A0A077Z4C8_TRITR Loading...

ABC transporter, ATP binding protein

AlphaFold DB , UniProt , Accession A0A077Z4C8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 2,299 aa.

						>A0A077Z4C8_TRITR|A0A077Z4C8
MAGLTFTKGTYAPKGMPSSGLFTMLQTYFCTLPNGCLNQSVPDWDLGSASKKLPLNDFIAGFRQGAQNGTVVQDAKTVLHYAGIINDIVLNMTTTNAPYTPIGITEFFHVSSRAEEFQVEAESVQGCTLTRRFWIDALRKKIELAHIEEKQIYGVSLMSSDDCKLCAVKETLLPVFTYLTGFSLSPEELFGFLIALSNLRDPIERFRKADTLSPLFKHLKNDTSNSQNSNSVIEKLGILSNLFCGGPLSLKCWYTVQRCLEMEVVPGPYFLNLSNLQGYYCLDLTYEYEQPSARLDEIFKAQKKLEQLREQMVHTDPRHIDEKRQSLYLKHFKDSVKGNTTKEGETTVCSGFFLGSIETACWKWLQTYQLPRELAVQLYTLLRGVILVSPSSPVVKTIVEELNGKLHEIEVFRTLFVSWYQNMANYPIAFEESKLYNASKTLAHMYVNVDDKVDISSVLADGQFYRKLAESLITESWKNISYDELKLSLLQSFNLVYVLSMKSIVSLLFSCCFRPSRFHVIKDEKSLEETGSCLSAYFQFFSGVVFTQLNSSSTSLPKALEYKIRMADYLVDKTGQIVDRYKHEVHNVWSPQPRDRPFLDLKYIYFGFSFLQDLVDGIIISLQTNSTLKVGVFAQQFPSNCYRIDLSIGKSIPTFVVLSWMFSVAMIMKNVVTEKQLRLKEFMKMMGLRSFAHWLAWYIQGMIMLCCSVVFIAIIVKEGKILEYSNSFCFSLLLILYGSAIIPQTFLLSVFFKQANLAAGMGAVLYFLLFLPYEAINPYTNDITFTEQFLACLHPQIAFGWACSVIASLEEAKTGLQWNNMNFPLVQNGRLTFNVILVMLLVDGIMYSVFTWYAENVFPGDYGVPKKFYFPFQKSYWFGERTSPRDYEHLKRVSKKSEHHEEVNLPVGISVVGVTKIYGNAKKRDKPSLDDLNVDFYDGQITAVLGPNGAGKTTMMSIICGLIPPTEGTVFIYGKDIAENMAAVRQSLGFCPQHNILFDNLTVKEHLQFYGSIKGVDPQIKEREIDALLYDTKLMNKKNELAANLSGGMKRKLSIAIAFIGGAKIVILDEPTAGVDPYSRRAIWDLLLKCKQDRTIILSTHFFDEAEILGDRIAIIAKGQLKCYGSAIFLKHYYRCGYNLTFTRSVEVSAQKQRAVDSNRNLVNFVINYVPNVKVVRESLQEIQFMLPGKVLEELRPLVFEIDKRLSQFQCVAYGLSESSLEETNQIAFADIVLTFFKRSFKSNQDANSFLHEDEVETDFYGTVLSQVKAYMKKRFLNITRDWRAAVCIVKIRTLILINLAIPIVLISNSLTAQSLRFSPSRYYKEHGPLLVDPVITKLIHFSTKAGLCYSSFTRPPNDKSESNFMRPYIDAMISYGLGNRCHQQYRTRLPSSTCGAKKSWWYHYPTPSQQVNDSAVCHCNEDMHFVCERPYPNKPYRYTTRSDDVMADLSDMNITEWIMMTEMHYRKKRCGWPTVFDFFDTFRFSNELYNVEGLFENVWLRSHSKLALCPLISSPAFNRGFTKIVKFGGYSIANPPEVYVNVKIEDLERNVEILYRELMNFFQKTNVNLDTLQRHGTKWPPLNSTILAKLLNEMSPKHNVKVWYNNQGWVSLPSFMSALSNARLRAHIPNNMSREEYSIATINHPMKNIVDESMLHNKDSIAAEMSLALAFLMAFCSVTASFSIFAVEDKASDAKHLHFVSGMRRWLYWIANFVFDLLVYMFTMVLAIVILRIYGEKPYVGTANAALVMITIIMSFGQLLHASFLHALTCSVSMIPFSYLLSLYFQSPSLGFMVLSISNFFIGTIGSSLTMAFEVLGQDDEKLQKLAVDLKSVFIYFPPFVMARAWTDMKVVFNIYSAEGKELSKRTITITFQAVKISVCLDKDYYYDLLRWDLLGKPVVIETIEAIIFFLLLLVFEYRYKWFELRKRLPCFTEKQPDKTDCDENVAAEKRRVLSGVNKNSALKVINLRKAAMRNALIVRSSLLTAALPTFQVYFKGMALRKVAVVDDVCFEVLPGECFGLLGHNGAGKTTTFKMITRKISASSGSFFENSDGKAVHLSPIGYCPQFDALDSRLTARETLLLYTGIRCIKEKHRKGIVEAYLQRFDFKAYADKQVKTYSGGYKRRLSTAIALLGKSPLILLDEPTAGMDPESRRFLWDVILERIFAGHMEECEILCTRVGILAHGSFTCLDTIQGLKNKFGHGYQVAVKLLGGNERQLPSLVKFIEEHLPKCKLAEQHLNLAKFQLPPEKGVVLKAIDCVIEVKRRFKVEACSLNQTSLDDVFVSLAQTQAKFDTVEK
					

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(Predicted Aligned Error values between residue pairs)

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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	25	Very low	44.9	Very low	240 Å²	240	75.5 Å²	75.5	100%	1.182	45%	0.454	S	S	*	.				0	-27.8	0	-78.9	-173.8	172.3	0	0	113.4	G3	M1-G3 PolarHBondContact O-N 2.93Å
2	A	23.3	Very low	47.1	Very low	117 Å²	117	71.1 Å²	71.1	97%	0.967	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	40.6	-172.7	0	0	0	0	0	115.6
3	G	28.1	Very low	49.2	Very low	70 Å²	70	66.1 Å²	66.1	72%	0.722	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.9	8.2	-171.3	0	0	0	0	0	116.6	M1 T5	M1-G3 PolarHBondContact O-N 2.93Å; G3-T5 PolarHBondContact O-N 2.92Å
4	L	35.6	Very low	51.4	Low	73 Å²	73	61.7 Å²	61.7	38%	0.382	37%	0.374	S	S	.	.			trans	-83	112	173.8	-72.9	160.4	0	0	0	108.2	F6 L305	L4-F6 HydrophobicContact CB-CD2 4.08Å; L4-F6 HydrophobicContact CB-CE1 4.02Å; L4-F6 HydrophobicContact CB-CE2 3.54Å; L4-F6 HydrophobicContact CB-CZ 3.51Å; L4-F6 HydrophobicContact CD1-CE1 4.24Å; L4-F6 HydrophobicContact CD1-CZ 3.83Å; L4-F6 HydrophobicContact CG-CZ 4.32Å; L4-F6 WeakPolarHBondContact O-CD2 3.42Å; L4-F6 VanDerWaalsContact O-CE2 3.24Å; L4-F6 WeakPolarHBondContact O-CE2 3.07Å; L4-F6 PolarHBondContact O-N 3Å; L4-F6 VanDerWaalsContact O-N 3.17Å; L4-L305 HydrophobicContact CD1-CD1 3.47Å; L4-L305 VanDerWaalsContact CD1-CD1 3.47Å; L4-L305 HydrophobicContact CD2-CD1 4.13Å; L4-L305 HydrophobicContact CG-CD1 4.45Å
5	T	35.1	Very low	53.2	Low	107 Å²	107	57.7 Å²	57.7	66%	0.656	35%	0.35	S	S	*	.			trans	-75.7	98	168.7	47.7	0	0	0	0	108.4	G3	G3-T5 PolarHBondContact O-N 2.92Å
6	F	46.8	Very low	55.2	Low	112 Å²	112	54.1 Å²	54.1	49%	0.491	33%	0.328	S	S	.	.			trans	-88.2	129.8	175.2	-47.1	-100.2	0	0	0	109.5	L4 M1424	L4-F6 HydrophobicContact CB-CD2 4.08Å; L4-F6 HydrophobicContact CB-CE1 4.02Å; L4-F6 HydrophobicContact CB-CE2 3.54Å; L4-F6 HydrophobicContact CB-CZ 3.51Å; L4-F6 HydrophobicContact CD1-CE1 4.24Å; L4-F6 HydrophobicContact CD1-CZ 3.83Å; L4-F6 HydrophobicContact CG-CZ 4.32Å; L4-F6 WeakPolarHBondContact O-CD2 3.42Å; L4-F6 VanDerWaalsContact O-CE2 3.24Å; L4-F6 WeakPolarHBondContact O-CE2 3.07Å; L4-F6 PolarHBondContact O-N 3Å; L4-F6 VanDerWaalsContact O-N 3.17Å; F6-M1424 HydrophobicContact CB-CE 3.35Å; F6-M1424 HydrophobicContact CB-SD 3.51Å; F6-M1424 VanDerWaalsContact CB-SD 3.51Å; F6-M1424 HydrophobicContact CD1-CE 3.84Å; F6-M1424 HydrophobicContact CD2-CE 3.36Å; F6-M1424 HydrophobicContact CD2-SD 3.27Å; F6-M1424 WeakPolarHBondContact CD2-SD 3.27Å; F6-M1424 HydrophobicContact CE1-CE 4.42Å; F6-M1424 HydrophobicContact CE2-CE 4Å; F6-M1424 HydrophobicContact CE2-SD 4.12Å; F6-M1424 HydrophobicContact CG-CE 3.26Å; F6-M1424 HydrophobicContact CG-SD 3.64Å; F6-M1424 HydrophobicContact CZ-CE 4.48Å
7	T	46.9	Very low	56.7	Low	55 Å²	55	51.6 Å²	51.6	34%	0.337	31%	0.314	S	S	.	.			trans	-131.9	162.6	-159.2	42.5	0	0	0	0	112.7	G9 N38	T7-G9 PolarHBondContact O-N 2.94Å; T7-G9 VanDerWaalsContact O-N 3.16Å; T7-N38 VanDerWaalsContact CB-OD1 3.23Å; T7-N38 WeakPolarHBondContact CB-OD1 3.49Å; T7-N38 PolarHBondContact OG1-OD1 2.91Å
8	K	53	Low	58	Low	41 Å²	41	50.3 Å²	50.3	18%	0.178	31%	0.307	C	S	.	.			trans	-54.3	111.5	174.4	-174.1	-177.9	-174.4	177.8	0	109.8	T10 M1460	K8-T10 PolarHBondContact O-N 2.88Å; K8-M1460 HydrophobicContact CD-CE 4.4Å; K8-M1460 HydrophobicContact CD-SD 4.24Å; K8-M1460 WeakPolarHBondContact CE-SD 3.39Å; K8-M1460 HydrophobicContact CG-CE 3.52Å; K8-M1460 HydrophobicContact CG-SD 3.99Å
9	G	60.1	Low	58.9	Low	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-84.4	92	-172.3	0	0	0	0	0	112.5	T7 C36 P638 S639	T7-G9 PolarHBondContact O-N 2.94Å; T7-G9 VanDerWaalsContact O-N 3.16Å; G9-C36 WeakPolarHBondContact CA-SG 3.49Å; G9-P638 CarbonylContact O-C 3.49Å; G9-P638 WeakPolarHBondContact O-CA 3.43Å; G9-S639 PolarHBondContact N-O 3.18Å; G9-S639 PolarHBondContact O-N 2.91Å
10	T	66.9	Low	59.6	Low	8 Å²	8	45.8 Å²	45.8	5%	0.049	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-97.8	139	168	71.5	0	0	0	0	110.6	K8 C36 L37 Q39 P638 T1456	K8-T10 PolarHBondContact O-N 2.88Å; T10-C36 CarbonylContact O-C 3.57Å; T10-C36 WeakPolarHBondContact O-CA 3.37Å; T10-L37 PolarHBondContact O-N 3.39Å; T10-L37 PolarHBondContact OG1-O 2.9Å; T10-Q39 PolarHBondContact OG1-O 2.95Å; T10-Q39 VanDerWaalsContact OG1-O 3.08Å; T10-P638 HydrophobicContact CG2-CB 4.1Å; T10-T1456 HydrophobicContact CG2-CG2 4.23Å
11	Y	73.6	Confident	60.2	Low	8 Å²	8	44.7 Å²	44.7	3%	0.031	27%	0.274	C	S	.	.			trans	-111.7	151.9	-173.5	-56.8	-77	0	0	0	110.7	C36 P593 D595 Q635 Q636 F637 S639	Y11-C36 VanDerWaalsContact CE1-SG 3.51Å; Y11-P593 WeakPolarHBondContact OH-CB 3.45Å; Y11-D595 HydrophobicContact CD1-CB 4.48Å; Y11-D595 HydrophobicContact CE1-CB 3.49Å; Y11-D595 VanDerWaalsContact CE1-CB 3.49Å; Y11-D595 WeakPolarHBondContact OH-CB 3.47Å; Y11-D595 PolarHBondContact OH-OD2 3.28Å; Y11-Q635 PolarHBondContact O-NE2 3.16Å; Y11-Q635 PolarHBondContact O-OE1 3.15Å; Y11-Q636 HydrophobicContact CD2-CB 3.72Å; Y11-Q636 HydrophobicContact CG-CB 4.02Å; Y11-F637 WeakPolarHBondContact CD2-O 3.28Å; Y11-F637 WeakPolarHBondContact CE2-O 3.38Å; Y11-S639 PolarHBondContact OH-OG 2.77Å
12	A	70.6	Confident	62.3	Low	22 Å²	22	36.2 Å²	36.2	18%	0.182	23%	0.23	C	C	.	.			trans	-78.3	146.1	176.3	0	0	0	0	0	112.7	T31 L37	A12-T31 HydrophobicContact CB-CG2 3.62Å; A12-L37 HydrophobicContact CB-CD1 4.45Å
13	P	75.1	Confident	64.6	Low	6 Å²	6	31.6 Å²	31.6	4%	0.039	19%	0.19	C	C	.	.			trans	-72.4	149.3	175.6	29	-33.6	0	0	0	111.7	L46 Q635	P13-L46 WeakPolarHBondContact CG-O 3.15Å; P13-Q635 VanDerWaalsContact CB-OE1 3.31Å
14	K	79.5	Confident	67	Low	5 Å²	5	28.8 Å²	28.8	2%	0.022	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.4	180	-60.3	-176.8	-174	177.7	0	110.5	T31 N34 I604 Y605 F633 A634	K14-T31 VanDerWaalsContact CE-OG1 3.26Å; K14-T31 WeakPolarHBondContact CE-OG1 3.31Å; K14-N34 WeakPolarHBondContact CE-OD1 3.47Å; K14-N34 PolarHBondContact NZ-OD1 3.19Å; K14-I604 HydrophobicContact CD-CD1 4.12Å; K14-I604 HydrophobicContact CD-CG2 3.89Å; K14-Y605 VanDerWaalsContact NZ-CZ 3.27Å; K14-Y605 PolarHBondContact NZ-OH 2.94Å; K14-F633 CarbonylContact O-C 3.49Å; K14-F633 WeakPolarHBondContact O-CA 3.31Å; K14-A634 PolarHBondContact N-O 3.14Å; K14-A634 PolarHBondContact O-N 3.09Å
15	G	78.8	Confident	68.8	Low	1 Å²	1	27.6 Å²	27.6	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	132	179.2	0	0	0	0	0	111.7	S19 M24 T27	G15-S19 WeakPolarHBondContact CA-OG 3.32Å; G15-M24 WeakPolarHBondContact O-CG 3.33Å; G15-T27 PolarHBondContact N-OG1 3.4Å
16	M	84.5	Confident	70.4	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.125	C	C	.	.			trans	-85	162.3	168.6	-62.9	-67.7	165.4	0	0	109.9	S18 S19 F610 D613 V632 A634 L1613 M1617	M16-S18 PolarHBondContact O-N 3.1Å; M16-S19 WeakPolarHBondContact O-CB 3.36Å; M16-S19 PolarHBondContact O-N 2.98Å; M16-S19 PolarHBondContact O-OG 3.15Å; M16-F610 HydrophobicContact SD-CD1 3.62Å; M16-F610 HydrophobicContact SD-CE1 3.87Å; M16-D613 HydrophobicContact CB-CB 4.27Å; M16-D613 WeakPolarHBondContact CB-OD2 3.32Å; M16-V632 HydrophobicContact CB-CB 4.18Å; M16-V632 WeakPolarHBondContact CB-O 3.22Å; M16-V632 HydrophobicContact CG-CB 4.28Å; M16-V632 HydrophobicContact CG-CG1 4.23Å; M16-V632 PolarHBondContact N-O 2.63Å; M16-A634 HydrophobicContact CE-CB 3.45Å; M16-A634 VanDerWaalsContact CE-CB 3.45Å; M16-L1613 HydrophobicContact CE-CD2 4.15Å; M16-M1617 HydrophobicContact CG-CE 4.24Å
17	P	81	Confident	71.4	Confident	13 Å²	13	18.5 Å²	18.5	8%	0.084	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-51.5	-31.5	-180	-28.8	34.8	0	0	0	115	S19 G20 M24 F610 L614	P17-S19 PolarHBondContact O-N 3.1Å; P17-G20 PolarHBondContact O-N 2.95Å; P17-M24 HydrophobicContact CB-SD 4.36Å; P17-M24 HydrophobicContact CG-CG 4.4Å; P17-M24 HydrophobicContact CG-SD 3.74Å; P17-F610 HydrophobicContact CG-CB 3.79Å; P17-F610 HydrophobicContact CG-CG 4.43Å; P17-L614 HydrophobicContact CB-CD1 4.24Å; P17-L614 HydrophobicContact CB-CD2 3.65Å; P17-L614 HydrophobicContact CB-CG 3.71Å; P17-L614 HydrophobicContact CG-CD1 4.15Å; P17-L614 HydrophobicContact CG-CD2 4.39Å; P17-L614 HydrophobicContact CG-CG 3.9Å
18	S	79.6	Confident	72.6	Confident	27 Å²	27	16.1 Å²	16.1	19%	0.189	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-61.7	-23.1	173.2	53.3	0	0	0	0	115.1	M16 G20 D613 V630 G631 V632	M16-S18 PolarHBondContact O-N 3.1Å; S18-G20 PolarHBondContact O-N 3.08Å; S18-D613 WeakPolarHBondContact CB-OD2 3.39Å; S18-D613 PolarHBondContact N-OD2 3.37Å; S18-D613 PolarHBondContact OG-OD1 2.88Å; S18-D613 PolarHBondContact OG-OD2 3.49Å; S18-V630 WeakPolarHBondContact CB-O 3.25Å; S18-G631 WeakPolarHBondContact O-CA 3.4Å; S18-V632 WeakPolarHBondContact OG-CB 3.42Å; S18-V632 WeakPolarHBondContact OG-CG2 3.14Å; S18-V632 PolarHBondContact OG-N 2.88Å
19	S	75.5	Confident	73.3	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.007	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-76.6	2.2	174.3	70.7	0	0	0	0	114.4	G15 M16 P17 T23 P1597	G15-S19 WeakPolarHBondContact CA-OG 3.32Å; M16-S19 WeakPolarHBondContact O-CB 3.36Å; M16-S19 PolarHBondContact O-N 2.98Å; M16-S19 PolarHBondContact O-OG 3.15Å; P17-S19 PolarHBondContact O-N 3.1Å; S19-T23 WeakPolarHBondContact O-CB 3.42Å; S19-T23 PolarHBondContact O-OG1 3.04Å; S19-T23 VanDerWaalsContact O-OG1 3.06Å; S19-P1597 WeakPolarHBondContact O-CD 3.45Å
20	G	74.2	Confident	73.3	Confident	9 Å²	9	21 Å²	21	9%	0.093	12%	0.115	C	C	.	.			trans	101.8	129.7	-168.8	0	0	0	0	0	109.6	P17 S18 F22 T23 M24 E1594	P17-G20 PolarHBondContact O-N 2.95Å; S18-G20 PolarHBondContact O-N 3.08Å; G20-F22 PolarHBondContact O-N 3.47Å; G20-T23 WeakPolarHBondContact O-CB 3.44Å; G20-T23 PolarHBondContact O-N 2.89Å; G20-T23 VanDerWaalsContact O-N 3.16Å; G20-M24 PolarHBondContact O-N 3.31Å; G20-E1594 WeakPolarHBondContact CA-O 3.37Å
21	L	71.7	Confident	73.2	Confident	24 Å²	24	21.1 Å²	21.1	13%	0.126	12%	0.116	C	C	.	.	H	α-helix	trans	-68.2	-29.4	-173.1	-155.1	157.2	0	0	0	111.5	L25 L406 I409	L21-L25 HydrophobicContact CD2-CD1 3.89Å; L21-L25 HydrophobicContact CD2-CG 4.24Å; L21-L25 WeakPolarHBondContact O-CG 3.32Å; L21-L25 PolarHBondContact O-N 3.45Å; L21-L406 HydrophobicContact CD1-CD2 4.12Å; L21-I409 HydrophobicContact CD1-CD1 4.41Å; L21-I409 HydrophobicContact CD2-CD1 3.4Å; L21-I409 HydrophobicContact CD2-CG1 4.08Å
22	F	69.3	Low	72.6	Confident	62 Å²	62	22.1 Å²	22.1	27%	0.272	12%	0.121	S	C	.	.	H	α-helix	trans	-66.2	-47.6	170.1	-160.9	-90.8	0	0	0	112.4	G20 M24 L25 Q26 L55 M1595	G20-F22 PolarHBondContact O-N 3.47Å; F22-M24 VanDerWaalsContact C-N 3.28Å; F22-M24 PolarHBondContact O-N 3.21Å; F22-L25 PolarHBondContact O-N 2.95Å; F22-Q26 WeakPolarHBondContact O-CB 3.45Å; F22-Q26 PolarHBondContact O-N 3.41Å; F22-L55 HydrophobicContact CE1-CD2 3.69Å; F22-L55 HydrophobicContact CE2-CD2 4.31Å; F22-L55 HydrophobicContact CZ-CD2 3.29Å; F22-M1595 HydrophobicContact CB-CE 4.17Å; F22-M1595 HydrophobicContact CB-SD 3.41Å; F22-M1595 WeakPolarHBondContact CB-SD 3.37Å; F22-M1595 HydrophobicContact CD1-CE 3.58Å; F22-M1595 HydrophobicContact CD1-SD 4Å; F22-M1595 HydrophobicContact CD2-SD 4.29Å; F22-M1595 HydrophobicContact CE1-CE 4.22Å; F22-M1595 HydrophobicContact CG-CE 3.84Å; F22-M1595 HydrophobicContact CG-SD 3.61Å
23	T	71.1	Confident	72	Confident	20 Å²	20	25 Å²	25	12%	0.123	14%	0.139	C	C	.	.	H	α-helix	trans	-57.9	-40	175.2	-42.5	0	0	0	0	112.2	S19 G20 T27 F633 M1595	S19-T23 WeakPolarHBondContact O-CB 3.42Å; S19-T23 PolarHBondContact O-OG1 3.04Å; S19-T23 VanDerWaalsContact O-OG1 3.06Å; G20-T23 WeakPolarHBondContact O-CB 3.44Å; G20-T23 PolarHBondContact O-N 2.89Å; G20-T23 VanDerWaalsContact O-N 3.16Å; T23-T27 WeakPolarHBondContact O-CB 3.47Å; T23-T27 WeakPolarHBondContact O-CG2 3.25Å; T23-T27 PolarHBondContact O-N 3.16Å; T23-T27 PolarHBondContact O-OG1 3.12Å; T23-F633 HydrophobicContact CG2-CE1 4.18Å; T23-F633 HydrophobicContact CG2-CZ 4.06Å; T23-M1595 PolarHBondContact OG1-O 3.42Å
24	M	78.8	Confident	71.5	Confident	10 Å²	10	25.2 Å²	25.2	5%	0.049	14%	0.139	C	C	.	.	H	α-helix	trans	-61.7	-52.6	173.7	177.9	-138.9	154.8	0	0	111.2	G15 P17 G20 F22 Q26 T27 Y28 F610	G15-M24 WeakPolarHBondContact O-CG 3.33Å; P17-M24 HydrophobicContact CB-SD 4.36Å; P17-M24 HydrophobicContact CG-CG 4.4Å; P17-M24 HydrophobicContact CG-SD 3.74Å; G20-M24 PolarHBondContact O-N 3.31Å; F22-M24 VanDerWaalsContact C-N 3.28Å; F22-M24 PolarHBondContact O-N 3.21Å; M24-Q26 PolarHBondContact O-N 3.16Å; M24-T27 PolarHBondContact O-N 3.02Å; M24-T27 PolarHBondContact O-OG1 3.49Å; M24-Y28 WeakPolarHBondContact O-CB 3.36Å; M24-Y28 PolarHBondContact O-N 3.39Å; M24-F610 HydrophobicContact CE-CB 4.22Å; M24-F610 HydrophobicContact CE-CD1 4Å; M24-F610 HydrophobicContact CE-CD2 3.26Å; M24-F610 HydrophobicContact CE-CE1 4.16Å; M24-F610 HydrophobicContact CE-CE2 3.47Å; M24-F610 VanDerWaalsContact CE-CE2 3.47Å; M24-F610 HydrophobicContact CE-CG 3.57Å; M24-F610 HydrophobicContact CE-CZ 3.93Å
25	L	72.4	Confident	70.5	Confident	49 Å²	49	27.1 Å²	27.1	26%	0.257	16%	0.16	S	C	.	.	H	α-helix	trans	-61.9	-43.6	178.2	-71.8	171.8	0	0	0	111.9	L21 F22 Y28 F29	L21-L25 HydrophobicContact CD2-CD1 3.89Å; L21-L25 HydrophobicContact CD2-CG 4.24Å; L21-L25 WeakPolarHBondContact O-CG 3.32Å; L21-L25 PolarHBondContact O-N 3.45Å; F22-L25 PolarHBondContact O-N 2.95Å; L25-Y28 PolarHBondContact O-N 2.77Å; L25-F29 HydrophobicContact CD2-CE2 4.25Å; L25-F29 WeakPolarHBondContact O-CD2 3.3Å; L25-F29 PolarHBondContact O-N 3.32Å
26	Q	68.8	Low	69.4	Low	20 Å²	20	29.5 Å²	29.5	9%	0.093	18%	0.176	C	C	.	.	H	α-helix	trans	-57.3	-56.7	176.8	-172.7	-171.3	6.8	0	0	111.1	F22 M24 Y28 F29 C30 S50 L53 N56	F22-Q26 WeakPolarHBondContact O-CB 3.45Å; F22-Q26 PolarHBondContact O-N 3.41Å; M24-Q26 PolarHBondContact O-N 3.16Å; Q26-Y28 VanDerWaalsContact C-N 3.28Å; Q26-Y28 PolarHBondContact O-N 2.88Å; Q26-F29 PolarHBondContact O-N 3.04Å; Q26-C30 WeakPolarHBondContact O-CB 3.36Å; Q26-C30 PolarHBondContact O-N 3.34Å; Q26-C30 PolarHBondContact O-SG 3.25Å; Q26-S50 PolarHBondContact NE2-O 3.06Å; Q26-L53 HydrophobicContact CG-CD1 3.73Å; Q26-N56 PolarHBondContact NE2-ND2 3.27Å; Q26-N56 PolarHBondContact OE1-ND2 3.01Å
27	T	68.9	Low	68.2	Low	7 Å²	7	31.9 Å²	31.9	4%	0.043	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-32.7	179.7	53.8	0	0	0	0	112.5	G15 T23 M24 T31	G15-T27 PolarHBondContact N-OG1 3.4Å; T23-T27 WeakPolarHBondContact O-CB 3.47Å; T23-T27 WeakPolarHBondContact O-CG2 3.25Å; T23-T27 PolarHBondContact O-N 3.16Å; T23-T27 PolarHBondContact O-OG1 3.12Å; M24-T27 PolarHBondContact O-N 3.02Å; M24-T27 PolarHBondContact O-OG1 3.49Å; T27-T31 WeakPolarHBondContact O-CB 3.39Å; T27-T31 VanDerWaalsContact O-CG2 3.3Å; T27-T31 WeakPolarHBondContact O-CG2 3.46Å; T27-T31 PolarHBondContact O-N 2.97Å; T27-T31 VanDerWaalsContact O-N 3.08Å; T27-T31 PolarHBondContact O-OG1 2.96Å
28	Y	71.9	Confident	66.8	Low	6 Å²	6	36.2 Å²	36.2	2%	0.024	21%	0.211	C	C	.	.	H	α-helix	trans	-63.5	-49.3	175.8	177.5	-88.7	0	0	0	112.7	M24 L25 Q26 L32 Q377 L378 L381 Y605 F610	M24-Y28 WeakPolarHBondContact O-CB 3.36Å; M24-Y28 PolarHBondContact O-N 3.39Å; L25-Y28 PolarHBondContact O-N 2.77Å; Q26-Y28 VanDerWaalsContact C-N 3.28Å; Q26-Y28 PolarHBondContact O-N 2.88Å; Y28-L32 HydrophobicContact CD1-CD1 4.45Å; Y28-L32 HydrophobicContact CE1-CD1 4.18Å; Y28-L32 PolarHBondContact O-N 3.24Å; Y28-Q377 VanDerWaalsContact OH-CD 3.31Å; Y28-Q377 PolarHBondContact OH-NE2 2.8Å; Y28-L378 HydrophobicContact CE1-CD2 4.15Å; Y28-L381 HydrophobicContact CE1-CD2 4.09Å; Y28-L381 HydrophobicContact CE2-CD2 4.38Å; Y28-Y605 HydrophobicContact CE2-CD1 4.13Å; Y28-Y605 PolarHBondContact OH-O 3.17Å; Y28-F610 AromaticContact CD2-CE2 3.88Å; Y28-F610 HydrophobicContact CD2-CE2 3.88Å; Y28-F610 AromaticContact CD2-CZ 3.86Å; Y28-F610 HydrophobicContact CD2-CZ 3.86Å; Y28-F610 AromaticContact CE2-CE2 3.99Å; Y28-F610 HydrophobicContact CE2-CE2 3.99Å; Y28-F610 HydrophobicContact CE2-CZ 4.33Å
29	F	67.8	Low	65.6	Low	103 Å²	103	41.6 Å²	41.6	45%	0.452	23%	0.233	S	C	.	.	H	α-helix	trans	-72.5	-37.1	179.4	-74.4	-66.6	0	0	0	112.7	L25 Q26 T31 L32 L378	L25-F29 HydrophobicContact CD2-CE2 4.25Å; L25-F29 WeakPolarHBondContact O-CD2 3.3Å; L25-F29 PolarHBondContact O-N 3.32Å; Q26-F29 PolarHBondContact O-N 3.04Å; F29-T31 PolarHBondContact O-N 2.93Å; F29-L32 HydrophobicContact CD1-CD1 4.22Å; F29-L32 WeakPolarHBondContact O-CB 3.3Å; F29-L378 HydrophobicContact CE1-CD1 4.42Å; F29-L378 HydrophobicContact CE1-CD2 3.61Å; F29-L378 HydrophobicContact CZ-CD2 3.7Å
30	C	60.3	Low	64.5	Low	39 Å²	39	44.6 Å²	44.6	26%	0.264	25%	0.254	S	S	.	.	H	α-helix	trans	-78.7	-17.4	-178.4	-57.6	0	0	0	0	114.1	Q26 A49 L53	Q26-C30 WeakPolarHBondContact O-CB 3.36Å; Q26-C30 PolarHBondContact O-N 3.34Å; Q26-C30 PolarHBondContact O-SG 3.25Å; C30-A49 HydrophobicContact CB-CB 4.06Å; C30-L53 WeakPolarHBondContact SG-CD1 3.33Å
31	T	63.1	Low	63.4	Low	11 Å²	11	46.1 Å²	46.1	7%	0.067	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	14.7	176.1	67.8	0	0	0	0	112.7	A12 K14 T27 F29 N34 Y605	A12-T31 HydrophobicContact CB-CG2 3.62Å; K14-T31 VanDerWaalsContact CE-OG1 3.26Å; K14-T31 WeakPolarHBondContact CE-OG1 3.31Å; T27-T31 WeakPolarHBondContact O-CB 3.39Å; T27-T31 VanDerWaalsContact O-CG2 3.3Å; T27-T31 WeakPolarHBondContact O-CG2 3.46Å; T27-T31 PolarHBondContact O-N 2.97Å; T27-T31 VanDerWaalsContact O-N 3.08Å; T27-T31 PolarHBondContact O-OG1 2.96Å; F29-T31 PolarHBondContact O-N 2.93Å; T31-N34 WeakPolarHBondContact O-CA 3.47Å; T31-N34 PolarHBondContact O-N 3.42Å; T31-Y605 PolarHBondContact O-OH 3.23Å
32	L	61	Low	62.6	Low	29 Å²	29	48.7 Å²	48.7	15%	0.152	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-43.1	-177.6	-145.9	117.2	0	0	0	114.4	Y28 F29 N34 L374 P597 F598 Y605	Y28-L32 HydrophobicContact CD1-CD1 4.45Å; Y28-L32 HydrophobicContact CE1-CD1 4.18Å; Y28-L32 PolarHBondContact O-N 3.24Å; F29-L32 HydrophobicContact CD1-CD1 4.22Å; F29-L32 WeakPolarHBondContact O-CB 3.3Å; L32-N34 PolarHBondContact O-N 3.39Å; L32-L374 HydrophobicContact CD1-CD1 4.05Å; L32-L374 HydrophobicContact CD2-CD1 4.12Å; L32-L374 HydrophobicContact CD2-CD2 3.63Å; L32-P597 WeakPolarHBondContact O-CB 3.42Å; L32-F598 HydrophobicContact CD2-CZ 3.85Å; L32-F598 HydrophobicContact CG-CZ 4.09Å; L32-Y605 PolarHBondContact O-OH 2.93Å
33	P	57.9	Low	61.7	Low	84 Å²	84	46.4 Å²	46.4	55%	0.545	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-8.7	174.4	27.2	-34.4	0	0	0	114.7	G35	P33-G35 PolarHBondContact O-N 3.04Å
34	N	64.8	Low	60.9	Low	9 Å²	9	48.6 Å²	48.6	5%	0.048	28%	0.277	C	S	.	.			trans	47.4	32.1	-176.3	-157	68.5	0	0	0	114.6	K14 T31 L32 D595 P597 L601 Q636	K14-N34 WeakPolarHBondContact CE-OD1 3.47Å; K14-N34 PolarHBondContact NZ-OD1 3.19Å; T31-N34 WeakPolarHBondContact O-CA 3.47Å; T31-N34 PolarHBondContact O-N 3.42Å; L32-N34 PolarHBondContact O-N 3.39Å; N34-D595 PolarHBondContact ND2-O 3.44Å; N34-P597 HydrophobicContact CB-CB 4.47Å; N34-L601 HydrophobicContact CB-CD1 4.38Å; N34-L601 WeakPolarHBondContact ND2-CD1 3.3Å; N34-Q636 PolarHBondContact ND2-NE2 3.16Å; N34-Q636 PolarHBondContact OD1-NE2 3.02Å
35	G	58.1	Low	59.7	Low	45 Å²	45	49.2 Å²	49.2	46%	0.464	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-63.7	146.3	-172	0	0	0	0	0	113.9	P33 L37	P33-G35 PolarHBondContact O-N 3.04Å; G35-L37 PolarHBondContact O-N 3.03Å
36	C	57.7	Low	58.7	Low	51 Å²	51	48.4 Å²	48.4	35%	0.345	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-70.6	117.7	170.1	-75.9	0	0	0	0	110.3	G9 T10 Y11 N38	G9-C36 WeakPolarHBondContact CA-SG 3.49Å; T10-C36 CarbonylContact O-C 3.57Å; T10-C36 WeakPolarHBondContact O-CA 3.37Å; Y11-C36 VanDerWaalsContact CE1-SG 3.51Å; C36-N38 PolarHBondContact O-N 3.47Å
37	L	57.9	Low	57.8	Low	50 Å²	50	47.6 Å²	47.6	26%	0.262	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-76	117.9	169.6	-62.5	171.2	0	0	0	108.8	T10 A12 G35 Q39 V41	T10-L37 PolarHBondContact O-N 3.39Å; T10-L37 PolarHBondContact OG1-O 2.9Å; A12-L37 HydrophobicContact CB-CD1 4.45Å; G35-L37 PolarHBondContact O-N 3.03Å; L37-Q39 PolarHBondContact O-N 3.4Å; L37-V41 HydrophobicContact CD1-CG2 3.69Å
38	N	52.9	Low	56.7	Low	105 Å²	105	49.2 Å²	49.2	56%	0.561	28%	0.284	S	S	*	.	S	Bend	trans	-66.5	-13	-177.6	-75.5	-13	0	0	0	114.3	T7 C36	T7-N38 VanDerWaalsContact CB-OD1 3.23Å; T7-N38 WeakPolarHBondContact CB-OD1 3.49Å; T7-N38 PolarHBondContact OG1-OD1 2.91Å; C36-N38 PolarHBondContact O-N 3.47Å
39	Q	53.5	Low	55.3	Low	139 Å²	139	50.5 Å²	50.5	65%	0.65	30%	0.296	S	S	*	.	S	Bend	trans	-109.6	138	176.7	-67.6	179.6	-9.3	0	0	109.4	T10 L37 V41	T10-Q39 PolarHBondContact OG1-O 2.95Å; T10-Q39 VanDerWaalsContact OG1-O 3.08Å; L37-Q39 PolarHBondContact O-N 3.4Å; Q39-V41 PolarHBondContact O-N 3.18Å
40	S	51.6	Low	54.4	Low	65 Å²	65	46.4 Å²	46.4	46%	0.455	28%	0.28	S	S	.	.			trans	-67.7	103.7	171	46.7	0	0	0	0	109.9
41	V	52.6	Low	53.7	Low	40 Å²	40	48.2 Å²	48.2	24%	0.242	28%	0.284	C	S	.	.			trans	-56.8	131.7	168.8	-175.1	0	0	0	0	108.4	L37 Q39 D43 D45	L37-V41 HydrophobicContact CD1-CG2 3.69Å; Q39-V41 PolarHBondContact O-N 3.18Å; V41-D43 PolarHBondContact O-N 3.48Å; V41-D45 HydrophobicContact CG1-CB 3.68Å
42	P	53.5	Low	53.1	Low	78 Å²	78	51.7 Å²	51.7	51%	0.506	30%	0.298	S	S	.	.			trans	-59.1	137.6	176.2	18.3	-26.3	0	0	0	110.5	W44 D45	P42-W44 PolarHBondContact O-N 3.06Å; P42-D45 HydrophobicContact CG-CB 4.21Å; P42-D45 WeakPolarHBondContact O-CB 3.35Å; P42-D45 PolarHBondContact O-N 2.96Å
