3.41Å; N1099-Y1103 PolarHBondContact O-N 3.43Å
1100	S	86.4	Confident	87.4	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.007	32%	0.318	C	S	.	.	H	α-helix	trans	-56.9	-36.7	-168.9	64.1	0	0	0	0	114.3	V1096 Q1097 Y1103 W1104	V1096-S1100 WeakPolarHBondContact O-CA 3.37Å; V1096-S1100 VanDerWaalsContact O-CB 3.29Å; V1096-S1100 WeakPolarHBondContact O-CB 3.37Å; V1096-S1100 PolarHBondContact O-N 3.15Å; Q1097-S1100 PolarHBondContact O-N 3.15Å; Q1097-S1100 PolarHBondContact O-OG 3.09Å; S1100-Y1103 PolarHBondContact O-N 3.41Å; S1100-W1104 PolarHBondContact O-N 3.39Å
1101	E	87.1	Confident	87	Confident	101 Å²	101	57.7 Å²	57.7	47%	0.472	30%	0.299	S	S	.	.	H	α-helix	trans	-67	-41.5	179.5	-169.2	-175.8	154.9	0	0	111.8	N1099 W1104 K1105	N1099-E1101 VanDerWaalsContact C-N 3.3Å; N1099-E1101 PolarHBondContact O-N 3.24Å; E1101-W1104 PolarHBondContact O-N 3.44Å; E1101-K1105 HydrophobicContact CG-CD 4.37Å; E1101-K1105 WeakPolarHBondContact O-CB 3.11Å; E1101-K1105 WeakPolarHBondContact O-CG 3.39Å; E1101-K1105 PolarHBondContact O-N 2.99Å; E1101-K1105 WeakPolarHBondContact OE1-CE 3.42Å; E1101-K1105 IonicContact OE1-NZ 3.67Å; E1101-K1105 PolarHBondContact OE1-NZ 2.91Å
1102	S	87.3	Confident	86.8	Confident	31 Å²	31	52.8 Å²	52.8	22%	0.217	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-43.3	175.6	179.1	0	0	0	0	111	R712 N1099 W1104 K1105 F1106	R712-S1102 PolarHBondContact O-OG 3.25Å; N1099-S1102 PolarHBondContact O-N 3.04Å; N1099-S1102 VanDerWaalsContact O-N 3.13Å; S1102-W1104 VanDerWaalsContact C-N 3.33Å; S1102-W1104 PolarHBondContact O-N 3.17Å; S1102-K1105 PolarHBondContact O-N 3.34Å; S1102-F1106 PolarHBondContact O-N 3.39Å
1103	Y	87.3	Confident	86.5	Confident	54 Å²	54	53.7 Å²	53.7	21%	0.212	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-42.7	173.7	-80.5	-81.9	0	0	0	112.4	R712 K975 N1099 S1100 F1106 Q1107	R712-Y1103 PolarHBondContact NH1-OH 3.43Å; K975-Y1103 VanDerWaalsContact NZ-CE2 3.28Å; K975-Y1103 PolarHBondContact NZ-OH 3.27Å; N1099-Y1103 HydrophobicContact CB-CD2 3.98Å; N1099-Y1103 HydrophobicContact CB-CE2 3.75Å; N1099-Y1103 VanDerWaalsContact O-CD2 3.24Å; N1099-Y1103 WeakPolarHBondContact O-CD2 3.41Å; N1099-Y1103 PolarHBondContact O-N 3.43Å; S1100-Y1103 PolarHBondContact O-N 3.41Å; Y1103-F1106 PolarHBondContact O-N 3.01Å; Y1103-Q1107 WeakPolarHBondContact O-CG 3.34Å; Y1103-Q1107 PolarHBondContact O-N 3.09Å
1104	W	90.9	Very high	86	Confident	12 Å²	12	51 Å²	51	5%	0.045	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-45.7	177.5	174.6	73	0	0	0	112.1	A961 I962 K964 G967 P968 I971 S1100 E1101 S1102 F1106 Q1107 R1108	A961-W1104 PolarHBondContact O-NE1 2.91Å; I962-W1104 WeakPolarHBondContact O-CZ2 3.4Å; K964-W1104 HydrophobicContact CB-CH2 3.96Å; K964-W1104 HydrophobicContact CB-CZ2 4.34Å; K964-W1104 HydrophobicContact CG-CH2 3.96Å; K964-W1104 HydrophobicContact CG-CZ3 4.24Å; G967-W1104 VanDerWaalsContact CA-CD1 3.47Å; P968-W1104 HydrophobicContact CB-CB 4.43Å; P968-W1104 HydrophobicContact CG-CB 3.86Å; P968-W1104 HydrophobicContact CG-CD2 4.14Å; P968-W1104 HydrophobicContact CG-CE3 4.47Å; P968-W1104 HydrophobicContact CG-CG 3.84Å; I971-W1104 VanDerWaalsContact CD1-CA 3.41Å; I971-W1104 HydrophobicContact CD1-CB 3.64Å; I971-W1104 HydrophobicContact CD1-CG 4.44Å; S1100-W1104 PolarHBondContact O-N 3.39Å; E1101-W1104 PolarHBondContact O-N 3.44Å; S1102-W1104 VanDerWaalsContact C-N 3.33Å; S1102-W1104 PolarHBondContact O-N 3.17Å; W1104-F1106 PolarHBondContact O-N 3.48Å; W1104-Q1107 PolarHBondContact O-N 3.31Å; W1104-R1108 HydrophobicContact CZ2-CG 4.49Å; W1104-R1108 VanDerWaalsContact O-CB 3.32Å; W1104-R1108 WeakPolarHBondContact O-CB 3.44Å; W1104-R1108 PolarHBondContact O-N 3.12Å
1105	K	89.6	Confident	85.6	Confident	34 Å²	34	47.8 Å²	47.8	15%	0.148	25%	0.245	C	C	.	.	H	α-helix	trans	-57.4	-37.8	176.3	-78.8	175.9	174.9	170.6	0	111.9	Q721 E1101 S1102	Q721-K1105 HydrophobicContact CG-CD 4.21Å; Q721-K1105 HydrophobicContact CG-CG 4.25Å; Q721-K1105 PolarHBondContact NE2-O 2.84Å; E1101-K1105 HydrophobicContact CG-CD 4.37Å; E1101-K1105 WeakPolarHBondContact O-CB 3.11Å; E1101-K1105 WeakPolarHBondContact O-CG 3.39Å; E1101-K1105 PolarHBondContact O-N 2.99Å; E1101-K1105 WeakPolarHBondContact OE1-CE 3.42Å; E1101-K1105 IonicContact OE1-NZ 3.67Å; E1101-K1105 PolarHBondContact OE1-NZ 2.91Å; S1102-K1105 PolarHBondContact O-N 3.34Å
1106	F	90.1	Very high	85.3	Confident	22 Å²	22	42.5 Å²	42.5	10%	0.096	22%	0.22	C	C	.	.	H	α-helix	trans	-67	-51.7	172.8	177	-100.2	0	0	0	112.4	M707 D710 R712 F715 S1102 Y1103 W1104 R1108 Y1109	M707-F1106 HydrophobicContact CE-CD2 4.41Å; M707-F1106 HydrophobicContact CE-CE1 3.87Å; M707-F1106 HydrophobicContact CE-CE2 3.61Å; M707-F1106 HydrophobicContact CE-CZ 3.3Å; M707-F1106 HydrophobicContact SD-CD2 4.02Å; M707-F1106 HydrophobicContact SD-CE2 3.47Å; M707-F1106 WeakPolarHBondContact SD-CE2 3.17Å; M707-F1106 HydrophobicContact SD-CZ 3.86Å; D710-F1106 HydrophobicContact CB-CZ 4.46Å; D710-F1106 WeakPolarHBondContact OD1-CE1 3.42Å; D710-F1106 WeakPolarHBondContact OD1-CZ 3.43Å; R712-F1106 HydrophobicContact CG-CB 4.43Å; R712-F1106 HydrophobicContact CG-CD2 4.36Å; R712-F1106 HydrophobicContact CG-CG 4.24Å; F715-F1106 HydrophobicContact CB-CB 4.36Å; F715-F1106 HydrophobicContact CB-CD2 4.07Å; F715-F1106 AromaticContact CD2-CD2 3.55Å; F715-F1106 HydrophobicContact CD2-CD2 3.55Å; F715-F1106 AromaticContact CD2-CE2 3.84Å; F715-F1106 HydrophobicContact CD2-CE2 3.84Å; F715-F1106 HydrophobicContact CE2-CD2 4.28Å; F715-F1106 HydrophobicContact CE2-CE2 4.16Å; F715-F1106 AromaticContact CG-CD2 3.94Å; F715-F1106 HydrophobicContact CG-CD2 3.94Å; S1102-F1106 PolarHBondContact O-N 3.39Å; Y1103-F1106 PolarHBondContact O-N 3.01Å; W1104-F1106 PolarHBondContact O-N 3.48Å; F1106-R1108 VanDerWaalsContact C-N 3.26Å; F1106-R1108 PolarHBondContact O-N 3.35Å; F1106-Y1109 WeakPolarHBondContact O-CB 3.38Å; F1106-Y1109 PolarHBondContact O-N 3.25Å
1107	Q	86.1	Confident	84.8	Confident	88 Å²	88	44.4 Å²	44.4	41%	0.411	24%	0.235	S	C	.	.	H	α-helix	trans	-63.1	-31.7	179.3	-74.5	-171.7	-25.3	0	0	113.4	Y1103 W1104 Y1109 N1110 L1111	Y1103-Q1107 WeakPolarHBondContact O-CG 3.34Å; Y1103-Q1107 PolarHBondContact O-N 3.09Å; W1104-Q1107 PolarHBondContact O-N 3.31Å; Q1107-Y1109 PolarHBondContact O-N 3.33Å; Q1107-N1110 PolarHBondContact O-N 3.05Å; Q1107-N1110 VanDerWaalsContact O-N 3.1Å; Q1107-L1111 PolarHBondContact O-N 3.03Å
1108	R	89.1	Confident	84.4	Confident	36 Å²	36	40.9 Å²	40.9	14%	0.136	22%	0.218	C	C	.	.	H	α-helix	trans	-54.4	-35.1	176.2	-176.7	-175.8	175.3	-151.2	-2.5	112.2	S725 W1104 F1106 I1112	S725-R1108 PolarHBondContact OG-NH1 3.23Å; S725-R1108 PolarHBondContact OG-NH2 2.84Å; W1104-R1108 HydrophobicContact CZ2-CG 4.49Å; W1104-R1108 VanDerWaalsContact O-CB 3.32Å; W1104-R1108 WeakPolarHBondContact O-CB 3.44Å; W1104-R1108 PolarHBondContact O-N 3.12Å; F1106-R1108 VanDerWaalsContact C-N 3.26Å; F1106-R1108 PolarHBondContact O-N 3.35Å; R1108-I1112 HydrophobicContact CG-CD1 3.73Å; R1108-I1112 HydrophobicContact CG-CG1 4.29Å; R1108-I1112 WeakPolarHBondContact O-CB 3.47Å; R1108-I1112 VanDerWaalsContact O-CG1 3.24Å; R1108-I1112 WeakPolarHBondContact O-CG1 3.29Å; R1108-I1112 PolarHBondContact O-N 3.47Å
1109	Y	87.4	Confident	84.1	Confident	18 Å²	18	37.7 Å²	37.7	7%	0.071	19%	0.191	C	C	.	.	H	α-helix	trans	-57.7	-52.9	175.1	171.5	-91.2	0	0	0	111.8	L703 M707 F715 L724 F1106 Q1107 L1111 I1112 V1113 F1150	L703-Y1109 HydrophobicContact CB-CE2 4.05Å; L703-Y1109 HydrophobicContact CD1-CE2 4.23Å; L703-Y1109 HydrophobicContact CD2-CE2 4.38Å; L703-Y1109 HydrophobicContact CG-CE2 4.45Å; M707-Y1109 HydrophobicContact CE-CD1 4.04Å; M707-Y1109 HydrophobicContact CG-CD1 3.4Å; M707-Y1109 VanDerWaalsContact CG-CD1 3.4Å; M707-Y1109 HydrophobicContact CG-CE1 3.28Å; M707-Y1109 HydrophobicContact CG-CG 4.24Å; M707-Y1109 HydrophobicContact SD-CD1 3.31Å; M707-Y1109 WeakPolarHBondContact SD-CD1 3.15Å; M707-Y1109 HydrophobicContact SD-CE1 3.9Å; M707-Y1109 HydrophobicContact SD-CG 3.89Å; F715-Y1109 HydrophobicContact CD1-CD2 4.49Å; F715-Y1109 HydrophobicContact CD1-CG 4.43Å; F715-Y1109 HydrophobicContact CE1-CD1 4.49Å; F715-Y1109 AromaticContact CE1-CD2 3.71Å; F715-Y1109 HydrophobicContact CE1-CD2 3.71Å; F715-Y1109 HydrophobicContact CE1-CE2 4.29Å; F715-Y1109 AromaticContact CE1-CG 3.82Å; F715-Y1109 HydrophobicContact CE1-CG 3.82Å; F715-Y1109 HydrophobicContact CZ-CD2 4.5Å; F715-Y1109 HydrophobicContact CZ-CG 4.47Å; L724-Y1109 HydrophobicContact CD1-CD2 4.16Å; L724-Y1109 HydrophobicContact CD2-CD2 3.57Å; L724-Y1109 HydrophobicContact CD2-CE2 4.17Å; L724-Y1109 HydrophobicContact CG-CD2 4.49Å; F1106-Y1109 WeakPolarHBondContact O-CB 3.38Å; F1106-Y1109 PolarHBondContact O-N 3.25Å; Q1107-Y1109 PolarHBondContact O-N 3.33Å; Y1109-L1111 VanDerWaalsContact C-N 3.31Å; Y1109-L1111 PolarHBondContact O-N 3.07Å; Y1109-I1112 PolarHBondContact O-N 3.1Å; Y1109-I1112 VanDerWaalsContact O-N 3.14Å; Y1109-V1113 HydrophobicContact CD1-CG2 4.17Å; Y1109-V1113 HydrophobicContact CD2-CG2 4.3Å; Y1109-V1113 HydrophobicContact CE1-CG2 3.67Å; Y1109-V1113 HydrophobicContact CE2-CG2 3.83Å; Y1109-V1113 HydrophobicContact CG-CG2 4.47Å; Y1109-V1113 WeakPolarHBondContact O-CG2 3.31Å; Y1109-V1113 PolarHBondContact O-N 2.86Å; Y1109-F1150 HydrophobicContact CE2-CE1 4.36Å
1110	N	83.2	Confident	83.5	Confident	81 Å²	81	34.9 Å²	34.9	43%	0.433	18%	0.178	S	C	.	.	H	α-helix	trans	-59	-44.8	-177.6	-75.2	-22.6	0	0	0	111.4	M707 Q1107 I1112 V1113 E1114	M707-N1110 WeakPolarHBondContact CE-ND2 3.31Å; M707-N1110 WeakPolarHBondContact CE-OD1 3.39Å; Q1107-N1110 PolarHBondContact O-N 3.05Å; Q1107-N1110 VanDerWaalsContact O-N 3.1Å; N1110-I1112 PolarHBondContact O-N 3.19Å; N1110-V1113 PolarHBondContact O-N 2.92Å; N1110-E1114 WeakPolarHBondContact O-CB 3.4Å; N1110-E1114 PolarHBondContact O-N 3.4Å
1111	L	83.4	Confident	83.2	Confident	18 Å²	18	38.4 Å²	38.4	9%	0.094	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-43.6	176.9	-66.4	171.1	0	0	0	111.8	A961 I962 Q1107 Y1109 V1113 E1114 Y1115	A961-L1111 HydrophobicContact CB-CD1 4.47Å; I962-L1111 HydrophobicContact CB-CD1 4.46Å; I962-L1111 HydrophobicContact CD1-CB 4.42Å; Q1107-L1111 PolarHBondContact O-N 3.03Å; Y1109-L1111 VanDerWaalsContact C-N 3.31Å; Y1109-L1111 PolarHBondContact O-N 3.07Å; L1111-V1113 PolarHBondContact O-N 3.46Å; L1111-E1114 WeakPolarHBondContact O-CB 3.33Å; L1111-E1114 PolarHBondContact O-N 2.79Å; L1111-Y1115 VanDerWaalsContact O-CD2 3.22Å; L1111-Y1115 WeakPolarHBondContact O-CD2 3.25Å; L1111-Y1115 PolarHBondContact O-N 3.02Å