43	D	51.8	Low	52.4	Low	14 Å²	14	52.6 Å²	52.6	8%	0.075	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-32.9	-164.9	-66.2	-45.8	0	0	0	113.9	V41 N1454 I1455 T1456 K1602	V41-D43 PolarHBondContact O-N 3.48Å; D43-N1454 VanDerWaalsContact OD2-CA 3.29Å; D43-N1454 WeakPolarHBondContact OD2-CA 3.31Å; D43-N1454 PolarHBondContact OD2-OD1 2.91Å; D43-I1455 HydrophobicContact CB-CD1 4.29Å; D43-I1455 HydrophobicContact CB-CG1 4.41Å; D43-I1455 PolarHBondContact OD2-N 3.48Å; D43-T1456 VanDerWaalsContact OD1-CB 3.31Å; D43-T1456 WeakPolarHBondContact OD1-CB 3.42Å; D43-T1456 PolarHBondContact OD1-N 2.91Å; D43-T1456 PolarHBondContact OD1-OG1 3.16Å; D43-K1602 PolarHBondContact O-NZ 2.75Å
44	W	53.6	Low	51.9	Low	67 Å²	67	50.2 Å²	50.2	25%	0.254	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-8.3	-178.2	-53	99.4	0	0	0	114.9	P42 R1355 D1478 F1480 F1485	P42-W44 PolarHBondContact O-N 3.06Å; W44-R1355 WeakPolarHBondContact CH2-O 3.35Å; W44-D1478 VanDerWaalsContact CZ3-OD1 3.28Å; W44-D1478 WeakPolarHBondContact CZ3-OD1 3.42Å; W44-F1480 HydrophobicContact CE3-CB 3.99Å; W44-F1480 HydrophobicContact CZ3-CB 4.24Å; W44-F1485 HydrophobicContact CB-CE2 4.01Å; W44-F1485 HydrophobicContact CB-CZ 4.22Å
45	D	52.9	Low	51.2	Low	22 Å²	22	52.8 Å²	52.8	12%	0.118	30%	0.3	C	S	.	.			trans	-79.4	150.8	-176.3	-143.3	-39.3	0	0	0	112.4	V41 P42 G47 K51 K1602	V41-D45 HydrophobicContact CG1-CB 3.68Å; P42-D45 HydrophobicContact CG-CB 4.21Å; P42-D45 WeakPolarHBondContact O-CB 3.35Å; P42-D45 PolarHBondContact O-N 2.96Å; D45-G47 PolarHBondContact O-N 3.28Å; D45-K51 WeakPolarHBondContact OD1-CD 3.44Å; D45-K51 WeakPolarHBondContact OD1-CE 3.19Å; D45-K51 IonicContact OD1-NZ 2.64Å; D45-K51 PolarHBondContact OD1-NZ 3.3Å; D45-K51 IonicContact OD2-NZ 3.24Å; D45-K51 PolarHBondContact OD2-NZ 2.95Å; D45-K1602 PolarHBondContact O-NZ 2.96Å
46	L	51.4	Low	50.9	Low	33 Å²	33	52.7 Å²	52.7	17%	0.173	29%	0.289	C	S	.	.			trans	-88.5	16.9	176.6	-77.7	171.2	0	0	0	112.5	P13 S50 F633 F1480 T1482	P13-L46 WeakPolarHBondContact CG-O 3.15Å; L46-S50 PolarHBondContact O-OG 3.36Å; L46-F633 HydrophobicContact CD2-CD1 3.92Å; L46-F633 HydrophobicContact CD2-CD2 4Å; L46-F633 HydrophobicContact CD2-CE1 3.68Å; L46-F633 HydrophobicContact CD2-CE2 3.77Å; L46-F633 HydrophobicContact CD2-CG 4.08Å; L46-F633 HydrophobicContact CD2-CZ 3.6Å; L46-F1480 HydrophobicContact CD1-CE2 4.26Å; L46-F1480 HydrophobicContact CD2-CE2 3.79Å; L46-F1480 HydrophobicContact CD2-CZ 3.65Å; L46-F1480 HydrophobicContact CG-CE2 4Å; L46-F1480 HydrophobicContact CG-CZ 4.36Å; L46-T1482 HydrophobicContact CD1-CG2 4.42Å
47	G	50.1	Low	50.6	Low	3 Å²	3	54.3 Å²	54.3	3%	0.031	30%	0.295	C	S	.	.			trans	81.4	144.3	-176.6	0	0	0	0	0	112.8	D45 A49 S50	D45-G47 PolarHBondContact O-N 3.28Å; G47-A49 PolarHBondContact O-N 3.41Å; G47-S50 PolarHBondContact O-N 3.46Å; G47-S50 PolarHBondContact O-OG 3.43Å
48	S	45.7	Very low	50.2	Low	41 Å²	41	56.4 Å²	56.4	29%	0.287	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.6	-176.3	53.7	0	0	0	0	114.6	K52	S48-K52 WeakPolarHBondContact O-CB 3.09Å; S48-K52 WeakPolarHBondContact O-CG 3.45Å
49	A	44	Very low	50.1	Low	33 Å²	33	53.1 Å²	53.1	27%	0.273	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-35.7	-177.7	0	0	0	0	0	113.8	C30 G47 L53	C30-A49 HydrophobicContact CB-CB 4.06Å; G47-A49 PolarHBondContact O-N 3.41Å; A49-L53 WeakPolarHBondContact O-CD1 3.46Å
50	S	47.6	Very low	50	Low	17 Å²	17	49 Å²	49	12%	0.119	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-27.1	-178.7	65.5	0	0	0	0	112.9	Q26 L46 G47 N56	Q26-S50 PolarHBondContact NE2-O 3.06Å; L46-S50 PolarHBondContact O-OG 3.36Å; G47-S50 PolarHBondContact O-N 3.46Å; G47-S50 PolarHBondContact O-OG 3.43Å; S50-N56 PolarHBondContact O-ND2 3.34Å
51	K	46.9	Very low	50	Low	77 Å²	77	47.8 Å²	47.8	34%	0.335	27%	0.271	S	S	.	.	S	Bend	trans	-82.7	-17.9	178.8	-79.4	-177	171.4	174.4	0	115.4	D45 F1485	D45-K51 WeakPolarHBondContact OD1-CD 3.44Å; D45-K51 WeakPolarHBondContact OD1-CE 3.19Å; D45-K51 IonicContact OD1-NZ 2.64Å; D45-K51 PolarHBondContact OD1-NZ 3.3Å; D45-K51 IonicContact OD2-NZ 3.24Å; D45-K51 PolarHBondContact OD2-NZ 2.95Å; K51-F1485 VanDerWaalsContact NZ-CD1 3.33Å
52	K	48.9	Very low	49.9	Very low	84 Å²	84	50.5 Å²	50.5	37%	0.365	28%	0.28	S	S	.	.	S	Bend	trans	-107.9	2.6	-171.2	-77.3	-174.8	162.4	-164.6	0	114.9	S48 T285	S48-K52 WeakPolarHBondContact O-CB 3.09Å; S48-K52 WeakPolarHBondContact O-CG 3.45Å; K52-T285 HydrophobicContact CB-CG2 4.25Å; K52-T285 PolarHBondContact NZ-O 3.09Å
53	L	47.3	Very low	49.9	Very low	48 Å²	48	49.4 Å²	49.4	25%	0.251	27%	0.266	S	S	.	.			trans	-83.6	122.7	179.4	-87.8	150.7	0	0	0	110.1	Q26 C30 A49 L55 N56	Q26-L53 HydrophobicContact CG-CD1 3.73Å; C30-L53 WeakPolarHBondContact SG-CD1 3.33Å; A49-L53 WeakPolarHBondContact O-CD1 3.46Å; L53-L55 PolarHBondContact O-N 2.9Å; L53-N56 PolarHBondContact O-N 2.79Å
54	P	47.1	Very low	49.9	Very low	33 Å²	33	55.5 Å²	55.5	21%	0.214	29%	0.294	C	S	.	.	H	α-helix	trans	-61.2	-18.3	-169.8	22	-34.4	0	0	0	114.6	F58 C252 V256	P54-F58 VanDerWaalsContact O-CB 3.27Å; P54-F58 WeakPolarHBondContact O-CB 3.39Å; P54-F58 PolarHBondContact O-N 3.33Å; P54-C252 HydrophobicContact CB-CB 3.4Å; P54-C252 VanDerWaalsContact CB-CB 3.4Å; P54-C252 HydrophobicContact CG-CB 4.37Å; P54-V256 HydrophobicContact CG-CG2 4.17Å
55	L	49.5	Very low	49.8	Very low	63 Å²	63	54.1 Å²	54.1	33%	0.33	30%	0.3	S	S	.	.	H	α-helix	trans	-70.6	-34.7	174.8	-167.8	72.3	0	0	0	112.8	F22 L53 F58 I59	F22-L55 HydrophobicContact CE1-CD2 3.69Å; F22-L55 HydrophobicContact CE2-CD2 4.31Å; F22-L55 HydrophobicContact CZ-CD2 3.29Å; L53-L55 PolarHBondContact O-N 2.9Å; L55-F58 HydrophobicContact CD1-CD1 4.2Å; L55-I59 HydrophobicContact CG-CD1 4.12Å; L55-I59 WeakPolarHBondContact O-CB 3.41Å; L55-I59 WeakPolarHBondContact O-CD1 3.43Å; L55-I59 WeakPolarHBondContact O-CG1 3.25Å; L55-I59 PolarHBondContact O-N 3.06Å
56	N	52.4	Low	49.8	Very low	43 Å²	43	54.3 Å²	54.3	23%	0.23	31%	0.305	C	S	.	.	H	α-helix	trans	-72	-38.5	175.9	-78.4	-0.4	0	0	0	110.7	Q26 S50 L53 I59 A60	Q26-N56 PolarHBondContact NE2-ND2 3.27Å; Q26-N56 PolarHBondContact OE1-ND2 3.01Å; S50-N56 PolarHBondContact O-ND2 3.34Å; L53-N56 PolarHBondContact O-N 2.79Å; N56-I59 PolarHBondContact O-N 2.59Å; N56-A60 VanDerWaalsContact O-CB 3.27Å; N56-A60 WeakPolarHBondContact O-CB 3.34Å; N56-A60 PolarHBondContact O-N 3.2Å
57	D	50.7	Low	49.8	Very low	86 Å²	86	57.4 Å²	57.4	46%	0.46	32%	0.319	S	S	.	.	H	α-helix	trans	-68.1	-39	175	-60.3	-38.3	0	0	0	111.8	A60 G61	D57-A60 PolarHBondContact O-N 3.24Å; D57-G61 PolarHBondContact O-N 3.45Å
58	F	49.8	Very low	50	Low	94 Å²	94	61.8 Å²	61.8	41%	0.412	34%	0.341	S	S	.	.	H	α-helix	trans	-57.8	-47.3	170.3	169.2	-116.2	0	0	0	112	P54 L55 G61 F62 S249	P54-F58 VanDerWaalsContact O-CB 3.27Å; P54-F58 WeakPolarHBondContact O-CB 3.39Å; P54-F58 PolarHBondContact O-N 3.33Å; L55-F58 HydrophobicContact CD1-CD1 4.2Å; F58-G61 PolarHBondContact O-N 3.24Å; F58-F62 VanDerWaalsContact O-CB 3.3Å; F58-F62 WeakPolarHBondContact O-CB 3.36Å; F58-F62 PolarHBondContact O-N 2.87Å; F58-S249 VanDerWaalsContact CD2-CB 3.43Å; F58-S249 WeakPolarHBondContact CD2-OG 3.07Å
59	I	52	Low	50.2	Low	36 Å²	36	61.8 Å²	61.8	19%	0.185	35%	0.348	C	S	.	.	H	α-helix	trans	-72.6	-35.9	-177.7	-69.1	171.7	0	0	0	111.4	L55 N56 R63 L1592 M1595	L55-I59 HydrophobicContact CG-CD1 4.12Å; L55-I59 WeakPolarHBondContact O-CB 3.41Å; L55-I59 WeakPolarHBondContact O-CD1 3.43Å; L55-I59 WeakPolarHBondContact O-CG1 3.25Å; L55-I59 PolarHBondContact O-N 3.06Å; N56-I59 PolarHBondContact O-N 2.59Å; I59-R63 VanDerWaalsContact O-CB 3.22Å; I59-R63 WeakPolarHBondContact O-CB 3.35Å; I59-R63 PolarHBondContact O-N 3.05Å; I59-L1592 HydrophobicContact CG2-CD2 3.73Å; I59-M1595 HydrophobicContact CD1-CE 3.46Å; I59-M1595 VanDerWaalsContact CD1-CE 3.46Å
60	A	51.5	Low	50.6	Low	51 Å²	51	63.9 Å²	63.9	42%	0.421	36%	0.357	S	S	.	.	H	α-helix	trans	-63.9	-49.5	171.8	0	0	0	0	0	111.3	N56 D57 F62 R63 Q64	N56-A60 VanDerWaalsContact O-CB 3.27Å; N56-A60 WeakPolarHBondContact O-CB 3.34Å; N56-A60 PolarHBondContact O-N 3.2Å; D57-A60 PolarHBondContact O-N 3.24Å; A60-F62 PolarHBondContact O-N 2.65Å; A60-R63 PolarHBondContact O-N 3.3Å; A60-Q64 VanDerWaalsContact O-CB 3.3Å; A60-Q64 WeakPolarHBondContact O-CB 3.45Å; A60-Q64 PolarHBondContact O-N 2.75Å
61	G	50	Low	50.8	Low	40 Å²	40	64.2 Å²	64.2	41%	0.412	36%	0.358	S	S	.	.	H	α-helix	trans	-60.9	-43.4	177.5	0	0	0	0	0	112.9	D57 F58 Q64 G65	D57-G61 PolarHBondContact O-N 3.45Å; F58-G61 PolarHBondContact O-N 3.24Å; G61-Q64 PolarHBondContact O-N 2.91Å; G61-G65 PolarHBondContact O-N 3.2Å
62	F	51.3	Low	50.9	Low	97 Å²	97	62 Å²	62	43%	0.425	35%	0.351	S	S	.	.	H	α-helix	trans	-62.1	-44.4	174.6	-173.5	-93.2	0	0	0	112	F58 A60 Q64 A66 L1588 L1592	F58-F62 VanDerWaalsContact O-CB 3.3Å; F58-F62 WeakPolarHBondContact O-CB 3.36Å; F58-F62 PolarHBondContact O-N 2.87Å; A60-F62 PolarHBondContact O-N 2.65Å; F62-Q64 PolarHBondContact O-N 2.76Å; F62-A66 WeakPolarHBondContact O-CB 3.46Å; F62-A66 PolarHBondContact O-N 2.58Å; F62-L1588 HydrophobicContact CE1-CD2 4.07Å; F62-L1588 HydrophobicContact CZ-CD2 4.29Å; F62-L1592 HydrophobicContact CD1-CD1 4.48Å; F62-L1592 HydrophobicContact CE1-CD1 4.44Å
63	R	52.9	Low	51.1	Low	55 Å²	55	64.9 Å²	64.9	21%	0.208	37%	0.366	C	S	.	.	H	α-helix	trans	-63.9	-39.9	177.1	-171.4	176.7	-170.1	162.1	6.4	111.9	I59 A60 Q67 L1592	I59-R63 VanDerWaalsContact O-CB 3.22Å; I59-R63 WeakPolarHBondContact O-CB 3.35Å; I59-R63 PolarHBondContact O-N 3.05Å; A60-R63 PolarHBondContact O-N 3.3Å; R63-Q67 VanDerWaalsContact O-CD 3.32Å; R63-Q67 WeakPolarHBondContact O-CG 3.34Å; R63-Q67 PolarHBondContact O-N 2.82Å; R63-Q67 PolarHBondContact O-OE1 2.94Å; R63-L1592 PolarHBondContact NH1-O 3.46Å
64	Q	53.2	Low	51.4	Low	143 Å²	143	64.6 Å²	64.6	67%	0.668	37%	0.365	S	S	*	.	H	α-helix	trans	-72.2	-39.7	-179.7	-161.3	171.8	17.9	0	0	111.8	A60 G61 F62 Q67	A60-Q64 VanDerWaalsContact O-CB 3.3Å; A60-Q64 WeakPolarHBondContact O-CB 3.45Å; A60-Q64 PolarHBondContact O-N 2.75Å; G61-Q64 PolarHBondContact O-N 2.91Å; F62-Q64 PolarHBondContact O-N 2.76Å; Q64-Q67 PolarHBondContact O-N 3.5Å
65	G	51.6	Low	51.5	Low	37 Å²	37	63.4 Å²	63.4	38%	0.381	36%	0.358	S	S	.	.	H	α-helix	trans	-65.5	-38	173.9	0	0	0	0	0	113.5	G61 Q67	G61-G65 PolarHBondContact O-N 3.2Å; G65-Q67 VanDerWaalsContact C-N 3.29Å; G65-Q67 PolarHBondContact O-N 3.37Å
66	A	51.9	Low	51.5	Low	27 Å²	27	66 Å²	66	22%	0.223	37%	0.366	C	S	.	.	H	α-helix	trans	-74.3	-14.2	177.7	0	0	0	0	0	114.4	F62 L1548	F62-A66 WeakPolarHBondContact O-CB 3.46Å; F62-A66 PolarHBondContact O-N 2.58Å; A66-L1548 HydrophobicContact CB-CD1 3.88Å
67	Q	52.4	Low	51.5	Low	98 Å²	98	67 Å²	67	46%	0.458	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-15.1	-175.4	-84.6	170.8	-14.5	0	0	114.8	R63 Q64 G65 L1548	R63-Q67 VanDerWaalsContact O-CD 3.32Å; R63-Q67 WeakPolarHBondContact O-CG 3.34Å; R63-Q67 PolarHBondContact O-N 2.82Å; R63-Q67 PolarHBondContact O-OE1 2.94Å; Q64-Q67 PolarHBondContact O-N 3.5Å; G65-Q67 VanDerWaalsContact C-N 3.29Å; G65-Q67 PolarHBondContact O-N 3.37Å; Q67-L1548 HydrophobicContact CG-CD1 4.45Å
68	N	53	Low	51.5	Low	94 Å²	94	63.9 Å²	63.9	50%	0.503	36%	0.358	S	S	.	.			trans	-103.2	99.7	-166.9	-155.9	8.6	0	0	0	112.9	T70 V71	N68-T70 VanDerWaalsContact C-N 3.3Å; N68-T70 PolarHBondContact O-N 3.09Å; N68-V71 HydrophobicContact CB-CG2 4.03Å; N68-V71 WeakPolarHBondContact O-CB 3.4Å; N68-V71 WeakPolarHBondContact O-CG2 3.35Å; N68-V71 PolarHBondContact O-N 3.03Å
69	G	50.4	Low	51.6	Low	42 Å²	42	61.5 Å²	61.5	43%	0.433	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.5	-168.5	0	0	0	0	0	116.8	V71	G69-V71 VanDerWaalsContact C-N 3.31Å; G69-V71 PolarHBondContact O-N 3.06Å
70	T	53	Low	51.7	Low	77 Å²	77	65.9 Å²	65.9	47%	0.472	37%	0.369	S	S	.	.	H	α-helix	trans	-66.4	-33.3	176.6	47.8	0	0	0	0	112.6	N68 V72 Q73 D74	N68-T70 VanDerWaalsContact C-N 3.3Å; N68-T70 PolarHBondContact O-N 3.09Å; T70-V72 PolarHBondContact O-N 3.29Å; T70-Q73 PolarHBondContact O-N 2.86Å; T70-D74 PolarHBondContact O-N 2.95Å
71	V	50.8	Low	51.6	Low	23 Å²	23	69.7 Å²	69.7	14%	0.139	37%	0.373	C	S	.	.	H	α-helix	trans	-57.7	-35.5	-177.5	173.6	0	0	0	0	112.3	N68 G69 D74 A75 L242	N68-V71 HydrophobicContact CB-CG2 4.03Å; N68-V71 WeakPolarHBondContact O-CB 3.4Å; N68-V71 WeakPolarHBondContact O-CG2 3.35Å; N68-V71 PolarHBondContact O-N 3.03Å; G69-V71 VanDerWaalsContact C-N 3.31Å; G69-V71 PolarHBondContact O-N 3.06Å; V71-D74 PolarHBondContact O-N 2.92Å; V71-A75 VanDerWaalsContact O-CB 3.29Å; V71-A75 WeakPolarHBondContact O-CB 3.47Å; V71-A75 PolarHBondContact O-N 2.94Å; V71-L242 HydrophobicContact CG1-CD1 3.45Å; V71-L242 VanDerWaalsContact CG1-CD1 3.45Å; V71-L242 HydrophobicContact CG1-CD2 3.38Å; V71-L242 HydrophobicContact CG1-CG 4.04Å
72	V	50.2	Low	51.5	Low	30 Å²	30	69.6 Å²	69.6	18%	0.182	37%	0.369	C	S	.	.	H	α-helix	trans	-71.6	-30.7	-179.9	-173.7	0	0	0	0	111.5	T70 K76 I1554	T70-V72 PolarHBondContact O-N 3.29Å; V72-K76 WeakPolarHBondContact O-CB 3.45Å; V72-K76 PolarHBondContact O-N 2.85Å; V72-I1554 HydrophobicContact CG1-CG2 3.99Å
73	Q	52.3	Low	51.4	Low	145 Å²	145	66.2 Å²	66.2	68%	0.678	36%	0.362	S	S	*	.	H	α-helix	trans	-77.3	-37	173.4	-76.9	-177.1	-43.8	0	0	112.5	T70 K76 T77	T70-Q73 PolarHBondContact O-N 2.86Å; Q73-K76 PolarHBondContact O-N 3.01Å; Q73-T77 PolarHBondContact O-N 3.16Å; Q73-T77 VanDerWaalsContact O-N 3.11Å; Q73-T77 PolarHBondContact O-OG1 3.13Å; Q73-T77 VanDerWaalsContact O-OG1 3.05Å
74	D	53.8	Low	51.4	Low	42 Å²	42	67.1 Å²	67.1	23%	0.225	37%	0.37	C	S	.	.	H	α-helix	trans	-69	-38.5	174.6	-75.5	-44.4	0	0	0	111.9	T70 V71 K76 T77 V78 K235	T70-D74 PolarHBondContact O-N 2.95Å; V71-D74 PolarHBondContact O-N 2.92Å; D74-K76 VanDerWaalsContact C-N 3.3Å; D74-K76 PolarHBondContact O-N 3.11Å; D74-T77 WeakPolarHBondContact CA-OG1 3.36Å; D74-T77 PolarHBondContact O-N 3.06Å; D74-T77 PolarHBondContact O-OG1 3.01Å; D74-T77 VanDerWaalsContact O-OG1 3.1Å; D74-V78 WeakPolarHBondContact O-CG2 3.36Å; D74-V78 PolarHBondContact O-N 2.83Å; D74-K235 WeakPolarHBondContact OD1-CE 3.41Å; D74-K235 IonicContact OD1-NZ 2.69Å; D74-K235 PolarHBondContact OD1-NZ 3.04Å
75	A	49.2	Very low	51.1	Low	8 Å²	8	64.1 Å²	64.1	7%	0.066	36%	0.357	C	S	.	.	H	α-helix	trans	-57.5	-43.2	171.2	0	0	0	0	0	112.2	V71 L79 L239	V71-A75 VanDerWaalsContact O-CB 3.29Å; V71-A75 WeakPolarHBondContact O-CB 3.47Å; V71-A75 PolarHBondContact O-N 2.94Å; A75-L79 WeakPolarHBondContact O-CB 3.34Å; A75-L79 VanDerWaalsContact O-CG 3.29Å; A75-L79 WeakPolarHBondContact O-CG 3.24Å; A75-L79 PolarHBondContact O-N 3.15Å; A75-L239 HydrophobicContact CB-CD1 4.35Å
76	K	49.6	Very low	50.8	Low	117 Å²	117	64.4 Å²	64.4	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-68.3	-32.9	179.8	-170.8	165.2	-177.9	163.2	0	113.5	V72 Q73 D74 E1558	V72-K76 WeakPolarHBondContact O-CB 3.45Å; V72-K76 PolarHBondContact O-N 2.85Å; Q73-K76 PolarHBondContact O-N 3.01Å; D74-K76 VanDerWaalsContact C-N 3.3Å; D74-K76 PolarHBondContact O-N 3.11Å; K76-E1558 WeakPolarHBondContact CE-OE1 3.35Å; K76-E1558 IonicContact NZ-OE1 3.43Å; K76-E1558 PolarHBondContact NZ-OE1 3.4Å
77	T	52.2	Low	50.6	Low	65 Å²	65	67.8 Å²	67.8	40%	0.399	36%	0.364	S	S	.	.	H	α-helix	trans	-78.6	-38.1	176.6	38	0	0	0	0	112.6	Q73 D74 H80 Y81	Q73-T77 PolarHBondContact O-N 3.16Å; Q73-T77 VanDerWaalsContact O-N 3.11Å; Q73-T77 PolarHBondContact O-OG1 3.13Å; Q73-T77 VanDerWaalsContact O-OG1 3.05Å; D74-T77 WeakPolarHBondContact CA-OG1 3.36Å; D74-T77 PolarHBondContact O-N 3.06Å; D74-T77 PolarHBondContact O-OG1 3.01Å; D74-T77 VanDerWaalsContact O-OG1 3.1Å; T77-H80 WeakPolarHBondContact O-CB 3.5Å; T77-H80 PolarHBondContact O-N 3.48Å; T77-Y81 VanDerWaalsContact O-CD2 3.29Å; T77-Y81 WeakPolarHBondContact O-CD2 3.22Å; T77-Y81 PolarHBondContact O-N 2.62Å
78	V	51.4	Low	50.4	Low	21 Å²	21	67.7 Å²	67.7	13%	0.127	37%	0.366	C	S	.	.	H	α-helix	trans	-72	-36.2	176.8	177.2	0	0	0	0	112.2	D74 H80 Y81 A82 K235 L236 L239	D74-V78 WeakPolarHBondContact O-CG2 3.36Å; D74-V78 PolarHBondContact O-N 2.83Å; V78-H80 PolarHBondContact O-N 2.83Å; V78-Y81 PolarHBondContact O-N 3.48Å; V78-A82 WeakPolarHBondContact O-CB 3.3Å; V78-A82 PolarHBondContact O-N 2.82Å; V78-K235 HydrophobicContact CG2-CB 4.05Å; V78-L236 HydrophobicContact CG1-CD2 4.16Å; V78-L239 HydrophobicContact CB-CD1 3.48Å; V78-L239 VanDerWaalsContact CB-CD1 3.48Å; V78-L239 HydrophobicContact CG1-CD1 3.74Å; V78-L239 HydrophobicContact CG2-CD1 3.93Å
79	L	50.8	Low	49.9	Very low	44 Å²	44	65.6 Å²	65.6	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-60.9	-27.1	171.2	-73.8	169.7	0	0	0	112.5	A75 G83 F1562	A75-L79 WeakPolarHBondContact O-CB 3.34Å; A75-L79 VanDerWaalsContact O-CG 3.29Å; A75-L79 WeakPolarHBondContact O-CG 3.24Å; A75-L79 PolarHBondContact O-N 3.15Å; L79-G83 PolarHBondContact O-N 2.83Å; L79-F1562 HydrophobicContact CB-CD2 4.16Å; L79-F1562 HydrophobicContact CB-CE2 4.34Å; L79-F1562 HydrophobicContact CD2-CD1 4.23Å; L79-F1562 HydrophobicContact CD2-CD2 3.79Å; L79-F1562 HydrophobicContact CD2-CE1 4.24Å; L79-F1562 HydrophobicContact CD2-CE2 3.79Å; L79-F1562 HydrophobicContact CD2-CG 4.02Å; L79-F1562 HydrophobicContact CD2-CZ 4.02Å; L79-F1562 HydrophobicContact CG-CD2 4.4Å
80	H	53.4	Low	49.5	Very low	127 Å²	127	67.1 Å²	67.1	59%	0.588	35%	0.354	S	S	*	.	H	α-helix	trans	-72.9	-46.3	173.3	-172.3	52.3	0	0	0	112	T77 V78 G83 I84	T77-H80 WeakPolarHBondContact O-CB 3.5Å; T77-H80 PolarHBondContact O-N 3.48Å; V78-H80 PolarHBondContact O-N 2.83Å; H80-G83 PolarHBondContact O-N 2.95Å; H80-I84 PolarHBondContact O-N 2.89Å
81	Y	50.3	Low	49.1	Very low	131 Å²	131	69.6 Å²	69.6	51%	0.514	37%	0.365	S	S	.	.	H	α-helix	trans	-67.5	-33	175.4	-76.6	-71.3	0	0	0	113.5	T77 V78 G83 I84 I85	T77-Y81 VanDerWaalsContact O-CD2 3.29Å; T77-Y81 WeakPolarHBondContact O-CD2 3.22Å; T77-Y81 PolarHBondContact O-N 2.62Å; V78-Y81 PolarHBondContact O-N 3.48Å; Y81-G83 VanDerWaalsContact C-N 3.28Å; Y81-G83 PolarHBondContact O-N 3.36Å; Y81-I84 HydrophobicContact CD1-CD1 4.18Å; Y81-I84 PolarHBondContact O-N 3.3Å; Y81-I85 WeakPolarHBondContact O-CG1 3.46Å; Y81-I85 PolarHBondContact O-N 3.07Å
82	A	47.6	Very low	48.5	Very low	39 Å²	39	76.2 Å²	76.2	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-34.5	173.6	0	0	0	0	0	112.2	V78 N86	V78-A82 WeakPolarHBondContact O-CB 3.3Å; V78-A82 PolarHBondContact O-N 2.82Å; A82-N86 VanDerWaalsContact O-CB 3.29Å; A82-N86 WeakPolarHBondContact O-CB 3.27Å; A82-N86 PolarHBondContact O-N 2.91Å
83	G	50.1	Low	47.9	Very low	26 Å²	26	79.1 Å²	79.1	27%	0.268	41%	0.414	S	S	.	.	H	α-helix	trans	-61.7	-46.6	170.6	0	0	0	0	0	112.5	L79 H80 Y81 I85 N86 D87	L79-G83 PolarHBondContact O-N 2.83Å; H80-G83 PolarHBondContact O-N 2.95Å; Y81-G83 VanDerWaalsContact C-N 3.28Å; Y81-G83 PolarHBondContact O-N 3.36Å; G83-I85 PolarHBondContact O-N 3.45Å; G83-N86 WeakPolarHBondContact O-CB 3.42Å; G83-N86 PolarHBondContact O-N 2.88Å; G83-D87 PolarHBondContact O-N 2.79Å
84	I	51.7	Low	46.9	Very low	74 Å²	74	77.1 Å²	77.1	38%	0.379	41%	0.412	S	S	.	.	H	α-helix	trans	-63.4	-42.1	179.7	-61.4	169	0	0	0	111.6	H80 Y81 N86 D87 I88	H80-I84 PolarHBondContact O-N 2.89Å; Y81-I84 HydrophobicContact CD1-CD1 4.18Å; Y81-I84 PolarHBondContact O-N 3.3Å; I84-N86 VanDerWaalsContact C-N 3.33Å; I84-D87 PolarHBondContact O-N 3.38Å; I84-I88 HydrophobicContact CG2-CD1 4.17Å; I84-I88 WeakPolarHBondContact O-CG1 3.45Å; I84-I88 PolarHBondContact O-N 3.37Å; I84-I88 VanDerWaalsContact O-N 3.11Å
85	I	46.8	Very low	45.8	Very low	80 Å²	80	81.5 Å²	81.5	41%	0.41	44%	0.44	S	S	.	.	H	α-helix	trans	-64.9	-39.9	176.2	-67.2	169	0	0	0	110.8	Y81 G83 D87 I88 V89	Y81-I85 WeakPolarHBondContact O-CG1 3.46Å; Y81-I85 PolarHBondContact O-N 3.07Å; G83-I85 PolarHBondContact O-N 3.45Å; I85-D87 VanDerWaalsContact C-N 3.35Å; I85-D87 PolarHBondContact O-N 3.46Å; I85-I88 PolarHBondContact O-N 3.3Å; I85-V89 WeakPolarHBondContact O-CG2 3.41Å; I85-V89 PolarHBondContact O-N 3.19Å
86	N	47	Very low	44.9	Very low	43 Å²	43	89.3 Å²	89.3	23%	0.23	48%	0.481	C	S	.	.	H	α-helix	trans	-63.9	-37.8	176.7	-176.6	73	0	0	0	112.1	A82 G83 I84 V89 L90	A82-N86 VanDerWaalsContact O-CB 3.29Å; A82-N86 WeakPolarHBondContact O-CB 3.27Å; A82-N86 PolarHBondContact O-N 2.91Å; G83-N86 WeakPolarHBondContact O-CB 3.42Å; G83-N86 PolarHBondContact O-N 2.88Å; I84-N86 VanDerWaalsContact C-N 3.33Å; N86-V89 PolarHBondContact O-N 2.8Å; N86-L90 WeakPolarHBondContact ND2-CD1 3.46Å; N86-L90 WeakPolarHBondContact O-CB 3.39Å; N86-L90 WeakPolarHBondContact O-CG 3.19Å; N86-L90 PolarHBondContact O-N 3.5Å
87	D	46.5	Very low	43.9	Very low	97 Å²	97	88.4 Å²	88.4	52%	0.519	50%	0.495	S	S	.	.	H	α-helix	trans	-68.7	-36.3	175.4	-68.3	-20.3	0	0	0	112.6	G83 I84 I85 L90 N91	G83-D87 PolarHBondContact O-N 2.79Å; I84-D87 PolarHBondContact O-N 3.38Å; I85-D87 VanDerWaalsContact C-N 3.35Å; I85-D87 PolarHBondContact O-N 3.46Å; D87-L90 PolarHBondContact O-N 2.89Å; D87-N91 PolarHBondContact O-N 3.47Å
88	I	47.9	Very low	43	Very low	97 Å²	97	90.6 Å²	90.6	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-40.2	174.7	-67.5	166.9	0	0	0	111.3	I84 I85	I84-I88 HydrophobicContact CG2-CD1 4.17Å; I84-I88 WeakPolarHBondContact O-CG1 3.45Å; I84-I88 PolarHBondContact O-N 3.37Å; I84-I88 VanDerWaalsContact O-N 3.11Å; I85-I88 PolarHBondContact O-N 3.3Å
89	V	43.5	Very low	41.9	Very low	50 Å²	50	100 Å²	100	30%	0.303	55%	0.545	S	S	.	.	H	α-helix	trans	-73	-33.8	177.1	174.1	0	0	0	0	111.9	I85 N86 M92 T93	I85-V89 WeakPolarHBondContact O-CG2 3.41Å; I85-V89 PolarHBondContact O-N 3.19Å; N86-V89 PolarHBondContact O-N 2.8Å; V89-M92 PolarHBondContact O-N 2.97Å; V89-T93 PolarHBondContact O-N 2.71Å; V89-T93 PolarHBondContact O-OG1 2.91Å
90	L	42.4	Very low	40.7	Very low	73 Å²	73	104.1 Å²	104.1	38%	0.382	57%	0.573	S	S	.	*	H	α-helix	trans	-63.8	-42	172.8	-86.8	160.8	0	0	0	111.9	N86 D87 M92 T93	N86-L90 WeakPolarHBondContact ND2-CD1 3.46Å; N86-L90 WeakPolarHBondContact O-CB 3.39Å; N86-L90 WeakPolarHBondContact O-CG 3.19Å; N86-L90 PolarHBondContact O-N 3.5Å; D87-L90 PolarHBondContact O-N 2.89Å; L90-M92 PolarHBondContact O-N 2.76Å; L90-M92 VanDerWaalsContact O-N 3.16Å; L90-T93 WeakPolarHBondContact CA-OG1 3.43Å; L90-T93 PolarHBondContact O-N 3.39Å; L90-T93 PolarHBondContact O-OG1 3.18Å; L90-T93 VanDerWaalsContact O-OG1 3.14Å
91	N	43.7	Very low	39.6	Very low	130 Å²	130	104.3 Å²	104.3	70%	0.695	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-15.9	176.4	-78.6	-19.6	0	0	0	114.4	D87	D87-N91 PolarHBondContact O-N 3.47Å
92	M	37.5	Very low	38.5	Very low	162 Å²	162	105.8 Å²	105.8	80%	0.798	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-8.3	172.4	-66	-165.8	-171.5	0	0	114	V89 L90	V89-M92 PolarHBondContact O-N 2.97Å; L90-M92 PolarHBondContact O-N 2.76Å; L90-M92 VanDerWaalsContact O-N 3.16Å
93	T	37.9	Very low	37.6	Very low	91 Å²	91	107.1 Å²	107.1	56%	0.558	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	2.9	-171.6	47.6	0	0	0	0	114.1	V89 L90 T95	V89-T93 PolarHBondContact O-N 2.71Å; V89-T93 PolarHBondContact O-OG1 2.91Å; L90-T93 WeakPolarHBondContact CA-OG1 3.43Å; L90-T93 PolarHBondContact O-N 3.39Å; L90-T93 PolarHBondContact O-OG1 3.18Å; L90-T93 VanDerWaalsContact O-OG1 3.14Å; T93-T95 PolarHBondContact O-N 2.84Å; T93-T95 VanDerWaalsContact O-N 3.09Å
94	T	31.6	Very low	36.6	Very low	103 Å²	103	112.1 Å²	112.1	63%	0.632	64%	0.637	S	S	*	*			trans	-83.8	66.6	179.7	50.4	0	0	0	0	114.5
95	T	30.9	Very low	35.3	Very low	134 Å²	134	115.3 Å²	115.3	82%	0.822	66%	0.66	S	S	*	*			trans	-140.3	121.4	154.8	48.7	0	0	0	0	110.7	T93	T93-T95 PolarHBondContact O-N 2.84Å; T93-T95 VanDerWaalsContact O-N 3.09Å
96	N	30.7	Very low	34.4	Very low	172 Å²	172	120 Å²	120	92%	0.92	68%	0.68	S	S	*	*			trans	-76	120.7	-170.9	-64.1	-42.5	0	0	0	114.1
97	A	27.9	Very low	33.5	Very low	98 Å²	98	126.8 Å²	126.8	81%	0.81	71%	0.708	S	S	*	*			trans	-173.2	157.4	146.7	0	0	0	0	0	111.2
98	P	33.9	Very low	32.6	Very low	111 Å²	111	129.9 Å²	129.9	72%	0.721	72%	0.718	S	S	*	*			trans	-107.3	150.7	-164.7	39.8	-34.1	0	0	0	116.9
99	Y	27.6	Very low	31.7	Very low	217 Å²	217	133.7 Å²	133.7	85%	0.851	73%	0.733	S	S	*	*	S	Bend	trans	66.1	139.4	164.7	-71.2	-74.5	0	0	0	121