1112	I	85.4	Confident	82.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-42.9	178.2	-70.1	170.8	0	0	0	111	L724 I727 W728 R1108 Y1109 N1110 E1114 Y1115 H1116	L724-I1112 HydrophobicContact CB-CD1 3.94Å; I727-I1112 HydrophobicContact CG2-CG2 4.16Å; W728-I1112 HydrophobicContact CB-CD1 4.49Å; W728-I1112 HydrophobicContact CE3-CG1 3.9Å; W728-I1112 HydrophobicContact CE3-CG2 4.4Å; W728-I1112 HydrophobicContact CZ3-CG1 4.45Å; R1108-I1112 HydrophobicContact CG-CD1 3.73Å; R1108-I1112 HydrophobicContact CG-CG1 4.29Å; R1108-I1112 WeakPolarHBondContact O-CB 3.47Å; R1108-I1112 VanDerWaalsContact O-CG1 3.24Å; R1108-I1112 WeakPolarHBondContact O-CG1 3.29Å; R1108-I1112 PolarHBondContact O-N 3.47Å; Y1109-I1112 PolarHBondContact O-N 3.1Å; Y1109-I1112 VanDerWaalsContact O-N 3.14Å; N1110-I1112 PolarHBondContact O-N 3.19Å; I1112-E1114 VanDerWaalsContact C-N 3.32Å; I1112-E1114 PolarHBondContact O-N 2.95Å; I1112-Y1115 PolarHBondContact O-N 3.44Å; I1112-H1116 WeakPolarHBondContact O-CB 3.47Å; I1112-H1116 PolarHBondContact O-N 2.87Å
1113	V	81.2	Confident	82.4	Confident	45 Å²	45	33.8 Å²	33.8	27%	0.273	18%	0.175	S	C	.	.	H	α-helix	trans	-62	-43	176.8	175.6	0	0	0	0	110.6	Y1109 N1110 L1111 H1116 S1117 F1150	Y1109-V1113 HydrophobicContact CD1-CG2 4.17Å; Y1109-V1113 HydrophobicContact CD2-CG2 4.3Å; Y1109-V1113 HydrophobicContact CE1-CG2 3.67Å; Y1109-V1113 HydrophobicContact CE2-CG2 3.83Å; Y1109-V1113 HydrophobicContact CG-CG2 4.47Å; Y1109-V1113 WeakPolarHBondContact O-CG2 3.31Å; Y1109-V1113 PolarHBondContact O-N 2.86Å; N1110-V1113 PolarHBondContact O-N 2.92Å; L1111-V1113 PolarHBondContact O-N 3.46Å; V1113-H1116 PolarHBondContact O-N 3.31Å; V1113-S1117 WeakPolarHBondContact O-CB 3.33Å; V1113-S1117 PolarHBondContact O-N 3.38Å; V1113-F1150 HydrophobicContact CB-CZ 4.48Å; V1113-F1150 HydrophobicContact CG2-CD1 4.39Å; V1113-F1150 HydrophobicContact CG2-CE1 3.72Å; V1113-F1150 HydrophobicContact CG2-CE2 4.42Å; V1113-F1150 HydrophobicContact CG2-CZ 3.74Å
1114	E	79.8	Confident	81.9	Confident	35 Å²	35	32 Å²	32	16%	0.164	17%	0.17	C	C	.	.	H	α-helix	trans	-57.1	-56.4	176.5	-166.9	-159.9	136.8	0	0	110.8	N1110 L1111 I1112 H1116 S1117 K1118	N1110-E1114 WeakPolarHBondContact O-CB 3.4Å; N1110-E1114 PolarHBondContact O-N 3.4Å; L1111-E1114 WeakPolarHBondContact O-CB 3.33Å; L1111-E1114 PolarHBondContact O-N 2.79Å; I1112-E1114 VanDerWaalsContact C-N 3.32Å; I1112-E1114 PolarHBondContact O-N 2.95Å; E1114-H1116 PolarHBondContact O-N 3.23Å; E1114-S1117 WeakPolarHBondContact O-CB 3.34Å; E1114-S1117 PolarHBondContact O-N 3.38Å; E1114-S1117 VanDerWaalsContact O-N 3.16Å; E1114-S1117 PolarHBondContact O-OG 2.84Å; E1114-K1118 WeakPolarHBondContact O-CG 3.29Å; E1114-K1118 PolarHBondContact O-N 3.28Å; E1114-K1118 VanDerWaalsContact OE1-CE 3.22Å; E1114-K1118 WeakPolarHBondContact OE1-CE 3.46Å; E1114-K1118 IonicContact OE1-NZ 3.82Å; E1114-K1118 PolarHBondContact OE1-NZ 3.5Å
1115	Y	79.1	Confident	81.5	Confident	16 Å²	16	37 Å²	37	6%	0.063	19%	0.192	C	C	.	.	H	α-helix	trans	-66.6	-33.9	-179.6	-79.3	-71	0	0	0	113.8	W728 F842 I962 L1111 I1112 S1117 K1118	W728-Y1115 HydrophobicContact CZ3-CG 4.46Å; F842-Y1115 HydrophobicContact CB-CD1 4.45Å; F842-Y1115 HydrophobicContact CD2-CD1 4.16Å; F842-Y1115 HydrophobicContact CD2-CD2 4.31Å; F842-Y1115 AromaticContact CD2-CE1 3.77Å; F842-Y1115 HydrophobicContact CD2-CE1 3.77Å; F842-Y1115 AromaticContact CD2-CE2 3.97Å; F842-Y1115 HydrophobicContact CD2-CE2 3.97Å; F842-Y1115 HydrophobicContact CD2-CG 4.43Å; F842-Y1115 AromaticContact CD2-CZ 3.68Å; F842-Y1115 HydrophobicContact CE2-CE2 4.26Å; I962-Y1115 HydrophobicContact CD1-CD2 4.26Å; L1111-Y1115 VanDerWaalsContact O-CD2 3.22Å; L1111-Y1115 WeakPolarHBondContact O-CD2 3.25Å; L1111-Y1115 PolarHBondContact O-N 3.02Å; I1112-Y1115 PolarHBondContact O-N 3.44Å; Y1115-S1117 VanDerWaalsContact C-N 3.31Å; Y1115-S1117 PolarHBondContact O-N 3.31Å; Y1115-K1118 HydrophobicContact CD1-CD 4.22Å; Y1115-K1118 HydrophobicContact CE1-CD 4.45Å; Y1115-K1118 PolarHBondContact O-N 3.43Å
1116	H	79.6	Confident	81.2	Confident	18 Å²	18	35.6 Å²	35.6	8%	0.083	19%	0.186	C	C	.	.	H	α-helix	trans	-65.3	-38	174.3	-178.4	-83.9	0	0	0	111.3	P838 I1112 V1113 E1114 K1118 K1146 H1149 F1150	P838-H1116 HydrophobicContact CG-CB 4.22Å; I1112-H1116 WeakPolarHBondContact O-CB 3.47Å; I1112-H1116 PolarHBondContact O-N 2.87Å; V1113-H1116 PolarHBondContact O-N 3.31Å; E1114-H1116 PolarHBondContact O-N 3.23Å; H1116-K1118 VanDerWaalsContact C-N 3.34Å; H1116-K1146 PolarHBondContact CE1-O 3.39Å; H1116-K1146 PolarHBondContact O-NZ 2.89Å; H1116-H1149 AromaticContact NE2-CG 3.98Å; H1116-F1150 HydrophobicContact CB-CE2 4.04Å; H1116-F1150 HydrophobicContact CB-CZ 4.47Å; H1116-F1150 AromaticContact CE1-CE2 3.98Å; H1116-F1150 AromaticContact CG-CE2 3.68Å; H1116-F1150 AromaticContact ND1-CE2 3.52Å
1117	S	75.3	Confident	80.8	Confident	61 Å²	61	36.6 Å²	36.6	43%	0.427	19%	0.193	S	C	.	.	H	α-helix	trans	-70.5	-28.1	176.7	85.4	0	0	0	0	113.1	V1113 E1114 Y1115	V1113-S1117 WeakPolarHBondContact O-CB 3.33Å; V1113-S1117 PolarHBondContact O-N 3.38Å; E1114-S1117 WeakPolarHBondContact O-CB 3.34Å; E1114-S1117 PolarHBondContact O-N 3.38Å; E1114-S1117 VanDerWaalsContact O-N 3.16Å; E1114-S1117 PolarHBondContact O-OG 2.84Å; Y1115-S1117 VanDerWaalsContact C-N 3.31Å; Y1115-S1117 PolarHBondContact O-N 3.31Å
1118	K	76.7	Confident	80.7	Confident	14 Å²	14	38.8 Å²	38.8	6%	0.061	20%	0.201	C	C	.	.	S	Bend	trans	-61.4	146.7	178.4	-77.7	-177.2	-176.5	-170.5	0	111.5	E889 E893 E1114 Y1115 H1116 K1146	E889-K1118 VanDerWaalsContact OE1-CE 3.27Å; E889-K1118 WeakPolarHBondContact OE1-CE 3.43Å; E889-K1118 IonicContact OE1-NZ 3.66Å; E889-K1118 IonicContact OE2-NZ 3.9Å; E889-K1118 PolarHBondContact OE2-NZ 3.44Å; E893-K1118 IonicContact OE2-NZ 2.65Å; E893-K1118 PolarHBondContact OE2-NZ 3.49Å; E1114-K1118 WeakPolarHBondContact O-CG 3.29Å; E1114-K1118 PolarHBondContact O-N 3.28Å; E1114-K1118 VanDerWaalsContact OE1-CE 3.22Å; E1114-K1118 WeakPolarHBondContact OE1-CE 3.46Å; E1114-K1118 IonicContact OE1-NZ 3.82Å; E1114-K1118 PolarHBondContact OE1-NZ 3.5Å; Y1115-K1118 HydrophobicContact CD1-CD 4.22Å; Y1115-K1118 HydrophobicContact CE1-CD 4.45Å; Y1115-K1118 PolarHBondContact O-N 3.43Å; H1116-K1118 VanDerWaalsContact C-N 3.34Å; K1118-K1146 PolarHBondContact O-NZ 3.46Å
1119	P	76.8	Confident	80.2	Confident	16 Å²	16	38.3 Å²	38.3	10%	0.104	20%	0.203	C	C	.	.			trans	-64.1	152.7	170.5	29.2	-34.4	0	0	0	110.4	L1121 I1126 S1129	P1119-L1121 VanDerWaalsContact C-N 3.31Å; P1119-L1121 PolarHBondContact O-N 3.05Å; P1119-I1126 HydrophobicContact CG-CD1 3.65Å; P1119-I1126 HydrophobicContact CG-CG1 3.6Å; P1119-S1129 WeakPolarHBondContact CB-OG 3.47Å
1120	S	72.1	Confident	79.8	Confident	31 Å²	31	38.6 Å²	38.6	22%	0.217	21%	0.205	C	C	.	.	S	Bend	trans	-74.3	-18.4	-175.9	51.5	0	0	0	0	114.3	W835	W835-S1120 WeakPolarHBondContact O-CB 3.31Å
1121	L	79.3	Confident	79.7	Confident	76 Å²	76	38.9 Å²	38.9	40%	0.398	21%	0.206	S	C	.	.	S	Bend	trans	-84.5	123.5	177.6	-71	171.5	0	0	0	109.9	P1119 I1126	P1119-L1121 VanDerWaalsContact C-N 3.31Å; P1119-L1121 PolarHBondContact O-N 3.05Å; L1121-I1126 WeakPolarHBondContact O-CG1 3.36Å
1122	A	79.2	Confident	79.5	Confident	13 Å²	13	41.8 Å²	41.8	11%	0.107	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-71.9	153.8	174.5	0	0	0	0	0	111.9	N845 M848 F1125 I1126	N845-A1122 VanDerWaalsContact OD1-CA 3.26Å; N845-A1122 WeakPolarHBondContact OD1-CA 3.36Å; N845-A1122 VanDerWaalsContact OD1-CB 3.23Å; N845-A1122 WeakPolarHBondContact OD1-CB 3.35Å; M848-A1122 HydrophobicContact CB-CB 4.08Å; M848-A1122 HydrophobicContact CG-CB 3.71Å; A1122-F1125 PolarHBondContact O-N 2.89Å; A1122-I1126 PolarHBondContact O-N 3.42Å
1123	P	79.2	Confident	79	Confident	22 Å²	22	44.2 Å²	44.2	14%	0.143	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	134.2	166.4	-24.6	35	0	0	0	110.3	M848 W882 I1126	M848-P1123 WeakPolarHBondContact CB-O 3.35Å; M848-P1123 VanDerWaalsContact CE-O 3.26Å; M848-P1123 WeakPolarHBondContact CE-O 3.35Å; W882-P1123 WeakPolarHBondContact CZ2-O 3.36Å; P1123-I1126 HydrophobicContact CG-CG2 4.43Å
1124	P	76.8	Confident	78.7	Confident	15 Å²	15	46.7 Å²	46.7	10%	0.097	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	cis	-93.6	-6.9	13.1	36.5	-35.2	0	0	0	114.7	F881 W882 T885 I1126	F881-P1124 HydrophobicContact CD1-CB 4.22Å; F881-P1124 HydrophobicContact CE1-CB 3.89Å; W882-P1124 HydrophobicContact CD2-CB 4.28Å; W882-P1124 HydrophobicContact CD2-CG 4.44Å; W882-P1124 HydrophobicContact CE3-CB 4.23Å; W882-P1124 HydrophobicContact CE3-CG 4.02Å; W882-P1124 HydrophobicContact CH2-CG 4.31Å; W882-P1124 HydrophobicContact CZ3-CG 3.96Å; T885-P1124 HydrophobicContact CG2-CB 4.37Å; P1124-I1126 PolarHBondContact O-N 2.9Å
1125	F	82.3	Confident	78.7	Confident	117 Å²	117	48.1 Å²	48.1	51%	0.513	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-5.6	-175	-55	-64.7	0	0	0	114	M848 A1122 I1127 F1128	M848-F1125 HydrophobicContact CE-CE2 4.22Å; A1122-F1125 PolarHBondContact O-N 2.89Å; F1125-I1127 PolarHBondContact O-N 3.16Å; F1125-I1127 VanDerWaalsContact O-N 3.12Å; F1125-F1128 HydrophobicContact CD1-CE2 4.45Å; F1125-F1128 PolarHBondContact O-N 2.82Å
1126	I	82.4	Confident	78.4	Confident	5 Å²	5	52 Å²	52	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-55.5	-28.2	178	-159.7	174	0	0	0	113.1	E889 P1119 L1121 A1122 P1123 P1124 F1128 S1129 H1130	E889-I1126 HydrophobicContact CB-CD1 4.28Å; E889-I1126 HydrophobicContact CG-CD1 3.58Å; P1119-I1126 HydrophobicContact CG-CD1 3.65Å; P1119-I1126 HydrophobicContact CG-CG1 3.6Å; L1121-I1126 WeakPolarHBondContact O-CG1 3.36Å; A1122-I1126 PolarHBondContact O-N 3.42Å; P1123-I1126 HydrophobicContact CG-CG2 4.43Å; P1124-I1126 PolarHBondContact O-N 2.9Å; I1126-F1128 VanDerWaalsContact C-N 3.28Å; I1126-F1128 PolarHBondContact O-N 2.88Å; I1126-S1129 WeakPolarHBondContact O-CA 3.49Å; I1126-S1129 VanDerWaalsContact O-CB 3.28Å; I1126-S1129 WeakPolarHBondContact O-CB 3.31Å; I1126-S1129 PolarHBondContact O-N 3.38Å; I1126-H1130 PolarHBondContact O-CD2 3.37Å; I1126-H1130 PolarHBondContact O-N 2.66Å
1127	I	81.6	Confident	78	Confident	44 Å²	44	55 Å²	55	23%	0.226	28%	0.281	C	S	.	.	H	α-helix	trans	-58.9	-37.1	-178.5	-156.7	161.4	0	0	0	112.7	F884 F1125 S1129 H1130 I1131	F884-I1127 HydrophobicContact CE1-CD1 4.26Å; F1125-I1127 PolarHBondContact O-N 3.16Å; F1125-I1127 VanDerWaalsContact O-N 3.12Å; I1127-S1129 VanDerWaalsContact C-N 3.28Å; I1127-S1129 PolarHBondContact O-N 2.86Å; I1127-H1130 PolarHBondContact O-N 3.23Å; I1127-I1131 HydrophobicContact CG1-CD1 4.47Å; I1127-I1131 WeakPolarHBondContact O-CG1 3.42Å; I1127-I1131 PolarHBondContact O-N 3.3Å
1128	F	84.1	Confident	77.7	Confident	134 Å²	134	60.7 Å²	60.7	59%	0.588	30%	0.297	S	S	*	.	H	α-helix	trans	-64.9	-34.9	175.5	-63.9	-65.8	0	0	0	111.9	F1125 I1126 N1132	F1125-F1128 HydrophobicContact CD1-CE2 4.45Å; F1125-F1128 PolarHBondContact O-N 2.82Å; I1126-F1128 VanDerWaalsContact C-N 3.28Å; I1126-F1128 PolarHBondContact O-N 2.88Å; F1128-N1132 WeakPolarHBondContact O-CB 3.29Å; F1128-N1132 PolarHBondContact O-N 3.27Å
1129	S	79.3	Confident	77.4	Confident	25 Å²	25	66.1 Å²	66.1	18%	0.175	33%	0.326	C	S	.	.	H	α-helix	trans	-68.8	-42.3	174.3	-175.1	0	0	0	0	111.5	P1119 I1126 I1127 I1131 N1132 L1133	P1119-S1129 WeakPolarHBondContact CB-OG 3.47Å; I1126-S1129 WeakPolarHBondContact O-CA 3.49Å; I1126-S1129 VanDerWaalsContact O-CB 3.28Å; I1126-S1129 WeakPolarHBondContact O-CB 3.31Å; I1126-S1129 PolarHBondContact O-N 3.38Å; I1127-S1129 VanDerWaalsContact C-N 3.28Å; I1127-S1129 PolarHBondContact O-N 2.86Å; S1129-I1131 PolarHBondContact O-N 2.92Å; S1129-N1132 PolarHBondContact O-N 3.49Å; S1129-L1133 WeakPolarHBondContact O-CB 3.44Å; S1129-L1133 PolarHBondContact O-N 3.26Å
1130	H	78.8	Confident	76.9	Confident	25 Å²	25	73.9 Å²	73.9	12%	0.116	35%	0.353	C	S	.	.	H	α-helix	trans	-60.5	-45.5	175.5	-69.8	-75.3	0	0	0	111.6	I1126 I1127 N1132 L1133 I1134	I1126-H1130 PolarHBondContact O-CD2 3.37Å; I1126-H1130 PolarHBondContact O-N 2.66Å; I1127-H1130 PolarHBondContact O-N 3.23Å; H1130-N1132 PolarHBondContact O-N 2.95Å; H1130-L1133 PolarHBondContact O-N 2.84Å; H1130-I1134 WeakPolarHBondContact O-CB 3.34Å; H1130-I1134 VanDerWaalsContact O-CG1 3.24Å; H1130-I1134 WeakPolarHBondContact O-CG1 3.44Å; H1130-I1134 PolarHBondContact O-N 3.01Å
1131	I	81.6	Confident	76.4	Confident	87 Å²	87	81 Å²	81	45%	0.446	38%	0.38	S	S	.	.	H	α-helix	trans	-59.2	-47.6	176.4	-67.2	165.6	0	0	0	110.4	I1127 S1129 L1133 I1134 I1135	I1127-I1131 HydrophobicContact CG1-CD1 4.47Å; I1127-I1131 WeakPolarHBondContact O-CG1 3.42Å; I1127-I1131 PolarHBondContact O-N 3.3Å; S1129-I1131 PolarHBondContact O-N 2.92Å; I1131-L1133 VanDerWaalsContact C-N 3.33Å; I1131-L1133 PolarHBondContact O-N 3.31Å; I1131-I1134 PolarHBondContact O-N 3.33Å; I1131-I1135 HydrophobicContact CG2-CD1 3.69Å; I1131-I1135 HydrophobicContact CG2-CG1 4.47Å; I1131-I1135 WeakPolarHBondContact O-CB 3.48Å; I1131-I1135 WeakPolarHBondContact O-CD1 3.22Å; I1131-I1135 WeakPolarHBondContact O-CG1 3.5Å; I1131-I1135 PolarHBondContact O-N 3.46Å
1132	N	79.6	Confident	75.5	Confident	78 Å²	78	81.2 Å²	81.2	42%	0.417	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-40	177.2	-171.7	2.3	0	0	0	112.4	F1128 S1129 H1130 I1135 K1136	F1128-N1132 WeakPolarHBondContact O-CB 3.29Å; F1128-N1132 PolarHBondContact O-N 3.27Å; S1129-N1132 PolarHBondContact O-N 3.49Å; H1130-N1132 PolarHBondContact O-N 2.95Å; N1132-I1135 PolarHBondContact O-N 3.05Å; N1132-K1136 WeakPolarHBondContact O-CB 3.47Å; N1132-K1136 WeakPolarHBondContact O-CG 3.26Å; N1132-K1136 PolarHBondContact O-N 2.94Å; N1132-K1136 VanDerWaalsContact OD1-CE 3.3Å; N1132-K1136 WeakPolarHBondContact OD1-CE 3.28Å
1133	L	73.7	Confident	74.4	Confident	52 Å²	52	85.9 Å²	85.9	27%	0.272	41%	0.413	S	S	.	.	H	α-helix	trans	-70.1	-40.2	-179.9	-155.7	115.5	0	0	0	111.9	F896 S1129 H1130 I1131 K1136 R1137	F896-L1133 HydrophobicContact CD1-CD2 4.12Å; F896-L1133 HydrophobicContact CE1-CD2 3.27Å; F896-L1133 HydrophobicContact CE2-CD2 4.44Å; F896-L1133 HydrophobicContact CZ-CD2 3.46Å; F896-L1133 VanDerWaalsContact CZ-CD2 3.46Å; S1129-L1133 WeakPolarHBondContact O-CB 3.44Å; S1129-L1133 PolarHBondContact O-N 3.26Å; H1130-L1133 PolarHBondContact O-N 2.84Å; I1131-L1133 VanDerWaalsContact C-N 3.33Å; I1131-L1133 PolarHBondContact O-N 3.31Å; L1133-K1136 PolarHBondContact O-N 3.46Å; L1133-R1137 WeakPolarHBondContact O-CB 3.38Å; L1133-R1137 WeakPolarHBondContact O-CG 3.41Å; L1133-R1137 PolarHBondContact O-N 2.97Å
1134	I	76.3	Confident	73.2	Confident	96 Å²	96	87 Å²	87	49%	0.492	42%	0.422	S	S	.	.	H	α-helix	trans	-61.9	-47.3	173.6	-69.3	166.3	0	0	0	109.7	H1130 I1131 K1136 R1137 K1138	H1130-I1134 WeakPolarHBondContact O-CB 3.34Å; H1130-I1134 VanDerWaalsContact O-CG1 3.24Å; H1130-I1134 WeakPolarHBondContact O-CG1 3.44Å; H1130-I1134 PolarHBondContact O-N 3.01Å; I1131-I1134 PolarHBondContact O-N 3.33Å; I1134-K1136 PolarHBondContact O-N 3.3Å; I1134-R1137 PolarHBondContact O-N 3.45Å; I1134-K1138 WeakPolarHBondContact O-CB 3.4Å; I1134-K1138 PolarHBondContact O-N 3.47Å
1135	I	78.4	Confident	72.1	Confident	65 Å²	65	91 Å²	91	33%	0.333	45%	0.446	S	S	.	.	I	π-helix	trans	-59.9	-48.7	176.7	-68.3	166.1	0	0	0	110.7	I1131 N1132 R1137 I1139 R1140	I1131-I1135 HydrophobicContact CG2-CD1 3.69Å; I1131-I1135 HydrophobicContact CG2-CG1 4.47Å; I1131-I1135 WeakPolarHBondContact O-CB 3.48Å; I1131-I1135 WeakPolarHBondContact O-CD1 3.22Å; I1131-I1135 WeakPolarHBondContact O-CG1 3.5Å; I1131-I1135 PolarHBondContact O-N 3.46Å; N1132-I1135 PolarHBondContact O-N 3.05Å; I1135-R1137 PolarHBondContact O-N 3.25Å; I1135-I1139 HydrophobicContact CB-CD1 4.43Å; I1135-I1139 HydrophobicContact CG1-CD1 4.19Å; I1135-I1139 HydrophobicContact CG2-CD1 4.28Å; I1135-I1139 WeakPolarHBondContact O-CA 3.47Å; I1135-I1139 VanDerWaalsContact O-CB 3.24Å; I1135-I1139 WeakPolarHBondContact O-CB 3.47Å; I1135-I1139 PolarHBondContact O-N 2.82Å; I1135-R1140 PolarHBondContact O-N 3.4Å; I1135-R1140 VanDerWaalsContact O-N 3.1Å
1136	K	73.9	Confident	70.7	Confident	99 Å²	99	88 Å²	88	43%	0.43	43%	0.433	S	S	.	.	I	π-helix	trans	-61.7	-39	-179.8	-81.3	178.4	177.8	176.8	0	113.4	N1132 L1133 I1134 R1140 K1141 V1142	N1132-K1136 WeakPolarHBondContact O-CB 3.47Å; N1132-K1136 WeakPolarHBondContact O-CG 3.26Å; N1132-K1136 PolarHBondContact O-N 2.94Å; N1132-K1136 VanDerWaalsContact OD1-CE 3.3Å; N1132-K1136 WeakPolarHBondContact OD1-CE 3.28Å; L1133-K1136 PolarHBondContact O-N 3.46Å; I1134-K1136 PolarHBondContact O-N 3.3Å; K1136-R1140 CarbonylContact O-C 3.57Å; K1136-R1140 WeakPolarHBondContact O-CB 3.48Å; K1136-R1140 PolarHBondContact O-N 2.84Å; K1136-K1141 PolarHBondContact O-N 3.08Å; K1136-V1142 PolarHBondContact O-N 3.33Å; K1136-V1142 VanDerWaalsContact O-N 3.17Å
1137	R	69.9	Low	69.5	Low	81 Å²	81	91.6 Å²	91.6	31%	0.306	46%	0.455	S	S	.	.	I	π-helix	trans	-85.7	-49.6	-176.5	-71.4	-172.5	-177	-151.8	4.4	113.5	F896 D898 L1133 I1134 I1135 K1141	F896-R1137 VanDerWaalsContact CE1-CZ 3.46Å; F896-R1137 VanDerWaalsContact CE1-NH1 3.31Å; D898-R1137 IonicContact OD1-NH1 2.67Å; L1133-R1137 WeakPolarHBondContact O-CB 3.38Å; L1133-R1137 WeakPolarHBondContact O-CG 3.41Å; L1133-R1137 PolarHBondContact O-N 2.97Å; I1134-R1137 PolarHBondContact O-N 3.45Å; I1135-R1137 PolarHBondContact O-N 3.25Å; R1137-K1141 PolarHBondContact O-N 3.12Å
1138	K	70.3	Confident	68.1	Low	179 Å²	179	95.7 Å²	95.7	78%	0.778	47%	0.473	S	S	*	.	I	π-helix	trans	-78.4	-37.9	-176.8	-76.6	-78	-172.4	175.4	0	112.6	I1134	I1134-K1138 WeakPolarHBondContact O-CB 3.4Å; I1134-K1138 PolarHBondContact O-N 3.47Å
1139	I	70.4	Confident	66.8	Low	129 Å²	129	94.1 Å²	94.1	66%	0.662	47%	0.467	S	S	*	.	I	π-helix	trans	-96.4	-45.5	-174.5	-52.4	177.5	0	0	0	111.1	I1135	I1135-I1139 HydrophobicContact CB-CD1 4.43Å; I1135-I1139 HydrophobicContact CG1-CD1 4.19Å; I1135-I1139 HydrophobicContact CG2-CD1 4.28Å; I1135-I1139 WeakPolarHBondContact O-CA 3.47Å; I1135-I1139 VanDerWaalsContact O-CB 3.24Å; I1135-I1139 WeakPolarHBondContact O-CB 3.47Å; I1135-I1139 PolarHBondContact O-N 2.82Å
1140	R	65.1	Low	65.9	Low	178 Å²	178	94.1 Å²	94.1	67%	0.672	46%	0.464	S	S	*	.	S	Bend	trans	-98.2	-6.7	-175.4	-61.9	-174.2	177	-178.7	-0.3	115.9	I1135 K1136 V1142	I1135-R1140 PolarHBondContact O-N 3.4Å; I1135-R1140 VanDerWaalsContact O-N 3.1Å; K1136-R1140 CarbonylContact O-C 3.57Å; K1136-R1140 WeakPolarHBondContact O-CB 3.48Å; K1136-R1140 PolarHBondContact O-N 2.84Å; R1140-V1142 HydrophobicContact CB-CG2 3.98Å; R1140-V1142 WeakPolarHBondContact O-CG2 3.37Å; R1140-V1142 PolarHBondContact O-N 3.31Å
1141	K	62.7	Low	65.4	Low	182 Å²	182	94.1 Å²	94.1	79%	0.791	47%	0.466	S	S	*	.			trans	47	31.5	-178.3	-62.2	-174	-179.6	178.8	0	114.9	K1136 R1137	K1136-K1141 PolarHBondContact O-N 3.08Å; R1137-K1141 PolarHBondContact O-N 3.12Å
1142	V	60.5	Low	65	Low	80 Å²	80	92.3 Å²	92.3	49%	0.485	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-85.9	127.4	-179.9	-177.5	0	0	0	0	109.8	K1136 R1140	K1136-V1142 PolarHBondContact O-N 3.33Å; K1136-V1142 VanDerWaalsContact O-N 3.17Å; R1140-V1142 HydrophobicContact CB-CG2 3.98Å; R1140-V1142 WeakPolarHBondContact O-CG2 3.37Å; R1140-V1142 PolarHBondContact O-N 3.31Å
1143	P	55.3	Low	64.6	Low	110 Å²	110	95.9 Å²	95.9	71%	0.714	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-67.8	153	176.1	26.5	-32.4	0	0	0	112.2	V1145	P1143-V1145 PolarHBondContact O-N 3.24Å
1144	S	55.2	Low	64.6	Low	46 Å²	46	96.2 Å²	96.2	32%	0.322	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-76.4	121.9	-176.7	-175	0	0	0	0	112.1	K1146	S1144-K1146 VanDerWaalsContact C-N 3.3Å; S1144-K1146 PolarHBondContact O-N 2.84Å
1145	V	51.7	Low	64.7	Low	99 Å²	99	95.7 Å²	95.7	60%	0.6	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-67.6	-26.3	178.5	-177.8	0	0	0	0	112.6	P1143 V1147 Q1148	P1143-V1145 PolarHBondContact O-N 3.24Å; V1145-V1147 PolarHBondContact O-N 3.43Å; V1145-Q1148 WeakPolarHBondContact O-CB 3.28Å; V1145-Q1148 PolarHBondContact O-N 3.11Å
1146	K	54.3	Low	64.7	Low	54 Å²	54	101.1 Å²	101.1	24%	0.235	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-63.5	-23	-179.5	-76	-168.5	167.2	-155.8	0	113.9	H1116 K1118 S1144 Q1148	H1116-K1146 PolarHBondContact CE1-O 3.39Å; H1116-K1146 PolarHBondContact O-NZ 2.89Å; K1118-K1146 PolarHBondContact O-NZ 3.46Å; S1144-K1146 VanDerWaalsContact C-N 3.3Å; S1144-K1146 PolarHBondContact O-N 2.84Å; K1146-Q1148 PolarHBondContact O-N 3.03Å
1147	V	56.9	Low	65.1	Low	81 Å²	81	101.4 Å²	101.4	49%	0.491	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-68.8	-22.6	180	179.2	0	0	0	0	111.9	V1145 H1149 F1150	V1145-V1147 PolarHBondContact O-N 3.43Å; V1147-H1149 VanDerWaalsContact C-N 3.32Å; V1147-H1149 PolarHBondContact O-N 3.27Å; V1147-F1150 PolarHBondContact O-N 3.46Å
1148	Q	51.4	Low	65.5	Low	130 Å²	130	99.4 Å²	99.4	61%	0.607	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-72.4	-17.3	-175	-65.8	177.8	-30.2	0	0	114.4	V1145 K1146 F1150 V1151	V1145-Q1148 WeakPolarHBondContact O-CB 3.28Å; V1145-Q1148 PolarHBondContact O-N 3.11Å; K1146-Q1148 PolarHBondContact O-N 3.03Å; Q1148-F1150 VanDerWaalsContact C-N 3.34Å; Q1148-V1151 CarbonylContact O-C 3.53Å
1149	H	57.4	Low	66.1	Low	100 Å²	100	92.1 Å²	92.1	46%	0.463	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-75.5	-22.2	179.1	-72.9	80	0	0	0	113.5	H1116 V1147	H1116-H1149 AromaticContact NE2-CG 3.98Å; V1147-H1149 VanDerWaalsContact C-N 3.32Å; V1147-H1149 PolarHBondContact O-N 3.27Å
1150	F	60.8	Low	66.7	Low	25 Å²	25	91.1 Å²	91.1	11%	0.11	47%	0.47	C	S	.	.	S	Bend	trans	-105.1	-2.1	176.6	-71.8	-79.5	0	0	0	112.6	I727 Y1109 V1113 H1116 V1147 Q1148	I727-F1150 HydrophobicContact CD1-CD1 4.2Å; I727-F1150 HydrophobicContact CD1-CE1 3.67Å; I727-F1150 HydrophobicContact CD1-CZ 4.12Å; I727-F1150 HydrophobicContact CG2-CE1 4.38Å; I727-F1150 HydrophobicContact CG2-CE2 4.21Å; I727-F1150 HydrophobicContact CG2-CZ 3.72Å; Y1109-F1150 HydrophobicContact CE2-CE1 4.36Å; V1113-F1150 HydrophobicContact CB-CZ 4.48Å; V1113-F1150 HydrophobicContact CG2-CD1 4.39Å; V1113-F1150 HydrophobicContact CG2-CE1 3.72Å; V1113-F1150 HydrophobicContact CG2-CE2 4.42Å; V1113-F1150 HydrophobicContact CG2-CZ 3.74Å; H1116-F1150 HydrophobicContact CB-CE2 4.04Å; H1116-F1150 HydrophobicContact CB-CZ 4.47Å; H1116-F1150 AromaticContact CE1-CE2 3.98Å; H1116-F1150 AromaticContact CG-CE2 3.68Å; H1116-F1150 AromaticContact ND1-CE2 3.52Å; V1147-F1150 PolarHBondContact O-N 3.46Å; Q1148-F1150 VanDerWaalsContact C-N 3.34Å