100	T	25.8	Very low	30.9	Very low	131 Å²	131	136 Å²	136	80%	0.804	75%	0.747	S	S	*	*			trans	74.6	124.8	174	71.6	0	0	0	0	118.2
101	P	31	Very low	30.2	Very low	131 Å²	131	136.8 Å²	136.8	85%	0.851	76%	0.758	S	S	*	*			trans	-119.4	106.5	157.4	33.7	-20	0	0	0	111.1
102	I	26.6	Very low	29.6	Very low	162 Å²	162	135.7 Å²	135.7	83%	0.831	76%	0.761	S	S	*	*			trans	-89.5	129.8	157.7	-69.1	174.7	0	0	0	107.4
103	G	27.8	Very low	29	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	76%	0.756	S	S	*	*			trans	33.7	110.2	159.6	0	0	0	0	0	119.9
104	I	29.1	Very low	28.4	Very low	131 Å²	131	136.7 Å²	136.7	67%	0.672	77%	0.765	S	S	*	*			trans	-111.6	86.4	156.6	-59.5	-179.1	0	0	0	109.2	F107	I104-F107 HydrophobicContact CD1-CD2 4.47Å; I104-F107 HydrophobicContact CG2-CB 4.1Å; I104-F107 HydrophobicContact CG2-CD2 3.77Å; I104-F107 HydrophobicContact CG2-CG 4.43Å
105	T	26.1	Very low	28	Very low	140 Å²	140	138.9 Å²	138.9	86%	0.859	77%	0.768	S	S	*	*			trans	-102.5	58.6	150.9	48.6	0	0	0	0	108.7
106	E	26.5	Very low	27.7	Very low	178 Å²	178	139.7 Å²	139.7	83%	0.832	76%	0.762	S	S	*	*			trans	-170.5	83.6	169.6	-114.5	168.6	-145.4	0	0	110.1
107	F	27.9	Very low	27.5	Very low	186 Å²	186	139.4 Å²	139.4	82%	0.816	75%	0.753	S	S	*	*			trans	-153.2	58.3	164.8	-109.9	-75.6	0	0	0	110.4	I104	I104-F107 HydrophobicContact CD1-CD2 4.47Å; I104-F107 HydrophobicContact CG2-CB 4.1Å; I104-F107 HydrophobicContact CG2-CD2 3.77Å; I104-F107 HydrophobicContact CG2-CG 4.43Å
108	F	27.4	Very low	27.2	Very low	163 Å²	163	141.9 Å²	141.9	72%	0.715	75%	0.748	S	S	*	*			trans	-145.9	74.1	171.1	-111.7	-69.8	0	0	0	111.4
109	H	29.9	Very low	26.8	Very low	176 Å²	176	142.3 Å²	142.3	82%	0.815	75%	0.748	S	S	*	*			trans	-166	114.1	138.4	-114.6	-84.2	0	0	0	106.7
110	V	27.2	Very low	26.7	Very low	100 Å²	100	141.2 Å²	141.2	61%	0.606	75%	0.751	S	S	*	*				64.5	115.3	50	-174.9	0	0	0	0	110
111	S	27.1	Very low	26.5	Very low	88 Å²	88	138.4 Å²	138.4	62%	0.615	74%	0.741	S	S	*	*			cis	-169.7	-179.3	-1	52.3	0	0	0	0	109.9
112	S	30.5	Very low	26	Very low	108 Å²	108	141 Å²	141	76%	0.755	74%	0.741	S	S	*	*			trans	67.1	148.1	153.2	54.2	0	0	0	0	114.7
113	R	25.6	Very low	25.9	Very low	185 Å²	185	138.7 Å²	138.7	70%	0.698	74%	0.74	S	S	*	*			cis	-157.4	-179.3	42.5	-152.3	-169.2	-165.4	-177.6	0.1	107.7	E115 E116	R113-E115 WeakPolarHBondContact CB-O 3.5Å; R113-E115 WeakPolarHBondContact CD-O 3.47Å; R113-E115 PolarHBondContact NH1-O 2.8Å; R113-E115 PolarHBondContact O-N 3.45Å; R113-E115 VanDerWaalsContact O-N 3.09Å; R113-E116 PolarHBondContact NH1-O 3.14Å
114	A	25.8	Very low	25.8	Very low	89 Å²	89	141.3 Å²	141.3	74%	0.736	74%	0.742	S	S	*	*	S	Bend	trans	-61.2	98.1	131.4	0	0	0	0	0	106.6
115	E	22.4	Very low	25.5	Very low	149 Å²	149	144.1 Å²	144.1	70%	0.696	75%	0.752	S	S	*	*	S	Bend	trans	81.5	125.4	170.2	-55.3	161.5	169.5	0	0	119.9	R113	R113-E115 WeakPolarHBondContact CB-O 3.5Å; R113-E115 WeakPolarHBondContact CD-O 3.47Å; R113-E115 PolarHBondContact NH1-O 2.8Å; R113-E115 PolarHBondContact O-N 3.45Å; R113-E115 VanDerWaalsContact O-N 3.09Å
116	E	25.2	Very low	25.4	Very low	150 Å²	150	141 Å²	141	70%	0.701	75%	0.748	S	S	*	*			trans	39.2	115.1	143.4	-56.5	-178	150.4	0	0	120.6	R113	R113-E116 PolarHBondContact NH1-O 3.14Å
117	F	25.2	Very low	25.3	Very low	166 Å²	166	138.3 Å²	138.3	73%	0.728	75%	0.748	S	S	*	*				-176	112.7	101.4	-111.2	-96.2	0	0	0	106.6
118	Q	23.5	Very low	25.2	Very low	151 Å²	151	135.4 Å²	135.4	71%	0.706	75%	0.745	S	S	*	*				55.9	108.3	83.9	-79.1	-162.5	-31.1	0	0	112.9
119	V	23.8	Very low	25.4	Very low	119 Å²	119	135.2 Å²	135.2	72%	0.721	75%	0.751	S	S	*	*				87.8	121.5	60.3	164.4	0	0	0	0	110.9	A121	V119-A121 HydrophobicContact CG1-CB 4.35Å
120	E	25.4	Very low	25.6	Very low	195 Å²	195	130.2 Å²	130.2	91%	0.911	73%	0.733	S	S	*	*				-171	154.6	126.1	-106	178	-160.9	0	0	110.2
121	A	21.9	Very low	25.9	Very low	72 Å²	72	133.3 Å²	133.3	60%	0.595	73%	0.733	S	S	*	*				-158.1	152.1	-71.5	0	0	0	0	0	109	V119	V119-A121 HydrophobicContact CG1-CB 4.35Å
122	E	22.2	Very low	26.2	Very low	184 Å²	184	137.7 Å²	137.7	86%	0.86	74%	0.737	S	S	*	*			trans	41.8	141.6	145.4	-60.6	-175.6	145.7	0	0	123.7
123	S	23.4	Very low	26.7	Very low	114 Å²	114	139.9 Å²	139.9	80%	0.797	73%	0.733	S	S	*	*			trans	100.1	157.6	145.3	84.5	0	0	0	0	120
124	V	26.1	Very low	27.2	Very low	124 Å²	124	140.5 Å²	140.5	75%	0.752	74%	0.735	S	S	*	*			trans	68.9	82.1	-177.7	-165.4	0	0	0	0	114.2
125	Q	22.6	Very low	28.2	Very low	190 Å²	190	140 Å²	140	89%	0.888	72%	0.719	S	S	*	*				48.2	111	88.1	-67	-170.7	-16.6	0	0	115.4
126	G	23.5	Very low	28.9	Very low	75 Å²	75	136.9 Å²	136.9	77%	0.773	71%	0.708	S	S	*	*			trans	97.3	87.5	151.1	0	0	0	0	0	117.4
127	C	24.1	Very low	29.8	Very low	121 Å²	121	132.3 Å²	132.3	82%	0.818	70%	0.695	S	S	*	*			trans	-144.2	74	137.7	-138.7	0	0	0	0	111.3	L129	C127-L129 PolarHBondContact O-N 3.3Å
128	T	26.8	Very low	30.5	Very low	124 Å²	124	127.8 Å²	127.8	76%	0.761	68%	0.678	S	S	*	*			trans	-69	86	172.1	47.9	0	0	0	0	110.9	T130	T128-T130 PolarHBondContact O-N 3.02Å
129	L	30.6	Very low	31.2	Very low	160 Å²	160	128.6 Å²	128.6	84%	0.838	68%	0.675	S	S	*	*			trans	-89.7	92.8	168.6	-105.1	157.7	0	0	0	110	C127	C127-L129 PolarHBondContact O-N 3.3Å
130	T	34	Very low	31.9	Very low	70 Å²	70	131 Å²	131	43%	0.429	68%	0.675	S	S	.	*			trans	-73.8	152.6	-154.8	57.1	0	0	0	0	116.2	T128 R132 F133	T128-T130 PolarHBondContact O-N 3.02Å; T130-R132 PolarHBondContact O-N 3.16Å; T130-R132 WeakPolarHBondContact OG1-CB 3.39Å; T130-F133 PolarHBondContact O-N 3.4Å; T130-F133 VanDerWaalsContact O-N 3.09Å
131	R	34.8	Very low	32.4	Very low	165 Å²	165	130.4 Å²	130.4	62%	0.623	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.3	-12.8	158.2	-162.7	176.4	-175.7	-176.1	2.2	114.6	I135 L179	R131-I135 HydrophobicContact CG-CD1 4.15Å; R131-I135 WeakPolarHBondContact O-CD1 3.34Å; R131-I135 VanDerWaalsContact O-CG1 3.3Å; R131-I135 WeakPolarHBondContact O-CG1 3.3Å; R131-L179 PolarHBondContact NE-O 3.06Å; R131-L179 PolarHBondContact NH2-O 3.47Å
132	R	33.8	Very low	33.1	Very low	181 Å²	181	133 Å²	133	68%	0.683	67%	0.672	S	S	*	*	H	α-helix	trans	-73.4	-33.8	174	-74	-178.8	167.5	159.5	-4.4	114	T130 W134 I135 D136	T130-R132 PolarHBondContact O-N 3.16Å; T130-R132 WeakPolarHBondContact OG1-CB 3.39Å; R132-W134 VanDerWaalsContact C-N 3.32Å; R132-W134 PolarHBondContact O-N 2.88Å; R132-I135 PolarHBondContact O-N 3.38Å; R132-I135 VanDerWaalsContact O-N 3.11Å; R132-D136 WeakPolarHBondContact O-CB 3.48Å; R132-D136 PolarHBondContact O-N 2.94Å
133	F	40.9	Very low	33.7	Very low	154 Å²	154	131.9 Å²	131.9	68%	0.675	67%	0.667	S	S	*	*	H	α-helix	trans	-62.1	-41.3	-175.8	-170.8	-96.3	0	0	0	112.2	T130 A137	T130-F133 PolarHBondContact O-N 3.4Å; T130-F133 VanDerWaalsContact O-N 3.09Å; F133-A137 VanDerWaalsContact O-CB 3.23Å; F133-A137 WeakPolarHBondContact O-CB 3.25Å; F133-A137 PolarHBondContact O-N 3.45Å; F133-A137 VanDerWaalsContact O-N 3.07Å
134	W	36.1	Very low	34.2	Very low	198 Å²	198	133.5 Å²	133.5	75%	0.75	67%	0.666	S	S	*	*	H	α-helix	trans	-70.2	-36.6	173.8	-80.4	93.1	0	0	0	113.1	R132 L138	R132-W134 VanDerWaalsContact C-N 3.32Å; R132-W134 PolarHBondContact O-N 2.88Å; W134-L138 WeakPolarHBondContact O-CB 3.43Å; W134-L138 WeakPolarHBondContact O-CD1 3.44Å; W134-L138 VanDerWaalsContact O-CG 3.23Å; W134-L138 WeakPolarHBondContact O-CG 3.25Å; W134-L138 PolarHBondContact O-N 3.2Å; W134-L138 VanDerWaalsContact O-N 3.1Å
135	I	45.8	Very low	34.5	Very low	77 Å²	77	132.1 Å²	132.1	40%	0.395	67%	0.668	S	S	.	*	H	α-helix	trans	-72	-37.2	179.5	-69	173.9	0	0	0	111.9	R131 R132 R139	R131-I135 HydrophobicContact CG-CD1 4.15Å; R131-I135 WeakPolarHBondContact O-CD1 3.34Å; R131-I135 VanDerWaalsContact O-CG1 3.3Å; R131-I135 WeakPolarHBondContact O-CG1 3.3Å; R132-I135 PolarHBondContact O-N 3.38Å; R132-I135 VanDerWaalsContact O-N 3.11Å; I135-R139 WeakPolarHBondContact O-CB 3.42Å; I135-R139 PolarHBondContact O-N 3.29Å
136	D	38.5	Very low	34.9	Very low	85 Å²	85	131.5 Å²	131.5	46%	0.455	67%	0.665	S	S	.	*	H	α-helix	trans	-77.2	-33.5	176.6	-75.1	-28.9	0	0	0	112.6	R132 L138 R139 K140	R132-D136 WeakPolarHBondContact O-CB 3.48Å; R132-D136 PolarHBondContact O-N 2.94Å; D136-L138 VanDerWaalsContact C-N 3.3Å; D136-L138 PolarHBondContact O-N 3.41Å; D136-R139 PolarHBondContact O-N 3.37Å; D136-K140 WeakPolarHBondContact O-CB 3.43Å; D136-K140 PolarHBondContact O-N 3.45Å
137	A	42.5	Very low	35.1	Very low	54 Å²	54	134.6 Å²	134.6	45%	0.446	66%	0.662	S	S	.	*	H	α-helix	trans	-65.9	-33.1	171.6	0	0	0	0	0	112.5	F133	F133-A137 VanDerWaalsContact O-CB 3.23Å; F133-A137 WeakPolarHBondContact O-CB 3.25Å; F133-A137 PolarHBondContact O-N 3.45Å; F133-A137 VanDerWaalsContact O-N 3.07Å
138	L	39.4	Very low	35.3	Very low	71 Å²	71	138.2 Å²	138.2	37%	0.372	67%	0.667	S	S	.	*	H	α-helix	trans	-76.3	-42.6	173.6	-73.4	168	0	0	0	112.1	W134 D136 K140 K141 I142 F192	W134-L138 WeakPolarHBondContact O-CB 3.43Å; W134-L138 WeakPolarHBondContact O-CD1 3.44Å; W134-L138 VanDerWaalsContact O-CG 3.23Å; W134-L138 WeakPolarHBondContact O-CG 3.25Å; W134-L138 PolarHBondContact O-N 3.2Å; W134-L138 VanDerWaalsContact O-N 3.1Å; D136-L138 VanDerWaalsContact C-N 3.3Å; D136-L138 PolarHBondContact O-N 3.41Å; L138-K140 PolarHBondContact O-N 3.48Å; L138-K141 PolarHBondContact O-N 3.05Å; L138-I142 WeakPolarHBondContact O-CG1 3.49Å; L138-I142 PolarHBondContact O-N 3.21Å; L138-F192 HydrophobicContact CD2-CE2 4.48Å; L138-F192 HydrophobicContact CD2-CZ 3.75Å
139	R	38.9	Very low	35.4	Very low	168 Å²	168	139.5 Å²	139.5	63%	0.634	66%	0.664	S	S	*	*	H	α-helix	trans	-56.1	-49	173.7	-88.3	-177.4	166.3	-170.8	-7.4	112.4	I135 D136 K141 I142 E143	I135-R139 WeakPolarHBondContact O-CB 3.42Å; I135-R139 PolarHBondContact O-N 3.29Å; D136-R139 PolarHBondContact O-N 3.37Å; R139-K141 PolarHBondContact O-N 3.37Å; R139-I142 PolarHBondContact O-N 3.05Å; R139-I142 VanDerWaalsContact O-N 3.13Å; R139-E143 PolarHBondContact O-N 3.21Å
140	K	38.7	Very low	35.1	Very low	168 Å²	168	139.3 Å²	139.3	73%	0.73	66%	0.657	S	S	*	*	H	α-helix	trans	-63.6	-13.3	-176.7	-104.2	-178.4	174.6	177.6	0	116.1	D136 L138	D136-K140 WeakPolarHBondContact O-CB 3.43Å; D136-K140 PolarHBondContact O-N 3.45Å; L138-K140 PolarHBondContact O-N 3.48Å
141	K	35.2	Very low	34.7	Very low	183 Å²	183	144.1 Å²	144.1	80%	0.796	67%	0.674	S	S	*	*	H	α-helix	trans	-106	-15.7	175.7	-90.2	-170.4	171.3	-173.4	0	114.2	L138 R139	L138-K141 PolarHBondContact O-N 3.05Å; R139-K141 PolarHBondContact O-N 3.37Å
142	I	38.3	Very low	34.2	Very low	126 Å²	126	142 Å²	142	65%	0.646	67%	0.674	S	S	*	*	H	α-helix	trans	-85.7	-23.5	178.1	-68.4	169.5	0	0	0	111	L138 R139 L144	L138-I142 WeakPolarHBondContact O-CG1 3.49Å; L138-I142 PolarHBondContact O-N 3.21Å; R139-I142 PolarHBondContact O-N 3.05Å; R139-I142 VanDerWaalsContact O-N 3.13Å; I142-L144 PolarHBondContact O-N 2.89Å
143	E	33	Very low	33.8	Very low	161 Å²	161	144.3 Å²	144.3	75%	0.752	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	14	178.1	-68.9	179.6	148	0	0	115.5	R139	R139-E143 PolarHBondContact O-N 3.21Å
144	L	33.7	Very low	32.9	Very low	148 Å²	148	140.4 Å²	140.4	78%	0.775	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	11	-164.9	-107.2	173.2	0	0	0	118.7	I142	I142-L144 PolarHBondContact O-N 2.89Å
145	A	33.1	Very low	32.3	Very low	96 Å²	96	137.4 Å²	137.4	79%	0.793	69%	0.691	S	S	*	*			trans	-149.2	126.1	171.9	0	0	0	0	0	113.7
146	H	31	Very low	31.2	Very low	177 Å²	177	138.1 Å²	138.1	82%	0.819	70%	0.703	S	S	*	*			trans	-102.3	141.5	179.6	-89.4	-88.4	0	0	0	112.8
147	I	28.2	Very low	30.6	Very low	140 Å²	140	141.6 Å²	141.6	72%	0.718	72%	0.72	S	S	*	*			trans	27.4	123.6	132.2	-34.7	175.4	0	0	0	118.4
148	E	28.8	Very low	29.8	Very low	196 Å²	196	147.1 Å²	147.1	92%	0.916	74%	0.739	S	S	*	*				-177.1	167.7	111.3	-96.7	-171.4	-171.6	0	0	115.6
149	E	27.7	Very low	29.2	Very low	151 Å²	151	147.7 Å²	147.7	71%	0.706	75%	0.749	S	S	*	*			trans	-97.5	157.3	-157.9	-96.9	-164.3	129.7	0	0	116.2
150	K	25	Very low	28.6	Very low	157 Å²	157	145 Å²	145	68%	0.683	76%	0.756	S	S	*	*			trans	61.6	115.6	150.9	-66.6	167.5	172.7	91.4	0	119.3
151	Q	24.5	Very low	28.1	Very low	170 Å²	170	144.8 Å²	144.8	79%	0.794	76%	0.763	S	S	*	*				169.9	137.8	102.1	-91.9	-159	-14.7	0	0	116.1
152	I	24.4	Very low	27.5	Very low	122 Å²	122	141.8 Å²	141.8	63%	0.626	76%	0.755	S	S	*	*			trans	71.7	109.2	135.9	-62.8	176.8	0	0	0	121.9
153	Y	26	Very low	27.1	Very low	229 Å²	229	138.8 Å²	138.8	90%	0.898	75%	0.745	S	S	*	*			trans	29.1	126.5	135.2	-63.1	-90.4	0	0	0	122.7
154	G	23.1	Very low	27	Very low	71 Å²	71	141.2 Å²	141.2	73%	0.732	75%	0.753	S	S	*	*			trans	156.3	113.2	141.1	0	0	0	0	0	118.4
155	V	23	Very low	26.8	Very low	136 Å²	136	140.5 Å²	140.5	82%	0.824	75%	0.749	S	S	*	*			trans	74.5	96.5	149.2	-170.4	0	0	0	0	119.9
156	S	22.5	Very low	26.6	Very low	92 Å²	92	139.8 Å²	139.8	64%	0.643	74%	0.737	S	S	*	*			trans	82.4	152.4	133.2	81.1	0	0	0	0	122.7
157	L	25.3	Very low	26.9	Very low	157 Å²	157	135.5 Å²	135.5	82%	0.822	73%	0.733	S	S	*	*			trans	65.2	103.5	162.3	-62.9	157.5	0	0	0	115.4
158	M	27	Very low	27.1	Very low	170 Å²	170	131.9 Å²	131.9	84%	0.837	72%	0.717	S	S	*	*			cis	-153.7	170.6	37.3	-86.7	178.5	56.1	0	0	112.8
159	S	25.5	Very low	27.1	Very low	83 Å²	83	130 Å²	130	58%	0.58	71%	0.706	S	S	*	*			trans	-61.6	127.4	170.6	46.9	0	0	0	0	112.6	D161	S159-D161 PolarHBondContact O-N 2.91Å
160	S	26.2	Very low	27.5	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	71%	0.711	S	S	*	*	S	Bend	trans	-80.2	42.6	174.8	67.5	0	0	0	0	113.7	D162	S160-D162 PolarHBondContact O-N 3.43Å
161	D	28.2	Very low	28.4	Very low	165 Å²	165	128.5 Å²	128.5	88%	0.882	71%	0.709	S	S	*	*			trans	-79.4	52.5	158.5	-77	-36.9	0	0	0	108.5	S159	S159-D161 PolarHBondContact O-N 2.91Å
162	D	23.5	Very low	28.9	Very low	119 Å²	119	124.8 Å²	124.8	64%	0.636	69%	0.694	S	S	*	*			trans	-106.3	159.6	-156.9	-141.9	-23.1	0	0	0	112.3	S160	S160-D162 PolarHBondContact O-N 3.43Å
163	C	30.4	Very low	29.4	Very low	64 Å²	64	123.4 Å²	123.4	43%	0.432	69%	0.687	S	S	.	*			trans	56.8	97.6	162.7	-88.6	0	0	0	0	118.9	L165 C166	C163-L165 HydrophobicContact CB-CB 4.21Å; C163-L165 PolarHBondContact O-N 3.31Å; C163-C166 HydrophobicContact CB-CB 4.4Å; C163-C166 PolarHBondContact O-N 2.87Å
164	K	30.4	Very low	30.1	Very low	211 Å²	211	116.4 Å²	116.4	92%	0.917	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	-3.1	144.8	-77.4	-174.3	175.7	179.7	0	114.1
165	L	29.2	Very low	30.9	Very low	133 Å²	133	116.5 Å²	116.5	70%	0.696	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-12.8	170.3	-104.8	76.7	0	0	0	114.4	C163 A167 V168	C163-L165 HydrophobicContact CB-CB 4.21Å; C163-L165 PolarHBondContact O-N 3.31Å; L165-A167 VanDerWaalsContact C-N 3.27Å; L165-A167 PolarHBondContact O-N 3.06Å; L165-V168 WeakPolarHBondContact O-CB 3.35Å; L165-V168 WeakPolarHBondContact O-CG2 3.37Å; L165-V168 PolarHBondContact O-N 3.26Å
166	C	29.2	Very low	31.6	Very low	81 Å²	81	115 Å²	115	55%	0.547	64%	0.639	S	S	.	*	G	3₁₀ helix	trans	-72.3	-18	-179.2	-77.9	0	0	0	0	113.9	C163 V168 K169	C163-C166 HydrophobicContact CB-CB 4.4Å; C163-C166 PolarHBondContact O-N 2.87Å; C166-V168 PolarHBondContact O-N 2.89Å; C166-V168 VanDerWaalsContact O-N 3.17Å; C166-K169 WeakPolarHBondContact O-CB 3.45Å; C166-K169 PolarHBondContact O-N 3.5Å
167	A	36.2	Very low	32.5	Very low	88 Å²	88	113.7 Å²	113.7	73%	0.727	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-67.8	-7.2	172.9	0	0	0	0	0	114.1	L165 K169	L165-A167 VanDerWaalsContact C-N 3.27Å; L165-A167 PolarHBondContact O-N 3.06Å; A167-K169 VanDerWaalsContact C-N 3.32Å
168	V	33.7	Very low	33.5	Very low	63 Å²	63	115.8 Å²	115.8	38%	0.382	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-82.6	-11.6	180	-178.4	0	0	0	0	112.5	L165 C166 E170 T171 L172	L165-V168 WeakPolarHBondContact O-CB 3.35Å; L165-V168 WeakPolarHBondContact O-CG2 3.37Å; L165-V168 PolarHBondContact O-N 3.26Å; C166-V168 PolarHBondContact O-N 2.89Å; C166-V168 VanDerWaalsContact O-N 3.17Å; V168-E170 VanDerWaalsContact C-N 3.28Å; V168-E170 PolarHBondContact O-N 3.42Å; V168-T171 PolarHBondContact O-N 2.74Å; V168-L172 HydrophobicContact CG1-CB 4.03Å; V168-L172 HydrophobicContact CG1-CD1 3.53Å; V168-L172 HydrophobicContact CG1-CG 4.26Å; V168-L172 PolarHBondContact O-N 2.73Å
169	K	28.7	Very low	33.9	Very low	158 Å²	158	112.9 Å²	112.9	69%	0.687	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-23.3	-169.6	-149.2	174.2	-172.8	-179.3	0	114.4	C166 A167	C166-K169 WeakPolarHBondContact O-CB 3.45Å; C166-K169 PolarHBondContact O-N 3.5Å; A167-K169 VanDerWaalsContact C-N 3.32Å
170	E	36.5	Very low	34.8	Very low	173 Å²	173	111.7 Å²	111.7	81%	0.808	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-24.1	-177.7	-67.8	179	158.9	0	0	113.8	V168 P174	V168-E170 VanDerWaalsContact C-N 3.28Å; V168-E170 PolarHBondContact O-N 3.42Å; E170-P174 WeakPolarHBondContact O-CD 3.4Å
171	T	42.3	Very low	35.3	Very low	103 Å²	103	109.2 Å²	109.2	63%	0.632	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-28	-177.6	45.4	0	0	0	0	114.5	V168	V168-T171 PolarHBondContact O-N 2.74Å
172	L	34.7	Very low	35.9	Very low	92 Å²	92	109.3 Å²	109.3	48%	0.482	59%	0.586	S	S	.	*	S	Bend	trans	-97.9	-19	-178.1	-100.2	165.9	0	0	0	114.2	V168 V175 F176	V168-L172 HydrophobicContact CG1-CB 4.03Å; V168-L172 HydrophobicContact CG1-CD1 3.53Å; V168-L172 HydrophobicContact CG1-CG 4.26Å; V168-L172 PolarHBondContact O-N 2.73Å; L172-V175 HydrophobicContact CD2-CB 4.35Å; L172-V175 HydrophobicContact CD2-CG1 4.43Å; L172-V175 PolarHBondContact O-N 3.25Å; L172-F176 WeakPolarHBondContact O-CB 3.47Å; L172-F176 PolarHBondContact O-N 2.79Å
173	L	34.9	Very low	36.7	Very low	92 Å²	92	109.2 Å²	109.2	48%	0.482	60%	0.595	S	S	.	*	H	α-helix	trans	-64.2	-43.2	-180	-165.6	68.3	0	0	0	113.4	T177 L189	L173-T177 WeakPolarHBondContact O-CB 3.47Å; L173-T177 PolarHBondContact O-N 3.36Å; L173-T177 PolarHBondContact O-OG1 2.83Å; L173-L189 HydrophobicContact CD1-CD2 4.2Å
174	P	41.2	Very low	37.2	Very low	83 Å²	83	112.1 Å²	112.1	54%	0.539	61%	0.606	S	S	.	*	H	α-helix	trans	-65.6	-40.5	174.7	-19	32.8	0	0	0	111.9	E170 Y178	E170-P174 WeakPolarHBondContact O-CD 3.4Å; P174-Y178 WeakPolarHBondContact O-CB 3.4Å; P174-Y178 PolarHBondContact O-N 2.66Å
175	V	40.2	Very low	38	Very low	72 Å²	72	104.4 Å²	104.4	44%	0.436	58%	0.578	S	S	.	*	H	α-helix	trans	-67.5	-42.4	-176.9	178.9	0	0	0	0	111.4	L172 Y178 L179	L172-V175 HydrophobicContact CD2-CB 4.35Å; L172-V175 HydrophobicContact CD2-CG1 4.43Å; L172-V175 PolarHBondContact O-N 3.25Å; V175-Y178 PolarHBondContact O-N 3.49Å; V175-L179 HydrophobicContact CG1-CD1 3.86Å; V175-L179 WeakPolarHBondContact O-CB 3.47Å; V175-L179 VanDerWaalsContact O-CG 3.31Å; V175-L179 WeakPolarHBondContact O-CG 3.12Å; V175-L179 PolarHBondContact O-N 2.89Å
176	F	37.6	Very low	38.6	Very low	106 Å²	106	102.8 Å²	102.8	47%	0.465	58%	0.576	S	S	.	*	H	α-helix	trans	-70.4	-39.8	179	-152.8	-93.4	0	0	0	112.1	L172 L179 T180	L172-F176 WeakPolarHBondContact O-CB 3.47Å; L172-F176 PolarHBondContact O-N 2.79Å; F176-L179 PolarHBondContact O-N 2.92Å; F176-T180 HydrophobicContact CD1-CG2 4.16Å; F176-T180 HydrophobicContact CE1-CG2 3.98Å; F176-T180 HydrophobicContact CZ-CG2 4.35Å; F176-T180 WeakPolarHBondContact O-CB 3.42Å; F176-T180 PolarHBondContact O-N 3.5Å; F176-T180 PolarHBondContact O-OG1 3.31Å
177	T	41.4	Very low	39.2	Very low	64 Å²	64	106.9 Å²	106.9	39%	0.393	59%	0.587	S	S	.	*	H	α-helix	trans	-66.7	-38.2	175.5	-45.5	0	0	0	0	111.3	L173 G181	L173-T177 WeakPolarHBondContact O-CB 3.47Å; L173-T177 PolarHBondContact O-N 3.36Å; L173-T177 PolarHBondContact O-OG1 2.83Å; T177-G181 WeakPolarHBondContact O-CA 3.37Å; T177-G181 PolarHBondContact O-N 3Å
178	Y	47.1	Very low	39.6	Very low	201 Å²	201	108 Å²	108	79%	0.788	58%	0.577	S	S	*	*	H	α-helix	trans	-69.1	-37.6	175.8	-171.7	-100.6	0	0	0	113	P174 V175	P174-Y178 WeakPolarHBondContact O-CB 3.4Å; P174-Y178 PolarHBondContact O-N 2.66Å; V175-Y178 PolarHBondContact O-N 3.49Å
179	L	36	Very low	40.3	Very low	108 Å²	108	107.8 Å²	107.8	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-76.8	-32.9	178.6	-74.1	168.5	0	0	0	113.5	R131 V175 F176	R131-L179 PolarHBondContact NE-O 3.06Å; R131-L179 PolarHBondContact NH2-O 3.47Å; V175-L179 HydrophobicContact CG1-CD1 3.86Å; V175-L179 WeakPolarHBondContact O-CB 3.47Å; V175-L179 VanDerWaalsContact O-CG 3.31Å; V175-L179 WeakPolarHBondContact O-CG 3.12Å; V175-L179 PolarHBondContact O-N 2.89Å; F176-L179 PolarHBondContact O-N 2.92Å
180	T	43.3	Very low	41.2	Very low	59 Å²	59	106.6 Å²	106.6	36%	0.362	57%	0.568	S	S	.	*	H	α-helix	trans	-107.3	-27	-172.9	63.8	0	0	0	0	115.2	F176	F176-T180 HydrophobicContact CD1-CG2 4.16Å; F176-T180 HydrophobicContact CE1-CG2 3.98Å; F176-T180 HydrophobicContact CZ-CG2 4.35Å; F176-T180 WeakPolarHBondContact O-CB 3.42Å; F176-T180 PolarHBondContact O-N 3.5Å; F176-T180 PolarHBondContact O-OG1 3.31Å
181	G	37.3	Very low	41.6	Very low	59 Å²	59	100.5 Å²	100.5	61%	0.608	55%	0.552	S	S	*	*			trans	78.1	10.3	172.7	0	0	0	0	0	116.8	T177	T177-G181 WeakPolarHBondContact O-CA 3.37Å; T177-G181 PolarHBondContact O-N 3Å
182	F	39.9	Very low	41.7	Very low	166 Å²	166	100 Å²	100	73%	0.728	54%	0.542	S	S	*	.			trans	-120.8	142.7	176.3	-76.3	-85.7	0	0	0	112
183	S	41.6	Very low	42.2	Very low	117 Å²	117	100.6 Å²	100.6	82%	0.818	55%	0.545	S	S	*	.			trans	-95.6	114.9	173.1	57.1	0	0	0	0	110.8
184	L	40.3	Very low	42.8	Very low	126 Å²	126	101.1 Å²	101.1	66%	0.66	55%	0.547	S	S	*	.			trans	-114.2	156.7	175.3	-82.8	150	0	0	0	110.5	E188	L184-E188 HydrophobicContact CD2-CB 4.48Å
185	S	47	Very low	42.6	Very low	48 Å²	48	101.3 Å²	101.3	34%	0.336	56%	0.555	S	S	.	*			trans	-77.8	159.2	-175.8	73.8	0	0	0	0	112.8	E187 E188 L189	S185-E187 VanDerWaalsContact C-N 3.26Å; S185-E187 PolarHBondContact O-N 3.46Å; S185-E188 VanDerWaalsContact CB-OE2 3.28Å; S185-E188 WeakPolarHBondContact CB-OE2 3.35Å; S185-E188 PolarHBondContact N-OE2 2.95Å; S185-E188 PolarHBondContact O-N 3.17Å; S185-E188 WeakPolarHBondContact OG-CG 3.36Å; S185-E188 PolarHBondContact OG-OE2 3.4Å; S185-L189 PolarHBondContact O-N 3.05Å
186	P	41.7	Very low	42.5	Very low	99 Å²	99	103.5 Å²	103.5	64%	0.643	56%	0.564	S	S	*	*	H	α-helix	trans	-62.4	-28.6	-175.6	-24.5	35.2	0	0	0	114.8	F190	P186-F190 PolarHBondContact O-N 3.17Å
187	E	42.8	Very low	42.5	Very low	167 Å²	167	102.6 Å²	102.6	78%	0.78	57%	0.571	S	S	*	*	H	α-helix	trans	-78	-38.1	-178.2	-63.6	178.9	166.7	0	0	111.1	S185 F190 G191	S185-E187 VanDerWaalsContact C-N 3.26Å; S185-E187 PolarHBondContact O-N 3.46Å; E187-F190 PolarHBondContact O-N 3.03Å; E187-G191 PolarHBondContact O-N 3.22Å; E187-G191 VanDerWaalsContact O-N 3.12Å
188	E	44.2	Very low	42.1	Very low	111 Å²	111	106.9 Å²	106.9	52%	0.519	59%	0.592	S	S	.	*	H	α-helix	trans	-66.3	-39.8	174.3	-65.8	166.2	131.3	0	0	111.7	L184 S185 F190 G191 F192	L184-E188 HydrophobicContact CD2-CB 4.48Å; S185-E188 VanDerWaalsContact CB-OE2 3.28Å; S185-E188 WeakPolarHBondContact CB-OE2 3.35Å; S185-E188 PolarHBondContact N-OE2 2.95Å; S185-E188 PolarHBondContact O-N 3.17Å; S185-E188 WeakPolarHBondContact OG-CG 3.36Å; S185-E188 PolarHBondContact OG-OE2 3.4Å; E188-F190 VanDerWaalsContact C-N 3.29Å; E188-F190 PolarHBondContact O-N 3.28Å; E188-G191 PolarHBondContact O-N 3.48Å; E188-F192 WeakPolarHBondContact O-CB 3.5Å; E188-F192 PolarHBondContact O-N 3.02Å
189	L	48.4	Very low	41.4	Very low	59 Å²	59	105.3 Å²	105.3	31%	0.309	60%	0.596	S	S	.	*	H	α-helix	trans	-61.8	-37.8	174.9	-163.9	84.8	0	0	0	111.7	L173 S185 F192 L193	L173-L189 HydrophobicContact CD1-CD2 4.2Å; S185-L189 PolarHBondContact O-N 3.05Å; L189-F192 PolarHBondContact O-N 3.02Å; L189-L193 HydrophobicContact CD2-CD1 4.33Å; L189-L193 HydrophobicContact CG-CD1 4.19Å; L189-L193 WeakPolarHBondContact O-CG 3.48Å; L189-L193 PolarHBondContact O-N 3.39Å
190	F	47.3	Very low	41.3	Very low	133 Å²	133	111.1 Å²	111.1	58%	0.583	61%	0.61	S	S	*	*	H	α-helix	trans	-69.3	-42.7	179.4	-153.7	-101.3	0	0	0	111.5	P186 E187 E188 F192 L193 I194	P186-F190 PolarHBondContact O-N 3.17Å; E187-F190 PolarHBondContact O-N 3.03Å; E188-F190 VanDerWaalsContact C-N 3.29Å; E188-F190 PolarHBondContact O-N 3.28Å; F190-F192 VanDerWaalsContact C-N 3.32Å; F190-F192 PolarHBondContact O-N 2.9Å; F190-L193 PolarHBondContact O-N 2.91Å; F190-I194 HydrophobicContact CD1-CD1 3.78Å; F190-I194 HydrophobicContact CE1-CD1 3.85Å; F190-I194 WeakPolarHBondContact O-CG1 3.39Å; F190-I194 PolarHBondContact O-N 2.66Å; F190-I194 VanDerWaalsContact O-N 3.17Å