1151	V	68.5	Low	67.8	Low	25 Å²	25	86.5 Å²	86.5	15%	0.152	45%	0.453	C	S	.	.			trans	-144	109.7	-173.6	174.5	0	0	0	0	109.3	K693 T701 Q1148	K693-V1151 HydrophobicContact CD-CG1 3.55Å; K693-V1151 HydrophobicContact CG-CG1 3.83Å; T701-V1151 HydrophobicContact CG2-CG2 4.36Å; Q1148-V1151 CarbonylContact O-C 3.53Å
1152	L	73.4	Confident	68.9	Low	49 Å²	49	78.6 Å²	78.6	26%	0.257	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-105.7	121.5	174.7	-171.9	67.2	0	0	0	110.1	D688 I691 K693 L1154	D688-L1152 HydrophobicContact CB-CD2 4.13Å; I691-L1152 HydrophobicContact CB-CB 4.4Å; I691-L1152 HydrophobicContact CD1-CB 3.88Å; I691-L1152 HydrophobicContact CD1-CD2 4.24Å; I691-L1152 HydrophobicContact CG1-CB 3.74Å; I691-L1152 HydrophobicContact CG1-CD2 4.3Å; I691-L1152 PolarHBondContact O-N 2.89Å; K693-L1152 PolarHBondContact N-O 3.07Å; K693-L1152 VanDerWaalsContact N-O 3.13Å; L1152-L1154 HydrophobicContact CD2-CD1 4.32Å; L1152-L1154 HydrophobicContact CD2-CD2 3.8Å; L1152-L1154 HydrophobicContact CD2-CG 3.91Å; L1152-L1154 HydrophobicContact CG-CD2 4.23Å; L1152-L1154 HydrophobicContact CG-CG 4.1Å
1153	Q	71.4	Confident	70.2	Confident	154 Å²	154	76.2 Å²	76.2	72%	0.72	40%	0.403	S	S	*	.			trans	-96.2	106.2	167	-77.2	-176.5	-27.8	0	0	108.6	K693	K693-Q1153 HydrophobicContact CD-CG 4.01Å
1154	L	73.1	Confident	71.9	Confident	58 Å²	58	74.8 Å²	74.8	30%	0.304	39%	0.392	S	S	.	.			trans	-83.7	149.2	176.2	-72.4	164.5	0	0	0	110.6	R692 L1152 A1158 A1159 L1162	R692-L1154 HydrophobicContact CB-CD1 4.09Å; L1152-L1154 HydrophobicContact CD2-CD1 4.32Å; L1152-L1154 HydrophobicContact CD2-CD2 3.8Å; L1152-L1154 HydrophobicContact CD2-CG 3.91Å; L1152-L1154 HydrophobicContact CG-CD2 4.23Å; L1152-L1154 HydrophobicContact CG-CG 4.1Å; L1154-A1158 HydrophobicContact CD2-CB 4.25Å; L1154-A1159 HydrophobicContact CB-CB 4.17Å; L1154-L1162 HydrophobicContact CD1-CD2 3.9Å
1155	S	78.2	Confident	73.6	Confident	85 Å²	85	73.7 Å²	73.7	59%	0.594	38%	0.381	S	S	*	.			trans	-60.2	146.3	164.5	175.1	0	0	0	0	109.8	K1157 A1158 A1159	S1155-K1157 PolarHBondContact O-N 3.37Å; S1155-K1157 VanDerWaalsContact O-N 3.12Å; S1155-A1158 PolarHBondContact O-N 2.72Å; S1155-A1159 PolarHBondContact O-N 3.46Å
1156	K	78	Confident	75.6	Confident	179 Å²	179	69 Å²	69	78%	0.778	35%	0.353	S	S	*	.	H	α-helix	trans	-52.1	-39.2	-178.1	-67.5	-176	179.5	-178.2	0	112.7	N1160	K1156-N1160 WeakPolarHBondContact O-CB 3.34Å; K1156-N1160 VanDerWaalsContact O-CG 3.29Å; K1156-N1160 PolarHBondContact O-N 3.38Å; K1156-N1160 PolarHBondContact O-OD1 3.32Å
1157	K	82.1	Confident	77.3	Confident	105 Å²	105	68 Å²	68	46%	0.457	35%	0.351	S	S	.	.	H	α-helix	trans	-67	-41.9	178.7	-169.8	178.5	-177.6	-179.2	0	112.3	S1155 R1161	S1155-K1157 PolarHBondContact O-N 3.37Å; S1155-K1157 VanDerWaalsContact O-N 3.12Å; K1157-R1161 WeakPolarHBondContact O-CG 3.48Å; K1157-R1161 PolarHBondContact O-N 3.45Å; K1157-R1161 VanDerWaalsContact O-N 3.13Å
1158	A	79.8	Confident	79	Confident	40 Å²	40	68.2 Å²	68.2	33%	0.331	35%	0.349	S	S	.	.	H	α-helix	trans	-70.1	-40.2	177.7	0	0	0	0	0	111.5	L1154 S1155 R1161 L1162	L1154-A1158 HydrophobicContact CD2-CB 4.25Å; S1155-A1158 PolarHBondContact O-N 2.72Å; A1158-R1161 PolarHBondContact O-N 3.45Å; A1158-L1162 PolarHBondContact O-N 2.94Å
1159	A	81.2	Confident	81	Confident	26 Å²	26	63.1 Å²	63.1	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-59.1	-48.3	173.5	0	0	0	0	0	111.1	L1154 S1155 R1161 L1162 M1163	L1154-A1159 HydrophobicContact CB-CB 4.17Å; S1155-A1159 PolarHBondContact O-N 3.46Å; A1159-R1161 VanDerWaalsContact C-N 3.32Å; A1159-R1161 PolarHBondContact O-N 3.25Å; A1159-L1162 PolarHBondContact O-N 3.25Å; A1159-M1163 WeakPolarHBondContact O-CB 3.48Å; A1159-M1163 WeakPolarHBondContact O-CG 3.36Å; A1159-M1163 PolarHBondContact O-N 2.83Å
1160	N	84.7	Confident	82.7	Confident	108 Å²	108	58.8 Å²	58.8	58%	0.578	31%	0.305	S	S	*	.	H	α-helix	trans	-61.1	-38	177.6	-73	-0.3	0	0	0	112.8	K1156 M1163 T1164	K1156-N1160 WeakPolarHBondContact O-CB 3.34Å; K1156-N1160 VanDerWaalsContact O-CG 3.29Å; K1156-N1160 PolarHBondContact O-N 3.38Å; K1156-N1160 PolarHBondContact O-OD1 3.32Å; N1160-M1163 WeakPolarHBondContact O-CB 3.33Å; N1160-M1163 PolarHBondContact O-N 3.24Å; N1160-T1164 WeakPolarHBondContact O-CG2 3.16Å; N1160-T1164 PolarHBondContact O-N 3.37Å; N1160-T1164 PolarHBondContact O-OG1 3.47Å
1161	R	86.6	Confident	84.2	Confident	81 Å²	81	63.1 Å²	63.1	31%	0.306	33%	0.325	S	S	.	.	H	α-helix	trans	-65.5	-41.9	175.3	-75	175.1	173.3	178.4	-7.8	112.6	K1157 A1158 A1159 M1163 T1164 W1165	K1157-R1161 WeakPolarHBondContact O-CG 3.48Å; K1157-R1161 PolarHBondContact O-N 3.45Å; K1157-R1161 VanDerWaalsContact O-N 3.13Å; A1158-R1161 PolarHBondContact O-N 3.45Å; A1159-R1161 VanDerWaalsContact C-N 3.32Å; A1159-R1161 PolarHBondContact O-N 3.25Å; R1161-M1163 VanDerWaalsContact C-N 3.32Å; R1161-T1164 WeakPolarHBondContact CA-OG1 3.41Å; R1161-T1164 PolarHBondContact O-N 3.29Å; R1161-T1164 PolarHBondContact O-OG1 2.99Å; R1161-W1165 WeakPolarHBondContact O-CB 3.38Å; R1161-W1165 PolarHBondContact O-N 2.99Å
1162	L	87.5	Confident	85.3	Confident	15 Å²	15	66 Å²	66	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-66.1	-38.8	176.3	-173.5	64.9	0	0	0	111	R685 D688 L689 L1154 A1158 A1159 W1165 E1166	R685-L1162 HydrophobicContact CB-CD1 4.2Å; D688-L1162 HydrophobicContact CB-CD2 4.42Å; L689-L1162 HydrophobicContact CD1-CD2 4.43Å; L689-L1162 HydrophobicContact CD1-CG 4.43Å; L1154-L1162 HydrophobicContact CD1-CD2 3.9Å; A1158-L1162 PolarHBondContact O-N 2.94Å; A1159-L1162 PolarHBondContact O-N 3.25Å; L1162-W1165 HydrophobicContact CD1-CE3 3.8Å; L1162-W1165 HydrophobicContact CD1-CZ3 4.15Å; L1162-W1165 PolarHBondContact O-N 3.33Å; L1162-E1166 WeakPolarHBondContact O-CB 3.27Å; L1162-E1166 PolarHBondContact O-N 2.97Å
1163	M	87.4	Confident	86.2	Confident	31 Å²	31	65.3 Å²	65.3	15%	0.153	34%	0.335	C	S	.	.	H	α-helix	trans	-60.5	-48.2	173.3	-75.1	-52.7	-51.8	0	0	112.3	G631 E632 R692 A1159 N1160 R1161 W1165 E1166 T1167	G631-M1163 VanDerWaalsContact O-CE 3.27Å; G631-M1163 WeakPolarHBondContact O-CE 3.41Å; E632-M1163 HydrophobicContact CB-CE 4.09Å; E632-M1163 HydrophobicContact CG-CE 3.31Å; E632-M1163 HydrophobicContact CG-SD 3.55Å; E632-M1163 VanDerWaalsContact CG-SD 3.55Å; R692-M1163 VanDerWaalsContact CZ-SD 3.54Å; R692-M1163 PolarHBondContact NH2-SD 3.35Å; A1159-M1163 WeakPolarHBondContact O-CB 3.48Å; A1159-M1163 WeakPolarHBondContact O-CG 3.36Å; A1159-M1163 PolarHBondContact O-N 2.83Å; N1160-M1163 WeakPolarHBondContact O-CB 3.33Å; N1160-M1163 PolarHBondContact O-N 3.24Å; R1161-M1163 VanDerWaalsContact C-N 3.32Å; M1163-W1165 VanDerWaalsContact C-N 3.27Å; M1163-W1165 PolarHBondContact O-N 3.5Å; M1163-E1166 PolarHBondContact O-N 2.96Å; M1163-T1167 WeakPolarHBondContact O-CG2 3.43Å; M1163-T1167 PolarHBondContact O-N 3.44Å; M1163-T1167 PolarHBondContact O-OG1 2.99Å
1164	T	90.6	Very high	87.2	Confident	80 Å²	80	59 Å²	59	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-64	-34.9	177.6	48.6	0	0	0	0	112.2	N1160 R1161 T1167 I1168	N1160-T1164 WeakPolarHBondContact O-CG2 3.16Å; N1160-T1164 PolarHBondContact O-N 3.37Å; N1160-T1164 PolarHBondContact O-OG1 3.47Å; R1161-T1164 WeakPolarHBondContact CA-OG1 3.41Å; R1161-T1164 PolarHBondContact O-N 3.29Å; R1161-T1164 PolarHBondContact O-OG1 2.99Å; T1164-T1167 VanDerWaalsContact CA-OG1 3.31Å; T1164-T1167 WeakPolarHBondContact CA-OG1 3.46Å; T1164-T1167 PolarHBondContact O-OG1 3.15Å; T1164-I1168 WeakPolarHBondContact O-CD1 3.41Å; T1164-I1168 VanDerWaalsContact O-CG1 3.23Å; T1164-I1168 WeakPolarHBondContact O-CG1 3.29Å; T1164-I1168 PolarHBondContact O-N 3.43Å; T1164-I1168 VanDerWaalsContact O-N 3.1Å
1165	W	91.8	Very high	88.1	Confident	23 Å²	23	60.5 Å²	60.5	9%	0.087	32%	0.318	C	S	.	.	H	α-helix	trans	-67	-45.5	174.3	173.4	77.2	0	0	0	111.4	C678 D682 R685 R1161 L1162 M1163 T1167 I1168 Q1169	C678-W1165 HydrophobicContact CB-CH2 3.67Å; C678-W1165 HydrophobicContact CB-CZ2 4.43Å; C678-W1165 HydrophobicContact CB-CZ3 4.11Å; D682-W1165 HydrophobicContact CB-CZ2 4.14Å; R685-W1165 HydrophobicContact CB-CE3 4.42Å; R685-W1165 HydrophobicContact CB-CH2 3.92Å; R685-W1165 HydrophobicContact CB-CZ2 4.23Å; R685-W1165 HydrophobicContact CB-CZ3 4.03Å; R1161-W1165 WeakPolarHBondContact O-CB 3.38Å; R1161-W1165 PolarHBondContact O-N 2.99Å; L1162-W1165 HydrophobicContact CD1-CE3 3.8Å; L1162-W1165 HydrophobicContact CD1-CZ3 4.15Å; L1162-W1165 PolarHBondContact O-N 3.33Å; M1163-W1165 VanDerWaalsContact C-N 3.27Å; M1163-W1165 PolarHBondContact O-N 3.5Å; W1165-T1167 VanDerWaalsContact C-N 3.31Å; W1165-T1167 PolarHBondContact O-N 3.28Å; W1165-I1168 PolarHBondContact O-N 3.49Å; W1165-Q1169 HydrophobicContact CD2-CG 4.37Å; W1165-Q1169 HydrophobicContact CZ2-CG 4.24Å; W1165-Q1169 WeakPolarHBondContact O-CG 3.35Å; W1165-Q1169 PolarHBondContact O-N 3.34Å
1166	E	92.3	Very high	88.7	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-57.4	-42.9	174.9	-172.9	-172.7	167.3	0	0	111.4	S633 V634 L689 R692 L1162 M1163 Q1169 K1170	S633-E1166 PolarHBondContact N-OE1 3.37Å; S633-E1166 PolarHBondContact OG-OE1 3.05Å; V634-E1166 PolarHBondContact N-OE1 2.97Å; L689-E1166 HydrophobicContact CD1-CG 4.33Å; L689-E1166 VanDerWaalsContact CD1-OE2 3.27Å; L689-E1166 WeakPolarHBondContact CD1-OE2 3.47Å; R692-E1166 IonicContact CZ-OE2 3.73Å; R692-E1166 IonicContact NH2-OE2 2.76Å; R692-E1166 PolarHBondContact NH2-OE2 2.96Å; L1162-E1166 WeakPolarHBondContact O-CB 3.27Å; L1162-E1166 PolarHBondContact O-N 2.97Å; M1163-E1166 PolarHBondContact O-N 2.96Å; E1166-Q1169 PolarHBondContact O-N 3.14Å; E1166-K1170 PolarHBondContact O-N 3.48Å
1167	T	91.3	Very high	89.3	Confident	33 Å²	33	53.8 Å²	53.8	20%	0.202	29%	0.287	C	S	.	.	H	α-helix	trans	-66.7	-39	179	52.2	0	0	0	0	112.8	M1163 T1164 W1165 K1170 E1171	M1163-T1167 WeakPolarHBondContact O-CG2 3.43Å; M1163-T1167 PolarHBondContact O-N 3.44Å; M1163-T1167 PolarHBondContact O-OG1 2.99Å; T1164-T1167 VanDerWaalsContact CA-OG1 3.31Å; T1164-T1167 WeakPolarHBondContact CA-OG1 3.46Å; T1164-T1167 PolarHBondContact O-OG1 3.15Å; W1165-T1167 VanDerWaalsContact C-N 3.31Å; W1165-T1167 PolarHBondContact O-N 3.28Å; T1167-K1170 WeakPolarHBondContact O-CB 3.49Å; T1167-K1170 PolarHBondContact O-N 3.2Å; T1167-E1171 WeakPolarHBondContact O-CG 3.4Å; T1167-E1171 PolarHBondContact O-N 3.48Å
1168	I	92.4	Very high	89.6	Confident	85 Å²	85	52.2 Å²	52.2	44%	0.436	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-46.5	174.8	-68	162.4	0	0	0	109.9	T1164 W1165 K1170 E1171 D1172	T1164-I1168 WeakPolarHBondContact O-CD1 3.41Å; T1164-I1168 VanDerWaalsContact O-CG1 3.23Å; T1164-I1168 WeakPolarHBondContact O-CG1 3.29Å; T1164-I1168 PolarHBondContact O-N 3.43Å; T1164-I1168 VanDerWaalsContact O-N 3.1Å; W1165-I1168 PolarHBondContact O-N 3.49Å; I1168-K1170 VanDerWaalsContact C-N 3.27Å; I1168-K1170 PolarHBondContact O-N 3.03Å; I1168-E1171 PolarHBondContact O-N 3.1Å; I1168-E1171 VanDerWaalsContact O-N 3.14Å; I1168-D1172 PolarHBondContact O-N 3Å