191	G	43.9	Very low	40.7	Very low	46 Å²	46	115.6 Å²	115.6	47%	0.474	63%	0.632	S	S	.	*	H	α-helix	trans	-60.4	-39.3	171.5	0	0	0	0	0	113.1	E187 E188 A195	E187-G191 PolarHBondContact O-N 3.22Å; E187-G191 VanDerWaalsContact O-N 3.12Å; E188-G191 PolarHBondContact O-N 3.48Å; G191-A195 PolarHBondContact O-N 3.42Å
192	F	45.5	Very low	40.4	Very low	92 Å²	92	117.5 Å²	117.5	40%	0.404	63%	0.633	S	S	.	*	H	α-helix	trans	-68.9	-36.4	179.3	-158.3	-92.5	0	0	0	113.2	L138 E188 L189 F190 L196	L138-F192 HydrophobicContact CD2-CE2 4.48Å; L138-F192 HydrophobicContact CD2-CZ 3.75Å; E188-F192 WeakPolarHBondContact O-CB 3.5Å; E188-F192 PolarHBondContact O-N 3.02Å; L189-F192 PolarHBondContact O-N 3.02Å; F190-F192 VanDerWaalsContact C-N 3.32Å; F190-F192 PolarHBondContact O-N 2.9Å; F192-L196 HydrophobicContact CD1-CD1 4.08Å; F192-L196 HydrophobicContact CE1-CD1 3.81Å
193	L	45.1	Very low	40.2	Very low	105 Å²	105	116.4 Å²	116.4	55%	0.55	63%	0.634	S	S	.	*	H	α-helix	trans	-73.6	-34.8	178.3	-75.1	166.4	0	0	0	113	L189 F190 A195 L196	L189-L193 HydrophobicContact CD2-CD1 4.33Å; L189-L193 HydrophobicContact CG-CD1 4.19Å; L189-L193 WeakPolarHBondContact O-CG 3.48Å; L189-L193 PolarHBondContact O-N 3.39Å; F190-L193 PolarHBondContact O-N 2.91Å; L193-A195 VanDerWaalsContact C-N 3.29Å; L193-A195 PolarHBondContact O-N 3.03Å; L193-L196 PolarHBondContact O-N 2.88Å
194	I	46.7	Very low	39.8	Very low	103 Å²	103	119.3 Å²	119.3	53%	0.528	63%	0.634	S	S	.	*	H	α-helix	trans	-61.7	-39.9	174.5	-69.8	169.7	0	0	0	110.6	F190 L196 S197	F190-I194 HydrophobicContact CD1-CD1 3.78Å; F190-I194 HydrophobicContact CE1-CD1 3.85Å; F190-I194 WeakPolarHBondContact O-CG1 3.39Å; F190-I194 PolarHBondContact O-N 2.66Å; F190-I194 VanDerWaalsContact O-N 3.17Å; I194-L196 PolarHBondContact O-N 3.44Å; I194-S197 PolarHBondContact O-N 3.27Å; I194-S197 PolarHBondContact O-OG 2.96Å
195	A	36.9	Very low	39.4	Very low	86 Å²	86	124.2 Å²	124.2	71%	0.711	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-13.7	-179.7	0	0	0	0	0	115.3	G191 L193	G191-A195 PolarHBondContact O-N 3.42Å; L193-A195 VanDerWaalsContact C-N 3.29Å; L193-A195 PolarHBondContact O-N 3.03Å
196	L	38.1	Very low	38.7	Very low	118 Å²	118	131.4 Å²	131.4	62%	0.618	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	0.8	-178.8	-82.8	165.4	0	0	0	114.3	F192 L193 I194 N198	F192-L196 HydrophobicContact CD1-CD1 4.08Å; F192-L196 HydrophobicContact CE1-CD1 3.81Å; L193-L196 PolarHBondContact O-N 2.88Å; I194-L196 PolarHBondContact O-N 3.44Å; L196-N198 PolarHBondContact O-N 3.48Å
197	S	38.9	Very low	38.3	Very low	88 Å²	88	137.9 Å²	137.9	62%	0.615	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	5.1	-166.5	57.8	0	0	0	0	117.4	I194	I194-S197 PolarHBondContact O-N 3.27Å; I194-S197 PolarHBondContact O-OG 2.96Å
198	N	32.4	Very low	37.6	Very low	154 Å²	154	139.2 Å²	139.2	82%	0.824	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	20.6	-168	-83.6	-24	0	0	0	116.7	L196	L196-N198 PolarHBondContact O-N 3.48Å
199	L	32.6	Very low	36.9	Very low	167 Å²	167	138 Å²	138	87%	0.874	69%	0.694	S	S	*	*			trans	-137.4	109	178.3	-74.1	166.5	0	0	0	112
200	R	32.7	Very low	36	Very low	231 Å²	231	143.1 Å²	143.1	87%	0.872	72%	0.721	S	S	*	*			trans	-117.3	-13.1	-168.4	-163.6	169.5	-178.4	179.8	0.2	117
201	D	32.1	Very low	35.2	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-11.4	-158.9	-62.7	-41.8	0	0	0	121.1
202	P	31	Very low	34.8	Very low	99 Å²	99	144.2 Å²	144.2	64%	0.643	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-25	-176.1	-19.3	33.2	0	0	0	116.8
203	I	34.1	Very low	34.4	Very low	144 Å²	144	144.7 Å²	144.7	74%	0.738	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-82.4	-23.6	-159	-66.9	174.5	0	0	0	113.7	R205	I203-R205 VanDerWaalsContact C-N 3.3Å; I203-R205 PolarHBondContact O-N 2.97Å
204	E	34.9	Very low	33.9	Very low	177 Å²	177	144.3 Å²	144.3	83%	0.827	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-72.6	-16.8	-178.9	-68	-162.3	149.5	0	0	114.5
205	R	30.3	Very low	33.4	Very low	229 Å²	229	143.9 Å²	143.9	86%	0.864	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-80	-21.8	-176.8	-78.4	-172.9	175.3	-174.4	-0.3	115.1	I203	I203-R205 VanDerWaalsContact C-N 3.3Å; I203-R205 PolarHBondContact O-N 2.97Å
206	F	33.2	Very low	33.6	Very low	199 Å²	199	145.1 Å²	145.1	87%	0.873	73%	0.733	S	S	*	*	G	3₁₀ helix	trans	-82.8	-7.5	-177.3	-100.6	-84.9	0	0	0	114.8	K208	F206-K208 PolarHBondContact O-N 3.4Å
207	R	34.2	Very low	33.7	Very low	235 Å²	235	146.7 Å²	146.7	89%	0.887	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-91.2	16.3	-172	-149.9	177.2	-174.5	169.2	2.6	114.8
208	K	27.4	Very low	33.8	Very low	195 Å²	195	149 Å²	149	85%	0.848	74%	0.736	S	S	*	*			trans	-134.8	36.3	-165.9	-84.4	-169.1	171.8	-177.6	0	115.9	F206	F206-K208 PolarHBondContact O-N 3.4Å
209	A	30.1	Very low	34.1	Very low	86 Å²	86	147.2 Å²	147.2	71%	0.711	73%	0.725	S	S	*	*			trans	-123.9	120.8	176	0	0	0	0	0	112.6
210	D	28.7	Very low	34.4	Very low	167 Å²	167	147 Å²	147	89%	0.893	72%	0.717	S	S	*	*			trans	-85.3	124.9	-177.5	-69.4	-54.4	0	0	0	113
211	T	31	Very low	34.5	Very low	127 Å²	127	140.9 Å²	140.9	78%	0.779	70%	0.702	S	S	*	*			trans	-142.3	20.2	-179.7	52.2	0	0	0	0	116.6
212	L	33.8	Very low	34.7	Very low	75 Å²	75	140.3 Å²	140.3	39%	0.393	70%	0.699	S	S	.	*			trans	-127	6.1	179.3	-89.6	168.2	0	0	0	117.4	L215 K452	L212-L215 HydrophobicContact CD2-CB 4.31Å; L212-K452 HydrophobicContact CD1-CD 3.67Å; L212-K452 VanDerWaalsContact CD1-NZ 3.26Å
213	S	39	Very low	34.9	Very low	102 Å²	102	139.7 Å²	139.7	71%	0.713	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-30.8	175.4	-167.7	0	0	0	0	116.3
214	P	33.7	Very low	34.7	Very low	96 Å²	96	137.3 Å²	137.3	62%	0.623	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-35.8	-177.1	-19.7	33.4	0	0	0	115	F216 K217 H218	P214-F216 PolarHBondContact O-N 2.7Å; P214-K217 WeakPolarHBondContact O-CB 3.38Å; P214-K217 PolarHBondContact O-N 3.29Å; P214-H218 PolarHBondContact O-N 3.07Å
215	L	37.1	Very low	34.5	Very low	94 Å²	94	136.6 Å²	136.6	49%	0.492	69%	0.691	S	S	.	*	H	α-helix	trans	-65	-42.7	-170.1	-154.9	91.3	0	0	0	112	L212 K217 H218 L219	L212-L215 HydrophobicContact CD2-CB 4.31Å; L215-K217 PolarHBondContact O-N 3.29Å; L215-H218 PolarHBondContact O-N 3.31Å; L215-L219 PolarHBondContact O-N 2.92Å
216	F	40.9	Very low	34.4	Very low	113 Å²	113	129.6 Å²	129.6	50%	0.496	68%	0.678	S	S	.	*	H	α-helix	trans	-68	-18.3	174.9	-100.4	-84.1	0	0	0	113.7	P214 K220 V449 V453	P214-F216 PolarHBondContact O-N 2.7Å; F216-K220 WeakPolarHBondContact O-CB 3.24Å; F216-V449 HydrophobicContact CZ-CG1 4.06Å; F216-V453 HydrophobicContact CE2-CG2 4.05Å; F216-V453 HydrophobicContact CZ-CG2 3.9Å
217	K	40.6	Very low	34.3	Very low	150 Å²	150	129.5 Å²	129.5	65%	0.652	68%	0.68	S	S	*	*	H	α-helix	trans	-83	-21.8	178.5	-132.4	176.2	-175.1	179.2	0	112.8	P214 L215	P214-K217 WeakPolarHBondContact O-CB 3.38Å; P214-K217 PolarHBondContact O-N 3.29Å; L215-K217 PolarHBondContact O-N 3.29Å
218	H	40.4	Very low	34.5	Very low	138 Å²	138	123.5 Å²	123.5	64%	0.639	67%	0.666	S	S	*	*	H	α-helix	trans	-84.2	-48.2	174.6	-120.5	45.5	0	0	0	112	P214 L215 K220 N221 D222	P214-H218 PolarHBondContact O-N 3.07Å; L215-H218 PolarHBondContact O-N 3.31Å; H218-K220 PolarHBondContact O-N 2.76Å; H218-N221 PolarHBondContact O-N 2.77Å; H218-D222 PolarHBondContact O-N 3Å
219	L	38.5	Very low	35	Very low	115 Å²	115	118 Å²	118	60%	0.602	65%	0.652	S	S	*	*	H	α-helix	trans	-56.9	-25	174.9	-84.3	163.9	0	0	0	113.8	L215 T223	L215-L219 PolarHBondContact O-N 2.92Å; L219-T223 WeakPolarHBondContact O-CG2 3.49Å; L219-T223 PolarHBondContact O-OG1 3.32Å
220	K	37.8	Very low	35.5	Very low	162 Å²	162	119.9 Å²	119.9	70%	0.704	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-15.4	177.6	-169.8	169.1	-177.7	174.8	0	114.4	F216 H218	F216-K220 WeakPolarHBondContact O-CB 3.24Å; H218-K220 PolarHBondContact O-N 2.76Å
221	N	36.1	Very low	36.4	Very low	103 Å²	103	113.8 Å²	113.8	55%	0.551	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-40.2	-176.9	-78.9	2.4	0	0	0	112.6	H218 T223 S224	H218-N221 PolarHBondContact O-N 2.77Å; N221-T223 PolarHBondContact O-N 2.92Å; N221-S224 WeakPolarHBondContact O-CB 3.14Å; N221-S224 PolarHBondContact O-N 3.07Å; N221-S224 PolarHBondContact O-OG 3.29Å
222	D	35.4	Very low	37	Very low	140 Å²	140	110.7 Å²	110.7	75%	0.749	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-8.8	178.2	-69.4	-24.3	0	0	0	113.5	H218	H218-D222 PolarHBondContact O-N 3Å
223	T	36.4	Very low	37.5	Very low	86 Å²	86	113 Å²	113	53%	0.528	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.3	18.4	176.8	51.5	0	0	0	0	113.5	L219 N221 N225	L219-T223 WeakPolarHBondContact O-CG2 3.49Å; L219-T223 PolarHBondContact O-OG1 3.32Å; N221-T223 PolarHBondContact O-N 2.92Å; T223-N225 PolarHBondContact O-N 2.71Å; T223-N225 VanDerWaalsContact O-N 3.17Å
224	S	28.8	Very low	37.9	Very low	94 Å²	94	114.1 Å²	114.1	66%	0.657	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-1.1	-175	48	0	0	0	0	115.9	N221	N221-S224 WeakPolarHBondContact O-CB 3.14Å; N221-S224 PolarHBondContact O-N 3.07Å; N221-S224 PolarHBondContact O-OG 3.29Å
225	N	30.4	Very low	38.4	Very low	162 Å²	162	113 Å²	113	87%	0.866	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	50	-179	-93.9	-23.9	0	0	0	114.5	T223	T223-N225 PolarHBondContact O-N 2.71Å; T223-N225 VanDerWaalsContact O-N 3.17Å
226	S	29.2	Very low	38.7	Very low	83 Å²	83	112.4 Å²	112.4	58%	0.58	59%	0.589	S	S	*	*			trans	-164.8	141.2	149	63.3	0	0	0	0	113.1	N228	S226-N228 PolarHBondContact O-N 2.77Å
227	Q	31.6	Very low	39.1	Very low	196 Å²	196	107.4 Å²	107.4	92%	0.916	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	10.9	-179.1	-74.6	-171.9	-31.4	0	0	115.1
228	N	38.2	Very low	39.4	Very low	110 Å²	110	104.4 Å²	104.4	59%	0.588	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	2.8	-163.9	-76.4	-11.8	0	0	0	116	S226 N230 S231	S226-N228 PolarHBondContact O-N 2.77Å; N228-N230 PolarHBondContact O-N 2.96Å; N228-S231 WeakPolarHBondContact O-CB 3.47Å; N228-S231 PolarHBondContact O-N 3.01Å; N228-S231 VanDerWaalsContact O-N 3.12Å; N228-S231 PolarHBondContact O-OG 3.14Å
229	S	36.7	Very low	39.5	Very low	79 Å²	79	99.2 Å²	99.2	55%	0.552	54%	0.536	S	S	*	.	H	α-helix	trans	-67	-32.8	-172.5	50.8	0	0	0	0	115.2	S231	S229-S231 VanDerWaalsContact C-N 3.3Å; S229-S231 PolarHBondContact O-N 2.99Å
230	N	41.5	Very low	39.9	Very low	125 Å²	125	95.2 Å²	95.2	67%	0.668	52%	0.518	S	S	*	.	H	α-helix	trans	-66.3	-32.9	172.4	-77.4	3.2	0	0	0	112.3	N228 V232 I233 E234	N228-N230 PolarHBondContact O-N 2.96Å; N230-V232 VanDerWaalsContact C-N 3.27Å; N230-V232 PolarHBondContact O-N 2.97Å; N230-I233 PolarHBondContact O-N 2.65Å; N230-E234 PolarHBondContact O-N 2.75Å
231	S	47.3	Very low	40.2	Very low	39 Å²	39	91.7 Å²	91.7	27%	0.273	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-25.8	-174.9	77.4	0	0	0	0	113.6	N228 S229 K235	N228-S231 WeakPolarHBondContact O-CB 3.47Å; N228-S231 PolarHBondContact O-N 3.01Å; N228-S231 VanDerWaalsContact O-N 3.12Å; N228-S231 PolarHBondContact O-OG 3.14Å; S229-S231 VanDerWaalsContact C-N 3.3Å; S229-S231 PolarHBondContact O-N 2.99Å; S231-K235 WeakPolarHBondContact O-CB 3.32Å; S231-K235 WeakPolarHBondContact O-CG 3.38Å; S231-K235 PolarHBondContact O-N 2.96Å
232	V	42.8	Very low	40.5	Very low	63 Å²	63	89.4 Å²	89.4	38%	0.382	49%	0.494	S	S	.	.	H	α-helix	trans	-78.3	-37	-179.9	-179.3	0	0	0	0	111.2	N230 L236	N230-V232 VanDerWaalsContact C-N 3.27Å; N230-V232 PolarHBondContact O-N 2.97Å; V232-L236 HydrophobicContact CG1-CD1 4.17Å; V232-L236 VanDerWaalsContact O-CB 3.27Å; V232-L236 WeakPolarHBondContact O-CB 3.45Å; V232-L236 WeakPolarHBondContact O-CG 3.45Å; V232-L236 PolarHBondContact O-N 3.44Å
233	I	45.5	Very low	40.9	Very low	124 Å²	124	88.6 Å²	88.6	64%	0.636	48%	0.484	S	S	*	.	H	α-helix	trans	-76.6	-39.8	176.8	-61.9	176.7	0	0	0	110.5	N230 L236 G237	N230-I233 PolarHBondContact O-N 2.65Å; I233-L236 PolarHBondContact O-N 3.09Å; I233-G237 PolarHBondContact O-N 2.71Å
234	E	46.8	Very low	41.2	Very low	125 Å²	125	86.1 Å²	86.1	58%	0.584	47%	0.47	S	S	*	.	H	α-helix	trans	-61.9	-44.1	170	-78.9	-175.9	129.2	0	0	111.7	N230 G237 I238	N230-E234 PolarHBondContact O-N 2.75Å; E234-G237 CarbonylContact O-C 3.57Å; E234-G237 WeakPolarHBondContact O-CA 3.24Å; E234-G237 PolarHBondContact O-N 2.79Å; E234-G237 VanDerWaalsContact O-N 3.16Å; E234-I238 VanDerWaalsContact O-CG1 3.28Å; E234-I238 WeakPolarHBondContact O-CG1 3.47Å; E234-I238 PolarHBondContact O-N 3.37Å
235	K	44.6	Very low	41.6	Very low	72 Å²	72	83.4 Å²	83.4	31%	0.313	46%	0.457	S	S	.	.	H	α-helix	trans	-71.2	-32.3	178.1	-71.6	178.7	-177.8	-147.4	0	113.4	D74 V78 S231 G237 I238 L239	D74-K235 WeakPolarHBondContact OD1-CE 3.41Å; D74-K235 IonicContact OD1-NZ 2.69Å; D74-K235 PolarHBondContact OD1-NZ 3.04Å; V78-K235 HydrophobicContact CG2-CB 4.05Å; S231-K235 WeakPolarHBondContact O-CB 3.32Å; S231-K235 WeakPolarHBondContact O-CG 3.38Å; S231-K235 PolarHBondContact O-N 2.96Å; K235-G237 VanDerWaalsContact C-N 3.32Å; K235-I238 PolarHBondContact O-N 3.32Å; K235-L239 VanDerWaalsContact O-CB 3.24Å; K235-L239 WeakPolarHBondContact O-CB 3.35Å; K235-L239 PolarHBondContact O-N 2.68Å
236	L	44.3	Very low	42.2	Very low	82 Å²	82	76.6 Å²	76.6	43%	0.429	43%	0.425	S	S	.	.	H	α-helix	trans	-65.1	-37	167.2	-87.1	163.1	0	0	0	111.5	V78 V232 I233 S240	V78-L236 HydrophobicContact CG1-CD2 4.16Å; V232-L236 HydrophobicContact CG1-CD1 4.17Å; V232-L236 VanDerWaalsContact O-CB 3.27Å; V232-L236 WeakPolarHBondContact O-CB 3.45Å; V232-L236 WeakPolarHBondContact O-CG 3.45Å; V232-L236 PolarHBondContact O-N 3.44Å; I233-L236 PolarHBondContact O-N 3.09Å; L236-S240 WeakPolarHBondContact O-CB 3.33Å; L236-S240 PolarHBondContact O-N 3.15Å; L236-S240 PolarHBondContact O-OG 2.99Å
237	G	47.5	Very low	42.7	Very low	8 Å²	8	73.6 Å²	73.6	8%	0.082	40%	0.403	C	S	.	.	H	α-helix	trans	-66.8	-36	171.8	0	0	0	0	0	113.6	I233 E234 K235 S240 N241	I233-G237 PolarHBondContact O-N 2.71Å; E234-G237 CarbonylContact O-C 3.57Å; E234-G237 WeakPolarHBondContact O-CA 3.24Å; E234-G237 PolarHBondContact O-N 2.79Å; E234-G237 VanDerWaalsContact O-N 3.16Å; K235-G237 VanDerWaalsContact C-N 3.32Å; G237-S240 PolarHBondContact O-OG 3.17Å; G237-S240 VanDerWaalsContact O-OG 3.08Å; G237-N241 WeakPolarHBondContact O-CB 3.43Å; G237-N241 PolarHBondContact O-N 3.08Å; G237-N241 PolarHBondContact O-ND2 2.94Å
238	I	46.9	Very low	43	Very low	86 Å²	86	70.7 Å²	70.7	44%	0.441	39%	0.394	S	S	.	.	H	α-helix	trans	-72.5	-37.3	175.4	-69.2	161.2	0	0	0	111.1	E234 K235 N241 L242	E234-I238 VanDerWaalsContact O-CG1 3.28Å; E234-I238 WeakPolarHBondContact O-CG1 3.47Å; E234-I238 PolarHBondContact O-N 3.37Å; K235-I238 PolarHBondContact O-N 3.32Å; I238-N241 CarbonylContact O-C 3.56Å; I238-N241 WeakPolarHBondContact O-CB 3.2Å; I238-N241 PolarHBondContact O-N 3.16Å; I238-L242 PolarHBondContact O-N 3.31Å; I238-L242 VanDerWaalsContact O-N 3.09Å
239	L	43.2	Very low	43.2	Very low	30 Å²	30	66.6 Å²	66.6	16%	0.157	37%	0.374	C	S	.	.	H	α-helix	trans	-81	-31.8	-179.9	-157.9	152.8	0	0	0	112.1	A75 V78 K235 L242 F243	A75-L239 HydrophobicContact CB-CD1 4.35Å; V78-L239 HydrophobicContact CB-CD1 3.48Å; V78-L239 VanDerWaalsContact CB-CD1 3.48Å; V78-L239 HydrophobicContact CG1-CD1 3.74Å; V78-L239 HydrophobicContact CG2-CD1 3.93Å; K235-L239 VanDerWaalsContact O-CB 3.24Å; K235-L239 WeakPolarHBondContact O-CB 3.35Å; K235-L239 PolarHBondContact O-N 2.68Å; L239-L242 WeakPolarHBondContact O-CB 3.46Å; L239-L242 PolarHBondContact O-N 2.96Å; L239-L242 VanDerWaalsContact O-N 3.08Å; L239-F243 HydrophobicContact CD2-CD2 3.68Å; L239-F243 HydrophobicContact CD2-CE2 3.84Å; L239-F243 PolarHBondContact O-N 2.55Å
240	S	47.7	Very low	43.4	Very low	31 Å²	31	67.9 Å²	67.9	22%	0.217	37%	0.374	C	S	.	.	H	α-helix	trans	-64.6	-43.6	162.4	82.8	0	0	0	0	109.6	L236 G237 L242 C244 G245 Y465	L236-S240 WeakPolarHBondContact O-CB 3.33Å; L236-S240 PolarHBondContact O-N 3.15Å; L236-S240 PolarHBondContact O-OG 2.99Å; G237-S240 PolarHBondContact O-OG 3.17Å; G237-S240 VanDerWaalsContact O-OG 3.08Å; S240-L242 PolarHBondContact O-N 3.44Å; S240-C244 CarbonylContact O-C 3.43Å; S240-C244 WeakPolarHBondContact O-CA 3.43Å; S240-C244 WeakPolarHBondContact O-CB 3.37Å; S240-C244 PolarHBondContact O-N 3.38Å; S240-G245 PolarHBondContact O-N 3.38Å; S240-Y465 WeakPolarHBondContact OG-CE1 3.25Å; S240-Y465 PolarHBondContact OG-OH 3.26Å; S240-Y465 VanDerWaalsContact OG-OH 3.09Å
241	N	43.4	Very low	43.3	Very low	87 Å²	87	67.9 Å²	67.9	47%	0.465	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-1.7	168.5	-80.1	-39.9	0	0	0	114.7	G237 I238 G245 Y465	G237-N241 WeakPolarHBondContact O-CB 3.43Å; G237-N241 PolarHBondContact O-N 3.08Å; G237-N241 PolarHBondContact O-ND2 2.94Å; I238-N241 CarbonylContact O-C 3.56Å; I238-N241 WeakPolarHBondContact O-CB 3.2Å; I238-N241 PolarHBondContact O-N 3.16Å; N241-G245 VanDerWaalsContact C-N 3.28Å; N241-G245 WeakPolarHBondContact O-CA 3.49Å; N241-G245 PolarHBondContact O-N 3.15Å; N241-Y465 PolarHBondContact OD1-OH 2.88Å
242	L	43	Very low	43.2	Very low	55 Å²	55	67.8 Å²	67.8	29%	0.288	37%	0.367	S	S	.	.	H	α-helix	trans	-101.4	-54.6	173.7	-152.7	79	0	0	0	112.5	V71 I238 L239 S240 G245	V71-L242 HydrophobicContact CG1-CD1 3.45Å; V71-L242 VanDerWaalsContact CG1-CD1 3.45Å; V71-L242 HydrophobicContact CG1-CD2 3.38Å; V71-L242 HydrophobicContact CG1-CG 4.04Å; I238-L242 PolarHBondContact O-N 3.31Å; I238-L242 VanDerWaalsContact O-N 3.09Å; L239-L242 WeakPolarHBondContact O-CB 3.46Å; L239-L242 PolarHBondContact O-N 2.96Å; L239-L242 VanDerWaalsContact O-N 3.08Å; S240-L242 PolarHBondContact O-N 3.44Å; L242-G245 VanDerWaalsContact C-N 3.33Å; L242-G245 PolarHBondContact O-N 3.31Å
243	F	43.2	Very low	43.2	Very low	123 Å²	123	72 Å²	72	54%	0.539	38%	0.376	S	S	.	.	H	α-helix	trans	-74.5	-43.6	174.3	-77.2	-88.6	0	0	0	111.4	L239 G245 L1559	L239-F243 HydrophobicContact CD2-CD2 3.68Å; L239-F243 HydrophobicContact CD2-CE2 3.84Å; L239-F243 PolarHBondContact O-N 2.55Å; F243-G245 VanDerWaalsContact C-N 3.27Å; F243-L1559 HydrophobicContact CE1-CD1 4.34Å; F243-L1559 HydrophobicContact CE1-CD2 4.25Å; F243-L1559 HydrophobicContact CZ-CD1 4.08Å; F243-L1559 HydrophobicContact CZ-CD2 4.01Å; F243-L1559 HydrophobicContact CZ-CG 4.41Å
244	C	42.2	Very low	43.1	Very low	34 Å²	34	72.5 Å²	72.5	23%	0.23	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	40.6	159.5	-42.5	0	0	0	0	110.7	S240 G246 P247	S240-C244 CarbonylContact O-C 3.43Å; S240-C244 WeakPolarHBondContact O-CA 3.43Å; S240-C244 WeakPolarHBondContact O-CB 3.37Å; S240-C244 PolarHBondContact O-N 3.38Å; C244-G246 VanDerWaalsContact C-N 3.26Å; C244-P247 VanDerWaalsContact CA-CD 3.41Å; C244-P247 HydrophobicContact CB-CG 3.69Å; C244-P247 WeakPolarHBondContact O-CD 3.43Å; C244-P247 VanDerWaalsContact O-CG 3.29Å; C244-P247 WeakPolarHBondContact O-CG 3.27Å
245	G	37.7	Very low	42.9	Very low	38 Å²	38	70.7 Å²	70.7	39%	0.392	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-18.5	149	0	0	0	0	0	111.2	S240 N241 L242 F243	S240-G245 PolarHBondContact O-N 3.38Å; N241-G245 VanDerWaalsContact C-N 3.28Å; N241-G245 WeakPolarHBondContact O-CA 3.49Å; N241-G245 PolarHBondContact O-N 3.15Å; L242-G245 VanDerWaalsContact C-N 3.33Å; L242-G245 PolarHBondContact O-N 3.31Å; F243-G245 VanDerWaalsContact C-N 3.27Å
246	G	42.7	Very low	42.9	Very low	19 Å²	19	70 Å²	70	20%	0.196	37%	0.37	C	S	.	.	H	α-helix	trans	-50.1	-36.2	165.9	0	0	0	0	0	116.9	C244 L248 S249 L250	C244-G246 VanDerWaalsContact C-N 3.26Å; G246-L248 PolarHBondContact O-N 3.48Å; G246-S249 CarbonylContact O-C 3.5Å; G246-S249 VanDerWaalsContact O-C 3.28Å; G246-S249 WeakPolarHBondContact O-CA 3.25Å; G246-S249 WeakPolarHBondContact O-CB 3.43Å; G246-S249 PolarHBondContact O-N 3.36Å; G246-S249 PolarHBondContact O-OG 3.33Å; G246-L250 WeakPolarHBondContact O-CB 3.43Å; G246-L250 PolarHBondContact O-N 3.36Å
247	P	39.8	Very low	42.9	Very low	19 Å²	19	68.4 Å²	68.4	12%	0.123	36%	0.36	C	S	.	.	H	α-helix	trans	-56.4	-33.8	-172.3	-29.3	37.7	0	0	0	115.7	C244 S249 L250 K251 F464	C244-P247 VanDerWaalsContact CA-CD 3.41Å; C244-P247 HydrophobicContact CB-CG 3.69Å; C244-P247 WeakPolarHBondContact O-CD 3.43Å; C244-P247 VanDerWaalsContact O-CG 3.29Å; C244-P247 WeakPolarHBondContact O-CG 3.27Å; P247-S249 PolarHBondContact O-N 3.02Å; P247-L250 PolarHBondContact O-N 3.06Å; P247-K251 WeakPolarHBondContact O-CA 3.38Å; P247-K251 WeakPolarHBondContact O-CB 3.42Å; P247-K251 PolarHBondContact O-N 3.45Å; P247-F464 HydrophobicContact CB-CD1 4.18Å; P247-F464 HydrophobicContact CB-CD2 4.44Å; P247-F464 HydrophobicContact CB-CE1 3.68Å; P247-F464 HydrophobicContact CB-CE2 3.96Å; P247-F464 HydrophobicContact CB-CZ 3.56Å; P247-F464 HydrophobicContact CG-CD1 4.12Å; P247-F464 HydrophobicContact CG-CE1 3.29Å; P247-F464 HydrophobicContact CG-CE2 4.29Å; P247-F464 HydrophobicContact CG-CZ 3.4Å; P247-F464 VanDerWaalsContact CG-CZ 3.4Å
248	L	38.2	Very low	42.7	Very low	135 Å²	135	75.7 Å²	75.7	71%	0.707	39%	0.385	S	S	*	.	H	α-helix	trans	-66.1	-31.7	171.7	-106.7	150.4	0	0	0	111.3	G246 C252	G246-L248 PolarHBondContact O-N 3.48Å; L248-C252 WeakPolarHBondContact O-CB 3.34Å; L248-C252 PolarHBondContact O-SG 2.91Å
249	S	43	Very low	42.5	Very low	25 Å²	25	72.9 Å²	72.9	18%	0.175	37%	0.373	C	S	.	.	H	α-helix	trans	-85	-24.9	169.3	72	0	0	0	0	115.2	F58 G246 P247 C252 W253	F58-S249 VanDerWaalsContact CD2-CB 3.43Å; F58-S249 WeakPolarHBondContact CD2-OG 3.07Å; G246-S249 CarbonylContact O-C 3.5Å; G246-S249 VanDerWaalsContact O-C 3.28Å; G246-S249 WeakPolarHBondContact O-CA 3.25Å; G246-S249 WeakPolarHBondContact O-CB 3.43Å; G246-S249 PolarHBondContact O-N 3.36Å; G246-S249 PolarHBondContact O-OG 3.33Å; P247-S249 PolarHBondContact O-N 3.02Å; S249-C252 WeakPolarHBondContact O-CB 3.25Å; S249-W253 WeakPolarHBondContact O-CB 3.12Å; S249-W253 PolarHBondContact O-N 3.04Å
250	L	40.7	Very low	42.6	Very low	106 Å²	106	75.6 Å²	75.6	56%	0.555	39%	0.387	S	S	*	.	H	α-helix	trans	-90.5	-32.8	-176.1	-103.8	161.9	0	0	0	112.1	G246 P247 C252 W253 Y254	G246-L250 WeakPolarHBondContact O-CB 3.43Å; G246-L250 PolarHBondContact O-N 3.36Å; P247-L250 PolarHBondContact O-N 3.06Å; L250-C252 VanDerWaalsContact C-N 3.29Å; L250-W253 PolarHBondContact O-N 3.17Å; L250-Y254 WeakPolarHBondContact O-CB 3.35Å; L250-Y254 PolarHBondContact O-N 2.97Å
251	K	39.2	Very low	42.2	Very low	125 Å²	125	77.9 Å²	77.9	54%	0.543	39%	0.394	S	S	.	.	H	α-helix	trans	-64.7	-39.2	164.7	-171.6	178.3	-175.9	178.1	0	109.3	P247 T255	P247-K251 WeakPolarHBondContact O-CA 3.38Å; P247-K251 WeakPolarHBondContact O-CB 3.42Å; P247-K251 PolarHBondContact O-N 3.45Å; K251-T255 WeakPolarHBondContact O-CB 3.36Å; K251-T255 PolarHBondContact O-N 3.12Å; K251-T255 PolarHBondContact O-OG1 2.67Å
252	C	44.3	Very low	42.2	Very low	36 Å²	36	80.9 Å²	80.9	24%	0.243	41%	0.407	C	S	.	.	H	α-helix	trans	-66.8	-44	169.2	-79.2	0	0	0	0	113.2	P54 L248 S249 L250 Y254 T255 V256	P54-C252 HydrophobicContact CB-CB 3.4Å; P54-C252 VanDerWaalsContact CB-CB 3.4Å; P54-C252 HydrophobicContact CG-CB 4.37Å; L248-C252 WeakPolarHBondContact O-CB 3.34Å; L248-C252 PolarHBondContact O-SG 2.91Å; S249-C252 WeakPolarHBondContact O-CB 3.25Å; L250-C252 VanDerWaalsContact C-N 3.29Å; C252-Y254 VanDerWaalsContact C-N 3.33Å; C252-Y254 PolarHBondContact O-N 3.41Å; C252-T255 WeakPolarHBondContact O-CB 3.3Å; C252-T255 PolarHBondContact O-N 3.11Å; C252-T255 VanDerWaalsContact O-N 3.12Å; C252-V256 WeakPolarHBondContact O-CG2 3.38Å; C252-V256 PolarHBondContact O-N 2.84Å
253	W	43.8	Very low	41.9	Very low	153 Å²	153	84.4 Å²	84.4	58%	0.58	42%	0.422	S	S	*	.	H	α-helix	trans	-65.3	-37.5	175.7	-151.8	-96.3	0	0	0	111.9	S249 L250 T255 V256 Q257	S249-W253 WeakPolarHBondContact O-CB 3.12Å; S249-W253 PolarHBondContact O-N 3.04Å; L250-W253 PolarHBondContact O-N 3.17Å; W253-T255 VanDerWaalsContact C-N 3.31Å; W253-T255 PolarHBondContact O-N 2.89Å; W253-V256 PolarHBondContact O-N 3.45Å; W253-Q257 VanDerWaalsContact O-CB 3.23Å; W253-Q257 WeakPolarHBondContact O-CB 3.5Å; W253-Q257 PolarHBondContact O-N 2.57Å
254	Y	42.5	Very low	41.6	Very low	134 Å²	134	81.4 Å²	81.4	53%	0.525	41%	0.414	S	S	.	.	H	α-helix	trans	-63.4	-35.6	171.1	179.9	-100.7	0	0	0	111.7	L250 C252 R258	L250-Y254 WeakPolarHBondContact O-CB 3.35Å; L250-Y254 PolarHBondContact O-N 2.97Å; C252-Y254 VanDerWaalsContact C-N 3.33Å; C252-Y254 PolarHBondContact O-N 3.41Å; Y254-R258 VanDerWaalsContact O-CB 3.27Å; Y254-R258 WeakPolarHBondContact O-CB 3.22Å; Y254-R258 PolarHBondContact O-N 3.41Å
255	T	43.9	Very low	41	Very low	86 Å²	86	86.1 Å²	86.1	53%	0.528	44%	0.441	S	S	.	.	H	α-helix	trans	-69.6	-42.1	173.9	-53.3	0	0	0	0	111.3	K251 C252 W253 R258 C259	K251-T255 WeakPolarHBondContact O-CB 3.36Å; K251-T255 PolarHBondContact O-N 3.12Å; K251-T255 PolarHBondContact O-OG1 2.67Å; C252-T255 WeakPolarHBondContact O-CB 3.3Å; C252-T255 PolarHBondContact O-N 3.11Å; C252-T255 VanDerWaalsContact O-N 3.12Å; W253-T255 VanDerWaalsContact C-N 3.31Å; W253-T255 PolarHBondContact O-N 2.89Å; T255-R258 PolarHBondContact O-N 2.84Å; T255-C259 PolarHBondContact O-N 2.79Å; T255-C259 VanDerWaalsContact O-N 3.08Å
256	V	45	Very low	40.8	Very low	57 Å²	57	90.2 Å²	90.2	35%	0.345	46%	0.461	S	S	.	.	H	α-helix	trans	-63.5	-43.5	172.9	171.8	0	0	0	0	111.3	P54 C252 W253 C259 L260	P54-V256 HydrophobicContact CG-CG2 4.17Å; C252-V256 WeakPolarHBondContact O-CG2 3.38Å; C252-V256 PolarHBondContact O-N 2.84Å; W253-V256 PolarHBondContact O-N 3.45Å; V256-C259 WeakPolarHBondContact O-CB 3.34Å; V256-C259 PolarHBondContact O-N 3.48Å; V256-L260 HydrophobicContact CG1-CD1 4.13Å; V256-L260 PolarHBondContact O-N 3.12Å
257	Q	42.4	Very low	40.2	Very low	49 Å²	49	91.7 Å²	91.7	23%	0.229	48%	0.477	C	S	.	.	H	α-helix	trans	-59.9	-48.3	175.8	-179.7	-174.2	-23.7	0	0	110.9	W253 C259 L260 E261	W253-Q257 VanDerWaalsContact O-CB 3.23Å; W253-Q257 WeakPolarHBondContact O-CB 3.5Å; W253-Q257 PolarHBondContact O-N 2.57Å; Q257-C259 PolarHBondContact O-N 2.81Å; Q257-L260 CarbonylContact O-C 3.57Å; Q257-L260 PolarHBondContact O-N 3.18Å; Q257-E261 HydrophobicContact CG-CG 4.3Å; Q257-E261 WeakPolarHBondContact CG-OE1 3.35Å; Q257-E261 PolarHBondContact NE2-OE1 3.24Å; Q257-E261 WeakPolarHBondContact O-CB 3.49Å; Q257-E261 WeakPolarHBondContact O-CG 3.43Å; Q257-E261 PolarHBondContact O-N 3.49Å
258	R	43.9	Very low	39.7	Very low	162 Å²	162	96.4 Å²	96.4	61%	0.611	51%	0.507	S	S	*	.	H	α-helix	trans	-64	-29.1	178.7	-153.9	177.7	-166.9	-159.4	2.3	112.9	Y254 T255	Y254-R258 VanDerWaalsContact O-CB 3.27Å; Y254-R258 WeakPolarHBondContact O-CB 3.22Å; Y254-R258 PolarHBondContact O-N 3.41Å; T255-R258 PolarHBondContact O-N 2.84Å
259	C	43.2	Very low	39.2	Very low	27 Å²	27	99.8 Å²	99.8	18%	0.182	51%	0.512	C	S	.	.	H	α-helix	trans	-70.6	-39	172.1	-121.6	0	0	0	0	112.4	T255 V256 Q257 C281	T255-C259 PolarHBondContact O-N 2.79Å; T255-C259 VanDerWaalsContact O-N 3.08Å; V256-C259 WeakPolarHBondContact O-CB 3.34Å; V256-C259 PolarHBondContact O-N 3.48Å; Q257-C259 PolarHBondContact O-N 2.81Å; C259-C281 WeakPolarHBondContact CA-SG 3.4Å; C259-C281 HydrophobicContact CB-CB 3.84Å; C259-C281 WeakPolarHBondContact CB-SG 3.07Å; C259-C281 PolarHBondContact O-SG 3.35Å; C259-C281 VanDerWaalsContact SG-CA 3.52Å; C259-C281 WeakPolarHBondContact SG-CB 3.5Å; C259-C281 CovalentContact SG-SG 2.04Å; C259-C281 PolarHBondContact SG-SG 3.34Å
260	L	44.8	Very low	38.4	Very low	86 Å²	86	107.8 Å²	107.8	45%	0.45	54%	0.544	S	S	.	.	H	α-helix	trans	-74.3	-31.7	175.4	-70.3	164.8	0	0	0	113	V256 Q257 M262 E263	V256-L260 HydrophobicContact CG1-CD1 4.13Å; V256-L260 PolarHBondContact O-N 3.12Å; Q257-L260 CarbonylContact O-C 3.57Å; Q257-L260 PolarHBondContact O-N 3.18Å; L260-M262 VanDerWaalsContact C-N 3.26Å; L260-M262 PolarHBondContact O-N 2.95Å; L260-E263 PolarHBondContact O-N 3.03Å
261	E	40.2	Very low	37.8	Very low	80 Å²	80	110.9 Å²	110.9	37%	0.374	56%	0.56	S	S	.	*	H	α-helix	trans	-65.6	-26.1	177.9	-78.6	171	173.4	0	0	112.9	Q257 E263 L495	Q257-E261 HydrophobicContact CG-CG 4.3Å; Q257-E261 WeakPolarHBondContact CG-OE1 3.35Å; Q257-E261 PolarHBondContact NE2-OE1 3.24Å; Q257-E261 WeakPolarHBondContact O-CB 3.49Å; Q257-E261 WeakPolarHBondContact O-CG 3.43Å; Q257-E261 PolarHBondContact O-N 3.49Å; E261-E263 VanDerWaalsContact C-N 3.25Å; E261-E263 PolarHBondContact O-N 3.24Å; E261-L495 HydrophobicContact CG-CD2 4.4Å
262	M	42.8	Very low	37.3	Very low	150 Å²	150	112.4 Å²	112.4	74%	0.739	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-13.6	176.1	-69.8	-152.7	-62	0	0	114.4	L260	L260-M262 VanDerWaalsContact C-N 3.26Å; L260-M262 PolarHBondContact O-N 2.95Å
263	E	36.4	Very low	36.5	Very low	129 Å²	129	118.3 Å²	118.3	60%	0.603	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-9.8	-180	-72.7	-164.4	137.4	0	0	114.6	L260 E261 G278	L260-E263 PolarHBondContact O-N 3.03Å; E261-E263 VanDerWaalsContact C-N 3.25Å; E261-E263 PolarHBondContact O-N 3.24Å; E263-G278 VanDerWaalsContact OE1-CA 3.32Å; E263-G278 WeakPolarHBondContact OE1-CA 3.36Å
264	V	36.3	Very low	36	Very low	59 Å²	59	114.5 Å²	114.5	36%	0.358	60%	0.599	S	S	.	*			trans	-127.1	71.4	-167	-160.2	0	0	0	0	114.4	L495	V264-L495 HydrophobicContact CB-CD1 4.07Å; V264-L495 HydrophobicContact CB-CD2 4.04Å; V264-L495 HydrophobicContact CB-CG 4.3Å; V264-L495 HydrophobicContact CG1-CD1 3.83Å; V264-L495 HydrophobicContact CG1-CG 4.44Å; V264-L495 HydrophobicContact CG2-CD2 4.06Å; V264-L495 HydrophobicContact CG2-CG 4.3Å
265	V	31.3	Very low	35.9	Very low	133 Å²	133	113.9 Å²	113.9	81%	0.806	61%	0.605	S	S	*	*			trans	-112.8	103	154.9	180	0	0	0	0	108.8	G267	V265-G267 PolarHBondContact O-N 2.97Å
266	P	32.7	Very low	35.8	Very low	124 Å²	124	112.3 Å²	112.3	81%	0.805	59%	0.593	S	S	*	*			trans	-81.4	81.4	-179.1	32.5	-33.5	0	0	0	111.2
267	G	29.5	Very low	35.5	Very low	51 Å²	51	117.1 Å²	117.1	53%	0.526	61%	0.612	S	S	.	*			trans	-114.3	133.8	171.7	0	0	0	0	0	111.9	V265 Y269	V265-G267 PolarHBondContact O-N 2.97Å; G267-Y269 PolarHBondContact O-N 2.74Å
268	P	29.3	Very low	35.4	Very low	118 Å²	118	116.6 Å²	116.6	77%	0.766	62%	0.62	S	S	*	*	S	Bend	trans	-78.3	22.1	-169.9	31.3	-35.3	0	0	0	115.6
269	Y	27.3	Very low	35.3	Very low	205 Å²	205	115.1 Å²	115.1	80%	0.804	62%	0.615	S	S	*	*			trans	-136	49	-167.3	-68.1	-72.4	0	0	0	115.5	G267	G267-Y269 PolarHBondContact O-N 2.74Å
270	F	27.1	Very low	35.1	Very low	193 Å²	193	117.3 Å²	117.3	85%	0.846	62%	0.62	S	S	*	*			trans	-150.6	75.6	160.6	-102	-71.4	0	0	0	113.2
271	L	28	Very low	34.8	Very low	172 Å²	172	115.5 Å²	115.5	90%	0.901	61%	0.614	S	S	*	*			trans	-100	70.9	171.9	-97.4	162.7	0	0	0	110.8
272	N	27.9	Very low	34.9	Very low	156 Å²	156	118.3 Å²	118.3	83%	0.834	63%	0.631	S	S	*	*			trans	173.6	73.6	155.8	-95.1	-29.4	0	0	0	112.4
273	L	27.8	Very low	34.8	Very low	161 Å²	161	116.5 Å²	116.5	84%	0.843	62%	0.624	S	S	*	*	S	Bend	trans	-155.1	142.5	154.9	-104.7	142.3	0	0	0	108.6
274	S	33.3	Very low	34.6	Very low	72 Å²	72	115.4 Å²	115.4	50%	0.503	62%	0.622	S	S	.	*			trans	-93.5	129.2	-149.6	63	0	0	0	0	115.8	L276	S274-L276 PolarHBondContact O-N 2.85Å
275	N	41.8	Very low	34.7	Very low	122 Å²	122	115.4 Å²	115.4	65%	0.652	62%	0.622	S	S	*	*	S	Bend	trans	7.4	36.9	145.1	-53.4	12	0	0	0	121	Q369	N275-Q369 PolarHBondContact ND2-OE1 3.41Å
276	L	41.3	Very low	34.8	Very low	52 Å²	52	116.4 Å²	116.4	27%	0.272	61%	0.613	S	S	.	*			trans	-117	-22.9	177	-97.8	89.6	0	0	0	114.2	S274 Y279 Y280 K303	S274-L276 PolarHBondContact O-N 2.85Å; L276-Y279 PolarHBondContact O-N 2.83Å; L276-Y280 HydrophobicContact CB-CE2 4.01Å; L276-Y280 HydrophobicContact CD2-CE2 4.3Å; L276-Y280 WeakPolarHBondContact CD2-OH 3.2Å; L276-Y280 WeakPolarHBondContact O-CD2 3.4Å; L276-K303 HydrophobicContact CD1-CD 4.31Å
277	Q	38.6	Very low	34.5	Very low	158 Å²	158	118.7 Å²	118.7	74%	0.738	61%	0.612	S	S	*	*	H	α-helix	trans	-72.1	-33.5	-168.8	-79.5	178.1	-42.6	0	0	115.2	Y279 Y280	Q277-Y279 PolarHBondContact O-N 2.96Å; Q277-Y280 HydrophobicContact CG-CD2 4.28Å; Q277-Y280 PolarHBondContact O-N 2.84Å
278	G	40.6	Very low	34.4	Very low	39 Å²	39	127 Å²	127	40%	0.402	63%	0.63	S	S	.	*	H	α-helix	trans	-63.4	-21.4	177.6	0	0	0	0	0	115	E263	E263-G278 VanDerWaalsContact OE1-CA 3.32Å; E263-G278 WeakPolarHBondContact OE1-CA 3.36Å
279	Y	40.6	Very low	34.3	Very low	131 Å²	131	129.5 Å²	129.5	51%	0.514	63%	0.631	S	S	.	*	H	α-helix	trans	-81.8	-31.7	171.9	-77.5	-85.6	0	0	0	112.5	L276 Q277 C281 L282	L276-Y279 PolarHBondContact O-N 2.83Å; Q277-Y279 PolarHBondContact O-N 2.96Å; Y279-C281 VanDerWaalsContact C-N 3.34Å; Y279-C281 PolarHBondContact O-N 3.05Å; Y279-L282 PolarHBondContact O-N 3.23Å
280	Y	39.3	Very low	34.2	Very low	73 Å²	73	127.5 Å²	127.5	29%	0.286	63%	0.629	S	S	.	*	H	α-helix	trans	-66.2	-32.2	-175.9	-70.9	-48.9	0	0	0	113.3	L276 Q277 L282 D283 L284 F299	L276-Y280 HydrophobicContact CB-CE2 4.01Å; L276-Y280 HydrophobicContact CD2-CE2 4.3Å; L276-Y280 WeakPolarHBondContact CD2-OH 3.2Å; L276-Y280 WeakPolarHBondContact O-CD2 3.4Å; Q277-Y280 HydrophobicContact CG-CD2 4.28Å; Q277-Y280 PolarHBondContact O-N 2.84Å; Y280-L282 PolarHBondContact O-N 2.98Å; Y280-D283 PolarHBondContact O-N 2.68Å; Y280-L284 WeakPolarHBondContact O-CD1 3.43Å; Y280-L284 WeakPolarHBondContact O-CG 3.43Å; Y280-L284 PolarHBondContact O-N 3.09Å; Y280-F299 HydrophobicContact CE1-CD2 4.24Å; Y280-F299 HydrophobicContact CE1-CE1 4.46Å; Y280-F299 AromaticContact CE1-CE2 3.87Å; Y280-F299 HydrophobicContact CE1-CE2 3.87Å; Y280-F299 AromaticContact CE1-CZ 4Å; Y280-F299 HydrophobicContact CE1-CZ 4Å
281	C	39.3	Very low	34.4	Very low	47 Å²	47	123.8 Å²	123.8	32%	0.318	62%	0.624	S	S	.	*	H	α-helix	trans	-71	-12.1	179.1	-93.9	0	0	0	0	115.2	C259 Y279	C259-C281 WeakPolarHBondContact CA-SG 3.4Å; C259-C281 HydrophobicContact CB-CB 3.84Å; C259-C281 WeakPolarHBondContact CB-SG 3.07Å; C259-C281 PolarHBondContact O-SG 3.35Å; C259-C281 VanDerWaalsContact SG-CA 3.52Å; C259-C281 WeakPolarHBondContact SG-CB 3.5Å; C259-C281 CovalentContact SG-SG 2.04Å; C259-C281 PolarHBondContact SG-SG 3.34Å; Y279-C281 VanDerWaalsContact C-N 3.34Å; Y279-C281 PolarHBondContact O-N 3.05Å
282	L	42.6	Very low	34.3	Very low	139 Å²	139	120.2 Å²	120.2	73%	0.728	61%	0.613	S	S	*	*	H	α-helix	trans	-90.5	-21	172.9	-96.3	152.6	0	0	0	113.4	Y279 Y280	Y279-L282 PolarHBondContact O-N 3.23Å; Y280-L282 PolarHBondContact O-N 2.98Å
283	D	38.7	Very low	34.4	Very low	112 Å²	112	117.1 Å²	117.1	60%	0.599	61%	0.61	S	S	*	*	H	α-helix	trans	-102.4	-8.2	-177.6	-94.1	-28.2	0	0	0	114.2	Y280 T285	Y280-D283 PolarHBondContact O-N 2.68Å; D283-T285 VanDerWaalsContact C-N 3.29Å; D283-T285 PolarHBondContact O-N 3.07Å
284	L	33.6	Very low	34.9	Very low	106 Å²	106	118.3 Å²	118.3	56%	0.555	60%	0.603	S	S	*	*			trans	-76.8	70.1	-178.6	-80.7	165.5	0	0	0	113.6	Y280	Y280-L284 WeakPolarHBondContact O-CD1 3.43Å; Y280-L284 WeakPolarHBondContact O-CG 3.43Å; Y280-L284 PolarHBondContact O-N 3.09Å
285	T	37.4	Very low	35	Very low	59 Å²	59	119.9 Å²	119.9	36%	0.362	61%	0.605	S	S	.	*			trans	-118.3	26.8	160.8	59.6	0	0	0	0	112.3	K52 D283	K52-T285 HydrophobicContact CB-CG2 4.25Å; K52-T285 PolarHBondContact NZ-O 3.09Å; D283-T285 VanDerWaalsContact C-N 3.29Å; D283-T285 PolarHBondContact O-N 3.07Å
286	Y	34.2	Very low	35	Very low	155 Å²	155	119.7 Å²	119.7	61%	0.608	60%	0.604	S	S	*	*			trans	-126.8	62.1	-178.2	-108.9	-75.6	0	0	0	112.2
287	E	26.7	Very low	34.8	Very low	171 Å²	171	124.2 Å²	124.2	80%	0.799	62%	0.624	S	S	*	*			trans	-126.8	95.2	160.1	-74.1	-161.8	137	0	0	109.9
288	Y	27	Very low	34.9	Very low	227 Å²	227	120.6 Å²	120.6	89%	0.89	61%	0.609	S	S	*	*	S	Bend	trans	-178.1	75.4	131.7	-107	-74.7	0	0	0	109.8
289	E	26.6	Very low	35	Very low	169 Å²	169	122.1 Å²	122.1	79%	0.79	60%	0.604	S	S	*	*	S	Bend	trans	178.9	139	131.1	-96.9	-173.4	167.7	0	0	109.4
290	Q	26.1	Very low	35.2	Very low	164 Å²	164	122.7 Å²	122.7	77%	0.766	61%	0.61	S	S	*	*			trans	-84.9	163.8	-162.7	-105.6	-167.2	18.9	0	0	113.7
291	P	30.4	Very low	35.2	Very low	115 Å²	115	121.2 Å²	121.2	75%	0.747	61%	0.612	S	S	*	*			cis	-133.7	144.3	43.2	36.3	-17.1	0	0	0	118.2	A293	P291-A293 PolarHBondContact O-N 3.07Å
292	S	26.7	Very low	35.4	Very low	96 Å²	96	123.2 Å²	123.2	67%	0.671	62%	0.617	S	S	*	*			trans	-89.3	42.7	-166.5	47.3	0	0	0	0	115.8
293	A	29.9	Very low	35.4	Very low	92 Å²	92	120.8 Å²	120.8	76%	0.76	60%	0.6	S	S	*	*	S	Bend	trans	-125.7	6.6	-171.7	0	0	0	0	0	117	P291	P291-A293 PolarHBondContact O-N 3.07Å
294	R	38.4	Very low	35.4	Very low	186 Å²	186	122 Å²	122	70%	0.702	60%	0.6	S	S	*	*	S	Bend	trans	-134.2	-12.2	-177.4	-88	-177.1	173.8	167.4	-0.8	117.5	D296 E297 I298	R294-D296 PolarHBondContact O-N 3.08Å; R294-E297 PolarHBondContact O-N 3.35Å; R294-I298 HydrophobicContact CB-CD1 4.37Å; R294-I298 WeakPolarHBondContact O-CG1 3.27Å; R294-I298 PolarHBondContact O-N 3.16Å
295	L	35.7	Very low	35.7	Very low	105 Å²	105	119.8 Å²	119.8	55%	0.55	59%	0.589	S	S	.	*	H	α-helix	trans	-66.1	-35.9	-173.3	-87.3	129.6	0	0	0	113.9	E297 I298 F299	L295-E297 VanDerWaalsContact C-N 3.32Å; L295-E297 PolarHBondContact O-N 3.41Å; L295-I298 PolarHBondContact O-N 3.16Å; L295-I298 VanDerWaalsContact O-N 3.16Å; L295-F299 HydrophobicContact CD2-CD2 4.39Å; L295-F299 HydrophobicContact CD2-CE2 3.75Å; L295-F299 WeakPolarHBondContact O-CD2 3.36Å; L295-F299 PolarHBondContact O-N 3.49Å
296	D	40.7	Very low	35.9	Very low	117 Å²	117	121.5 Å²	121.5	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-65.9	-33.6	177.9	-119.8	23.4	0	0	0	112.9	R294 K300	R294-D296 PolarHBondContact O-N 3.08Å; D296-K300 VanDerWaalsContact O-CB 3.31Å; D296-K300 WeakPolarHBondContact O-CB 3.15Å; D296-K300 WeakPolarHBondContact O-CG 3.47Å; D296-K300 PolarHBondContact O-N 3.1Å
297	E	38.7	Very low	36.2	Very low	148 Å²	148	119.2 Å²	119.2	69%	0.692	59%	0.587	S	S	*	*	H	α-helix	trans	-74	-36.9	171.3	-71.8	-154.2	137	0	0	111.9	R294 L295 A301	R294-E297 PolarHBondContact O-N 3.35Å; L295-E297 VanDerWaalsContact C-N 3.32Å; L295-E297 PolarHBondContact O-N 3.41Å; E297-A301 WeakPolarHBondContact O-CA 3.27Å; E297-A301 WeakPolarHBondContact O-CB 3.3Å; E297-A301 PolarHBondContact O-N 3.2Å
298	I	39	Very low	36.7	Very low	81 Å²	81	115.1 Å²	115.1	42%	0.415	57%	0.571	S	S	.	*	H	α-helix	trans	-62.5	-48	175.3	-68.8	165.2	0	0	0	110.1	R294 L295 A301 Q302	R294-I298 HydrophobicContact CB-CD1 4.37Å; R294-I298 WeakPolarHBondContact O-CG1 3.27Å; R294-I298 PolarHBondContact O-N 3.16Å; L295-I298 PolarHBondContact O-N 3.16Å; L295-I298 VanDerWaalsContact O-N 3.16Å; I298-A301 PolarHBondContact O-N 3.25Å; I298-Q302 WeakPolarHBondContact O-CB 3.27Å; I298-Q302 PolarHBondContact O-N 3.27Å
299	F	42.6	Very low	37.2	Very low	71 Å²	71	109.3 Å²	109.3	31%	0.311	55%	0.547	S	S	.	.	H	α-helix	trans	-71	-35.8	178.5	-76.3	-64.5	0	0	0	113.3	Y280 L295 Q302 K303	Y280-F299 HydrophobicContact CE1-CD2 4.24Å; Y280-F299 HydrophobicContact CE1-CE1 4.46Å; Y280-F299 AromaticContact CE1-CE2 3.87Å; Y280-F299 HydrophobicContact CE1-CE2 3.87Å; Y280-F299 AromaticContact CE1-CZ 4Å; Y280-F299 HydrophobicContact CE1-CZ 4Å; L295-F299 HydrophobicContact CD2-CD2 4.39Å; L295-F299 HydrophobicContact CD2-CE2 3.75Å; L295-F299 WeakPolarHBondContact O-CD2 3.36Å; L295-F299 PolarHBondContact O-N 3.49Å; F299-Q302 PolarHBondContact O-N 2.86Å; F299-K303 VanDerWaalsContact O-CB 3.27Å; F299-K303 WeakPolarHBondContact O-CB 3.29Å; F299-K303 PolarHBondContact O-N 3.47Å
300	K	45.4	Very low	37.8	Very low	144 Å²	144	104.4 Å²	104.4	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-64	-42.1	169.1	-83	173	179.6	157.1	0	111.8	D296 K304	D296-K300 VanDerWaalsContact O-CB 3.31Å; D296-K300 WeakPolarHBondContact O-CB 3.15Å; D296-K300 WeakPolarHBondContact O-CG 3.47Å; D296-K300 PolarHBondContact O-N 3.1Å; K300-K304 WeakPolarHBondContact O-CB 3.26Å; K300-K304 PolarHBondContact O-N 3Å
301	A	39.8	Very low	38.1	Very low	41 Å²	41	103.5 Å²	103.5	34%	0.339	52%	0.52	S	S	.	.	H	α-helix	trans	-64.6	-43.9	176.1	0	0	0	0	0	110.7	E297 I298 K304 L305	E297-A301 WeakPolarHBondContact O-CA 3.27Å; E297-A301 WeakPolarHBondContact O-CB 3.3Å; E297-A301 PolarHBondContact O-N 3.2Å; I298-A301 PolarHBondContact O-N 3.25Å; A301-K304 CarbonylContact O-C 3.55Å; A301-K304 PolarHBondContact O-N 3.48Å; A301-L305 WeakPolarHBondContact O-CB 3.44Å; A301-L305 PolarHBondContact O-N 3.13Å
302	Q	42.5	Very low	38.1	Very low	89 Å²	89	104.6 Å²	104.6	42%	0.416	52%	0.517	S	S	.	.	H	α-helix	trans	-64.1	-48.6	178.9	-171.5	171.3	-3.3	0	0	111.5	I298 F299 K304 L305 E306	I298-Q302 WeakPolarHBondContact O-CB 3.27Å; I298-Q302 PolarHBondContact O-N 3.27Å; F299-Q302 PolarHBondContact O-N 2.86Å; Q302-K304 VanDerWaalsContact C-N 3.28Å; Q302-K304 PolarHBondContact O-N 2.91Å; Q302-L305 CarbonylContact O-C 3.57Å; Q302-L305 PolarHBondContact O-N 3.05Å; Q302-L305 VanDerWaalsContact O-N 3.11Å; Q302-E306 WeakPolarHBondContact O-CB 3.16Å; Q302-E306 WeakPolarHBondContact O-CG 3.35Å; Q302-E306 PolarHBondContact O-N 3.38Å
303	K	43.2	Very low	38.6	Very low	88 Å²	88	104 Å²	104	38%	0.383	51%	0.509	S	S	.	.	H	α-helix	trans	-60.9	-35.5	174.1	-167.8	173.4	-172.6	175.2	0	112.4	L276 F299 Q307	L276-K303 HydrophobicContact CD1-CD 4.31Å; F299-K303 VanDerWaalsContact O-CB 3.27Å; F299-K303 WeakPolarHBondContact O-CB 3.29Å; F299-K303 PolarHBondContact O-N 3.47Å; K303-Q307 WeakPolarHBondContact O-CB 3.44Å; K303-Q307 VanDerWaalsContact O-CG 3.31Å; K303-Q307 WeakPolarHBondContact O-CG 3.4Å; K303-Q307 PolarHBondContact O-N 2.81Å
304	K	39.6	Very low	38.7	Very low	137 Å²	137	107.9 Å²	107.9	60%	0.596	51%	0.511	S	S	*	.	H	α-helix	trans	-78.4	-26.2	176.2	-160.9	171.3	-169.7	174.8	0	112.7	K300 A301 Q302 L308	K300-K304 WeakPolarHBondContact O-CB 3.26Å; K300-K304 PolarHBondContact O-N 3Å; A301-K304 CarbonylContact O-C 3.55Å; A301-K304 PolarHBondContact O-N 3.48Å; Q302-K304 VanDerWaalsContact C-N 3.28Å; Q302-K304 PolarHBondContact O-N 2.91Å; K304-L308 HydrophobicContact CG-CD1 4.47Å; K304-L308 VanDerWaalsContact O-CB 3.28Å; K304-L308 WeakPolarHBondContact O-CB 3.44Å; K304-L308 WeakPolarHBondContact O-CD1 3.4Å; K304-L308 WeakPolarHBondContact O-CG 3.44Å; K304-L308 PolarHBondContact O-N 3.18Å
305	L	39.8	Very low	38.4	Very low	60 Å²	60	102.6 Å²	102.6	31%	0.314	50%	0.5	S	S	.	.	H	α-helix	trans	-83.7	-27.6	175.7	-159.8	129.2	0	0	0	111.4	L4 A301 Q302 R309	L4-L305 HydrophobicContact CD1-CD1 3.47Å; L4-L305 VanDerWaalsContact CD1-CD1 3.47Å; L4-L305 HydrophobicContact CD2-CD1 4.13Å; L4-L305 HydrophobicContact CG-CD1 4.45Å; A301-L305 WeakPolarHBondContact O-CB 3.44Å; A301-L305 PolarHBondContact O-N 3.13Å; Q302-L305 CarbonylContact O-C 3.57Å; Q302-L305 PolarHBondContact O-N 3.05Å; Q302-L305 VanDerWaalsContact O-N 3.11Å; L305-R309 HydrophobicContact CD2-CG 4.44Å; L305-R309 WeakPolarHBondContact O-CB 3.5Å; L305-R309 WeakPolarHBondContact O-CG 3.46Å; L305-R309 PolarHBondContact O-N 2.99Å
306	E	41.3	Very low	38.3	Very low	95 Å²	95	101 Å²	101	44%	0.444	49%	0.491	S	S	.	.	H	α-helix	trans	-66.2	-52.6	162.2	-76	172.4	174.7	0	0	109.7	Q302 L308 R309 E310	Q302-E306 WeakPolarHBondContact O-CB 3.16Å; Q302-E306 WeakPolarHBondContact O-CG 3.35Å; Q302-E306 PolarHBondContact O-N 3.38Å; E306-L308 VanDerWaalsContact C-N 3.3Å; E306-L308 PolarHBondContact O-N 3.4Å; E306-R309 CarbonylContact O-C 3.56Å; E306-R309 PolarHBondContact O-N 2.92Å; E306-E310 WeakPolarHBondContact O-CB 3.4Å; E306-E310 VanDerWaalsContact O-CG 3.29Å; E306-E310 WeakPolarHBondContact O-CG 3.38Å; E306-E310 PolarHBondContact O-N 3.14Å
307	Q	40.6	Very low	38.1	Very low	107 Å²	107	98.4 Å²	98.4	50%	0.5	48%	0.481	S	S	.	.	H	α-helix	trans	-55.7	-41	173.6	-76.6	177.2	-26.8	0	0	113.1	K303 Q311	K303-Q307 WeakPolarHBondContact O-CB 3.44Å; K303-Q307 VanDerWaalsContact O-CG 3.31Å; K303-Q307 WeakPolarHBondContact O-CG 3.4Å; K303-Q307 PolarHBondContact O-N 2.81Å; Q307-Q311 WeakPolarHBondContact O-CB 3.23Å; Q307-Q311 VanDerWaalsContact O-CG 3.27Å; Q307-Q311 WeakPolarHBondContact O-CG 3.39Å; Q307-Q311 PolarHBondContact O-N 2.81Å
308	L	35.8	Very low	38	Very low	85 Å²	85	98.4 Å²	98.4	45%	0.445	48%	0.475	S	S	.	.	H	α-helix	trans	-74.8	-29.7	175.9	-75	165	0	0	0	113.1	K304 E306 M312	K304-L308 HydrophobicContact CG-CD1 4.47Å; K304-L308 VanDerWaalsContact O-CB 3.28Å; K304-L308 WeakPolarHBondContact O-CB 3.44Å; K304-L308 WeakPolarHBondContact O-CD1 3.4Å; K304-L308 WeakPolarHBondContact O-CG 3.44Å; K304-L308 PolarHBondContact O-N 3.18Å; E306-L308 VanDerWaalsContact C-N 3.3Å; E306-L308 PolarHBondContact O-N 3.4Å; L308-M312 WeakPolarHBondContact O-CB 3.23Å; L308-M312 WeakPolarHBondContact O-CE 3.5Å; L308-M312 WeakPolarHBondContact O-CG 3.48Å; L308-M312 PolarHBondContact O-N 3.03Å
309	R	39	Very low	37.8	Very low	106 Å²	106	99.8 Å²	99.8	40%	0.4	48%	0.48	S	S	.	.	H	α-helix	trans	-69.8	-39.7	170.4	-87.9	175.7	158.8	175.7	-7.6	111.3	L305 E306 Q311 M312 V313	L305-R309 HydrophobicContact CD2-CG 4.44Å; L305-R309 WeakPolarHBondContact O-CB 3.5Å; L305-R309 WeakPolarHBondContact O-CG 3.46Å; L305-R309 PolarHBondContact O-N 2.99Å; E306-R309 CarbonylContact O-C 3.56Å; E306-R309 PolarHBondContact O-N 2.92Å; R309-Q311 VanDerWaalsContact C-N 3.3Å; R309-M312 PolarHBondContact O-N 3.38Å; R309-M312 VanDerWaalsContact O-N 3.15Å; R309-V313 WeakPolarHBondContact O-CG2 3.4Å; R309-V313 PolarHBondContact O-N 3.41Å
310	E	38	Very low	37.5	Very low	66 Å²	66	97.9 Å²	97.9	31%	0.308	47%	0.472	S	S	.	.	H	α-helix	trans	-66.5	-32.7	174.2	-70.9	178.6	144.6	0	0	111.2	E306 R318	E306-E310 WeakPolarHBondContact O-CB 3.4Å; E306-E310 VanDerWaalsContact O-CG 3.29Å; E306-E310 WeakPolarHBondContact O-CG 3.38Å; E306-E310 PolarHBondContact O-N 3.14Å; E310-R318 VanDerWaalsContact CD-NH2 3.3Å; E310-R318 IonicContact OE1-CZ 2.65Å; E310-R318 VanDerWaalsContact OE1-CZ 3.24Å; E310-R318 IonicContact OE1-NE 2.89Å; E310-R318 PolarHBondContact OE1-NE 2.92Å; E310-R318 VanDerWaalsContact OE1-NE 3.13Å; E310-R318 IonicContact OE1-NH2 2.62Å; E310-R318 PolarHBondContact OE1-NH2 2.77Å; E310-R318 IonicContact OE2-CZ 3.12Å; E310-R318 IonicContact OE2-NE 3.63Å; E310-R318 IonicContact OE2-NH2 3.23Å; E310-R318 PolarHBondContact OE2-NH2 2.78Å
311	Q	32.2	Very low	37	Very low	144 Å²	144	92.2 Å²	92.2	67%	0.673	45%	0.449	S	S	*	.	H	α-helix	trans	-73.7	-24.7	169.9	-74.4	174.8	-2.8	0	0	114.1	Q307 R309	Q307-Q311 WeakPolarHBondContact O-CB 3.23Å; Q307-Q311 VanDerWaalsContact O-CG 3.27Å; Q307-Q311 WeakPolarHBondContact O-CG 3.39Å; Q307-Q311 PolarHBondContact O-N 2.81Å; R309-Q311 VanDerWaalsContact C-N 3.3Å
312	M	32.2	Very low	37	Very low	138 Å²	138	96 Å²	96	68%	0.68	46%	0.459	S	S	*	.	H	α-helix	trans	-93.8	-25.7	178.6	-75.7	-170.5	-71	0	0	114.1	L308 R309 H314	L308-M312 WeakPolarHBondContact O-CB 3.23Å; L308-M312 WeakPolarHBondContact O-CE 3.5Å; L308-M312 WeakPolarHBondContact O-CG 3.48Å; L308-M312 PolarHBondContact O-N 3.03Å; R309-M312 PolarHBondContact O-N 3.38Å; R309-M312 VanDerWaalsContact O-N 3.15Å; M312-H314 PolarHBondContact O-N 2.97Å
313	V	36.8	Very low	36.8	Very low	85 Å²	85	94.4 Å²	94.4	52%	0.515	45%	0.451	S	S	.	.	S	Bend	trans	-84	98.3	168.5	177.6	0	0	0	0	107.5	R309 T315	R309-V313 WeakPolarHBondContact O-CG2 3.4Å; R309-V313 PolarHBondContact O-N 3.41Å; V313-T315 VanDerWaalsContact C-N 3.25Å; V313-T315 PolarHBondContact O-N 3.25Å
314	H	32.2	Very low	36.5	Very low	172 Å²	172	94.1 Å²	94.1	80%	0.796	45%	0.448	S	S	*	.	S	Bend	trans	-62.4	78.1	177	-90.5	-63.9	0	0	0	113.2	M312	M312-H314 PolarHBondContact O-N 2.97Å
315	T	31.3	Very low	36.5	Very low	76 Å²	76	91.8 Å²	91.8	47%	0.466	44%	0.439	S	S	.	.			trans	173.9	109.2	144.4	34.6	0	0	0	0	106.5	V313 P317	V313-T315 VanDerWaalsContact C-N 3.25Å; V313-T315 PolarHBondContact O-N 3.25Å; T315-P317 VanDerWaalsContact O-CD 3.24Å; T315-P317 WeakPolarHBondContact O-CD 3.48Å
316	D	33.1	Very low	36.6	Very low	70 Å²	70	92 Å²	92	37%	0.374	45%	0.445	S	S	.	.			trans	-71.2	114	173.7	-173.7	-15.1	0	0	0	109.7	R318	D316-R318 PolarHBondContact O-N 2.96Å; D316-R318 VanDerWaalsContact OD1-CB 3.26Å; D316-R318 WeakPolarHBondContact OD1-CB 3.26Å; D316-R318 VanDerWaalsContact OD1-CG 3.31Å; D316-R318 WeakPolarHBondContact OD1-CG 3.08Å; D316-R318 PolarHBondContact OD1-N 2.98Å