1169	Q	92.5	Very high	90.1	Very high	23 Å²	23	58 Å²	58	11%	0.107	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-35.1	178.2	-66.2	-52.9	-55.2	0	0	112.7	W1165 E1166 F1173	W1165-Q1169 HydrophobicContact CD2-CG 4.37Å; W1165-Q1169 HydrophobicContact CZ2-CG 4.24Å; W1165-Q1169 WeakPolarHBondContact O-CG 3.35Å; W1165-Q1169 PolarHBondContact O-N 3.34Å; E1166-Q1169 PolarHBondContact O-N 3.14Å; Q1169-F1173 WeakPolarHBondContact O-CB 3.45Å; Q1169-F1173 PolarHBondContact O-N 3.44Å
1170	K	93.2	Very high	90.5	Very high	9 Å²	9	62.3 Å²	62.3	4%	0.039	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-46.3	172.6	178.1	-167.7	63.4	177.7	0	111.4	E628 A630 I674 E1166 T1167 I1168 F1173 L1174	E628-K1170 WeakPolarHBondContact O-CE 3.44Å; E628-K1170 PolarHBondContact O-NZ 3.28Å; A630-K1170 PolarHBondContact O-NZ 3.07Å; I674-K1170 HydrophobicContact CD1-CG 4.07Å; E1166-K1170 PolarHBondContact O-N 3.48Å; T1167-K1170 WeakPolarHBondContact O-CB 3.49Å; T1167-K1170 PolarHBondContact O-N 3.2Å; I1168-K1170 VanDerWaalsContact C-N 3.27Å; I1168-K1170 PolarHBondContact O-N 3.03Å; K1170-F1173 WeakPolarHBondContact O-CB 3.45Å; K1170-F1173 PolarHBondContact O-N 2.82Å; K1170-L1174 HydrophobicContact CD-CD1 4.32Å; K1170-L1174 HydrophobicContact CG-CD1 3.93Å; K1170-L1174 HydrophobicContact CG-CG 4.29Å; K1170-L1174 WeakPolarHBondContact O-CB 3.49Å; K1170-L1174 WeakPolarHBondContact O-CG 3.41Å; K1170-L1174 PolarHBondContact O-N 3.43Å
1171	E	91.8	Very high	90.6	Very high	116 Å²	116	62.2 Å²	62.2	54%	0.542	32%	0.316	S	S	.	.	H	α-helix	trans	-63.6	-43.1	179.1	-73.9	174.8	-170.6	0	0	111.8	T1167 I1168 F1173 L1174 T1175	T1167-E1171 WeakPolarHBondContact O-CG 3.4Å; T1167-E1171 PolarHBondContact O-N 3.48Å; I1168-E1171 PolarHBondContact O-N 3.1Å; I1168-E1171 VanDerWaalsContact O-N 3.14Å; E1171-F1173 VanDerWaalsContact C-N 3.28Å; E1171-F1173 PolarHBondContact O-N 3.39Å; E1171-L1174 PolarHBondContact O-N 3.47Å; E1171-T1175 WeakPolarHBondContact O-CB 3.42Å; E1171-T1175 VanDerWaalsContact O-CG2 3.26Å; E1171-T1175 WeakPolarHBondContact O-CG2 3.33Å; E1171-T1175 PolarHBondContact O-N 3.04Å; E1171-T1175 PolarHBondContact O-OG1 3.34Å
1172	D	91.8	Very high	90.5	Very high	86 Å²	86	64.9 Å²	64.9	46%	0.46	33%	0.33	S	S	.	.	H	α-helix	trans	-59.2	-41.6	173.5	-71	-21.4	0	0	0	111.2	I1168 T1175 A1176	I1168-D1172 PolarHBondContact O-N 3Å; D1172-T1175 WeakPolarHBondContact CA-OG1 3.43Å; D1172-T1175 PolarHBondContact O-OG1 3.47Å; D1172-A1176 WeakPolarHBondContact O-CB 3.33Å; D1172-A1176 PolarHBondContact O-N 2.96Å
1173	F	92.8	Very high	90.5	Very high	34 Å²	34	66.6 Å²	66.6	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-65.3	-49.5	175.3	173.2	-98.9	0	0	0	112.4	L670 D673 I674 Q1169 K1170 E1171 T1175 A1176 Q1177	L670-F1173 HydrophobicContact CD2-CE1 4.48Å; D673-F1173 HydrophobicContact CB-CE1 4.37Å; D673-F1173 HydrophobicContact CB-CE2 3.61Å; D673-F1173 HydrophobicContact CB-CZ 3.5Å; I674-F1173 HydrophobicContact CG1-CD1 3.84Å; I674-F1173 HydrophobicContact CG1-CE1 4.31Å; I674-F1173 HydrophobicContact CG1-CG 4.23Å; Q1169-F1173 WeakPolarHBondContact O-CB 3.45Å; Q1169-F1173 PolarHBondContact O-N 3.44Å; K1170-F1173 WeakPolarHBondContact O-CB 3.45Å; K1170-F1173 PolarHBondContact O-N 2.82Å; E1171-F1173 VanDerWaalsContact C-N 3.28Å; E1171-F1173 PolarHBondContact O-N 3.39Å; F1173-T1175 VanDerWaalsContact C-N 3.33Å; F1173-T1175 PolarHBondContact O-N 2.92Å; F1173-A1176 WeakPolarHBondContact O-CB 3.35Å; F1173-A1176 PolarHBondContact O-N 2.89Å; F1173-Q1177 WeakPolarHBondContact O-CB 3.37Å; F1173-Q1177 PolarHBondContact O-N 2.88Å
1174	L	92.1	Very high	90.8	Very high	21 Å²	21	67.6 Å²	67.6	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-63.9	-37.8	-179	-70.9	174	0	0	0	111.7	W627 E628 K1170 E1171 Q1177 N1178	W627-L1174 HydrophobicContact CZ3-CD2 4.26Å; E628-L1174 HydrophobicContact CB-CD1 4.27Å; E628-L1174 HydrophobicContact CG-CD1 3.98Å; E628-L1174 HydrophobicContact CG-CD2 4.29Å; K1170-L1174 HydrophobicContact CD-CD1 4.32Å; K1170-L1174 HydrophobicContact CG-CD1 3.93Å; K1170-L1174 HydrophobicContact CG-CG 4.29Å; K1170-L1174 WeakPolarHBondContact O-CB 3.49Å; K1170-L1174 WeakPolarHBondContact O-CG 3.41Å; K1170-L1174 PolarHBondContact O-N 3.43Å; E1171-L1174 PolarHBondContact O-N 3.47Å; L1174-Q1177 PolarHBondContact O-N 3.16Å; L1174-N1178 VanDerWaalsContact O-CB 3.23Å; L1174-N1178 WeakPolarHBondContact O-CB 3.34Å; L1174-N1178 PolarHBondContact O-N 2.78Å; L1174-N1178 PolarHBondContact O-ND2 3.49Å; L1174-N1178 VanDerWaalsContact O-ND2 3.09Å
1175	T	92.4	Very high	90.8	Very high	90 Å²	90	69.7 Å²	69.7	55%	0.552	36%	0.361	S	S	*	.	H	α-helix	trans	-67	-41	174.9	55.9	0	0	0	0	111.5	E1171 D1172 F1173 K1179	E1171-T1175 WeakPolarHBondContact O-CB 3.42Å; E1171-T1175 VanDerWaalsContact O-CG2 3.26Å; E1171-T1175 WeakPolarHBondContact O-CG2 3.33Å; E1171-T1175 PolarHBondContact O-N 3.04Å; E1171-T1175 PolarHBondContact O-OG1 3.34Å; D1172-T1175 WeakPolarHBondContact CA-OG1 3.43Å; D1172-T1175 PolarHBondContact O-OG1 3.47Å; F1173-T1175 VanDerWaalsContact C-N 3.33Å; F1173-T1175 PolarHBondContact O-N 2.92Å; T1175-K1179 WeakPolarHBondContact O-CB 3.28Å; T1175-K1179 PolarHBondContact O-N 2.95Å
1176	A	91	Very high	90.7	Very high	46 Å²	46	71.6 Å²	71.6	38%	0.38	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-45.1	173.7	0	0	0	0	0	111.9	D1172 F1173 K1179 I1180	D1172-A1176 WeakPolarHBondContact O-CB 3.33Å; D1172-A1176 PolarHBondContact O-N 2.96Å; F1173-A1176 WeakPolarHBondContact O-CB 3.35Å; F1173-A1176 PolarHBondContact O-N 2.89Å; A1176-K1179 WeakPolarHBondContact O-CB 3.47Å; A1176-K1179 PolarHBondContact O-N 3.39Å; A1176-I1180 VanDerWaalsContact O-CG1 3.31Å; A1176-I1180 WeakPolarHBondContact O-CG1 3.48Å; A1176-I1180 PolarHBondContact O-N 3.33Å
1177	Q	89.3	Confident	90.4	Very high	76 Å²	76	74.1 Å²	74.1	36%	0.355	39%	0.39	S	S	.	.	H	α-helix	trans	-62.1	-47.3	177.1	-172.2	177.6	21.5	0	0	111.4	F1173 L1174 K1179 I1180 Q1181	F1173-Q1177 WeakPolarHBondContact O-CB 3.37Å; F1173-Q1177 PolarHBondContact O-N 2.88Å; L1174-Q1177 PolarHBondContact O-N 3.16Å; Q1177-K1179 VanDerWaalsContact C-N 3.28Å; Q1177-K1179 PolarHBondContact O-N 3.28Å; Q1177-I1180 PolarHBondContact O-N 3.37Å; Q1177-I1180 VanDerWaalsContact O-N 3.15Å; Q1177-Q1181 WeakPolarHBondContact O-CB 3.43Å; Q1177-Q1181 PolarHBondContact O-N 3.04Å
1178	N	88.7	Confident	90.4	Very high	73 Å²	73	79 Å²	79	39%	0.39	41%	0.405	S	S	.	.	H	α-helix	trans	-60.3	-37.2	175.1	-83.4	-43.5	0	0	0	112.1	L1174 K1182	L1174-N1178 VanDerWaalsContact O-CB 3.23Å; L1174-N1178 WeakPolarHBondContact O-CB 3.34Å; L1174-N1178 PolarHBondContact O-N 2.78Å; L1174-N1178 PolarHBondContact O-ND2 3.49Å; L1174-N1178 VanDerWaalsContact O-ND2 3.09Å; N1178-K1182 VanDerWaalsContact O-CB 3.28Å; N1178-K1182 WeakPolarHBondContact O-CB 3.47Å; N1178-K1182 WeakPolarHBondContact O-CG 3.28Å; N1178-K1182 PolarHBondContact O-N 3.29Å
1179	K	91.4	Very high	90.3	Very high	160 Å²	160	80.2 Å²	80.2	70%	0.696	41%	0.411	S	S	*	.	H	α-helix	trans	-65.9	-43.3	174.7	-173.7	178.5	-179.6	179.4	0	111.4	T1175 A1176 Q1177 K1182 S1183	T1175-K1179 WeakPolarHBondContact O-CB 3.28Å; T1175-K1179 PolarHBondContact O-N 2.95Å; A1176-K1179 WeakPolarHBondContact O-CB 3.47Å; A1176-K1179 PolarHBondContact O-N 3.39Å; Q1177-K1179 VanDerWaalsContact C-N 3.28Å; Q1177-K1179 PolarHBondContact O-N 3.28Å; K1179-K1182 PolarHBondContact O-N 3.48Å; K1179-S1183 VanDerWaalsContact O-CB 3.31Å; K1179-S1183 WeakPolarHBondContact O-CB 3.29Å; K1179-S1183 PolarHBondContact O-N 2.79Å; K1179-S1183 PolarHBondContact O-OG 3.03Å
1180	I	89.3	Confident	90.1	Very high	117 Å²	117	85.1 Å²	85.1	60%	0.6	43%	0.432	S	S	*	.	H	α-helix	trans	-62.5	-48.5	176	-67.8	164.7	0	0	0	110	A1176 Q1177 K1182 S1183 S1184	A1176-I1180 VanDerWaalsContact O-CG1 3.31Å; A1176-I1180 WeakPolarHBondContact O-CG1 3.48Å; A1176-I1180 PolarHBondContact O-N 3.33Å; Q1177-I1180 PolarHBondContact O-N 3.37Å; Q1177-I1180 VanDerWaalsContact O-N 3.15Å; I1180-K1182 PolarHBondContact O-N 3.48Å; I1180-S1183 WeakPolarHBondContact CA-OG 3.49Å; I1180-S1183 CarbonylContact O-C 3.45Å; I1180-S1183 WeakPolarHBondContact O-CA 3.43Å; I1180-S1183 PolarHBondContact O-N 3.44Å; I1180-S1183 PolarHBondContact O-OG 3.27Å; I1180-S1184 PolarHBondContact O-N 3.48Å
1181	Q	86.1	Confident	89.8	Confident	107 Å²	107	90.2 Å²	90.2	50%	0.5	45%	0.451	S	S	.	.	H	α-helix	trans	-60.2	-45.3	177.8	-171.1	175.2	6.9	0	0	111.6	Q1177 S1183 S1184 E1187	Q1177-Q1181 WeakPolarHBondContact O-CB 3.43Å; Q1177-Q1181 PolarHBondContact O-N 3.04Å; Q1181-S1183 PolarHBondContact O-N 2.87Å; Q1181-S1184 WeakPolarHBondContact O-CB 3.24Å; Q1181-S1184 PolarHBondContact O-N 3.46Å; Q1181-S1184 VanDerWaalsContact O-N 3.15Å; Q1181-E1187 HydrophobicContact CG-CG 4.43Å
1182	K	85.6	Confident	89.7	Confident	136 Å²	136	90.2 Å²	90.2	59%	0.591	45%	0.453	S	S	*	.	H	α-helix	trans	-62.5	-30.9	173.6	-74.4	174	-176.6	178.9	0	112.7	N1178 K1179 I1180 S1184 R1191	N1178-K1182 VanDerWaalsContact O-CB 3.28Å; N1178-K1182 WeakPolarHBondContact O-CB 3.47Å; N1178-K1182 WeakPolarHBondContact O-CG 3.28Å; N1178-K1182 PolarHBondContact O-N 3.29Å; K1179-K1182 PolarHBondContact O-N 3.48Å; I1180-K1182 PolarHBondContact O-N 3.48Å; K1182-S1184 VanDerWaalsContact C-N 3.35Å; K1182-R1191 PolarHBondContact O-NH2 2.98Å
1183	S	86.8	Confident	89.6	Confident	52 Å²	52	89.1 Å²	89.1	36%	0.364	45%	0.452	S	S	.	.	H	α-helix	trans	-80.5	-14.4	177.6	75.2	0	0	0	0	114	K1179 I1180 Q1181 R1188	K1179-S1183 VanDerWaalsContact O-CB 3.31Å; K1179-S1183 WeakPolarHBondContact O-CB 3.29Å; K1179-S1183 PolarHBondContact O-N 2.79Å; K1179-S1183 PolarHBondContact O-OG 3.03Å; I1180-S1183 WeakPolarHBondContact CA-OG 3.49Å; I1180-S1183 CarbonylContact O-C 3.45Å; I1180-S1183 WeakPolarHBondContact O-CA 3.43Å; I1180-S1183 PolarHBondContact O-N 3.44Å; I1180-S1183 PolarHBondContact O-OG 3.27Å; Q1181-S1183 PolarHBondContact O-N 2.87Å; S1183-R1188 WeakPolarHBondContact O-CD 3.34Å; S1183-R1188 PolarHBondContact O-NE 2.92Å; S1183-R1188 VanDerWaalsContact O-NE 3.14Å
1184	S	93.4	Very high	89.2	Confident	51 Å²	51	90.3 Å²	90.3	36%	0.357	47%	0.468	S	S	.	.	S	Bend	trans	-57.6	139.3	177.6	-173.6	0	0	0	0	111.3	I1180 Q1181 K1182 S1186 E1187 R1188	I1180-S1184 PolarHBondContact O-N 3.48Å; Q1181-S1184 WeakPolarHBondContact O-CB 3.24Å; Q1181-S1184 PolarHBondContact O-N 3.46Å; Q1181-S1184 VanDerWaalsContact O-N 3.15Å; K1182-S1184 VanDerWaalsContact C-N 3.35Å; S1184-S1186 PolarHBondContact O-N 3.47Å; S1184-S1186 PolarHBondContact OG-OG 3.06Å; S1184-E1187 PolarHBondContact O-N 3.28Å; S1184-R1188 WeakPolarHBondContact O-CB 3.44Å; S1184-R1188 WeakPolarHBondContact O-CG 3.13Å; S1184-R1188 PolarHBondContact O-N 2.87Å
1185	D	91.3	Very high	89.2	Confident	124 Å²	124	96.2 Å²	96.2	66%	0.663	49%	0.493	S	S	*	.	H	α-helix	trans	-62.9	-30.1	-177.8	-65.5	-30.8	0	0	0	112	L1189	D1185-L1189 VanDerWaalsContact O-CB 3.26Å; D1185-L1189 WeakPolarHBondContact O-CB 3.33Å; D1185-L1189 PolarHBondContact O-N 3.39Å