317	P	36.3	Very low	36.4	Very low	64 Å²	64	92.3 Å²	92.3	42%	0.416	45%	0.449	S	S	.	.	H	α-helix	trans	-68.8	-21	-178.2	-17.2	32.4	0	0	0	112.9	T315 I320 D321	T315-P317 VanDerWaalsContact O-CD 3.24Å; T315-P317 WeakPolarHBondContact O-CD 3.48Å; P317-I320 PolarHBondContact O-N 3.29Å; P317-D321 PolarHBondContact O-N 3.46Å
318	R	37	Very low	36.3	Very low	147 Å²	147	91.8 Å²	91.8	56%	0.555	44%	0.444	S	S	*	.	H	α-helix	trans	-72.6	-38.4	-167.7	-55.4	172.6	-176	-144.1	4.3	112	E310 D316 D321 E322	E310-R318 VanDerWaalsContact CD-NH2 3.3Å; E310-R318 IonicContact OE1-CZ 2.65Å; E310-R318 VanDerWaalsContact OE1-CZ 3.24Å; E310-R318 IonicContact OE1-NE 2.89Å; E310-R318 PolarHBondContact OE1-NE 2.92Å; E310-R318 VanDerWaalsContact OE1-NE 3.13Å; E310-R318 IonicContact OE1-NH2 2.62Å; E310-R318 PolarHBondContact OE1-NH2 2.77Å; E310-R318 IonicContact OE2-CZ 3.12Å; E310-R318 IonicContact OE2-NE 3.63Å; E310-R318 IonicContact OE2-NH2 3.23Å; E310-R318 PolarHBondContact OE2-NH2 2.78Å; D316-R318 PolarHBondContact O-N 2.96Å; D316-R318 VanDerWaalsContact OD1-CB 3.26Å; D316-R318 WeakPolarHBondContact OD1-CB 3.26Å; D316-R318 VanDerWaalsContact OD1-CG 3.31Å; D316-R318 WeakPolarHBondContact OD1-CG 3.08Å; D316-R318 PolarHBondContact OD1-N 2.98Å; R318-D321 PolarHBondContact O-N 3.34Å; R318-E322 PolarHBondContact O-N 2.81Å
319	H	35.7	Very low	36.6	Very low	111 Å²	111	92.7 Å²	92.7	51%	0.514	45%	0.449	S	S	.	.	H	α-helix	trans	-77.3	-32.5	175.2	-87.7	-25.2	0	0	0	113.5	D321 E322 K323 D1820	H319-D321 PolarHBondContact O-N 3.45Å; H319-E322 IonicContact CE1-OE2 2.67Å; H319-E322 PolarHBondContact CE1-OE2 3.24Å; H319-E322 IonicContact ND1-OE2 3.98Å; H319-E322 PolarHBondContact ND1-OE2 2.82Å; H319-E322 PolarHBondContact O-N 3.38Å; H319-K323 PolarHBondContact O-N 3.33Å; H319-D1820 HydrophobicContact CB-CB 4.25Å
320	I	35.5	Very low	36.5	Very low	31 Å²	31	94.2 Å²	94.2	16%	0.159	46%	0.458	C	S	.	.	H	α-helix	trans	-55.8	-37.6	169.8	-64.9	173.8	0	0	0	109.6	P317 R324 D1820	P317-I320 PolarHBondContact O-N 3.29Å; I320-R324 HydrophobicContact CG2-CG 4.34Å; I320-R324 WeakPolarHBondContact O-CB 3.42Å; I320-R324 WeakPolarHBondContact O-CD 3.49Å; I320-R324 WeakPolarHBondContact O-CG 3.49Å; I320-R324 PolarHBondContact O-N 2.93Å; I320-D1820 VanDerWaalsContact CG1-OD2 3.25Å; I320-D1820 WeakPolarHBondContact CG1-OD2 3.4Å
321	D	36.2	Very low	36.6	Very low	25 Å²	25	97.8 Å²	97.8	13%	0.134	47%	0.474	C	S	.	.	H	α-helix	trans	-74.5	-39.3	179.7	-86.5	-15.2	0	0	0	114.8	P317 R318 H319 R324 Q325 R372	P317-D321 PolarHBondContact O-N 3.46Å; R318-D321 PolarHBondContact O-N 3.34Å; H319-D321 PolarHBondContact O-N 3.45Å; D321-R324 IonicContact OD1-NH1 2.75Å; D321-R324 PolarHBondContact OD1-NH1 2.79Å; D321-Q325 WeakPolarHBondContact O-CG 3.46Å; D321-Q325 PolarHBondContact O-N 2.98Å; D321-R372 WeakPolarHBondContact OD1-CD 3.23Å; D321-R372 IonicContact OD1-CZ 2.74Å; D321-R372 IonicContact OD1-NE 2.64Å; D321-R372 IonicContact OD1-NH1 3.78Å; D321-R372 PolarHBondContact OD1-NH1 3.29Å; D321-R372 WeakPolarHBondContact OD2-CB 3.46Å; D321-R372 WeakPolarHBondContact OD2-CD 3.27Å
322	E	39.6	Very low	36.9	Very low	120 Å²	120	97.8 Å²	97.8	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-63.8	-41.5	173.1	-71.7	-178.3	135.3	0	0	111.6	R318 H319 Q325 S326	R318-E322 PolarHBondContact O-N 2.81Å; H319-E322 IonicContact CE1-OE2 2.67Å; H319-E322 PolarHBondContact CE1-OE2 3.24Å; H319-E322 IonicContact ND1-OE2 3.98Å; H319-E322 PolarHBondContact ND1-OE2 2.82Å; H319-E322 PolarHBondContact O-N 3.38Å; E322-Q325 WeakPolarHBondContact O-CB 3.47Å; E322-Q325 PolarHBondContact O-N 2.9Å; E322-S326 PolarHBondContact O-N 2.9Å
323	K	36.8	Very low	37.1	Very low	55 Å²	55	97.9 Å²	97.9	24%	0.239	47%	0.469	C	S	.	.	H	α-helix	trans	-75.2	-35.8	179.6	-143.4	166.6	-178.3	178.9	0	112	H319 Q325 S326 L327 Q1819 D1820	H319-K323 PolarHBondContact O-N 3.33Å; K323-Q325 VanDerWaalsContact C-N 3.34Å; K323-Q325 PolarHBondContact O-N 3.36Å; K323-S326 PolarHBondContact O-N 3.05Å; K323-S326 PolarHBondContact O-OG 3.09Å; K323-L327 PolarHBondContact O-N 3.34Å; K323-Q1819 WeakPolarHBondContact CD-O 3.35Å; K323-Q1819 VanDerWaalsContact CE-O 3.29Å; K323-Q1819 WeakPolarHBondContact CE-O 3.34Å; K323-Q1819 PolarHBondContact NZ-O 3.47Å; K323-D1820 WeakPolarHBondContact CD-O 3.46Å; K323-D1820 PolarHBondContact NZ-O 3.18Å
324	R	38.3	Very low	37	Very low	82 Å²	82	98.8 Å²	98.8	31%	0.309	47%	0.471	S	S	.	.	H	α-helix	trans	-55.4	-45.7	164.8	-83.3	170.4	167.8	177.9	-10.3	111.6	I320 D321 S326 L327 Y328	I320-R324 HydrophobicContact CG2-CG 4.34Å; I320-R324 WeakPolarHBondContact O-CB 3.42Å; I320-R324 WeakPolarHBondContact O-CD 3.49Å; I320-R324 WeakPolarHBondContact O-CG 3.49Å; I320-R324 PolarHBondContact O-N 2.93Å; D321-R324 IonicContact OD1-NH1 2.75Å; D321-R324 PolarHBondContact OD1-NH1 2.79Å; R324-S326 VanDerWaalsContact C-N 3.34Å; R324-S326 PolarHBondContact O-N 3.16Å; R324-L327 PolarHBondContact O-N 3.23Å; R324-Y328 WeakPolarHBondContact O-CB 3.31Å; R324-Y328 PolarHBondContact O-N 3.47Å
325	Q	39.6	Very low	37.4	Very low	88 Å²	88	95.1 Å²	95.1	41%	0.411	47%	0.465	S	S	.	.	H	α-helix	trans	-60.8	-42.5	175.4	-78.3	-176.4	13.1	0	0	111.6	D321 E322 K323 L327 Y328 L329	D321-Q325 WeakPolarHBondContact O-CG 3.46Å; D321-Q325 PolarHBondContact O-N 2.98Å; E322-Q325 WeakPolarHBondContact O-CB 3.47Å; E322-Q325 PolarHBondContact O-N 2.9Å; K323-Q325 VanDerWaalsContact C-N 3.34Å; K323-Q325 PolarHBondContact O-N 3.36Å; Q325-L327 PolarHBondContact O-N 2.94Å; Q325-Y328 PolarHBondContact O-N 3.04Å; Q325-L329 VanDerWaalsContact O-CB 3.3Å; Q325-L329 WeakPolarHBondContact O-CB 3.08Å; Q325-L329 PolarHBondContact O-N 3.36Å
326	S	41.8	Very low	37.7	Very low	65 Å²	65	96.8 Å²	96.8	46%	0.455	48%	0.475	S	S	.	.	H	α-helix	trans	-62	-40.8	177.8	83.5	0	0	0	0	113	E322 K323 R324 K330	E322-S326 PolarHBondContact O-N 2.9Å; K323-S326 PolarHBondContact O-N 3.05Å; K323-S326 PolarHBondContact O-OG 3.09Å; R324-S326 VanDerWaalsContact C-N 3.34Å; R324-S326 PolarHBondContact O-N 3.16Å; S326-K330 WeakPolarHBondContact O-CB 3.5Å; S326-K330 PolarHBondContact O-N 2.89Å
327	L	36	Very low	37.6	Very low	101 Å²	101	102.2 Å²	102.2	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-73.4	-40.6	178.4	-88.6	158.2	0	0	0	112.3	K323 R324 Q325 K330 H331	K323-L327 PolarHBondContact O-N 3.34Å; R324-L327 PolarHBondContact O-N 3.23Å; Q325-L327 PolarHBondContact O-N 2.94Å; L327-K330 WeakPolarHBondContact O-CB 3.25Å; L327-K330 PolarHBondContact O-N 3.24Å; L327-H331 PolarHBondContact O-N 3.31Å
328	Y	39.4	Very low	37.3	Very low	96 Å²	96	101.6 Å²	101.6	38%	0.376	50%	0.5	S	S	.	.	H	α-helix	trans	-62	-45	171.4	-112.5	-104.5	0	0	0	111	R324 Q325 K330 H331 F332 A536	R324-Y328 WeakPolarHBondContact O-CB 3.31Å; R324-Y328 PolarHBondContact O-N 3.47Å; Q325-Y328 PolarHBondContact O-N 3.04Å; Y328-K330 VanDerWaalsContact C-N 3.26Å; Y328-K330 PolarHBondContact O-N 3.23Å; Y328-H331 PolarHBondContact O-N 3.08Å; Y328-F332 WeakPolarHBondContact O-CB 3.37Å; Y328-F332 PolarHBondContact O-N 3.42Å; Y328-A536 PolarHBondContact OH-O 2.78Å
329	L	41.4	Very low	37	Very low	105 Å²	105	101.9 Å²	101.9	55%	0.55	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-29.7	174.9	-90.5	155.3	0	0	0	112.9	Q325 K333	Q325-L329 VanDerWaalsContact O-CB 3.3Å; Q325-L329 WeakPolarHBondContact O-CB 3.08Å; Q325-L329 PolarHBondContact O-N 3.36Å; L329-K333 VanDerWaalsContact O-CB 3.31Å; L329-K333 WeakPolarHBondContact O-CB 3.37Å; L329-K333 WeakPolarHBondContact O-CG 3.43Å; L329-K333 PolarHBondContact O-N 2.83Å
330	K	37.7	Very low	36.8	Very low	138 Å²	138	103.4 Å²	103.4	60%	0.6	53%	0.53	S	S	*	.	H	α-helix	trans	-70.6	-54.1	172.9	-129.2	174.4	-178.6	177.5	0	111.2	S326 L327 Y328 F332 K333 D334	S326-K330 WeakPolarHBondContact O-CB 3.5Å; S326-K330 PolarHBondContact O-N 2.89Å; L327-K330 WeakPolarHBondContact O-CB 3.25Å; L327-K330 PolarHBondContact O-N 3.24Å; Y328-K330 VanDerWaalsContact C-N 3.26Å; Y328-K330 PolarHBondContact O-N 3.23Å; K330-F332 VanDerWaalsContact C-N 3.28Å; K330-F332 PolarHBondContact O-N 3.27Å; K330-K333 PolarHBondContact O-N 3.38Å; K330-D334 WeakPolarHBondContact O-CB 3.38Å; K330-D334 PolarHBondContact O-N 2.73Å
331	H	39.2	Very low	36.6	Very low	141 Å²	141	107.8 Å²	107.8	65%	0.653	56%	0.558	S	S	*	*	H	α-helix	trans	-60.3	-36.4	176.5	-100.8	-71.4	0	0	0	112.7	L327 Y328 S335	L327-H331 PolarHBondContact O-N 3.31Å; Y328-H331 PolarHBondContact O-N 3.08Å; H331-S335 WeakPolarHBondContact O-CB 3.47Å; H331-S335 PolarHBondContact O-N 3.23Å
332	F	38.8	Very low	36.5	Very low	143 Å²	143	116.4 Å²	116.4	63%	0.627	60%	0.595	S	S	*	*	H	α-helix	trans	-72.6	-28.5	176	-156.3	-87.2	0	0	0	112.6	Y328 K330 V336	Y328-F332 WeakPolarHBondContact O-CB 3.37Å; Y328-F332 PolarHBondContact O-N 3.42Å; K330-F332 VanDerWaalsContact C-N 3.28Å; K330-F332 PolarHBondContact O-N 3.27Å; F332-V336 WeakPolarHBondContact O-CB 3.48Å; F332-V336 WeakPolarHBondContact O-CG2 3.3Å
333	K	35.8	Very low	36.1	Very low	141 Å²	141	120.3 Å²	120.3	61%	0.613	61%	0.613	S	S	*	*	H	α-helix	trans	-77.5	-39.4	170.6	-87.1	-179.6	172.8	175.7	0	113	L329 K330 K337	L329-K333 VanDerWaalsContact O-CB 3.31Å; L329-K333 WeakPolarHBondContact O-CB 3.37Å; L329-K333 WeakPolarHBondContact O-CG 3.43Å; L329-K333 PolarHBondContact O-N 2.83Å; K330-K333 PolarHBondContact O-N 3.38Å; K333-K337 WeakPolarHBondContact O-CG 3.49Å
334	D	36.1	Very low	35.9	Very low	103 Å²	103	121 Å²	121	55%	0.551	64%	0.636	S	S	*	*	H	α-helix	trans	-80.1	-38.3	-175	-65.9	-23.5	0	0	0	111.3	K330 V336 K337	K330-D334 WeakPolarHBondContact O-CB 3.38Å; K330-D334 PolarHBondContact O-N 2.73Å; D334-V336 PolarHBondContact O-N 3.01Å; D334-K337 PolarHBondContact O-N 2.61Å; D334-K337 VanDerWaalsContact O-N 3.17Å
335	S	39.3	Very low	35.7	Very low	96 Å²	96	124.1 Å²	124.1	67%	0.671	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-13.2	174.4	-167.6	0	0	0	0	114	H331	H331-S335 WeakPolarHBondContact O-CB 3.47Å; H331-S335 PolarHBondContact O-N 3.23Å
336	V	37.4	Very low	35.6	Very low	111 Å²	111	126 Å²	126	67%	0.673	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-4.9	175	173.4	0	0	0	0	111.7	F332 D334	F332-V336 WeakPolarHBondContact O-CB 3.48Å; F332-V336 WeakPolarHBondContact O-CG2 3.3Å; D334-V336 PolarHBondContact O-N 3.01Å
337	K	30.9	Very low	35.9	Very low	184 Å²	184	128.4 Å²	128.4	80%	0.8	68%	0.683	S	S	*	*	S	Bend	trans	-111.3	5.7	-178.4	-77.9	-171.1	172.2	-167.7	0	115.6	K333 D334	K333-K337 WeakPolarHBondContact O-CG 3.49Å; D334-K337 PolarHBondContact O-N 2.61Å; D334-K337 VanDerWaalsContact O-N 3.17Å
338	G	29.8	Very low	36.6	Very low	50 Å²	50	127.7 Å²	127.7	52%	0.515	68%	0.683	S	S	.	*	S	Bend	trans	-126.1	122.9	178	0	0	0	0	0	113.7
339	N	31.1	Very low	37.3	Very low	154 Å²	154	125 Å²	125	82%	0.824	68%	0.677	S	S	*	*			trans	68.3	69.1	167.9	-62.3	-15.1	0	0	0	118.4	T341	N339-T341 PolarHBondContact O-N 3.32Å
340	T	31.9	Very low	37.9	Very low	142 Å²	142	123.6 Å²	123.6	87%	0.871	68%	0.677	S	S	*	*			trans	-65.2	83.5	142	48.4	0	0	0	0	110
341	T	32.4	Very low	38.8	Very low	124 Å²	124	120.3 Å²	120.3	76%	0.761	68%	0.682	S	S	*	*			trans	168.9	85.1	157.2	27.9	0	0	0	0	110.8	N339	N339-T341 PolarHBondContact O-N 3.32Å
342	K	32.9	Very low	39.7	Very low	206 Å²	206	115.8 Å²	115.8	90%	0.896	66%	0.66	S	S	*	*			trans	-174.3	87.8	152.2	-107.2	164.1	-170.8	-178.8	0	109.5
343	E	30.6	Very low	40.4	Very low	202 Å²	202	112.8 Å²	112.8	94%	0.944	65%	0.647	S	S	*	*			trans	-74	134.9	169.6	-63.6	178.7	143.8	0	0	109.3
344	G	33.7	Very low	41.2	Very low	70 Å²	70	111.3 Å²	111.3	72%	0.722	65%	0.646	S	S	*	*	S	Bend	trans	101.7	87.3	177.2	0	0	0	0	0	115
345	E	33.9	Very low	42.1	Very low	147 Å²	147	108.1 Å²	108.1	69%	0.687	64%	0.637	S	S	*	*	S	Bend	trans	162	17.1	144.8	-90.6	-175.5	-178.7	0	0	114.1	R1867	E345-R1867 IonicContact OE2-CZ 2.86Å; E345-R1867 IonicContact OE2-NE 3.61Å; E345-R1867 IonicContact OE2-NH2 2.66Å; E345-R1867 PolarHBondContact OE2-NH2 3.04Å
346	T	37.7	Very low	43.1	Very low	127 Å²	127	108 Å²	108	78%	0.779	64%	0.636	S	S	*	*			trans	-121.2	55.6	178.9	47.9	0	0	0	0	113.9
347	T	48.4	Very low	44.1	Very low	116 Å²	116	105.3 Å²	105.3	71%	0.712	62%	0.618	S	S	*	*			trans	-99.4	-6	-172.3	45.9	0	0	0	0	116.7	S350	T347-S350 PolarHBondContact O-OG 3.14Å
348	V	50.2	Low	45.6	Very low	86 Å²	86	96.9 Å²	96.9	52%	0.521	58%	0.581	S	S	.	*	S	Bend	trans	-77.4	-41.1	-174.8	-176.4	0	0	0	0	112.7
349	C	54.2	Low	47.3	Very low	38 Å²	38	98.2 Å²	98.2	26%	0.257	58%	0.58	S	S	.	*	S	Bend	trans	-92.4	-19.3	-173.9	-39.3	0	0	0	0	113.8	G351 F352 C533	C349-G351 VanDerWaalsContact C-N 3.28Å; C349-G351 PolarHBondContact O-N 2.88Å; C349-F352 PolarHBondContact O-N 2.9Å; C349-C533 HydrophobicContact CB-CB 4.2Å; C349-C533 WeakPolarHBondContact CB-SG 3.38Å; C349-C533 WeakPolarHBondContact SG-CB 3.39Å; C349-C533 CovalentContact SG-SG 2.03Å; C349-C533 PolarHBondContact SG-SG 2.88Å
350	S	54.1	Low	48.8	Very low	77 Å²	77	92.4 Å²	92.4	54%	0.538	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-66.5	-26.8	-176.7	51.9	0	0	0	0	113.4	T347 F352	T347-S350 PolarHBondContact O-OG 3.14Å; S350-F352 PolarHBondContact O-N 3.05Å; S350-F352 VanDerWaalsContact O-N 3.16Å
351	G	57.2	Low	50.7	Low	69 Å²	69	85.7 Å²	85.7	71%	0.711	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-67.3	-8.2	178.1	0	0	0	0	0	115.7	C349	C349-G351 VanDerWaalsContact C-N 3.28Å; C349-G351 PolarHBondContact O-N 2.88Å
352	F	57	Low	52.5	Low	45 Å²	45	82.3 Å²	82.3	20%	0.197	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-114.3	-6.6	-177.2	-68.8	-82.3	0	0	0	114.8	C349 S350 T530 L534	C349-F352 PolarHBondContact O-N 2.9Å; S350-F352 PolarHBondContact O-N 3.05Å; S350-F352 VanDerWaalsContact O-N 3.16Å; F352-T530 HydrophobicContact CE2-CG2 4.18Å; F352-L534 HydrophobicContact CB-CD2 4Å; F352-L534 HydrophobicContact CG-CD2 4.33Å
353	F	53.1	Low	54.1	Low	80 Å²	80	79 Å²	79	35%	0.351	47%	0.471	S	S	.	.			trans	-97	122.4	-167.6	-119	-89.7	0	0	0	113.8	E358 Y537	F353-E358 WeakPolarHBondContact CD1-OE2 3.42Å; F353-Y537 AromaticContact CE2-CD1 3.9Å; F353-Y537 HydrophobicContact CE2-CD1 3.9Å; F353-Y537 AromaticContact CE2-CD2 3.53Å; F353-Y537 HydrophobicContact CE2-CD2 3.53Å; F353-Y537 HydrophobicContact CE2-CE1 4.13Å; F353-Y537 AromaticContact CE2-CE2 3.79Å; F353-Y537 HydrophobicContact CE2-CE2 3.79Å; F353-Y537 AromaticContact CE2-CG 3.57Å; F353-Y537 HydrophobicContact CE2-CG 3.57Å; F353-Y537 AromaticContact CZ-CD1 3.47Å; F353-Y537 HydrophobicContact CZ-CD1 3.47Å; F353-Y537 VanDerWaalsContact CZ-CD1 3.47Å; F353-Y537 HydrophobicContact CZ-CD2 4.01Å; F353-Y537 AromaticContact CZ-CE1 3.8Å; F353-Y537 HydrophobicContact CZ-CE1 3.8Å; F353-Y537 HydrophobicContact CZ-CE2 4.3Å; F353-Y537 AromaticContact CZ-CG 3.56Å; F353-Y537 HydrophobicContact CZ-CG 3.56Å
354	L	53.8	Low	56	Low	110 Å²	110	71.4 Å²	71.4	58%	0.576	43%	0.433	S	S	*	.			trans	-127	73.5	172.7	-87.1	159.7	0	0	0	109.7	S356 I357 E358	L354-S356 VanDerWaalsContact C-N 3.34Å; L354-S356 PolarHBondContact O-N 3.33Å; L354-S356 VanDerWaalsContact O-N 3.1Å; L354-I357 PolarHBondContact O-N 3.27Å; L354-I357 VanDerWaalsContact O-N 3.1Å; L354-E358 PolarHBondContact N-OE1 3.05Å; L354-E358 PolarHBondContact N-OE2 3.13Å; L354-E358 PolarHBondContact O-N 3.13Å
355	G	55.1	Low	57.6	Low	37 Å²	37	68.2 Å²	68.2	38%	0.381	40%	0.399	S	S	.	.	H	α-helix	trans	-60.9	-24.9	-159.1	0	0	0	0	0	117.7	T359	G355-T359 WeakPolarHBondContact O-CG2 3.24Å; G355-T359 PolarHBondContact O-N 2.91Å; G355-T359 PolarHBondContact O-OG1 2.95Å
356	S	59.2	Low	59	Low	92 Å²	92	65.3 Å²	65.3	64%	0.643	39%	0.386	S	S	*	.	H	α-helix	trans	-73.8	-35.8	176.6	54.9	0	0	0	0	112.8	L354 T359 A360	L354-S356 VanDerWaalsContact C-N 3.34Å; L354-S356 PolarHBondContact O-N 3.33Å; L354-S356 VanDerWaalsContact O-N 3.1Å; S356-T359 PolarHBondContact O-OG1 3.44Å; S356-A360 WeakPolarHBondContact O-CB 3.44Å; S356-A360 PolarHBondContact O-N 3.41Å
357	I	59.5	Low	60.1	Low	56 Å²	56	64.2 Å²	64.2	29%	0.287	38%	0.379	S	S	.	.	H	α-helix	trans	-81	-38.4	-176.7	-57.9	177.5	0	0	0	110.1	L354 A360 C361 C511	L354-I357 PolarHBondContact O-N 3.27Å; L354-I357 VanDerWaalsContact O-N 3.1Å; I357-A360 PolarHBondContact O-N 3.37Å; I357-C361 PolarHBondContact O-N 2.98Å; I357-C511 HydrophobicContact CG2-CB 3.7Å; I357-C511 VanDerWaalsContact CG2-O 3.32Å; I357-C511 WeakPolarHBondContact CG2-O 3.29Å
358	E	61.6	Low	60.5	Low	7 Å²	7	64.1 Å²	64.1	3%	0.033	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-47.5	176.5	-83.6	136.4	-141.2	0	0	112.9	F353 L354 A360 C361 W362 R383 Q539	F353-E358 WeakPolarHBondContact CD1-OE2 3.42Å; L354-E358 PolarHBondContact N-OE1 3.05Å; L354-E358 PolarHBondContact N-OE2 3.13Å; L354-E358 PolarHBondContact O-N 3.13Å; E358-A360 VanDerWaalsContact C-N 3.33Å; E358-A360 PolarHBondContact O-N 3.48Å; E358-C361 PolarHBondContact O-N 2.76Å; E358-W362 WeakPolarHBondContact O-CB 3.45Å; E358-W362 PolarHBondContact O-N 3.24Å; E358-R383 IonicContact OE1-CZ 3.22Å; E358-R383 IonicContact OE1-NE 3.8Å; E358-R383 PolarHBondContact OE1-NE 3.31Å; E358-R383 IonicContact OE1-NH2 2.74Å; E358-R383 PolarHBondContact OE1-NH2 2.83Å; E358-Q539 PolarHBondContact OE2-NE2 3.02Å
359	T	65.2	Low	60.7	Low	78 Å²	78	66.8 Å²	66.8	48%	0.479	37%	0.374	S	S	.	.	H	α-helix	trans	-67.9	-32.6	179.2	51.2	0	0	0	0	112.5	G355 S356 K363	G355-T359 WeakPolarHBondContact O-CG2 3.24Å; G355-T359 PolarHBondContact O-N 2.91Å; G355-T359 PolarHBondContact O-OG1 2.95Å; S356-T359 PolarHBondContact O-OG1 3.44Å; T359-K363 VanDerWaalsContact O-CB 3.32Å; T359-K363 WeakPolarHBondContact O-CB 3.45Å; T359-K363 WeakPolarHBondContact O-CG 3.4Å; T359-K363 PolarHBondContact O-N 3.28Å
360	A	64.1	Low	60.8	Low	31 Å²	31	67 Å²	67	26%	0.256	37%	0.372	S	S	.	.	H	α-helix	trans	-66.3	-45.3	173.2	0	0	0	0	0	111.8	S356 I357 E358 W364 L507	S356-A360 WeakPolarHBondContact O-CB 3.44Å; S356-A360 PolarHBondContact O-N 3.41Å; I357-A360 PolarHBondContact O-N 3.37Å; E358-A360 VanDerWaalsContact C-N 3.33Å; E358-A360 PolarHBondContact O-N 3.48Å; A360-W364 WeakPolarHBondContact O-CB 3.41Å; A360-W364 PolarHBondContact O-N 3.47Å; A360-L507 HydrophobicContact CB-CD1 4.38Å; A360-L507 HydrophobicContact CB-CD2 4.22Å
361	C	70.5	Confident	60.9	Low	1 Å²	1	66.7 Å²	66.7	1%	0.007	37%	0.368	C	S	.	.	H	α-helix	trans	-65.5	-43.1	177.9	-175.1	0	0	0	0	113	I357 E358 W364 L365 Y379 C512	I357-C361 PolarHBondContact O-N 2.98Å; E358-C361 PolarHBondContact O-N 2.76Å; C361-W364 PolarHBondContact O-N 3.4Å; C361-L365 PolarHBondContact O-N 3.41Å; C361-L365 VanDerWaalsContact O-N 3.11Å; C361-Y379 HydrophobicContact CB-CE2 4.32Å; C361-C512 WeakPolarHBondContact CA-SG 3.3Å; C361-C512 HydrophobicContact CB-CB 4.12Å; C361-C512 WeakPolarHBondContact CB-SG 3.36Å; C361-C512 WeakPolarHBondContact SG-CA 3.44Å; C361-C512 WeakPolarHBondContact SG-CB 3.42Å; C361-C512 CovalentContact SG-SG 2.03Å; C361-C512 PolarHBondContact SG-SG 3.1Å
362	W	70.2	Confident	60.9	Low	54 Å²	54	66.1 Å²	66.1	21%	0.205	34%	0.344	C	S	.	.	H	α-helix	trans	-64.6	-43.8	177.5	-177.6	-107.5	0	0	0	111.9	E358 W364 L365 Q366 A375 V376 Y379	E358-W362 WeakPolarHBondContact O-CB 3.45Å; E358-W362 PolarHBondContact O-N 3.24Å; W362-W364 VanDerWaalsContact C-N 3.29Å; W362-W364 PolarHBondContact O-N 3.43Å; W362-L365 PolarHBondContact O-N 3.05Å; W362-Q366 HydrophobicContact CZ2-CG 4.39Å; W362-Q366 VanDerWaalsContact NE1-NE2 3.19Å; W362-Q366 WeakPolarHBondContact O-CG 3.47Å; W362-Q366 PolarHBondContact O-N 2.94Å; W362-A375 HydrophobicContact CH2-CB 4.16Å; W362-A375 HydrophobicContact CZ3-CB 4.41Å; W362-V376 HydrophobicContact CH2-CB 4.44Å; W362-V376 HydrophobicContact CH2-CG2 3.62Å; W362-V376 HydrophobicContact CZ3-CG2 4.22Å; W362-Y379 HydrophobicContact CB-CE2 4.33Å; W362-Y379 HydrophobicContact CE3-CD1 4.14Å; W362-Y379 AromaticContact CE3-CD2 3.91Å; W362-Y379 HydrophobicContact CE3-CD2 3.91Å; W362-Y379 HydrophobicContact CE3-CE2 4.5Å; W362-Y379 AromaticContact CE3-CG 3.71Å; W362-Y379 HydrophobicContact CE3-CG 3.71Å; W362-Y379 HydrophobicContact CZ3-CD1 4.42Å; W362-Y379 HydrophobicContact CZ3-CG 4.06Å
363	K	68	Low	60.8	Low	137 Å²	137	68.5 Å²	68.5	60%	0.596	36%	0.356	S	S	*	.	H	α-helix	trans	-60.4	-38.5	173.5	-76.8	174.8	178.3	-178.4	0	112.4	T359 Q366 T367	T359-K363 VanDerWaalsContact O-CB 3.32Å; T359-K363 WeakPolarHBondContact O-CB 3.45Å; T359-K363 WeakPolarHBondContact O-CG 3.4Å; T359-K363 PolarHBondContact O-N 3.28Å; K363-Q366 PolarHBondContact O-N 3.35Å; K363-T367 PolarHBondContact O-N 3.22Å; K363-T367 PolarHBondContact O-OG1 2.95Å
364	W	70.4	Confident	61.4	Low	41 Å²	41	64.9 Å²	64.9	16%	0.155	34%	0.34	C	S	.	.	H	α-helix	trans	-64	-38.1	176.8	173.5	79.9	0	0	0	112.8	A360 C361 W362 T367 Y368 L507 L508	A360-W364 WeakPolarHBondContact O-CB 3.41Å; A360-W364 PolarHBondContact O-N 3.47Å; C361-W364 PolarHBondContact O-N 3.4Å; W362-W364 VanDerWaalsContact C-N 3.29Å; W362-W364 PolarHBondContact O-N 3.43Å; W364-T367 WeakPolarHBondContact CA-OG1 3.35Å; W364-T367 PolarHBondContact O-OG1 3.13Å; W364-Y368 HydrophobicContact CD2-CE2 4.49Å; W364-Y368 AromaticContact CE2-CE2 3.66Å; W364-Y368 HydrophobicContact CZ2-CD2 4.46Å; W364-Y368 AromaticContact CZ2-CE2 3.69Å; W364-Y368 HydrophobicContact CZ2-CE2 3.69Å; W364-Y368 AromaticContact NE1-CE2 3.63Å; W364-Y368 VanDerWaalsContact O-CD2 3.29Å; W364-Y368 WeakPolarHBondContact O-CD2 3.38Å; W364-L507 HydrophobicContact CB-CD2 4.36Å; W364-L508 HydrophobicContact CD2-CD1 4.31Å; W364-L508 HydrophobicContact CD2-CG 4.38Å; W364-L508 VanDerWaalsContact CE2-CD1 3.45Å; W364-L508 HydrophobicContact CE3-CG 4.45Å; W364-L508 HydrophobicContact CH2-CD1 3.97Å; W364-L508 HydrophobicContact CH2-CD2 3.64Å; W364-L508 HydrophobicContact CH2-CG 3.73Å; W364-L508 HydrophobicContact CZ2-CD1 3.3Å; W364-L508 HydrophobicContact CZ2-CD2 3.82Å; W364-L508 HydrophobicContact CZ2-CG 3.6Å; W364-L508 HydrophobicContact CZ3-CD2 4.29Å; W364-L508 HydrophobicContact CZ3-CG 4.13Å
365	L	66.8	Low	62	Low	3 Å²	3	59.8 Å²	59.8	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-68.4	-35.4	171.2	-77.1	165.7	0	0	0	112.3	C361 W362 L370 L378 Y379	C361-L365 PolarHBondContact O-N 3.41Å; C361-L365 VanDerWaalsContact O-N 3.11Å; W362-L365 PolarHBondContact O-N 3.05Å; L365-L370 HydrophobicContact CD2-CD1 4.26Å; L365-L378 HydrophobicContact CD1-CB 4.4Å; L365-L378 HydrophobicContact CD2-CB 3.91Å; L365-L378 HydrophobicContact CD2-CD1 4.22Å; L365-Y379 HydrophobicContact CD1-CD2 4.1Å; L365-Y379 HydrophobicContact CD1-CG 4.35Å
366	Q	62.5	Low	62.5	Low	86 Å²	86	58.5 Å²	58.5	40%	0.402	30%	0.299	S	S	.	.	H	α-helix	trans	-69.6	-28.1	177.3	-70.8	-174.9	-46.4	0	0	113.6	W362 K363 Y368 Q369	W362-Q366 HydrophobicContact CZ2-CG 4.39Å; W362-Q366 VanDerWaalsContact NE1-NE2 3.19Å; W362-Q366 WeakPolarHBondContact O-CG 3.47Å; W362-Q366 PolarHBondContact O-N 2.94Å; K363-Q366 PolarHBondContact O-N 3.35Å; Q366-Y368 PolarHBondContact O-N 2.92Å; Q366-Y368 VanDerWaalsContact O-N 3.16Å; Q366-Q369 PolarHBondContact O-N 2.89Å
367	T	61	Low	62.9	Low	105 Å²	105	54.2 Å²	54.2	64%	0.644	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.2	179.6	34	0	0	0	0	114.5	K363 W364	K363-T367 PolarHBondContact O-N 3.22Å; K363-T367 PolarHBondContact O-OG1 2.95Å; W364-T367 WeakPolarHBondContact CA-OG1 3.35Å; W364-T367 PolarHBondContact O-OG1 3.13Å
368	Y	56.7	Low	63.5	Low	113 Å²	113	52 Å²	52	44%	0.443	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	5.2	178.5	-68.6	-82.5	0	0	0	114.8	W364 Q366 L370	W364-Y368 HydrophobicContact CD2-CE2 4.49Å; W364-Y368 AromaticContact CE2-CE2 3.66Å; W364-Y368 HydrophobicContact CZ2-CD2 4.46Å; W364-Y368 AromaticContact CZ2-CE2 3.69Å; W364-Y368 HydrophobicContact CZ2-CE2 3.69Å; W364-Y368 AromaticContact NE1-CE2 3.63Å; W364-Y368 VanDerWaalsContact O-CD2 3.29Å; W364-Y368 WeakPolarHBondContact O-CD2 3.38Å; Q366-Y368 PolarHBondContact O-N 2.92Å; Q366-Y368 VanDerWaalsContact O-N 3.16Å; Y368-L370 PolarHBondContact O-N 3.13Å
369	Q	54.3	Low	64.2	Low	143 Å²	143	52.2 Å²	52.2	67%	0.668	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	29.2	-176.1	-58.2	-171.3	5.1	0	0	114.4	N275 Q366	N275-Q369 PolarHBondContact ND2-OE1 3.41Å; Q366-Q369 PolarHBondContact O-N 2.89Å
370	L	57.3	Low	64.6	Low	42 Å²	42	48.7 Å²	48.7	22%	0.22	24%	0.236	C	C	.	.			trans	-60.6	143.7	176	-64.5	164.6	0	0	0	109.8	L365 Y368 R372 L374 A375 L378	L365-L370 HydrophobicContact CD2-CD1 4.26Å; Y368-L370 PolarHBondContact O-N 3.13Å; L370-R372 PolarHBondContact O-N 3.26Å; L370-L374 HydrophobicContact CB-CD2 4.39Å; L370-L374 HydrophobicContact CD2-CD2 3.86Å; L370-A375 HydrophobicContact CB-CB 4.34Å; L370-L378 HydrophobicContact CD1-CD1 4Å
371	P	54.9	Low	65.1	Low	70 Å²	70	48.2 Å²	48.2	46%	0.455	23%	0.229	S	C	.	.			trans	-47.4	134.3	170.4	-28	34.4	0	0	0	110.7	E373 L374 A375	P371-E373 PolarHBondContact O-N 3.47Å; P371-E373 VanDerWaalsContact O-N 3.11Å; P371-L374 HydrophobicContact CB-CB 4.27Å; P371-L374 WeakPolarHBondContact O-CA 3.43Å; P371-L374 WeakPolarHBondContact O-CB 3.35Å; P371-L374 PolarHBondContact O-N 2.58Å; P371-A375 PolarHBondContact O-N 3.09Å
372	R	57.2	Low	65.3	Low	57 Å²	57	50 Å²	50	22%	0.215	24%	0.239	C	C	.	.	H	α-helix	trans	-53.3	-41.7	-170.7	-172.4	-167.4	178.1	-178.9	0.4	112.1	D321 L370 A375 V376	D321-R372 WeakPolarHBondContact OD1-CD 3.23Å; D321-R372 IonicContact OD1-CZ 2.74Å; D321-R372 IonicContact OD1-NE 2.64Å; D321-R372 IonicContact OD1-NH1 3.78Å; D321-R372 PolarHBondContact OD1-NH1 3.29Å; D321-R372 WeakPolarHBondContact OD2-CB 3.46Å; D321-R372 WeakPolarHBondContact OD2-CD 3.27Å; L370-R372 PolarHBondContact O-N 3.26Å; R372-A375 PolarHBondContact O-N 2.97Å; R372-V376 HydrophobicContact CG-CG2 4.4Å; R372-V376 WeakPolarHBondContact O-CG2 3.27Å; R372-V376 PolarHBondContact O-N 2.96Å
373	E	56.5	Low	65.7	Low	95 Å²	95	48.3 Å²	48.3	44%	0.444	23%	0.233	S	C	.	.	H	α-helix	trans	-58.9	-46.2	177.7	-60.6	172.4	158.1	0	0	111.6	P371 V376 Q377	P371-E373 PolarHBondContact O-N 3.47Å; P371-E373 VanDerWaalsContact O-N 3.11Å; E373-V376 PolarHBondContact O-N 3.31Å; E373-Q377 WeakPolarHBondContact O-CB 3.48Å; E373-Q377 PolarHBondContact O-N 3.25Å
374	L	64.4	Low	66.2	Low	4 Å²	4	41.9 Å²	41.9	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-38.1	174.6	177.3	64.5	0	0	0	112.3	L32 L370 P371 Q377 L378 F598	L32-L374 HydrophobicContact CD1-CD1 4.05Å; L32-L374 HydrophobicContact CD2-CD1 4.12Å; L32-L374 HydrophobicContact CD2-CD2 3.63Å; L370-L374 HydrophobicContact CB-CD2 4.39Å; L370-L374 HydrophobicContact CD2-CD2 3.86Å; P371-L374 HydrophobicContact CB-CB 4.27Å; P371-L374 WeakPolarHBondContact O-CA 3.43Å; P371-L374 WeakPolarHBondContact O-CB 3.35Å; P371-L374 PolarHBondContact O-N 2.58Å; L374-Q377 PolarHBondContact O-N 2.64Å; L374-L378 HydrophobicContact CD1-CD1 4.02Å; L374-L378 HydrophobicContact CD1-CG 4.08Å; L374-L378 HydrophobicContact CG-CD1 4Å; L374-L378 HydrophobicContact CG-CG 4.45Å; L374-L378 WeakPolarHBondContact O-CB 3.49Å; L374-L378 VanDerWaalsContact O-CG 3.26Å; L374-L378 WeakPolarHBondContact O-CG 3.32Å; L374-L378 PolarHBondContact O-N 2.92Å; L374-F598 HydrophobicContact CB-CZ 4.43Å; L374-F598 HydrophobicContact CD1-CE1 3.84Å; L374-F598 HydrophobicContact CD1-CZ 3.94Å
375	A	66.7	Low	67	Low	4 Å²	4	39.9 Å²	39.9	3%	0.033	20%	0.197	C	C	.	.	H	α-helix	trans	-66	-45.8	174.6	0	0	0	0	0	112.1	W362 L370 P371 R372 Q377 L378 Y379	W362-A375 HydrophobicContact CH2-CB 4.16Å; W362-A375 HydrophobicContact CZ3-CB 4.41Å; L370-A375 HydrophobicContact CB-CB 4.34Å; P371-A375 PolarHBondContact O-N 3.09Å; R372-A375 PolarHBondContact O-N 2.97Å; A375-Q377 VanDerWaalsContact C-N 3.33Å; A375-Q377 PolarHBondContact O-N 2.84Å; A375-L378 PolarHBondContact O-N 3.07Å; A375-Y379 VanDerWaalsContact O-CB 3.27Å; A375-Y379 WeakPolarHBondContact O-CB 3.45Å; A375-Y379 PolarHBondContact O-N 2.91Å
376	V	65.2	Low	68	Low	9 Å²	9	40.1 Å²	40.1	6%	0.055	20%	0.198	C	C	.	.	H	α-helix	trans	-58.9	-46.7	172.4	170.7	0	0	0	0	110.4	W362 R372 E373 Y379 T380 F538	W362-V376 HydrophobicContact CH2-CB 4.44Å; W362-V376 HydrophobicContact CH2-CG2 3.62Å; W362-V376 HydrophobicContact CZ3-CG2 4.22Å; R372-V376 HydrophobicContact CG-CG2 4.4Å; R372-V376 WeakPolarHBondContact O-CG2 3.27Å; R372-V376 PolarHBondContact O-N 2.96Å; E373-V376 PolarHBondContact O-N 3.31Å; V376-Y379 WeakPolarHBondContact O-CB 3.49Å; V376-Y379 PolarHBondContact O-N 3.39Å; V376-T380 HydrophobicContact CG1-CG2 4.4Å; V376-T380 WeakPolarHBondContact O-CG2 3.26Å; V376-T380 PolarHBondContact O-N 3.1Å; V376-T380 PolarHBondContact O-OG1 3.01Å; V376-T380 VanDerWaalsContact O-OG1 3.12Å; V376-F538 HydrophobicContact CB-CD1 4.45Å; V376-F538 HydrophobicContact CG1-CB 4.35Å; V376-F538 HydrophobicContact CG1-CD1 3.49Å; V376-F538 VanDerWaalsContact CG1-CD1 3.49Å; V376-F538 HydrophobicContact CG1-CE1 4.1Å; V376-F538 HydrophobicContact CG1-CG 4.16Å; V376-F538 HydrophobicContact CG2-CD1 4.01Å; V376-F538 HydrophobicContact CG2-CE1 4.12Å; V376-F538 HydrophobicContact CG2-CG 4.38Å
377	Q	68.4	Low	69.3	Low	2 Å²	2	36 Å²	36	1%	0.009	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-50.1	179.1	175.3	-174.9	8.7	0	0	111.9	Y28 E373 L374 A375 Y379 T380 L381 Y605 F606	Y28-Q377 VanDerWaalsContact OH-CD 3.31Å; Y28-Q377 PolarHBondContact OH-NE2 2.8Å; E373-Q377 WeakPolarHBondContact O-CB 3.48Å; E373-Q377 PolarHBondContact O-N 3.25Å; L374-Q377 PolarHBondContact O-N 2.64Å; A375-Q377 VanDerWaalsContact C-N 3.33Å; A375-Q377 PolarHBondContact O-N 2.84Å; Q377-Y379 VanDerWaalsContact C-N 3.34Å; Q377-Y379 PolarHBondContact O-N 3.06Å; Q377-T380 WeakPolarHBondContact CA-OG1 3.43Å; Q377-T380 PolarHBondContact O-N 2.81Å; Q377-T380 PolarHBondContact O-OG1 3.23Å; Q377-L381 WeakPolarHBondContact O-CB 3.15Å; Q377-L381 PolarHBondContact O-N 3.42Å; Q377-Y605 PolarHBondContact NE2-O 3.3Å; Q377-F606 HydrophobicContact CB-CD1 4.09Å; Q377-F606 HydrophobicContact CB-CE1 4.08Å; Q377-F606 HydrophobicContact CG-CD1 3.83Å; Q377-F606 HydrophobicContact CG-CE1 4.17Å
378	L	70.9	Confident	70.7	Confident	11 Å²	11	31.1 Å²	31.1	6%	0.058	15%	0.149	C	C	.	.	H	α-helix	trans	-63	-39.7	175.9	-72.3	170.6	0	0	0	111.7	Y28 F29 L365 L370 L374 A375 L381 L382	Y28-L378 HydrophobicContact CE1-CD2 4.15Å; F29-L378 HydrophobicContact CE1-CD1 4.42Å; F29-L378 HydrophobicContact CE1-CD2 3.61Å; F29-L378 HydrophobicContact CZ-CD2 3.7Å; L365-L378 HydrophobicContact CD1-CB 4.4Å; L365-L378 HydrophobicContact CD2-CB 3.91Å; L365-L378 HydrophobicContact CD2-CD1 4.22Å; L370-L378 HydrophobicContact CD1-CD1 4Å; L374-L378 HydrophobicContact CD1-CD1 4.02Å; L374-L378 HydrophobicContact CD1-CG 4.08Å; L374-L378 HydrophobicContact CG-CD1 4Å; L374-L378 HydrophobicContact CG-CG 4.45Å; L374-L378 WeakPolarHBondContact O-CB 3.49Å; L374-L378 VanDerWaalsContact O-CG 3.26Å; L374-L378 WeakPolarHBondContact O-CG 3.32Å; L374-L378 PolarHBondContact O-N 2.92Å; A375-L378 PolarHBondContact O-N 3.07Å; L378-L381 PolarHBondContact O-N 3.42Å; L378-L382 VanDerWaalsContact O-CB 3.26Å; L378-L382 WeakPolarHBondContact O-CB 3.31Å; L378-L382 WeakPolarHBondContact O-CG 3.29Å; L378-L382 PolarHBondContact O-N 3.23Å
379	Y	76.3	Confident	72.2	Confident	10 Å²	10	25.8 Å²	25.8	4%	0.039	13%	0.129	C	C	.	.	H	α-helix	trans	-60.5	-47.3	173.9	-175.7	-107.4	0	0	0	112	C361 W362 L365 A375 V376 Q377 L382 R383 F538 Q539	C361-Y379 HydrophobicContact CB-CE2 4.32Å; W362-Y379 HydrophobicContact CB-CE2 4.33Å; W362-Y379 HydrophobicContact CE3-CD1 4.14Å; W362-Y379 AromaticContact CE3-CD2 3.91Å; W362-Y379 HydrophobicContact CE3-CD2 3.91Å; W362-Y379 HydrophobicContact CE3-CE2 4.5Å; W362-Y379 AromaticContact CE3-CG 3.71Å; W362-Y379 HydrophobicContact CE3-CG 3.71Å; W362-Y379 HydrophobicContact CZ3-CD1 4.42Å; W362-Y379 HydrophobicContact CZ3-CG 4.06Å; L365-Y379 HydrophobicContact CD1-CD2 4.1Å; L365-Y379 HydrophobicContact CD1-CG 4.35Å; A375-Y379 VanDerWaalsContact O-CB 3.27Å; A375-Y379 WeakPolarHBondContact O-CB 3.45Å; A375-Y379 PolarHBondContact O-N 2.91Å; V376-Y379 WeakPolarHBondContact O-CB 3.49Å; V376-Y379 PolarHBondContact O-N 3.39Å; Q377-Y379 VanDerWaalsContact C-N 3.34Å; Q377-Y379 PolarHBondContact O-N 3.06Å; Y379-L382 PolarHBondContact O-N 3.28Å; Y379-R383 WeakPolarHBondContact O-CB 3.37Å; Y379-R383 PolarHBondContact O-N 2.99Å; Y379-F538 HydrophobicContact CD1-CB 4.22Å; Y379-F538 VanDerWaalsContact CD1-O 3.29Å; Y379-F538 WeakPolarHBondContact CD1-O 3.42Å; Y379-F538 HydrophobicContact CE1-CB 4.39Å; Y379-F538 WeakPolarHBondContact CE1-O 3.36Å; Y379-Q539 HydrophobicContact CE1-CG 4.34Å
380	T	73.9	Confident	73.9	Confident	4 Å²	4	19.6 Å²	19.6	3%	0.025	10%	0.1	C	C	.	.	H	α-helix	trans	-67.6	-33.8	175.6	58.7	0	0	0	0	112.8	V376 Q377 G384 F538 F541	V376-T380 HydrophobicContact CG1-CG2 4.4Å; V376-T380 WeakPolarHBondContact O-CG2 3.26Å; V376-T380 PolarHBondContact O-N 3.1Å; V376-T380 PolarHBondContact O-OG1 3.01Å; V376-T380 VanDerWaalsContact O-OG1 3.12Å; Q377-T380 WeakPolarHBondContact CA-OG1 3.43Å; Q377-T380 PolarHBondContact O-N 2.81Å; Q377-T380 PolarHBondContact O-OG1 3.23Å; T380-G384 WeakPolarHBondContact O-CA 3.45Å; T380-G384 PolarHBondContact O-N 2.83Å; T380-F538 VanDerWaalsContact CG2-O 3.27Å; T380-F538 WeakPolarHBondContact CG2-O 3.34Å; T380-F541 WeakPolarHBondContact O-CD2 3.37Å
381	L	75.5	Confident	75.2	Confident	21 Å²	21	19.3 Å²	19.3	11%	0.11	10%	0.102	C	C	.	.	H	α-helix	trans	-76.8	-20.3	177.6	-171.9	68.4	0	0	0	112.7	Y28 Q377 L378 R517 F541	Y28-L381 HydrophobicContact CE1-CD2 4.09Å; Y28-L381 HydrophobicContact CE2-CD2 4.38Å; Q377-L381 WeakPolarHBondContact O-CB 3.15Å; Q377-L381 PolarHBondContact O-N 3.42Å; L378-L381 PolarHBondContact O-N 3.42Å; L381-R517 PolarHBondContact O-NH1 3.04Å; L381-R517 PolarHBondContact O-NH2 2.92Å; L381-F541 HydrophobicContact CD1-CE2 4.16Å; L381-F541 HydrophobicContact CD1-CZ 4.3Å
382	L	74.6	Confident	76.7	Confident	40 Å²	40	16 Å²	16	21%	0.209	8%	0.081	C	C	.	.	H	α-helix	trans	-98.8	-36.7	177.4	-68.1	170.9	0	0	0	113.2	L378 Y379 F513 R514 R517	L378-L382 VanDerWaalsContact O-CB 3.26Å; L378-L382 WeakPolarHBondContact O-CB 3.31Å; L378-L382 WeakPolarHBondContact O-CG 3.29Å; L378-L382 PolarHBondContact O-N 3.23Å; Y379-L382 PolarHBondContact O-N 3.28Å; L382-F513 HydrophobicContact CD2-CD2 4.03Å; L382-F513 WeakPolarHBondContact O-CA 3.14Å; L382-R514 PolarHBondContact O-N 3.27Å; L382-R517 VanDerWaalsContact C-NH2 3.35Å; L382-R517 PolarHBondContact O-NH2 3.38Å
383	R	77.8	Confident	78	Confident	18 Å²	18	16.4 Å²	16.4	7%	0.068	9%	0.091	C	C	.	.	H	α-helix	trans	-122.3	-17.1	-172.5	-155.8	-168.2	179.5	83.4	-4	114.8	E358 Y379 C511 R514	E358-R383 IonicContact OE1-CZ 3.22Å; E358-R383 IonicContact OE1-NE 3.8Å; E358-R383 PolarHBondContact OE1-NE 3.31Å; E358-R383 IonicContact OE1-NH2 2.74Å; E358-R383 PolarHBondContact OE1-NH2 2.83Å; Y379-R383 WeakPolarHBondContact O-CB 3.37Å; Y379-R383 PolarHBondContact O-N 2.99Å; R383-C511 PolarHBondContact NH1-O 3.38Å; R383-R514 HydrophobicContact CG-CB 4.33Å
384	G	80	Confident	79.4	Confident	1 Å²	1	12.8 Å²	12.8	1%	0.01	8%	0.075	C	C	.	.			trans	-59.7	139.5	-169.6	0	0	0	0	0	114.1	T380 Q539	T380-G384 WeakPolarHBondContact O-CA 3.45Å; T380-G384 PolarHBondContact O-N 2.83Å; G384-Q539 CarbonylContact C-O 3.54Å; G384-Q539 WeakPolarHBondContact CA-O 3.45Å
385	V	85.3	Confident	80.5	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	137.3	-180	176.2	0	0	0	0	109.9	L387 L534 Q539 F541	V385-L387 HydrophobicContact CG1-CD2 3.6Å; V385-L387 HydrophobicContact CG1-CG 4.34Å; V385-L534 HydrophobicContact CB-CD1 4.15Å; V385-L534 HydrophobicContact CG1-CD1 4.05Å; V385-Q539 PolarHBondContact N-O 3.09Å; V385-F541 PolarHBondContact O-N 2.99Å
386	I	88.4	Confident	81.4	Confident	7 Å²	7	17.2 Å²	17.2	4%	0.036	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	116.6	174	-59.6	166.9	0	0	0	108.3	V388 R517 F518 H519 F541 S542 V544 L611	I386-V388 HydrophobicContact CG2-CG2 4.34Å; I386-R517 PolarHBondContact N-O 3.46Å; I386-F518 HydrophobicContact CB-CD1 3.79Å; I386-F518 HydrophobicContact CB-CE1 4Å; I386-F518 HydrophobicContact CB-CG 4.39Å; I386-F518 HydrophobicContact CD1-CD1 4.12Å; I386-F518 HydrophobicContact CD1-CE1 3.55Å; I386-F518 HydrophobicContact CD1-CE2 4.15Å; I386-F518 HydrophobicContact CD1-CZ 3.56Å; I386-F518 HydrophobicContact CG1-CE1 4.36Å; I386-F518 HydrophobicContact CG2-CD1 3.52Å; I386-F518 HydrophobicContact CG2-CE1 3.6Å; I386-F518 CarbonylContact O-C 3.57Å; I386-F518 WeakPolarHBondContact O-CA 3.24Å; I386-H519 PolarHBondContact O-N 3.13Å; I386-F541 HydrophobicContact CD1-CD1 3.98Å; I386-F541 HydrophobicContact CG1-CB 4.16Å; I386-F541 HydrophobicContact CG1-CD1 3.82Å; I386-F541 HydrophobicContact CG1-CG 4.4Å; I386-S542 VanDerWaalsContact CA-O 3.32Å; I386-S542 WeakPolarHBondContact CA-O 3.43Å; I386-V544 HydrophobicContact CG2-CG2 4.15Å; I386-L611 HydrophobicContact CD1-CD1 3.76Å; I386-L611 HydrophobicContact CG1-CD1 4.29Å; I386-L611 HydrophobicContact CG2-CD1 4.22Å
387	L	89.7	Confident	82.4	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133.5	179.8	-57.7	-178.6	0	0	0	109.6	V385 H519 I521 L527 T530 L534 F540 S542 G543 V544	V385-L387 HydrophobicContact CG1-CD2 3.6Å; V385-L387 HydrophobicContact CG1-CG 4.34Å; L387-H519 CarbonylContact C-O 3.48Å; L387-H519 WeakPolarHBondContact CA-O 3.37Å; L387-H519 HydrophobicContact CD2-CB 4.23Å; L387-I521 HydrophobicContact CB-CD1 4.12Å; L387-I521 HydrophobicContact CD1-CD1 3.8Å; L387-I521 HydrophobicContact CD2-CD1 3.82Å; L387-I521 HydrophobicContact CD2-CG1 4.46Å; L387-I521 HydrophobicContact CG-CD1 4.12Å; L387-L527 HydrophobicContact CB-CD1 3.66Å; L387-L527 HydrophobicContact CB-CG 3.81Å; L387-L527 HydrophobicContact CD1-CG 4.25Å; L387-T530 HydrophobicContact CD1-CG2 4.07Å; L387-L534 HydrophobicContact CD1-CD1 4.32Å; L387-L534 HydrophobicContact CD2-CD1 4.35Å; L387-F540 HydrophobicContact CD1-CD2 4.27Å; L387-F540 HydrophobicContact CD1-CE2 4Å; L387-F540 HydrophobicContact CG-CE2 4.26Å; L387-S542 PolarHBondContact N-O 3.48Å; L387-G543 CarbonylContact O-C 3.47Å; L387-G543 VanDerWaalsContact O-CA 3.23Å; L387-G543 WeakPolarHBondContact O-CA 3.18Å; L387-V544 PolarHBondContact O-N 3.32Å
388	V	90	Very high	83.3	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.012	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132	-177.2	-171.6	0	0	0	0	110.2	I386 V395 V399 F518 H519 V520 I521 V544 F546	I386-V388 HydrophobicContact CG2-CG2 4.34Å; V388-V395 HydrophobicContact CG1-CG1 3.52Å; V388-V399 HydrophobicContact CB-CG2 4.12Å; V388-V399 HydrophobicContact CG1-CG2 4.1Å; V388-V399 HydrophobicContact CG2-CG2 3.92Å; V388-F518 HydrophobicContact CG2-CB 4.44Å; V388-F518 HydrophobicContact CG2-CD1 3.97Å; V388-H519 PolarHBondContact N-O 3.4Å; V388-V520 CarbonylContact O-C 3.53Å; V388-V520 WeakPolarHBondContact O-CA 3.12Å; V388-I521 PolarHBondContact O-N 2.84Å; V388-V544 CarbonylContact C-O 3.55Å; V388-V544 WeakPolarHBondContact CA-O 3.33Å; V388-V544 HydrophobicContact CG1-CB 4.39Å; V388-V544 HydrophobicContact CG2-CB 4.39Å; V388-F546 HydrophobicContact CG1-CD2 4.27Å; V388-F546 HydrophobicContact CG1-CE2 3.79Å
389	S	89.5	Confident	84	Confident	2 Å²	2	19.5 Å²	19.5	1%	0.014	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	146.9	-177.5	180	0	0	0	0	111.4	D523 E524 V544 V545 F546	S389-D523 VanDerWaalsContact OG-C 3.26Å; S389-E524 PolarHBondContact OG-N 3.27Å; S389-V544 PolarHBondContact N-O 2.79Å; S389-V545 WeakPolarHBondContact O-CA 3.17Å; S389-F546 PolarHBondContact O-N 2.74Å
390	P	89.3	Confident	84.5	Confident	12 Å²	12	25 Å²	25	8%	0.078	13%	0.134	C	C	.	.	S	Bend	cis	-93.2	169.7	-3	33	-27.9	0	0	0	113.8	S392 V395 I521 K522 L549	P390-S392 VanDerWaalsContact C-N 3.32Å; P390-S392 PolarHBondContact O-N 3.4Å; P390-V395 WeakPolarHBondContact O-CB 3.38Å; P390-I521 CarbonylContact C-O 3.55Å; P390-K522 VanDerWaalsContact CA-O 3.29Å; P390-K522 WeakPolarHBondContact CA-O 3.21Å; P390-K522 WeakPolarHBondContact CB-O 3.27Å; P390-L549 HydrophobicContact CG-CB 4.46Å; P390-L549 WeakPolarHBondContact CG-O 3.42Å
391	S	84.6	Confident	84.9	Confident	37 Å²	37	29.3 Å²	29.3	26%	0.259	15%	0.154	S	C	.	.			trans	-71.7	75.7	179.5	172.2	0	0	0	0	113.7	I521 K522	S391-I521 PolarHBondContact N-O 3.38Å; S391-I521 VanDerWaalsContact N-O 3.08Å; S391-K522 PolarHBondContact N-O 3.27Å
392	S	86.2	Confident	85.2	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.007	15%	0.15	C	C	.	.			trans	-103.8	154.1	170.1	137.8	0	0	0	0	112	P390 V394 V395 K396 N550 S551 S553	P390-S392 VanDerWaalsContact C-N 3.32Å; P390-S392 PolarHBondContact O-N 3.4Å; S392-V394 VanDerWaalsContact C-N 3.28Å; S392-V394 PolarHBondContact O-N 2.86Å; S392-V394 PolarHBondContact OG-N 3.34Å; S392-V394 VanDerWaalsContact OG-N 3.15Å; S392-V395 PolarHBondContact O-N 2.73Å; S392-V395 VanDerWaalsContact O-N 3.16Å; S392-K396 PolarHBondContact O-N 3.32Å; S392-N550 WeakPolarHBondContact CB-O 3.21Å; S392-S551 WeakPolarHBondContact CA-O 3.02Å; S392-S553 PolarHBondContact OG-O 3.3Å
393	P	84.9	Confident	85.6	Confident	65 Å²	65	28.4 Å²	28.4	42%	0.422	15%	0.149	S	C	.	.	H	α-helix	trans	-57.6	-37.8	174.2	22.7	-32.8	0	0	0	113	V395 K396 T397 S553 T554	P393-V395 VanDerWaalsContact C-N 3.35Å; P393-V395 PolarHBondContact O-N 3.2Å; P393-K396 WeakPolarHBondContact O-CB 3.18Å; P393-K396 PolarHBondContact O-N 3.38Å; P393-T397 PolarHBondContact O-N 3.08Å; P393-T397 PolarHBondContact O-OG1 3.24Å; P393-S553 WeakPolarHBondContact CD-O 3.21Å; P393-S553 WeakPolarHBondContact CG-O 3.38Å; P393-T554 HydrophobicContact CG-CG2 4.32Å
394	V	86	Confident	85.5	Confident	18 Å²	18	29.4 Å²	29.4	11%	0.109	17%	0.166	C	C	.	.	H	α-helix	trans	-61.9	-43.4	174.9	177.6	0	0	0	0	111.4	S392 K396 T397 I398 S553 T554 L556	S392-V394 VanDerWaalsContact C-N 3.28Å; S392-V394 PolarHBondContact O-N 2.86Å; S392-V394 PolarHBondContact OG-N 3.34Å; S392-V394 VanDerWaalsContact OG-N 3.15Å; V394-K396 VanDerWaalsContact C-N 3.28Å; V394-K396 PolarHBondContact O-N 2.85Å; V394-T397 PolarHBondContact O-N 2.82Å; V394-I398 HydrophobicContact CG1-CD1 4.13Å; V394-I398 WeakPolarHBondContact O-CG1 3.33Å; V394-I398 PolarHBondContact O-N 2.88Å; V394-S553 WeakPolarHBondContact CG2-O 3.37Å; V394-T554 VanDerWaalsContact CG2-O 3.32Å; V394-T554 WeakPolarHBondContact CG2-O 3.35Å; V394-L556 HydrophobicContact CG1-CD1 4.44Å; V394-L556 HydrophobicContact CG1-CD2 4.28Å; V394-L556 HydrophobicContact CG1-CG 3.78Å
395	V	86.6	Confident	85.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67	-33.1	178.9	-179.9	0	0	0	0	110.9	V388 P390 S392 P393 I398 V399 F546 L549	V388-V395 HydrophobicContact CG1-CG1 3.52Å; P390-V395 WeakPolarHBondContact O-CB 3.38Å; S392-V395 PolarHBondContact O-N 2.73Å; S392-V395 VanDerWaalsContact O-N 3.16Å; P393-V395 VanDerWaalsContact C-N 3.35Å; P393-V395 PolarHBondContact O-N 3.2Å; V395-I398 PolarHBondContact O-N 3.39Å; V395-V399 WeakPolarHBondContact O-CB 2.99Å; V395-V399 WeakPolarHBondContact O-CG2 3.34Å; V395-V399 PolarHBondContact O-N 2.85Å; V395-F546 HydrophobicContact CG1-CD2 4.19Å; V395-F546 HydrophobicContact CG1-CE2 4.15Å; V395-F546 HydrophobicContact CG2-CD2 4.08Å; V395-L549 HydrophobicContact CG2-CD1 3.64Å
396	K	86.5	Confident	84.7	Confident	101 Å²	101	33.6 Å²	33.6	44%	0.439	18%	0.184	S	C	.	.	H	α-helix	trans	-63.8	-46.2	171.3	-69.4	178.4	178.1	-175	0	111.9	S392 P393 V394 I398 V399 E400 V520	S392-K396 PolarHBondContact O-N 3.32Å; P393-K396 WeakPolarHBondContact O-CB 3.18Å; P393-K396 PolarHBondContact O-N 3.38Å; V394-K396 VanDerWaalsContact C-N 3.28Å; V394-K396 PolarHBondContact O-N 2.85Å; K396-I398 VanDerWaalsContact C-N 3.33Å; K396-I398 PolarHBondContact O-N 2.98Å; K396-V399 CarbonylContact O-C 3.6Å; K396-V399 WeakPolarHBondContact O-CA 3.33Å; K396-V399 WeakPolarHBondContact O-CB 3.29Å; K396-V399 PolarHBondContact O-N 3.45Å; K396-E400 WeakPolarHBondContact O-CG 3.49Å; K396-E400 PolarHBondContact O-N 3.35Å; K396-V520 HydrophobicContact CG-CG2 4.47Å
397	T	86.4	Confident	83.8	Confident	62 Å²	62	38.3 Å²	38.3	38%	0.38	21%	0.206	S	C	.	.	H	α-helix	trans	-59.6	-42.1	174.9	-49.9	0	0	0	0	112.1	P393 V394 V399 E400 E401	P393-T397 PolarHBondContact O-N 3.08Å; P393-T397 PolarHBondContact O-OG1 3.24Å; V394-T397 PolarHBondContact O-N 2.82Å; T397-V399 VanDerWaalsContact C-N 3.29Å; T397-V399 PolarHBondContact O-N 2.54Å; T397-E400 PolarHBondContact O-N 3Å; T397-E401 WeakPolarHBondContact O-CG 3.41Å; T397-E401 PolarHBondContact O-N 3.05Å
398	I	87	Confident	82.7	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-40.6	173.7	-67.4	164.8	0	0	0	111.1	V394 V395 K396 L402 F546 L556 I618 L622	V394-I398 HydrophobicContact CG1-CD1 4.13Å; V394-I398 WeakPolarHBondContact O-CG1 3.33Å; V394-I398 PolarHBondContact O-N 2.88Å; V395-I398 PolarHBondContact O-N 3.39Å; K396-I398 VanDerWaalsContact C-N 3.33Å; K396-I398 PolarHBondContact O-N 2.98Å; I398-L402 HydrophobicContact CG2-CD1 3.87Å; I398-L402 WeakPolarHBondContact O-CB 3.45Å; I398-L402 WeakPolarHBondContact O-CD1 3.41Å; I398-L402 VanDerWaalsContact O-CG 3.24Å; I398-L402 WeakPolarHBondContact O-CG 3.41Å; I398-L402 PolarHBondContact O-N 3.38Å; I398-F546 HydrophobicContact CD1-CZ 4.43Å; I398-F546 HydrophobicContact CG2-CZ 4.46Å; I398-L556 HydrophobicContact CD1-CD2 4.26Å; I398-I618 HydrophobicContact CG2-CG2 4.27Å; I398-L622 HydrophobicContact CG1-CD1 3.58Å
399	V	86.6	Confident	81.6	Confident	9 Å²	9	42 Å²	42	6%	0.055	22%	0.224	C	C	.	.	H	α-helix	trans	-72	-33.4	178.5	162	0	0	0	0	113	V388 V395 K396 T397 L402 N403 F518 V520	V388-V399 HydrophobicContact CB-CG2 4.12Å; V388-V399 HydrophobicContact CG1-CG2 4.1Å; V388-V399 HydrophobicContact CG2-CG2 3.92Å; V395-V399 WeakPolarHBondContact O-CB 2.99Å; V395-V399 WeakPolarHBondContact O-CG2 3.34Å; V395-V399 PolarHBondContact O-N 2.85Å; K396-V399 CarbonylContact O-C 3.6Å; K396-V399 WeakPolarHBondContact O-CA 3.33Å; K396-V399 WeakPolarHBondContact O-CB 3.29Å; K396-V399 PolarHBondContact O-N 3.45Å; T397-V399 VanDerWaalsContact C-N 3.29Å; T397-V399 PolarHBondContact O-N 2.54Å; V399-L402 PolarHBondContact O-N 3.38Å; V399-N403 WeakPolarHBondContact O-CB 3.47Å; V399-N403 PolarHBondContact O-N 3.33Å; V399-N403 PolarHBondContact O-ND2 3.02Å; V399-F518 HydrophobicContact CB-CB 4.46Å; V399-F518 HydrophobicContact CG1-CB 3.73Å; V399-F518 HydrophobicContact CG2-CB 4.18Å; V399-V520 HydrophobicContact CB-CG2 4.2Å; V399-V520 HydrophobicContact CG1-CG2 4.12Å; V399-V520 HydrophobicContact CG2-CG2 3.93Å
400	E	85.7	Confident	80.4	Confident	124 Å²	124	43.7 Å²	43.7	58%	0.579	23%	0.231	S	C	*	.	H	α-helix	trans	-65.1	-48	173.6	-74.6	159.7	-169.2	0	0	110.5	K396 T397 L402 N403 G404	K396-E400 WeakPolarHBondContact O-CG 3.49Å; K396-E400 PolarHBondContact O-N 3.35Å; T397-E400 PolarHBondContact O-N 3Å; E400-L402 PolarHBondContact O-N 2.77Å; E400-N403 PolarHBondContact O-N 3.46Å; E400-G404 PolarHBondContact O-N 2.8Å
401	E	82.3	Confident	79.2	Confident	95 Å²	95	45 Å²	45	44%	0.444	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-40.9	172.7	-71.9	-68.6	156.6	0	0	112.8	T397 G404 K405 I618	T397-E401 WeakPolarHBondContact O-CG 3.41Å; T397-E401 PolarHBondContact O-N 3.05Å; E401-G404 PolarHBondContact O-N 3.36Å; E401-K405 PolarHBondContact O-N 3.31Å; E401-I618 HydrophobicContact CB-CD1 4.08Å; E401-I618 HydrophobicContact CB-CG1 4.43Å; E401-I618 HydrophobicContact CB-CG2 3.94Å
402	L	82.2	Confident	78.3	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-43.8	176.7	-82.4	164.8	0	0	0	112.5	I398 V399 E400 G404 F518 L614 V615 I618	I398-L402 HydrophobicContact CG2-CD1 3.87Å; I398-L402 WeakPolarHBondContact O-CB 3.45Å; I398-L402 WeakPolarHBondContact O-CD1 3.41Å; I398-L402 VanDerWaalsContact O-CG 3.24Å; I398-L402 WeakPolarHBondContact O-CG 3.41Å; I398-L402 PolarHBondContact O-N 3.38Å; V399-L402 PolarHBondContact O-N 3.38Å; E400-L402 PolarHBondContact O-N 2.77Å; L402-G404 VanDerWaalsContact C-N 3.31Å; L402-F518 HydrophobicContact CB-CD2 3.82Å; L402-F518 HydrophobicContact CB-CE1 4.42Å; L402-F518 HydrophobicContact CB-CE2 3.73Å; L402-F518 HydrophobicContact CB-CG 4.22Å; L402-F518 HydrophobicContact CB-CZ 4.05Å; L402-F518 HydrophobicContact CD1-CD1 3.96Å; L402-F518 HydrophobicContact CD1-CE1 3.8Å; L402-F518 HydrophobicContact CD1-CG 4.43Å; L402-F518 HydrophobicContact CD1-CZ 4.14Å; L402-F518 HydrophobicContact CD2-CE1 4.22Å; L402-F518 HydrophobicContact CD2-CE2 4.23Å; L402-F518 HydrophobicContact CD2-CZ 3.79Å; L402-F518 HydrophobicContact CG-CE1 4.39Å; L402-F518 HydrophobicContact CG-CE2 4.41Å; L402-F518 HydrophobicContact CG-CZ 4.23Å; L402-L614 HydrophobicContact CD2-CB 4.09Å; L402-V615 HydrophobicContact CD1-CG2 4.41Å; L402-V615 HydrophobicContact CD2-CG2 4.31Å; L402-I618 HydrophobicContact CB-CD1 4.22Å; L402-I618 HydrophobicContact CD2-CD1 3.54Å; L402-I618 HydrophobicContact CG-CD1 3.58Å