1186	S	89.1	Confident	89	Confident	64 Å²	64	98 Å²	98	45%	0.448	50%	0.497	S	S	.	.	H	α-helix	trans	-67.5	-45.7	176.4	69.3	0	0	0	0	112.2	S1184 L1189 K1190	S1184-S1186 PolarHBondContact O-N 3.47Å; S1184-S1186 PolarHBondContact OG-OG 3.06Å; S1186-L1189 WeakPolarHBondContact O-CB 3.32Å; S1186-L1189 PolarHBondContact O-N 3.36Å; S1186-K1190 WeakPolarHBondContact O-CG 3.45Å; S1186-K1190 PolarHBondContact O-N 3.06Å
1187	E	86.8	Confident	88.6	Confident	54 Å²	54	100.6 Å²	100.6	25%	0.252	50%	0.504	S	S	.	.	H	α-helix	trans	-72.1	-32.6	177.5	-72.4	-56.8	141.6	0	0	111.9	Q1181 S1184 K1190 R1191	Q1181-E1187 HydrophobicContact CG-CG 4.43Å; S1184-E1187 PolarHBondContact O-N 3.28Å; E1187-K1190 IonicContact OE1-NZ 3.88Å; E1187-K1190 PolarHBondContact OE1-NZ 3.27Å; E1187-R1191 WeakPolarHBondContact O-CB 3.3Å; E1187-R1191 WeakPolarHBondContact O-CG 3.42Å; E1187-R1191 PolarHBondContact O-N 3.07Å
1188	R	89.9	Confident	88.2	Confident	135 Å²	135	99.8 Å²	99.8	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-62.5	-44.6	169.4	-75.2	176.4	168.4	-173.6	-1.4	111.3	S1183 S1184 R1191 M1192	S1183-R1188 WeakPolarHBondContact O-CD 3.34Å; S1183-R1188 PolarHBondContact O-NE 2.92Å; S1183-R1188 VanDerWaalsContact O-NE 3.14Å; S1184-R1188 WeakPolarHBondContact O-CB 3.44Å; S1184-R1188 WeakPolarHBondContact O-CG 3.13Å; S1184-R1188 PolarHBondContact O-N 2.87Å; R1188-R1191 PolarHBondContact O-N 3.02Å; R1188-M1192 WeakPolarHBondContact O-CB 3.39Å; R1188-M1192 PolarHBondContact O-N 3.47Å
1189	L	90.8	Very high	88.2	Confident	110 Å²	110	100.9 Å²	100.9	58%	0.576	52%	0.516	S	S	*	.	H	α-helix	trans	-63.5	-44.8	176.5	-171.9	71.5	0	0	0	111.3	D1185 S1186 R1191 M1192 S1193	D1185-L1189 VanDerWaalsContact O-CB 3.26Å; D1185-L1189 WeakPolarHBondContact O-CB 3.33Å; D1185-L1189 PolarHBondContact O-N 3.39Å; S1186-L1189 WeakPolarHBondContact O-CB 3.32Å; S1186-L1189 PolarHBondContact O-N 3.36Å; L1189-R1191 PolarHBondContact O-N 3.41Å; L1189-M1192 HydrophobicContact CD1-CE 3.65Å; L1189-M1192 PolarHBondContact O-N 3.12Å; L1189-S1193 WeakPolarHBondContact O-CB 3.32Å; L1189-S1193 PolarHBondContact O-N 3.23Å
1190	K	88.3	Confident	87.9	Confident	126 Å²	126	96.9 Å²	96.9	55%	0.548	51%	0.505	S	S	.	.	H	α-helix	trans	-58.8	-44.8	174.7	-74.1	178.9	-171.2	171.1	0	112.1	S1186 E1187 S1193 A1194	S1186-K1190 WeakPolarHBondContact O-CG 3.45Å; S1186-K1190 PolarHBondContact O-N 3.06Å; E1187-K1190 IonicContact OE1-NZ 3.88Å; E1187-K1190 PolarHBondContact OE1-NZ 3.27Å; K1190-S1193 WeakPolarHBondContact O-CB 3.26Å; K1190-S1193 PolarHBondContact O-N 3.2Å; K1190-A1194 WeakPolarHBondContact O-CB 3.36Å; K1190-A1194 PolarHBondContact O-N 3.4Å
1191	R	87.1	Confident	87.4	Confident	116 Å²	116	94.8 Å²	94.8	44%	0.438	49%	0.491	S	S	.	.	H	α-helix	trans	-67.2	-37.9	176.7	-73.3	-173.8	-66.4	145.1	-4.3	112.3	K1182 E1187 R1188 L1189 S1193 A1194 K1195	K1182-R1191 PolarHBondContact O-NH2 2.98Å; E1187-R1191 WeakPolarHBondContact O-CB 3.3Å; E1187-R1191 WeakPolarHBondContact O-CG 3.42Å; E1187-R1191 PolarHBondContact O-N 3.07Å; R1188-R1191 PolarHBondContact O-N 3.02Å; L1189-R1191 PolarHBondContact O-N 3.41Å; R1191-S1193 VanDerWaalsContact C-N 3.34Å; R1191-A1194 PolarHBondContact O-N 3.37Å; R1191-K1195 WeakPolarHBondContact O-CB 3.31Å; R1191-K1195 VanDerWaalsContact O-CG 3.25Å; R1191-K1195 WeakPolarHBondContact O-CG 3.24Å; R1191-K1195 PolarHBondContact O-N 2.96Å
1192	M	89.8	Confident	87.1	Confident	117 Å²	117	94.8 Å²	94.8	58%	0.576	49%	0.491	S	S	*	.	H	α-helix	trans	-64.4	-41.3	173.8	-174.6	169.9	62	0	0	110.9	R1188 L1189 K1195 M1196	R1188-M1192 WeakPolarHBondContact O-CB 3.39Å; R1188-M1192 PolarHBondContact O-N 3.47Å; L1189-M1192 HydrophobicContact CD1-CE 3.65Å; L1189-M1192 PolarHBondContact O-N 3.12Å; M1192-K1195 PolarHBondContact O-N 2.66Å; M1192-M1196 VanDerWaalsContact O-CB 3.22Å; M1192-M1196 WeakPolarHBondContact O-CB 3.44Å; M1192-M1196 PolarHBondContact O-N 3.41Å
1193	S	89.3	Confident	87	Confident	62 Å²	62	94.8 Å²	94.8	43%	0.434	50%	0.495	S	S	.	.	H	α-helix	trans	-59.9	-53.1	173.1	-168.9	0	0	0	0	111.1	L1189 K1190 R1191 K1195 M1196 D1197	L1189-S1193 WeakPolarHBondContact O-CB 3.32Å; L1189-S1193 PolarHBondContact O-N 3.23Å; K1190-S1193 WeakPolarHBondContact O-CB 3.26Å; K1190-S1193 PolarHBondContact O-N 3.2Å; R1191-S1193 VanDerWaalsContact C-N 3.34Å; S1193-K1195 VanDerWaalsContact C-N 3.3Å; S1193-K1195 PolarHBondContact O-N 3.45Å; S1193-M1196 CarbonylContact O-C 3.54Å; S1193-M1196 WeakPolarHBondContact O-CA 3.32Å; S1193-M1196 WeakPolarHBondContact O-CB 3.28Å; S1193-M1196 PolarHBondContact O-N 2.92Å; S1193-D1197 PolarHBondContact O-N 3.5Å
1194	A	85.5	Confident	86.5	Confident	60 Å²	60	95.9 Å²	95.9	50%	0.496	50%	0.5	S	S	.	.	H	α-helix	trans	-61.2	-37.6	179.8	0	0	0	0	0	112.7	K1190 R1191 S1198	K1190-A1194 WeakPolarHBondContact O-CB 3.36Å; K1190-A1194 PolarHBondContact O-N 3.4Å; R1191-A1194 PolarHBondContact O-N 3.37Å; A1194-S1198 PolarHBondContact O-N 3.34Å
1195	K	90.9	Very high	85.8	Confident	145 Å²	145	97.2 Å²	97.2	63%	0.63	50%	0.5	S	S	*	.	H	α-helix	trans	-67.4	-41.6	172.7	-76.1	179.9	177.6	-168.2	0	111.8	R1191 M1192 S1193 D1197 S1198 V1199	R1191-K1195 WeakPolarHBondContact O-CB 3.31Å; R1191-K1195 VanDerWaalsContact O-CG 3.25Å; R1191-K1195 WeakPolarHBondContact O-CG 3.24Å; R1191-K1195 PolarHBondContact O-N 2.96Å; M1192-K1195 PolarHBondContact O-N 2.66Å; S1193-K1195 VanDerWaalsContact C-N 3.3Å; S1193-K1195 PolarHBondContact O-N 3.45Å; K1195-D1197 VanDerWaalsContact C-N 3.32Å; K1195-S1198 PolarHBondContact O-N 2.83Å; K1195-V1199 VanDerWaalsContact O-CG2 3.31Å; K1195-V1199 WeakPolarHBondContact O-CG2 3.14Å; K1195-V1199 PolarHBondContact O-N 2.92Å
1196	M	89.6	Confident	85.3	Confident	127 Å²	127	95.9 Å²	95.9	63%	0.626	49%	0.493	S	S	*	.	H	α-helix	trans	-63.4	-40.7	176.8	-172.5	159.5	179	0	0	110.7	M1192 S1193 S1198 V1199 V1200	M1192-M1196 VanDerWaalsContact O-CB 3.22Å; M1192-M1196 WeakPolarHBondContact O-CB 3.44Å; M1192-M1196 PolarHBondContact O-N 3.41Å; S1193-M1196 CarbonylContact O-C 3.54Å; S1193-M1196 WeakPolarHBondContact O-CA 3.32Å; S1193-M1196 WeakPolarHBondContact O-CB 3.28Å; S1193-M1196 PolarHBondContact O-N 2.92Å; M1196-S1198 PolarHBondContact O-N 3.18Å; M1196-V1199 PolarHBondContact O-N 3.27Å; M1196-V1200 WeakPolarHBondContact O-CB 3.28Å; M1196-V1200 VanDerWaalsContact O-CG2 3.23Å; M1196-V1200 WeakPolarHBondContact O-CG2 3.3Å; M1196-V1200 PolarHBondContact O-N 2.94Å
1197	D	81.2	Confident	84.9	Confident	101 Å²	101	100.9 Å²	100.9	54%	0.54	50%	0.502	S	S	.	.	H	α-helix	trans	-61	-42.9	173.7	-64.2	-30.8	0	0	0	111.6	S1193 K1195 V1200 K1201	S1193-D1197 PolarHBondContact O-N 3.5Å; K1195-D1197 VanDerWaalsContact C-N 3.32Å; D1197-V1200 PolarHBondContact O-N 3.4Å; D1197-K1201 PolarHBondContact O-N 3.46Å
1198	S	82.3	Confident	84.5	Confident	59 Å²	59	102.4 Å²	102.4	41%	0.413	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-42	174.3	167.9	0	0	0	0	112.6	A1194 K1195 M1196 V1200 K1201 H1202	A1194-S1198 PolarHBondContact O-N 3.34Å; K1195-S1198 PolarHBondContact O-N 2.83Å; M1196-S1198 PolarHBondContact O-N 3.18Å; S1198-V1200 VanDerWaalsContact C-N 3.34Å; S1198-K1201 PolarHBondContact O-N 3.46Å; S1198-H1202 PolarHBondContact O-CD2 2.82Å; S1198-H1202 VanDerWaalsContact O-CD2 3.32Å; S1198-H1202 PolarHBondContact O-N 2.97Å
1199	V	88	Confident	84	Confident	95 Å²	95	100.5 Å²	100.5	58%	0.576	51%	0.511	S	S	*	.	H	α-helix	trans	-65.1	-39.7	175.9	170.6	0	0	0	0	110.8	K1195 M1196 H1202 M1203	K1195-V1199 VanDerWaalsContact O-CG2 3.31Å; K1195-V1199 WeakPolarHBondContact O-CG2 3.14Å; K1195-V1199 PolarHBondContact O-N 2.92Å; M1196-V1199 PolarHBondContact O-N 3.27Å; V1199-H1202 PolarHBondContact O-N 3.18Å; V1199-M1203 VanDerWaalsContact O-CB 3.32Å; V1199-M1203 WeakPolarHBondContact O-CB 3.29Å; V1199-M1203 PolarHBondContact O-N 3.32Å
1200	V	84.3	Confident	83.6	Confident	77 Å²	77	99.7 Å²	99.7	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-43.5	175	169.5	0	0	0	0	110.5	M1196 D1197 S1198 M1203 T1204	M1196-V1200 WeakPolarHBondContact O-CB 3.28Å; M1196-V1200 VanDerWaalsContact O-CG2 3.23Å; M1196-V1200 WeakPolarHBondContact O-CG2 3.3Å; M1196-V1200 PolarHBondContact O-N 2.94Å; D1197-V1200 PolarHBondContact O-N 3.4Å; S1198-V1200 VanDerWaalsContact C-N 3.34Å; V1200-M1203 PolarHBondContact O-N 3.19Å; V1200-T1204 PolarHBondContact O-N 3.38Å; V1200-T1204 PolarHBondContact O-OG1 3.12Å
1201	K	79.6	Confident	83.2	Confident	72 Å²	72	99 Å²	99	31%	0.313	51%	0.506	S	S	.	.	H	α-helix	trans	-58.5	-48.6	175.2	-172.7	175.1	175.9	172.9	0	111.5	T399 D400 D1197 S1198 M1203 T1204 E1205	T399-K1201 PolarHBondContact OG1-NZ 2.98Å; D400-K1201 IonicContact OD1-NZ 3.98Å; D400-K1201 IonicContact OD2-NZ 2.78Å; D400-K1201 PolarHBondContact OD2-NZ 2.84Å; D1197-K1201 PolarHBondContact O-N 3.46Å; S1198-K1201 PolarHBondContact O-N 3.46Å; K1201-M1203 VanDerWaalsContact C-N 3.34Å; K1201-M1203 PolarHBondContact O-N 3.49Å; K1201-T1204 PolarHBondContact O-N 3.31Å; K1201-T1204 PolarHBondContact O-OG1 2.98Å; K1201-E1205 PolarHBondContact O-N 3.31Å
1202	H	80.6	Confident	83	Confident	107 Å²	107	101 Å²	101	50%	0.495	51%	0.514	S	S	.	.	H	α-helix	trans	-65.4	-35	176.6	-75.5	-54	0	0	0	113.4	S1198 V1199 T1204 E1205 N1206	S1198-H1202 PolarHBondContact O-CD2 2.82Å; S1198-H1202 VanDerWaalsContact O-CD2 3.32Å; S1198-H1202 PolarHBondContact O-N 2.97Å; V1199-H1202 PolarHBondContact O-N 3.18Å; H1202-T1204 VanDerWaalsContact C-N 3.34Å; H1202-E1205 IonicContact ND1-OE2 2.83Å; H1202-E1205 PolarHBondContact ND1-OE2 3.48Å; H1202-E1205 PolarHBondContact O-N 3.5Å; H1202-N1206 PolarHBondContact O-N 3.42Å
1203	M	81.8	Confident	82.8	Confident	137 Å²	137	100.1 Å²	100.1	68%	0.675	51%	0.511	S	S	*	.	H	α-helix	trans	-67.2	-35.1	176.8	-171.6	174.4	-178.5	0	0	112	V1199 V1200 K1201 R1207	V1199-M1203 VanDerWaalsContact O-CB 3.32Å; V1199-M1203 WeakPolarHBondContact O-CB 3.29Å; V1199-M1203 PolarHBondContact O-N 3.32Å; V1200-M1203 PolarHBondContact O-N 3.19Å; K1201-M1203 VanDerWaalsContact C-N 3.34Å; K1201-M1203 PolarHBondContact O-N 3.49Å; M1203-R1207 WeakPolarHBondContact O-CB 3.36Å; M1203-R1207 PolarHBondContact O-N 3.22Å; M1203-R1207 VanDerWaalsContact O-N 3.08Å
1204	T	77.8	Confident	82.6	Confident	75 Å²	75	105.1 Å²	105.1	46%	0.46	52%	0.52	S	S	.	.	H	α-helix	trans	-66.5	-43.6	173.6	46.8	0	0	0	0	112.3	V1200 K1201 H1202 N1206 R1207 D1208	V1200-T1204 PolarHBondContact O-N 3.38Å; V1200-T1204 PolarHBondContact O-OG1 3.12Å; K1201-T1204 PolarHBondContact O-N 3.31Å; K1201-T1204 PolarHBondContact O-OG1 2.98Å; H1202-T1204 VanDerWaalsContact C-N 3.34Å; T1204-N1206 PolarHBondContact O-N 3.25Å; T1204-R1207 PolarHBondContact O-N 2.91Å; T1204-D1208 PolarHBondContact O-N 3.04Å
1205	E	78.4	Confident	82.4	Confident	79 Å²	79	104.7 Å²	104.7	37%	0.369	52%	0.517	S	S	.	.	H	α-helix	trans	-60.8	-43.7	176.6	-69.3	165.7	-179.8	0	0	111.7	K1201 H1202 R1207 D1208 L1209	K1201-E1205 PolarHBondContact O-N 3.31Å; H1202-E1205 IonicContact ND1-OE2 2.83Å; H1202-E1205 PolarHBondContact ND1-OE2 3.48Å; H1202-E1205 PolarHBondContact O-N 3.5Å; E1205-R1207 VanDerWaalsContact C-N 3.35Å; E1205-R1207 PolarHBondContact O-N 3.29Å; E1205-D1208 PolarHBondContact O-N 3.12Å; E1205-L1209 PolarHBondContact O-N 3.41Å; E1205-L1209 VanDerWaalsContact O-N 3.14Å
1206	N	80.4	Confident	82.2	Confident	96 Å²	96	103.2 Å²	103.2	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-37.4	177.4	-74.7	-13.6	0	0	0	112.7	H1202 T1204 D1208 L1209 D1210	H1202-N1206 PolarHBondContact O-N 3.42Å; T1204-N1206 PolarHBondContact O-N 3.25Å; N1206-D1208 VanDerWaalsContact C-N 3.28Å; N1206-D1208 PolarHBondContact O-N 3.15Å; N1206-L1209 PolarHBondContact O-N 2.92Å; N1206-D1210 PolarHBondContact O-N 3.38Å
1207	R	81.5	Confident	82.1	Confident	168 Å²	168	102.7 Å²	102.7	63%	0.634	51%	0.512	S	S	*	.	H	α-helix	trans	-62.7	-37.4	177.2	-177.9	179.3	173.6	172.7	-1	111.8	M1203 T1204 E1205 Q1211	M1203-R1207 WeakPolarHBondContact O-CB 3.36Å; M1203-R1207 PolarHBondContact O-N 3.22Å; M1203-R1207 VanDerWaalsContact O-N 3.08Å; T1204-R1207 PolarHBondContact O-N 2.91Å; E1205-R1207 VanDerWaalsContact C-N 3.35Å; E1205-R1207 PolarHBondContact O-N 3.29Å; R1207-Q1211 WeakPolarHBondContact O-CG 3.33Å; R1207-Q1211 PolarHBondContact O-N 2.82Å; R1207-Q1211 VanDerWaalsContact O-N 3.13Å
1208	D	76.9	Confident	82.2	Confident	87 Å²	87	102.2 Å²	102.2	47%	0.465	51%	0.509	S	S	.	.	H	α-helix	trans	-71.1	-38.1	177.8	-68.5	-15	0	0	0	111.4	T1204 E1205 N1206 Q1211 R1212	T1204-D1208 PolarHBondContact O-N 3.04Å; E1205-D1208 PolarHBondContact O-N 3.12Å; N1206-D1208 VanDerWaalsContact C-N 3.28Å; N1206-D1208 PolarHBondContact O-N 3.15Å; D1208-Q1211 PolarHBondContact O-N 3.38Å; D1208-R1212 WeakPolarHBondContact O-CG 3.46Å; D1208-R1212 PolarHBondContact O-N 3.32Å
1209	L	80.9	Confident	82.4	Confident	95 Å²	95	105.2 Å²	105.2	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-61.7	-44.9	172.6	-71.8	171.8	0	0	0	111.9	E1205 N1206 Q1211 R1212 L1213	E1205-L1209 PolarHBondContact O-N 3.41Å; E1205-L1209 VanDerWaalsContact O-N 3.14Å; N1206-L1209 PolarHBondContact O-N 2.92Å; L1209-Q1211 VanDerWaalsContact C-N 3.3Å; L1209-Q1211 PolarHBondContact O-N 3.38Å; L1209-R1212 PolarHBondContact O-N 3.48Å; L1209-L1213 WeakPolarHBondContact O-CG 3.36Å; L1209-L1213 PolarHBondContact O-N 3.36Å
1210	D	80.8	Confident	82.3	Confident	92 Å²	92	106.8 Å²	106.8	49%	0.492	52%	0.519	S	S	.	.	H	α-helix	trans	-60.8	-39.1	176.3	-81.5	-10.1	0	0	0	112	N1206 R1214	N1206-D1210 PolarHBondContact O-N 3.38Å; D1210-R1214 WeakPolarHBondContact O-CG 3.39Å; D1210-R1214 PolarHBondContact O-N 3.48Å
1211	Q	81.3	Confident	82.3	Confident	112 Å²	112	108.6 Å²	108.6	52%	0.523	52%	0.522	S	S	.	.	H	α-helix	trans	-64.9	-42.7	175.3	-76.5	-176	-7.4	0	0	112	R1207 D1208 L1209 R1214 A1215	R1207-Q1211 WeakPolarHBondContact O-CG 3.33Å; R1207-Q1211 PolarHBondContact O-N 2.82Å; R1207-Q1211 VanDerWaalsContact O-N 3.13Å; D1208-Q1211 PolarHBondContact O-N 3.38Å; L1209-Q1211 VanDerWaalsContact C-N 3.3Å; L1209-Q1211 PolarHBondContact O-N 3.38Å; Q1211-R1214 PolarHBondContact O-N 3.09Å; Q1211-A1215 PolarHBondContact O-N 3.29Å
1212	R	82.2	Confident	82.3	Confident	158 Å²	158	108.7 Å²	108.7	60%	0.596	53%	0.526	S	S	*	.	H	α-helix	trans	-65	-42	176.8	-72.1	178.2	-179.1	-179.7	1.2	111.8	D1208 L1209 A1215 L1216	D1208-R1212 WeakPolarHBondContact O-CG 3.46Å; D1208-R1212 PolarHBondContact O-N 3.32Å; L1209-R1212 PolarHBondContact O-N 3.48Å; R1212-A1215 PolarHBondContact O-N 3.04Å; R1212-L1216 WeakPolarHBondContact O-CB 3.28Å; R1212-L1216 PolarHBondContact O-N 3.07Å
1213	L	85.3	Confident	82.5	Confident	99 Å²	99	107.3 Å²	107.3	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-45.2	176.5	-75.8	172.3	0	0	0	111.6	L1209 A1215 L1216 E1217	L1209-L1213 WeakPolarHBondContact O-CG 3.36Å; L1209-L1213 PolarHBondContact O-N 3.36Å; L1213-A1215 VanDerWaalsContact C-N 3.32Å; L1213-A1215 PolarHBondContact O-N 2.93Å; L1213-L1216 PolarHBondContact O-N 3.46Å; L1213-E1217 WeakPolarHBondContact O-CB 3.3Å; L1213-E1217 WeakPolarHBondContact O-CG 3.32Å; L1213-E1217 PolarHBondContact O-N 3.42Å
1214	R	84.3	Confident	82.6	Confident	166 Å²	166	103.9 Å²	103.9	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-62.5	-37.9	175.6	-71.7	179.2	-168.5	-157.1	3.7	112.8	D1210 Q1211 L1216 N1218	D1210-R1214 WeakPolarHBondContact O-CG 3.39Å; D1210-R1214 PolarHBondContact O-N 3.48Å; Q1211-R1214 PolarHBondContact O-N 3.09Å; R1214-L1216 VanDerWaalsContact C-N 3.34Å; R1214-N1218 WeakPolarHBondContact O-CB 3.3Å; R1214-N1218 PolarHBondContact O-N 3.46Å; R1214-N1218 PolarHBondContact O-ND2 2.79Å; R1214-N1218 VanDerWaalsContact O-ND2 3.14Å
1215	A	81.8	Confident	82.9	Confident	52 Å²	52	103.6 Å²	103.6	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-63.4	-43.5	175	0	0	0	0	0	111	Q1211 R1212 L1213 N1218 E1219	Q1211-A1215 PolarHBondContact O-N 3.29Å; R1212-A1215 PolarHBondContact O-N 3.04Å; L1213-A1215 VanDerWaalsContact C-N 3.32Å; L1213-A1215 PolarHBondContact O-N 2.93Å; A1215-N1218 PolarHBondContact O-N 2.75Å; A1215-E1219 PolarHBondContact O-N 2.84Å
1216	L	86.8	Confident	83	Confident	113 Å²	113	101.4 Å²	101.4	59%	0.592	51%	0.508	S	S	*	.	H	α-helix	trans	-69.3	-37.6	179	-159.5	124.1	0	0	0	112.6	R1212 L1213 R1214 E1219 M1220	R1212-L1216 WeakPolarHBondContact O-CB 3.28Å; R1212-L1216 PolarHBondContact O-N 3.07Å; L1213-L1216 PolarHBondContact O-N 3.46Å; R1214-L1216 VanDerWaalsContact C-N 3.34Å; L1216-E1219 PolarHBondContact O-N 3.29Å; L1216-M1220 WeakPolarHBondContact O-CB 3.49Å; L1216-M1220 PolarHBondContact O-N 3.37Å
1217	E	87.9	Confident	83.1	Confident	117 Å²	117	102.1 Å²	102.1	55%	0.547	51%	0.511	S	S	.	.	H	α-helix	trans	-60.3	-45.4	171.2	-77.2	176.2	168.4	0	0	111.1	L1213 M1220 E1221	L1213-E1217 WeakPolarHBondContact O-CB 3.3Å; L1213-E1217 WeakPolarHBondContact O-CG 3.32Å; L1213-E1217 PolarHBondContact O-N 3.42Å; E1217-M1220 PolarHBondContact O-N 2.91Å; E1217-E1221 WeakPolarHBondContact O-CB 3.28Å; E1217-E1221 PolarHBondContact O-N 3.26Å
1218	N	84.1	Confident	83.1	Confident	91 Å²	91	102 Å²	102	49%	0.487	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-41.9	176.2	-70.2	-27.3	0	0	0	111.8	R1214 A1215 E1221 N1222	R1214-N1218 WeakPolarHBondContact O-CB 3.3Å; R1214-N1218 PolarHBondContact O-N 3.46Å; R1214-N1218 PolarHBondContact O-ND2 2.79Å; R1214-N1218 VanDerWaalsContact O-ND2 3.14Å; A1215-N1218 PolarHBondContact O-N 2.75Å; N1218-E1221 PolarHBondContact O-N 3.28Å; N1218-N1222 WeakPolarHBondContact O-CB 3.45Å; N1218-N1222 PolarHBondContact O-N 2.92Å; N1218-N1222 PolarHBondContact O-ND2 3.02Å; N1218-N1222 VanDerWaalsContact O-ND2 3.14Å
1219	E	85.3	Confident	83.3	Confident	121 Å²	121	101.1 Å²	101.1	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-64.6	-42.3	175	-74.3	-162.9	170.4	0	0	111.9	A1215 L1216 N1222 C1223	A1215-E1219 PolarHBondContact O-N 2.84Å; L1216-E1219 PolarHBondContact O-N 3.29Å; E1219-N1222 WeakPolarHBondContact O-CB 3.43Å; E1219-N1222 PolarHBondContact O-N 2.82Å; E1219-C1223 WeakPolarHBondContact O-CB 3.42Å; E1219-C1223 PolarHBondContact O-N 2.65Å; E1219-C1223 PolarHBondContact O-SG 2.78Å; E1219-C1223 VanDerWaalsContact O-SG 3.37Å
1220	M	86.1	Confident	83.3	Confident	129 Å²	129	100.2 Å²	100.2	64%	0.635	50%	0.496	S	S	*	.	H	α-helix	trans	-63.9	-42	176.5	-172.8	-178.3	74.3	0	0	111.6	L1216 E1217 N1222 C1223 S1224	L1216-M1220 WeakPolarHBondContact O-CB 3.49Å; L1216-M1220 PolarHBondContact O-N 3.37Å; E1217-M1220 PolarHBondContact O-N 2.91Å; M1220-N1222 VanDerWaalsContact C-N 3.32Å; M1220-N1222 PolarHBondContact O-N 3.19Å; M1220-C1223 PolarHBondContact O-N 3.07Å; M1220-S1224 VanDerWaalsContact O-CB 3.31Å; M1220-S1224 WeakPolarHBondContact O-CB 3.44Å; M1220-S1224 PolarHBondContact O-N 3.35Å
1221	E	84.6	Confident	83.3	Confident	115 Å²	115	100.2 Å²	100.2	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-39.8	175.7	-168.6	172.8	-170	0	0	110.9	E1217 N1218 S1224 N1225	E1217-E1221 WeakPolarHBondContact O-CB 3.28Å; E1217-E1221 PolarHBondContact O-N 3.26Å; N1218-E1221 PolarHBondContact O-N 3.28Å; E1221-S1224 PolarHBondContact O-N 3.38Å; E1221-N1225 WeakPolarHBondContact O-CB 3.44Å; E1221-N1225 PolarHBondContact O-N 3.36Å; E1221-N1225 PolarHBondContact O-ND2 3.38Å; E1221-N1225 VanDerWaalsContact O-ND2 3.14Å
1222	N	80.3	Confident	83.1	Confident	74 Å²	74	98.9 Å²	98.9	40%	0.396	50%	0.496	S	S	.	.	H	α-helix	trans	-64.9	-44.6	173.7	-71.3	-25.8	0	0	0	112.4	N1218 E1219 M1220 S1224 N1225 A1226	N1218-N1222 WeakPolarHBondContact O-CB 3.45Å; N1218-N1222 PolarHBondContact O-N 2.92Å; N1218-N1222 PolarHBondContact O-ND2 3.02Å; N1218-N1222 VanDerWaalsContact O-ND2 3.14Å; E1219-N1222 WeakPolarHBondContact O-CB 3.43Å; E1219-N1222 PolarHBondContact O-N 2.82Å; M1220-N1222 VanDerWaalsContact C-N 3.32Å; M1220-N1222 PolarHBondContact O-N 3.19Å; N1222-S1224 VanDerWaalsContact C-N 3.35Å; N1222-N1225 PolarHBondContact O-N 3.36Å; N1222-A1226 VanDerWaalsContact O-CB 3.31Å; N1222-A1226 WeakPolarHBondContact O-CB 3.49Å; N1222-A1226 PolarHBondContact O-N 3.12Å
1223	C	83.6	Confident	82.4	Confident	78 Å²	78	93.6 Å²	93.6	53%	0.527	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-42.3	174.9	-73.5	0	0	0	0	111.6	E1219 M1220 A1226 L1227	E1219-C1223 WeakPolarHBondContact O-CB 3.42Å; E1219-C1223 PolarHBondContact O-N 2.65Å; E1219-C1223 PolarHBondContact O-SG 2.78Å; E1219-C1223 VanDerWaalsContact O-SG 3.37Å; M1220-C1223 PolarHBondContact O-N 3.07Å; C1223-A1226 PolarHBondContact O-N 3.02Å; C1223-L1227 WeakPolarHBondContact O-CB 3.46Å; C1223-L1227 VanDerWaalsContact O-CG 3.28Å; C1223-L1227 WeakPolarHBondContact O-CG 3.32Å; C1223-L1227 PolarHBondContact O-N 2.92Å
1224	S	85.1	Confident	81.7	Confident	65 Å²	65	95.3 Å²	95.3	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-60.8	-46.3	174.6	176	0	0	0	0	111.4	M1220 E1221 N1222 L1227 R1228	M1220-S1224 VanDerWaalsContact O-CB 3.31Å; M1220-S1224 WeakPolarHBondContact O-CB 3.44Å; M1220-S1224 PolarHBondContact O-N 3.35Å; E1221-S1224 PolarHBondContact O-N 3.38Å; N1222-S1224 VanDerWaalsContact C-N 3.35Å; S1224-L1227 PolarHBondContact O-N 2.91Å; S1224-R1228 VanDerWaalsContact O-CB 3.29Å; S1224-R1228 WeakPolarHBondContact O-CB 3.47Å; S1224-R1228 PolarHBondContact O-N 3.34Å
1225	N	82.8	Confident	81.1	Confident	68 Å²	68	91.2 Å²	91.2	36%	0.364	49%	0.492	S	S	.	.	H	α-helix	trans	-65.6	-38.8	177.4	-72.5	-28.6	0	0	0	112.3	E1221 N1222 W1229	E1221-N1225 WeakPolarHBondContact O-CB 3.44Å; E1221-N1225 PolarHBondContact O-N 3.36Å; E1221-N1225 PolarHBondContact O-ND2 3.38Å; E1221-N1225 VanDerWaalsContact O-ND2 3.14Å; N1222-N1225 PolarHBondContact O-N 3.36Å; N1225-W1229 WeakPolarHBondContact O-CB 3.48Å; N1225-W1229 PolarHBondContact O-N 3.17Å
1226	A	81.7	Confident	80.3	Confident	33 Å²	33	95 Å²	95	27%	0.273	50%	0.501	S	S	.	.	H	α-helix	trans	-67.2	-44.8	175.1	0	0	0	0	0	111.8	N1222 C1223 R1228 W1229 I1230 P1247	N1222-A1226 VanDerWaalsContact O-CB 3.31Å; N1222-A1226 WeakPolarHBondContact O-CB 3.49Å; N1222-A1226 PolarHBondContact O-N 3.12Å; C1223-A1226 PolarHBondContact O-N 3.02Å; A1226-R1228 VanDerWaalsContact C-N 3.34Å; A1226-R1228 PolarHBondContact O-N 3.16Å; A1226-W1229 PolarHBondContact O-N 3.27Å; A1226-I1230 VanDerWaalsContact O-CG1 3.28Å; A1226-I1230 WeakPolarHBondContact O-CG1 3.41Å; A1226-I1230 PolarHBondContact O-N 3.25Å; A1226-P1247 HydrophobicContact CB-CG 4.19Å
1227	L	82.6	Confident	78.6	Confident	111 Å²	111	92.6 Å²	92.6	58%	0.581	50%	0.503	S	S	*	.	H	α-helix	trans	-61.9	-42.2	174.8	-76.3	170	0	0	0	111.3	C1223 S1224 I1230 V1231	C1223-L1227 WeakPolarHBondContact O-CB 3.46Å; C1223-L1227 VanDerWaalsContact O-CG 3.28Å; C1223-L1227 WeakPolarHBondContact O-CG 3.32Å; C1223-L1227 PolarHBondContact O-N 2.92Å; S1224-L1227 PolarHBondContact O-N 2.91Å; L1227-I1230 PolarHBondContact O-N 2.86Å; L1227-V1231 VanDerWaalsContact O-CG2 3.29Å; L1227-V1231 WeakPolarHBondContact O-CG2 3.31Å; L1227-V1231 PolarHBondContact O-N 3.07Å
1228	R	81.4	Confident	77.1	Confident	165 Å²	165	91.3 Å²	91.3	62%	0.623	52%	0.522	S	S	*	.	H	α-helix	trans	-62.1	-43.3	175.3	-161.2	177.1	-161.4	143	4.3	111.6	S1224 A1226 V1231 D1232	S1224-R1228 VanDerWaalsContact O-CB 3.29Å; S1224-R1228 WeakPolarHBondContact O-CB 3.47Å; S1224-R1228 PolarHBondContact O-N 3.34Å; A1226-R1228 VanDerWaalsContact C-N 3.34Å; A1226-R1228 PolarHBondContact O-N 3.16Å; R1228-V1231 PolarHBondContact O-N 3.39Å; R1228-D1232 WeakPolarHBondContact O-CB 3.02Å; R1228-D1232 PolarHBondContact O-N 3.16Å
1229	W	81.3	Confident	75.5	Confident	70 Å²	70	91.4 Å²	91.4	27%	0.265	54%	0.535	S	S	.	.	H	α-helix	trans	-62	-41.5	173.4	179.7	89.7	0	0	0	112.3	N1225 A1226 D1232 T1233 R1244 P1246	N1225-W1229 WeakPolarHBondContact O-CB 3.48Å; N1225-W1229 PolarHBondContact O-N 3.17Å; A1226-W1229 PolarHBondContact O-N 3.27Å; W1229-D1232 PolarHBondContact O-N 2.76Å; W1229-T1233 HydrophobicContact CD2-CG2 4.04Å; W1229-T1233 HydrophobicContact CE3-CG2 4.49Å; W1229-T1233 HydrophobicContact CH2-CG2 4.31Å; W1229-T1233 HydrophobicContact CZ2-CG2 3.85Å; W1229-T1233 WeakPolarHBondContact O-CB 3.09Å; W1229-T1233 VanDerWaalsContact O-CG2 3.27Å; W1229-T1233 WeakPolarHBondContact O-CG2 3.37Å; W1229-T1233 PolarHBondContact O-N 2.83Å; W1229-T1233 PolarHBondContact O-OG1 3.48Å; W1229-R1244 PolarHBondContact NE1-O 3.04Å; W1229-R1244 VanDerWaalsContact NE1-O 3.13Å; W1229-P1246 HydrophobicContact CD2-CB 4.38Å; W1229-P1246 HydrophobicContact CE3-CB 4.46Å; W1229-P1246 HydrophobicContact CH2-CB 4Å; W1229-P1246 HydrophobicContact CZ2-CB 3.87Å; W1229-P1246 HydrophobicContact CZ2-CG 4.47Å; W1229-P1246 HydrophobicContact CZ3-CB 4.29Å
1230	I	80.6	Confident	74.1	Confident	76 Å²	76	95.9 Å²	95.9	39%	0.39	55%	0.553	S	S	.	*	H	α-helix	trans	-62.9	-44.3	175.3	-68.7	167	0	0	0	110.6	A1226 L1227 T1233 L1234	A1226-I1230 VanDerWaalsContact O-CG1 3.28Å; A1226-I1230 WeakPolarHBondContact O-CG1 3.41Å; A1226-I1230 PolarHBondContact O-N 3.25Å; L1227-I1230 PolarHBondContact O-N 2.86Å; I1230-T1233 WeakPolarHBondContact CA-OG1 3.46Å; I1230-T1233 PolarHBondContact O-N 2.87Å; I1230-T1233 PolarHBondContact O-OG1 2.98Å; I1230-L1234 HydrophobicContact CG2-CD1 3.68Å; I1230-L1234 HydrophobicContact CG2-CG 4.39Å; I1230-L1234 WeakPolarHBondContact O-CB 3.17Å; I1230-L1234 WeakPolarHBondContact O-CD1 3.45Å; I1230-L1234 WeakPolarHBondContact O-CG 3.42Å; I1230-L1234 PolarHBondContact O-N 3.26Å
1231	V	81.5	Confident	72.6	Confident	91 Å²	91	98.5 Å²	98.5	55%	0.552	56%	0.561	S	S	*	*	H	α-helix	trans	-65.2	-45.3	178.6	170.9	0	0	0	0	111.2	L1227 R1228 T1233 L1234 A1235	L1227-V1231 VanDerWaalsContact O-CG2 3.29Å; L1227-V1231 WeakPolarHBondContact O-CG2 3.31Å; L1227-V1231 PolarHBondContact O-N 3.07Å; R1228-V1231 PolarHBondContact O-N 3.39Å; V1231-T1233 PolarHBondContact O-N 3.06Å; V1231-L1234 PolarHBondContact O-N 3.21Å; V1231-A1235 WeakPolarHBondContact O-CB 3.39Å; V1231-A1235 PolarHBondContact O-N 3.45Å
1232	D	75.6	Confident	71	Confident	84 Å²	84	97.1 Å²	97.1	45%	0.449	56%	0.561	S	S	.	*	H	α-helix	trans	-64.3	-40.6	178.8	-69.8	-16.7	0	0	0	111.3	R1228 W1229 A1235 E1236	R1228-D1232 WeakPolarHBondContact O-CB 3.02Å; R1228-D1232 PolarHBondContact O-N 3.16Å; W1229-D1232 PolarHBondContact O-N 2.76Å; D1232-A1235 PolarHBondContact O-N 3.49Å; D1232-E1236 PolarHBondContact O-N 2.99Å
1233	T	68.9	Low	69.8	Low	48 Å²	48	98.3 Å²	98.3	29%	0.294	57%	0.573	S	S	.	*	H	α-helix	trans	-70.3	-31.5	176.5	50.5	0	0	0	0	113.4	W1229 I1230 V1231 P1242	W1229-T1233 HydrophobicContact CD2-CG2 4.04Å; W1229-T1233 HydrophobicContact CE3-CG2 4.49Å; W1229-T1233 HydrophobicContact CH2-CG2 4.31Å; W1229-T1233 HydrophobicContact CZ2-CG2 3.85Å; W1229-T1233 WeakPolarHBondContact O-CB 3.09Å; W1229-T1233 VanDerWaalsContact O-CG2 3.27Å; W1229-T1233 WeakPolarHBondContact O-CG2 3.37Å; W1229-T1233 PolarHBondContact O-N 2.83Å; W1229-T1233 PolarHBondContact O-OG1 3.48Å; I1230-T1233 WeakPolarHBondContact CA-OG1 3.46Å; I1230-T1233 PolarHBondContact O-N 2.87Å; I1230-T1233 PolarHBondContact O-OG1 2.98Å; V1231-T1233 PolarHBondContact O-N 3.06Å; T1233-P1242 HydrophobicContact CG2-CB 4.43Å
1234	L	70.4	Confident	68.6	Low	134 Å²	134	103.4 Å²	103.4	70%	0.702	58%	0.582	S	S	*	*	H	α-helix	trans	-75.9	-31.5	173.6	-72.9	169.3	0	0	0	112.4	I1230 V1231 E1236	I1230-L1234 HydrophobicContact CG2-CD1 3.68Å; I1230-L1234 HydrophobicContact CG2-CG 4.39Å; I1230-L1234 WeakPolarHBondContact O-CB 3.17Å; I1230-L1234 WeakPolarHBondContact O-CD1 3.45Å; I1230-L1234 WeakPolarHBondContact O-CG 3.42Å; I1230-L1234 PolarHBondContact O-N 3.26Å; V1231-L1234 PolarHBondContact O-N 3.21Å; L1234-E1236 VanDerWaalsContact C-N 3.34Å
1235	A	69.9	Low	67.4	Low	81 Å²	81	105.5 Å²	105.5	67%	0.669	59%	0.593	S	S	*	*	H	α-helix	trans	-71	-25.3	178.4	0	0	0	0	0	113.5	V1231 D1232 G1237	V1231-A1235 WeakPolarHBondContact O-CB 3.39Å; V1231-A1235 PolarHBondContact O-N 3.45Å; D1232-A1235 PolarHBondContact O-N 3.49Å; A1235-G1237 PolarHBondContact O-N 3.35Å
1236	E	65.4	Low	66.4	Low	131 Å²	131	105.7 Å²	105.7	61%	0.612	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	6.1	-176.6	-76.1	-175.5	171.8	0	0	115.9	D1232 L1234	D1232-E1236 PolarHBondContact O-N 2.99Å; L1234-E1236 VanDerWaalsContact C-N 3.34Å
1237	G	52.4	Low	65.4	Low	63 Å²	63	107.4 Å²	107.4	65%	0.649	61%	0.607	S	S	*	*			trans	42.4	92.4	160.3	0	0	0	0	0	119	A1235	A1235-G1237 PolarHBondContact O-N 3.35Å
1238	G	56	Low	64.1	Low	90 Å²	90	107.8 Å²	107.8	93%	0.928	61%	0.614	S	S	*	*	S	Bend	trans	93.1	-7.4	140.3	0	0	0	0	0	120.8
1239	A	50.8	Low	62.5	Low	92 Å²	92	107.4 Å²	107.4	76%	0.76	62%	0.617	S	S	*	*	S	Bend	trans	-110.4	118.3	175	0	0	0	0	0	112.1	K1241	A1239-K1241 PolarHBondContact O-N 3.38Å
1240	F	55.5	Low	60.9	Low	216 Å²	216	115.2 Å²	115.2	95%	0.947	65%	0.647	S	S	*	*	S	Bend	trans	-51.7	93.8	-178.3	-98.3	-100.4	0	0	0	114.1
1241	K	54.8	Low	59	Low	184 Å²	184	118.1 Å²	118.1	80%	0.8	66%	0.663	S	S	*	*			trans	166.5	123.2	132.5	-96.2	174.9	178.6	178.9	0	109.3	A1239	A1239-K1241 PolarHBondContact O-N 3.38Å
1242	P	51.5	Low	57	Low	85 Å²	85	117 Å²	117	55%	0.552	67%	0.669	S	S	*	*			trans	-64.3	131.1	176.5	25.4	-31.3	0	0	0	110.1	T1233 R1244	T1233-P1242 HydrophobicContact CG2-CB 4.43Å; P1242-R1244 PolarHBondContact O-N 3.14Å
1243	P	54.5	Low	55	Low	100 Å²	100	119.6 Å²	119.6	65%	0.649	69%	0.688	S	S	*	*	S	Bend	trans	-73.3	-12.2	-179.6	27.5	-32.6	0	0	0	113.1
1244	R	58.1	Low	53.4	Low	185 Å²	185	122.8 Å²	122.8	70%	0.698	71%	0.71	S	S	*	*	S	Bend	trans	-129.9	130.9	179.3	-73.9	-179.3	177.2	172	-0	111.7	W1229 P1242	W1229-R1244 PolarHBondContact NE1-O 3.04Å; W1229-R1244 VanDerWaalsContact NE1-O 3.13Å; P1242-R1244 PolarHBondContact O-N 3.14Å
1245	P	60.8	Low	51.6	Low	108 Å²	108	121.9 Å²	121.9	70%	0.701	71%	0.714	S	S	*	*			trans	-59.9	149.4	172.3	26.4	-32.6	0	0	0	110.2
1246	P	61.1	Low	49.7	Very low	73 Å²	73	123.4 Å²	123.4	47%	0.474	72%	0.72	S	S	.	*			trans	-57.1	148.2	173.8	25.1	-33.4	0	0	0	109.9	W1229 T1248	W1229-P1246 HydrophobicContact CD2-CB 4.38Å; W1229-P1246 HydrophobicContact CE3-CB 4.46Å; W1229-P1246 HydrophobicContact CH2-CB 4Å; W1229-P1246 HydrophobicContact CZ2-CB 3.87Å; W1229-P1246 HydrophobicContact CZ2-CG 4.47Å; W1229-P1246 HydrophobicContact CZ3-CB 4.29Å; P1246-T1248 PolarHBondContact O-N 2.89Å
1247	P	61.5	Low	48.1	Very low	68 Å²	68	122.9 Å²	122.9	44%	0.442	73%	0.731	S	S	.	*			trans	-56.7	108.6	173.8	21.9	-29.4	0	0	0	108.6	A1226	A1226-P1247 HydrophobicContact CB-CG 4.19Å
1248	T	54.8	Low	46.9	Very low	120 Å²	120	123.1 Å²	123.1	74%	0.736	73%	0.733	S	S	*	*			trans	-73.1	133.2	176.7	48.4	0	0	0	0	108.7	P1246 R1250	P1246-T1248 PolarHBondContact O-N 2.89Å; T1248-R1250 PolarHBondContact O-N 3.11Å
1249	F	46.8	Very low	45.7	Very low	157 Å²	157	124.8 Å²	124.8	69%	0.689	73%	0.731	S	S	*	*			trans	-46.6	111.1	169.9	-130.5	-99.1	0	0	0	108.6	D1251	F1249-D1251 PolarHBondContact O-N 2.97Å
1250	R	48.1	Very low	44.7	Very low	234 Å²	234	129.3 Å²	129.3	88%	0.883	76%	0.757	S	S	*	*			trans	-75.4	91.6	163.8	-104.8	-175.9	172.6	178.2	-1.5	105.2	T1248 G1252	T1248-R1250 PolarHBondContact O-N 3.11Å; R1250-G1252 PolarHBondContact O-N 2.04Å
1251	D	41.1	Very low	44.1	Very low	136 Å²	136	125 Å²	125	73%	0.727	75%	0.747	S	S	*	*			trans	-50.8	132.1	163.6	-77.2	-29.1	0	0	0	108	F1249	F1249-D1251 PolarHBondContact O-N 2.97Å
1252	G	39.6	Very low	43.6	Very low	67 Å²	67	121.8 Å²	121.8	69%	0.691	75%	0.745	S	S	*	*			trans	-48.2	152.3	-160.6	0	0	0	0	0	115.6	R1250	R1250-G1252 PolarHBondContact O-N 2.04Å
1253	V	32.8	Very low	43.1	Very low	140 Å²	140	123.9 Å²	123.9	85%	0.848	76%	0.755	S	S	*	*			trans	-39.2	127.3	166.3	178.3	0	0	0	0	109.9	S1255	V1253-S1255 PolarHBondContact O-N 3.49Å; V1253-S1255 VanDerWaalsContact O-N 3.12Å
1254	P	35	Very low	42.4	Very low	115 Å²	115	125.3 Å²	125.3	75%	0.747	76%	0.761	S	S	*	*			trans	-61.4	122.1	173.5	24.7	-30.2	0	0	0	107.7	S1256	P1254-S1256 PolarHBondContact O-N 3.05Å
1255	S	33	Very low	41.5	Very low	114 Å²	114	121.6 Å²	121.6	80%	0.797	77%	0.765	S	S	*	*			trans	-48.9	110.5	169.7	53.9	0	0	0	0	108.5	V1253 S1257	V1253-S1255 PolarHBondContact O-N 3.49Å; V1253-S1255 VanDerWaalsContact O-N 3.12Å; S1255-S1257 PolarHBondContact O-N 3.48Å
1256	S	30.4	Very low	40.2	Very low	113 Å²	113	122.5 Å²	122.5	79%	0.79	77%	0.77	S	S	*	*			trans	-54.1	116.2	169.9	53.5	0	0	0	0	107.7	P1254 G1258	P1254-S1256 PolarHBondContact O-N 3.05Å; S1256-G1258 VanDerWaalsContact C-N 3.33Å; S1256-G1258 PolarHBondContact O-N 3.06Å
1257	S	31.2	Very low	38.7	Very low	120 Å²	120	126 Å²	126	84%	0.839	79%	0.791	S	S	*	*			trans	-55.1	96.9	167.9	50.2	0	0	0	0	108.8	S1255 S1259	S1255-S1257 PolarHBondContact O-N 3.48Å; S1257-S1259 PolarHBondContact O-N 3.46Å
1258	G	28.8	Very low	36.9	Very low	68 Å²	68	130.5 Å²	130.5	70%	0.701	82%	0.818	S	S	*	*			trans	-68.4	109.1	164.3	0	0	0	0	0	107.9	S1256 S1260	S1256-G1258 VanDerWaalsContact C-N 3.33Å; S1256-G1258 PolarHBondContact O-N 3.06Å; G1258-S1260 PolarHBondContact O-N 3.47Å
1259	S	29.7	Very low	35.4	Very low	125 Å²	125	131.3 Å²	131.3	87%	0.874	83%	0.825	S	S	*	*			trans	-63.6	105	158.3	52.8	0	0	0	0	108.6	S1257	S1257-S1259 PolarHBondContact O-N 3.46Å
1260	S	29	Very low	34.4	Very low	187 Å²	187	129 Å²	129	100%	1.308	84%	0.837	S	S	*	*			trans	-152.4	0	153.6	60.2	0	0	0	0	108.6	G1258	G1258-S1260 PolarHBondContact O-N 3.47Å

Retrieved 1,260 of 1,260 residues in 316.7 ms (Link to these results)

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