403	N	82.2	Confident	77.3	Confident	36 Å²	36	49.2 Å²	49.2	19%	0.193	25%	0.251	C	S	.	.	H	α-helix	trans	-68.4	-32.8	174.3	-73.5	-51	0	0	0	111.2	V399 E400 K405 L406 H407 R517	V399-N403 WeakPolarHBondContact O-CB 3.47Å; V399-N403 PolarHBondContact O-N 3.33Å; V399-N403 PolarHBondContact O-ND2 3.02Å; E400-N403 PolarHBondContact O-N 3.46Å; N403-K405 PolarHBondContact O-N 2.83Å; N403-L406 PolarHBondContact O-N 3.02Å; N403-L406 VanDerWaalsContact O-N 3.11Å; N403-H407 PolarHBondContact O-N 2.93Å; N403-R517 PolarHBondContact OD1-N 2.88Å
404	G	76.6	Confident	76.1	Confident	40 Å²	40	49.4 Å²	49.4	41%	0.412	25%	0.251	S	S	.	.	H	α-helix	trans	-55.1	-47.4	175.1	0	0	0	0	0	113.1	E400 E401 L402 L406 H407	E400-G404 PolarHBondContact O-N 2.8Å; E401-G404 PolarHBondContact O-N 3.36Å; L402-G404 VanDerWaalsContact C-N 3.31Å; G404-L406 VanDerWaalsContact C-N 3.29Å; G404-L406 PolarHBondContact O-N 3.21Å; G404-H407 VanDerWaalsContact O-CB 3.3Å; G404-H407 WeakPolarHBondContact O-CB 3.34Å; G404-H407 PolarHBondContact O-N 3.02Å; G404-H407 VanDerWaalsContact O-N 3.13Å
405	K	74.8	Confident	74.9	Confident	71 Å²	71	51.4 Å²	51.4	31%	0.309	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-27.5	175.6	-69.9	-171.1	178.4	179.5	0	114.3	E401 N403 L614 I618	E401-K405 PolarHBondContact O-N 3.31Å; N403-K405 PolarHBondContact O-N 2.83Å; K405-L614 HydrophobicContact CD-CD2 3.99Å; K405-I618 HydrophobicContact CD-CD1 4.25Å
406	L	74	Confident	73.5	Confident	17 Å²	17	54.5 Å²	54.5	9%	0.089	28%	0.275	C	S	.	.	H	α-helix	trans	-79.6	-22.6	175	-69.1	178.5	0	0	0	112.5	L21 N403 G404 E408 I409 R517 F518	L21-L406 HydrophobicContact CD1-CD2 4.12Å; N403-L406 PolarHBondContact O-N 3.02Å; N403-L406 VanDerWaalsContact O-N 3.11Å; G404-L406 VanDerWaalsContact C-N 3.29Å; G404-L406 PolarHBondContact O-N 3.21Å; L406-E408 PolarHBondContact O-N 3.36Å; L406-I409 PolarHBondContact O-N 2.84Å; L406-R517 HydrophobicContact CD1-CB 4.4Å; L406-R517 HydrophobicContact CD1-CG 4.22Å; L406-F518 HydrophobicContact CD1-CD2 4.23Å; L406-F518 HydrophobicContact CD1-CE2 3.77Å
407	H	69	Low	72.1	Confident	107 Å²	107	51.6 Å²	51.6	50%	0.495	27%	0.265	S	S	.	.	H	α-helix	trans	-67.6	-19.5	179	-158.9	-45.6	0	0	0	112.7	N403 G404 I409 E410 V411	N403-H407 PolarHBondContact O-N 2.93Å; G404-H407 VanDerWaalsContact O-CB 3.3Å; G404-H407 WeakPolarHBondContact O-CB 3.34Å; G404-H407 PolarHBondContact O-N 3.02Å; G404-H407 VanDerWaalsContact O-N 3.13Å; H407-I409 VanDerWaalsContact C-N 3.26Å; H407-I409 PolarHBondContact O-N 3.03Å; H407-E410 WeakPolarHBondContact O-CB 3.28Å; H407-E410 PolarHBondContact O-N 3.34Å; H407-V411 WeakPolarHBondContact O-CG2 3.22Å; H407-V411 PolarHBondContact O-N 3.47Å
408	E	66.1	Low	70.6	Confident	57 Å²	57	50.5 Å²	50.5	27%	0.266	26%	0.26	S	S	.	.	H	α-helix	trans	-56	-37.8	173.2	-65.4	168	-150.4	0	0	112	L406 V411 F412	L406-E408 PolarHBondContact O-N 3.36Å; E408-V411 PolarHBondContact O-N 3.31Å; E408-F412 PolarHBondContact O-N 2.98Å; E408-F412 VanDerWaalsContact O-N 3.1Å
409	I	67.2	Low	69.2	Low	22 Å²	22	56.2 Å²	56.2	11%	0.113	28%	0.282	C	S	.	.	H	α-helix	trans	-68.5	-38.1	175.1	-67.1	169	0	0	0	111.7	L21 L406 H407 V411 F412 R413 F509 F513	L21-I409 HydrophobicContact CD1-CD1 4.41Å; L21-I409 HydrophobicContact CD2-CD1 3.4Å; L21-I409 HydrophobicContact CD2-CG1 4.08Å; L406-I409 PolarHBondContact O-N 2.84Å; H407-I409 VanDerWaalsContact C-N 3.26Å; H407-I409 PolarHBondContact O-N 3.03Å; I409-V411 VanDerWaalsContact C-N 3.27Å; I409-V411 PolarHBondContact O-N 2.93Å; I409-F412 WeakPolarHBondContact O-CB 3.31Å; I409-F412 PolarHBondContact O-N 3.05Å; I409-R413 WeakPolarHBondContact O-CB 3.34Å; I409-R413 PolarHBondContact O-N 2.64Å; I409-F509 HydrophobicContact CG2-CD1 4.49Å; I409-F509 HydrophobicContact CG2-CE1 4.19Å; I409-F513 HydrophobicContact CB-CE1 4.11Å; I409-F513 HydrophobicContact CB-CZ 4.13Å; I409-F513 HydrophobicContact CD1-CE1 4.24Å; I409-F513 HydrophobicContact CD1-CE2 3.63Å; I409-F513 HydrophobicContact CD1-CZ 3.4Å; I409-F513 HydrophobicContact CG1-CZ 4.35Å; I409-F513 HydrophobicContact CG2-CD1 4.19Å; I409-F513 HydrophobicContact CG2-CE1 3.99Å; I409-F513 HydrophobicContact CG2-CE2 4.43Å; I409-F513 HydrophobicContact CG2-CZ 4.13Å
410	E	64.9	Low	67.7	Low	38 Å²	38	58 Å²	58	18%	0.178	29%	0.288	C	S	.	.	H	α-helix	trans	-67.8	-32	179.8	-178.7	62.2	-172.4	0	0	111.7	H407 R413 T414	H407-E410 WeakPolarHBondContact O-CB 3.28Å; H407-E410 PolarHBondContact O-N 3.34Å; E410-R413 VanDerWaalsContact CD-NE 3.28Å; E410-R413 IonicContact OE1-CZ 3.16Å; E410-R413 VanDerWaalsContact OE1-CZ 3.31Å; E410-R413 IonicContact OE1-NE 2.74Å; E410-R413 PolarHBondContact OE1-NE 3.21Å; E410-R413 VanDerWaalsContact OE1-NE 3.15Å; E410-R413 IonicContact OE1-NH2 3.2Å; E410-R413 PolarHBondContact OE1-NH2 3.44Å; E410-R413 WeakPolarHBondContact OE2-CD 3.29Å; E410-R413 IonicContact OE2-CZ 3.66Å; E410-R413 IonicContact OE2-NE 2.85Å; E410-R413 PolarHBondContact OE2-NE 3.46Å; E410-R413 IonicContact OE2-NH2 2.97Å; E410-T414 WeakPolarHBondContact O-CG2 3.2Å; E410-T414 PolarHBondContact O-N 3.09Å; E410-T414 PolarHBondContact O-OG1 2.87Å
411	V	64.2	Low	66.2	Low	38 Å²	38	58.5 Å²	58.5	23%	0.23	29%	0.29	C	S	.	.	H	α-helix	trans	-68.2	-43.9	171.3	169.6	0	0	0	0	111.1	H407 E408 I409 R413 T414 L415 I1587	H407-V411 WeakPolarHBondContact O-CG2 3.22Å; H407-V411 PolarHBondContact O-N 3.47Å; E408-V411 PolarHBondContact O-N 3.31Å; I409-V411 VanDerWaalsContact C-N 3.27Å; I409-V411 PolarHBondContact O-N 2.93Å; V411-R413 PolarHBondContact O-N 3.45Å; V411-T414 PolarHBondContact O-N 2.88Å; V411-T414 PolarHBondContact O-OG1 3.18Å; V411-L415 HydrophobicContact CG1-CD1 4.42Å; V411-L415 PolarHBondContact O-N 3.35Å; V411-L415 VanDerWaalsContact O-N 3.14Å; V411-I1587 HydrophobicContact CG1-CG2 3.19Å
412	F	66	Low	64.9	Low	74 Å²	74	55.2 Å²	55.2	33%	0.325	28%	0.276	S	S	.	.	H	α-helix	trans	-60.7	-44.2	172.9	-177.9	-100.9	0	0	0	111.9	E408 I409 T414 L415 F416 L1591	E408-F412 PolarHBondContact O-N 2.98Å; E408-F412 VanDerWaalsContact O-N 3.1Å; I409-F412 WeakPolarHBondContact O-CB 3.31Å; I409-F412 PolarHBondContact O-N 3.05Å; F412-T414 PolarHBondContact O-N 3.44Å; F412-L415 PolarHBondContact O-N 2.96Å; F412-F416 HydrophobicContact CZ-CD2 4.39Å; F412-F416 WeakPolarHBondContact O-CB 3.34Å; F412-F416 PolarHBondContact O-N 3.48Å; F412-L1591 HydrophobicContact CB-CD1 3.97Å; F412-L1591 HydrophobicContact CD2-CD1 4.05Å; F412-L1591 HydrophobicContact CD2-CD2 4.43Å
413	R	63.7	Low	63.3	Low	53 Å²	53	57.4 Å²	57.4	20%	0.2	29%	0.286	C	S	.	.	H	α-helix	trans	-55.9	-49.9	176	176.9	-176.4	87	77.6	-0.1	112	I409 E410 V411 F416 V417 F509	I409-R413 WeakPolarHBondContact O-CB 3.34Å; I409-R413 PolarHBondContact O-N 2.64Å; E410-R413 VanDerWaalsContact CD-NE 3.28Å; E410-R413 IonicContact OE1-CZ 3.16Å; E410-R413 VanDerWaalsContact OE1-CZ 3.31Å; E410-R413 IonicContact OE1-NE 2.74Å; E410-R413 PolarHBondContact OE1-NE 3.21Å; E410-R413 VanDerWaalsContact OE1-NE 3.15Å; E410-R413 IonicContact OE1-NH2 3.2Å; E410-R413 PolarHBondContact OE1-NH2 3.44Å; E410-R413 WeakPolarHBondContact OE2-CD 3.29Å; E410-R413 IonicContact OE2-CZ 3.66Å; E410-R413 IonicContact OE2-NE 2.85Å; E410-R413 PolarHBondContact OE2-NE 3.46Å; E410-R413 IonicContact OE2-NH2 2.97Å; V411-R413 PolarHBondContact O-N 3.45Å; R413-F416 PolarHBondContact O-N 3.42Å; R413-V417 HydrophobicContact CG-CG2 4.33Å; R413-V417 WeakPolarHBondContact O-CB 3.13Å; R413-V417 VanDerWaalsContact O-CG2 3.29Å; R413-V417 WeakPolarHBondContact O-CG2 3.31Å; R413-V417 PolarHBondContact O-N 3.28Å; R413-F509 HydrophobicContact CB-CB 4.49Å; R413-F509 HydrophobicContact CB-CD1 4.22Å; R413-F509 WeakPolarHBondContact CD-O 3.45Å; R413-F509 HydrophobicContact CG-CB 3.77Å; R413-F509 HydrophobicContact CG-CD1 4.4Å; R413-F509 HydrophobicContact CG-CG 4.43Å
414	T	60	Low	61.7	Low	69 Å²	69	58.2 Å²	58.2	42%	0.423	30%	0.298	S	S	.	.	H	α-helix	trans	-66.9	-38.6	-175.9	45.7	0	0	0	0	111.9	E410 V411 F412 S418	E410-T414 WeakPolarHBondContact O-CG2 3.2Å; E410-T414 PolarHBondContact O-N 3.09Å; E410-T414 PolarHBondContact O-OG1 2.87Å; V411-T414 PolarHBondContact O-N 2.88Å; V411-T414 PolarHBondContact O-OG1 3.18Å; F412-T414 PolarHBondContact O-N 3.44Å; T414-S418 VanDerWaalsContact O-CB 3.27Å; T414-S418 WeakPolarHBondContact O-CB 3.16Å; T414-S418 PolarHBondContact O-N 3.32Å
415	L	60.2	Low	60.5	Low	61 Å²	61	59.8 Å²	59.8	32%	0.319	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-50.4	170.3	-76	169.3	0	0	0	112.4	V411 F412 V417 S418 W419 I1587	V411-L415 HydrophobicContact CG1-CD1 4.42Å; V411-L415 PolarHBondContact O-N 3.35Å; V411-L415 VanDerWaalsContact O-N 3.14Å; F412-L415 PolarHBondContact O-N 2.96Å; L415-V417 PolarHBondContact O-N 3.13Å; L415-S418 PolarHBondContact O-N 2.99Å; L415-W419 WeakPolarHBondContact O-CB 2.94Å; L415-W419 PolarHBondContact O-N 3.39Å; L415-I1587 HydrophobicContact CD1-CG2 3.88Å
416	F	57.6	Low	59.4	Low	65 Å²	65	60 Å²	60	29%	0.285	30%	0.297	S	S	.	.	H	α-helix	trans	-62.6	-44	-177.7	-170.1	-90.8	0	0	0	112.2	F412 R413 W419 Y420 V505	F412-F416 HydrophobicContact CZ-CD2 4.39Å; F412-F416 WeakPolarHBondContact O-CB 3.34Å; F412-F416 PolarHBondContact O-N 3.48Å; R413-F416 PolarHBondContact O-N 3.42Å; F416-W419 HydrophobicContact CE2-CZ3 4.38Å; F416-W419 PolarHBondContact O-N 2.79Å; F416-Y420 VanDerWaalsContact O-CB 3.23Å; F416-Y420 WeakPolarHBondContact O-CB 3.33Å; F416-Y420 PolarHBondContact O-N 3.37Å; F416-V505 HydrophobicContact CD1-CG1 4.08Å; F416-V505 HydrophobicContact CE1-CG1 3.96Å
417	V	58.1	Low	58.1	Low	39 Å²	39	62.4 Å²	62.4	24%	0.236	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-39.2	176.7	172.4	0	0	0	0	111.5	R413 L415 Y420 Q421	R413-V417 HydrophobicContact CG-CG2 4.33Å; R413-V417 WeakPolarHBondContact O-CB 3.13Å; R413-V417 VanDerWaalsContact O-CG2 3.29Å; R413-V417 WeakPolarHBondContact O-CG2 3.31Å; R413-V417 PolarHBondContact O-N 3.28Å; L415-V417 PolarHBondContact O-N 3.13Å; V417-Y420 PolarHBondContact O-N 3Å; V417-Q421 HydrophobicContact CG1-CG 4.45Å; V417-Q421 WeakPolarHBondContact O-CB 3.29Å; V417-Q421 VanDerWaalsContact O-CG 3.29Å; V417-Q421 WeakPolarHBondContact O-CG 2.97Å; V417-Q421 PolarHBondContact O-N 3.28Å
418	S	55.4	Low	57.2	Low	40 Å²	40	61.6 Å²	61.6	28%	0.28	31%	0.311	S	S	.	.	H	α-helix	trans	-68.2	-40.4	178.3	-173	0	0	0	0	112.6	T414 L415 N422	T414-S418 VanDerWaalsContact O-CB 3.27Å; T414-S418 WeakPolarHBondContact O-CB 3.16Å; T414-S418 PolarHBondContact O-N 3.32Å; L415-S418 PolarHBondContact O-N 2.99Å; S418-N422 PolarHBondContact O-N 3.44Å; S418-N422 PolarHBondContact O-ND2 2.86Å
419	W	57.2	Low	56.4	Low	120 Å²	120	61.1 Å²	61.1	46%	0.455	32%	0.317	S	S	.	.	H	α-helix	trans	-63.2	-49.8	172.7	178.6	77	0	0	0	111.2	L415 F416 Q421 N422 M423	L415-W419 WeakPolarHBondContact O-CB 2.94Å; L415-W419 PolarHBondContact O-N 3.39Å; F416-W419 HydrophobicContact CE2-CZ3 4.38Å; F416-W419 PolarHBondContact O-N 2.79Å; W419-Q421 VanDerWaalsContact C-N 3.33Å; W419-Q421 PolarHBondContact O-N 2.88Å; W419-N422 PolarHBondContact O-N 3.12Å; W419-N422 VanDerWaalsContact O-N 3.16Å; W419-M423 HydrophobicContact CE3-SD 4.35Å; W419-M423 HydrophobicContact CH2-CE 3.5Å; W419-M423 VanDerWaalsContact CH2-CE 3.5Å; W419-M423 HydrophobicContact CH2-SD 3.54Å; W419-M423 VanDerWaalsContact CH2-SD 3.54Å; W419-M423 HydrophobicContact CZ2-CE 3.37Å; W419-M423 HydrophobicContact CZ2-SD 3.71Å; W419-M423 HydrophobicContact CZ3-CE 4.42Å; W419-M423 HydrophobicContact CZ3-SD 3.87Å; W419-M423 PolarHBondContact O-N 2.67Å
420	Y	54.3	Low	55.6	Low	45 Å²	45	64.6 Å²	64.6	18%	0.176	33%	0.332	C	S	.	.	H	α-helix	trans	-57.2	-41.3	178.5	-179.3	-92.3	0	0	0	113.2	F416 V417 N422 M423 Y497 K502	F416-Y420 VanDerWaalsContact O-CB 3.23Å; F416-Y420 WeakPolarHBondContact O-CB 3.33Å; F416-Y420 PolarHBondContact O-N 3.37Å; V417-Y420 PolarHBondContact O-N 3Å; Y420-N422 VanDerWaalsContact C-N 3.33Å; Y420-N422 PolarHBondContact O-N 2.92Å; Y420-M423 PolarHBondContact O-N 3.2Å; Y420-Y497 HydrophobicContact CE1-CD2 4.23Å; Y420-Y497 HydrophobicContact CE1-CE2 4.47Å; Y420-Y497 HydrophobicContact CE2-CD2 4.43Å; Y420-Y497 AromaticContact CZ-CD2 3.74Å; Y420-Y497 WeakPolarHBondContact OH-CA 3.48Å; Y420-Y497 WeakPolarHBondContact OH-CD2 3.27Å; Y420-K502 HydrophobicContact CE1-CG 4.22Å; Y420-K502 WeakPolarHBondContact OH-CB 3.48Å
421	Q	53.9	Low	54.8	Low	135 Å²	135	68.5 Å²	68.5	63%	0.631	35%	0.35	S	S	*	.	H	α-helix	trans	-66.2	-31.5	179.1	-78.4	176.7	-7.2	0	0	113.6	V417 W419	V417-Q421 HydrophobicContact CG1-CG 4.45Å; V417-Q421 WeakPolarHBondContact O-CB 3.29Å; V417-Q421 VanDerWaalsContact O-CG 3.29Å; V417-Q421 WeakPolarHBondContact O-CG 2.97Å; V417-Q421 PolarHBondContact O-N 3.28Å; W419-Q421 VanDerWaalsContact C-N 3.33Å; W419-Q421 PolarHBondContact O-N 2.88Å
422	N	54.6	Low	54.1	Low	26 Å²	26	73.7 Å²	73.7	14%	0.139	37%	0.372	C	S	.	.	H	α-helix	trans	-92.7	-13.4	-179.2	-69.8	-67.9	0	0	0	113.5	S418 W419 Y420 A424 N425 Y426	S418-N422 PolarHBondContact O-N 3.44Å; S418-N422 PolarHBondContact O-ND2 2.86Å; W419-N422 PolarHBondContact O-N 3.12Å; W419-N422 VanDerWaalsContact O-N 3.16Å; Y420-N422 VanDerWaalsContact C-N 3.33Å; Y420-N422 PolarHBondContact O-N 2.92Å; N422-A424 PolarHBondContact O-N 3.44Å; N422-A424 VanDerWaalsContact O-N 3.14Å; N422-N425 PolarHBondContact O-N 3.46Å; N422-Y426 HydrophobicContact CB-CE1 4.39Å; N422-Y426 HydrophobicContact CB-CE2 4.46Å
423	M	49.6	Very low	53.4	Low	53 Å²	53	70.6 Å²	70.6	26%	0.261	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.5	-171.5	-160.7	171.3	-165.1	0	0	114.4	W419 Y420 N425 Y426 P427 F493	W419-M423 HydrophobicContact CE3-SD 4.35Å; W419-M423 HydrophobicContact CH2-CE 3.5Å; W419-M423 VanDerWaalsContact CH2-CE 3.5Å; W419-M423 HydrophobicContact CH2-SD 3.54Å; W419-M423 VanDerWaalsContact CH2-SD 3.54Å; W419-M423 HydrophobicContact CZ2-CE 3.37Å; W419-M423 HydrophobicContact CZ2-SD 3.71Å; W419-M423 HydrophobicContact CZ3-CE 4.42Å; W419-M423 HydrophobicContact CZ3-SD 3.87Å; W419-M423 PolarHBondContact O-N 2.67Å; Y420-M423 PolarHBondContact O-N 3.2Å; M423-N425 VanDerWaalsContact C-N 3.28Å; M423-N425 PolarHBondContact O-N 2.75Å; M423-Y426 HydrophobicContact CG-CD2 4.41Å; M423-P427 VanDerWaalsContact O-CD 3.25Å; M423-P427 WeakPolarHBondContact O-CD 3.5Å; M423-F493 HydrophobicContact CE-CE1 3.69Å; M423-F493 HydrophobicContact CE-CZ 4.35Å; M423-F493 HydrophobicContact SD-CE1 4.03Å
424	A	48.2	Very low	52.8	Low	53 Å²	53	73 Å²	73	44%	0.438	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19.3	176.6	0	0	0	0	0	114.1	N422	N422-A424 PolarHBondContact O-N 3.44Å; N422-A424 VanDerWaalsContact O-N 3.14Å
425	N	52.2	Low	52.5	Low	73 Å²	73	72.9 Å²	72.9	39%	0.39	37%	0.367	S	S	.	.	H	α-helix	trans	-89.6	-20.7	-178.3	-62.3	-23.5	0	0	0	112.7	N422 M423 A429	N422-N425 PolarHBondContact O-N 3.46Å; M423-N425 VanDerWaalsContact C-N 3.28Å; M423-N425 PolarHBondContact O-N 2.75Å; N425-A429 WeakPolarHBondContact O-CB 3.17Å; N425-A429 PolarHBondContact O-N 3.15Å; N425-A429 VanDerWaalsContact O-N 3.16Å
426	Y	51.7	Low	52.2	Low	76 Å²	76	71.8 Å²	71.8	30%	0.298	36%	0.359	S	S	.	.	H	α-helix	trans	-67.9	-38.6	-177.8	-56.1	-35.8	0	0	0	114.3	N422 M423 F430 W1580	N422-Y426 HydrophobicContact CB-CE1 4.39Å; N422-Y426 HydrophobicContact CB-CE2 4.46Å; M423-Y426 HydrophobicContact CG-CD2 4.41Å; Y426-F430 WeakPolarHBondContact O-CB 3.28Å; Y426-F430 PolarHBondContact O-N 3.3Å; Y426-F430 VanDerWaalsContact O-N 3.14Å; Y426-W1580 AromaticContact CD1-CH2 3.66Å; Y426-W1580 HydrophobicContact CD1-CH2 3.66Å; Y426-W1580 AromaticContact CD1-CZ3 3.94Å; Y426-W1580 HydrophobicContact CD1-CZ3 3.94Å; Y426-W1580 HydrophobicContact CE1-CE3 4.09Å; Y426-W1580 AromaticContact CE1-CH2 3.52Å; Y426-W1580 HydrophobicContact CE1-CH2 3.52Å; Y426-W1580 HydrophobicContact CE1-CZ2 4.4Å; Y426-W1580 AromaticContact CE1-CZ3 3.34Å; Y426-W1580 HydrophobicContact CE1-CZ3 3.34Å
427	P	47	Very low	52	Low	67 Å²	67	73.6 Å²	73.6	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-64.2	-44.4	175.1	-22.7	34.2	0	0	0	112.4	M423 A429 F430 E431	M423-P427 VanDerWaalsContact O-CD 3.25Å; M423-P427 WeakPolarHBondContact O-CD 3.5Å; P427-A429 VanDerWaalsContact C-N 3.35Å; P427-A429 PolarHBondContact O-N 2.89Å; P427-F430 WeakPolarHBondContact O-CA 3.24Å; P427-F430 WeakPolarHBondContact O-CB 3.35Å; P427-F430 PolarHBondContact O-N 3.11Å; P427-E431 PolarHBondContact O-N 3.2Å
428	I	49.3	Very low	51.8	Low	90 Å²	90	73.2 Å²	73.2	46%	0.462	37%	0.373	S	S	.	.	H	α-helix	trans	-61.4	-45	-179.7	-57.9	170.1	0	0	0	110.2	F430 E431 E432	I428-F430 PolarHBondContact O-N 2.84Å; I428-E431 PolarHBondContact O-N 3.41Å; I428-E432 PolarHBondContact O-N 3.34Å; I428-E432 VanDerWaalsContact O-N 3.12Å
429	A	49.1	Very low	51.7	Low	47 Å²	47	72.9 Å²	72.9	39%	0.388	37%	0.37	S	S	.	.	H	α-helix	trans	-66.8	-20.6	175.9	0	0	0	0	0	113.8	N425 P427	N425-A429 WeakPolarHBondContact O-CB 3.17Å; N425-A429 PolarHBondContact O-N 3.15Å; N425-A429 VanDerWaalsContact O-N 3.16Å; P427-A429 VanDerWaalsContact C-N 3.35Å; P427-A429 PolarHBondContact O-N 2.89Å
430	F	50.1	Low	51.4	Low	95 Å²	95	69.1 Å²	69.1	42%	0.417	36%	0.357	S	S	.	.	H	α-helix	trans	-85.5	-41.7	175.2	-173.2	-101.5	0	0	0	111.8	Y426 P427 I428 E432 S433 L435 Y436	Y426-F430 WeakPolarHBondContact O-CB 3.28Å; Y426-F430 PolarHBondContact O-N 3.3Å; Y426-F430 VanDerWaalsContact O-N 3.14Å; P427-F430 WeakPolarHBondContact O-CA 3.24Å; P427-F430 WeakPolarHBondContact O-CB 3.35Å; P427-F430 PolarHBondContact O-N 3.11Å; I428-F430 PolarHBondContact O-N 2.84Å; F430-E432 PolarHBondContact O-N 3.36Å; F430-S433 WeakPolarHBondContact O-CB 3.46Å; F430-S433 PolarHBondContact O-N 3.01Å; F430-S433 VanDerWaalsContact O-N 3.11Å; F430-S433 PolarHBondContact O-OG 3.13Å; F430-L435 HydrophobicContact CE2-CD2 4.12Å; F430-Y436 HydrophobicContact CE1-CD2 4.21Å
431	E	49.2	Very low	51.3	Low	120 Å²	120	69.9 Å²	69.9	56%	0.561	37%	0.367	S	S	*	.	H	α-helix	trans	-62.1	-38.8	175.4	-74.9	-171.4	124.2	0	0	112.9	P427 I428 S433	P427-E431 PolarHBondContact O-N 3.2Å; I428-E431 PolarHBondContact O-N 3.41Å; E431-S433 PolarHBondContact O-N 2.94Å
432	E	49	Very low	51.4	Low	146 Å²	146	67.7 Å²	67.7	68%	0.682	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-6.5	175.7	-67.8	-172.9	161.5	0	0	113.4	I428 F430	I428-E432 PolarHBondContact O-N 3.34Å; I428-E432 VanDerWaalsContact O-N 3.12Å; F430-E432 PolarHBondContact O-N 3.36Å
433	S	52.3	Low	51.3	Low	9 Å²	9	66.8 Å²	66.8	6%	0.063	36%	0.355	C	S	.	.	S	Bend	trans	-84.3	140	-176.1	82.7	0	0	0	0	112.9	F430 E431 L435 Y436	F430-S433 WeakPolarHBondContact O-CB 3.46Å; F430-S433 PolarHBondContact O-N 3.01Å; F430-S433 VanDerWaalsContact O-N 3.11Å; F430-S433 PolarHBondContact O-OG 3.13Å; E431-S433 PolarHBondContact O-N 2.94Å; S433-L435 PolarHBondContact O-N 2.76Å; S433-Y436 WeakPolarHBondContact O-CB 3.26Å; S433-Y436 PolarHBondContact O-N 3.35Å
434	K	50.9	Low	51.5	Low	103 Å²	103	68.5 Å²	68.5	45%	0.448	36%	0.362	S	S	.	.	H	α-helix	trans	-57.9	-22.3	171.7	-69.2	173.9	-178.4	163	0	112.9	Y436 N437 A438 T1566	K434-Y436 VanDerWaalsContact C-N 3.3Å; K434-Y436 PolarHBondContact O-N 3.01Å; K434-N437 PolarHBondContact O-N 2.7Å; K434-A438 PolarHBondContact O-N 3.18Å; K434-T1566 PolarHBondContact NZ-O 2.82Å
435	L	52.4	Low	51.7	Low	67 Å²	67	71.4 Å²	71.4	35%	0.351	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-34.4	175.9	-155.9	92.2	0	0	0	112	F430 S433 S439 F1562	F430-L435 HydrophobicContact CE2-CD2 4.12Å; S433-L435 PolarHBondContact O-N 2.76Å; L435-S439 VanDerWaalsContact O-CB 3.24Å; L435-S439 WeakPolarHBondContact O-CB 3.47Å; L435-S439 PolarHBondContact O-N 3.45Å; L435-S439 PolarHBondContact O-OG 2.91Å; L435-F1562 HydrophobicContact CD1-CE1 3.89Å; L435-F1562 HydrophobicContact CD1-CZ 4.09Å
436	Y	53.6	Low	52	Low	38 Å²	38	70.8 Å²	70.8	15%	0.149	36%	0.361	C	S	.	.	H	α-helix	trans	-62.8	-49.4	175.8	175.7	-111.2	0	0	0	111.2	F430 S433 K434 S439 K440	F430-Y436 HydrophobicContact CE1-CD2 4.21Å; S433-Y436 WeakPolarHBondContact O-CB 3.26Å; S433-Y436 PolarHBondContact O-N 3.35Å; K434-Y436 VanDerWaalsContact C-N 3.3Å; K434-Y436 PolarHBondContact O-N 3.01Å; Y436-S439 PolarHBondContact O-N 3.1Å; Y436-S439 PolarHBondContact O-OG 3.14Å; Y436-K440 WeakPolarHBondContact O-CB 3.16Å; Y436-K440 PolarHBondContact O-N 3.09Å
437	N	54.4	Low	52.4	Low	104 Å²	104	67.8 Å²	67.8	56%	0.556	35%	0.35	S	S	*	.	H	α-helix	trans	-62.6	-46.2	176.4	-76.2	-21.9	0	0	0	112.2	K434 S439 K440 T441	K434-N437 PolarHBondContact O-N 2.7Å; N437-S439 VanDerWaalsContact C-N 3.33Å; N437-S439 PolarHBondContact O-N 2.93Å; N437-K440 PolarHBondContact O-N 2.86Å; N437-T441 PolarHBondContact O-N 2.92Å; N437-T441 PolarHBondContact O-OG1 3.49Å; N437-T441 VanDerWaalsContact O-OG1 3.06Å
438	A	53.4	Low	52.8	Low	30 Å²	30	68.5 Å²	68.5	25%	0.248	35%	0.351	C	S	.	.	H	α-helix	trans	-60.7	-40.7	177.4	0	0	0	0	0	112.4	K434 T441 L442	K434-A438 PolarHBondContact O-N 3.18Å; A438-T441 PolarHBondContact O-N 3.43Å; A438-L442 WeakPolarHBondContact O-CB 3.5Å; A438-L442 PolarHBondContact O-N 3.33Å
439	S	53.6	Low	53.1	Low	33 Å²	33	66.5 Å²	66.5	23%	0.231	34%	0.342	C	S	.	.	H	α-helix	trans	-70	-34.2	175.8	69	0	0	0	0	113	L435 Y436 N437 L442 A443	L435-S439 VanDerWaalsContact O-CB 3.24Å; L435-S439 WeakPolarHBondContact O-CB 3.47Å; L435-S439 PolarHBondContact O-N 3.45Å; L435-S439 PolarHBondContact O-OG 2.91Å; Y436-S439 PolarHBondContact O-N 3.1Å; Y436-S439 PolarHBondContact O-OG 3.14Å; N437-S439 VanDerWaalsContact C-N 3.33Å; N437-S439 PolarHBondContact O-N 2.93Å; S439-L442 PolarHBondContact O-N 3.29Å; S439-A443 VanDerWaalsContact O-CB 3.23Å; S439-A443 WeakPolarHBondContact O-CB 3.46Å; S439-A443 PolarHBondContact O-N 3.38Å
440	K	50.7	Low	53.2	Low	41 Å²	41	64.4 Å²	64.4	18%	0.178	32%	0.324	C	S	.	.	H	α-helix	trans	-63.1	-45.9	171	-175.9	174.6	-177.4	-177	0	111.2	Y436 N437 A443 H444 E475	Y436-K440 WeakPolarHBondContact O-CB 3.16Å; Y436-K440 PolarHBondContact O-N 3.09Å; N437-K440 PolarHBondContact O-N 2.86Å; K440-A443 PolarHBondContact O-N 3.47Å; K440-H444 WeakPolarHBondContact O-CB 3.21Å; K440-H444 PolarHBondContact O-N 2.65Å; K440-E475 IonicContact NZ-OE1 2.66Å; K440-E475 PolarHBondContact NZ-OE1 2.87Å
441	T	53.3	Low	53.4	Low	62 Å²	62	64.5 Å²	64.5	38%	0.38	33%	0.33	S	S	.	.	H	α-helix	trans	-65.9	-41.6	177.5	-47.3	0	0	0	0	112	N437 A438 H444 M445	N437-T441 PolarHBondContact O-N 2.92Å; N437-T441 PolarHBondContact O-OG1 3.49Å; N437-T441 VanDerWaalsContact O-OG1 3.06Å; A438-T441 PolarHBondContact O-N 3.43Å; T441-H444 PolarHBondContact O-N 2.74Å; T441-M445 PolarHBondContact O-N 2.8Å
442	L	54.1	Low	53.5	Low	88 Å²	88	65.3 Å²	65.3	46%	0.461	33%	0.331	S	S	.	.	H	α-helix	trans	-65.6	-40.6	175	-85.9	163.9	0	0	0	112.6	A438 S439 H444 M445 Y446	A438-L442 WeakPolarHBondContact O-CB 3.5Å; A438-L442 PolarHBondContact O-N 3.33Å; S439-L442 PolarHBondContact O-N 3.29Å; L442-H444 VanDerWaalsContact C-N 3.33Å; L442-M445 PolarHBondContact O-N 2.9Å; L442-Y446 VanDerWaalsContact O-CB 3.31Å; L442-Y446 WeakPolarHBondContact O-CB 3.42Å; L442-Y446 PolarHBondContact O-N 3.43Å
443	A	53.8	Low	53.7	Low	7 Å²	7	62 Å²	62	6%	0.058	32%	0.321	C	S	.	.	H	α-helix	trans	-60.6	-45.6	172.5	0	0	0	0	0	110.5	S439 K440 M445 Y446 V447 A469 L472 I473	S439-A443 VanDerWaalsContact O-CB 3.23Å; S439-A443 WeakPolarHBondContact O-CB 3.46Å; S439-A443 PolarHBondContact O-N 3.38Å; K440-A443 PolarHBondContact O-N 3.47Å; A443-M445 VanDerWaalsContact C-N 3.28Å; A443-M445 PolarHBondContact O-N 2.97Å; A443-Y446 WeakPolarHBondContact O-CA 3.37Å; A443-Y446 WeakPolarHBondContact O-CB 3.25Å; A443-Y446 PolarHBondContact O-N 2.91Å; A443-V447 PolarHBondContact O-N 2.67Å; A443-A469 HydrophobicContact CB-CB 4.15Å; A443-L472 HydrophobicContact CB-CB 3.81Å; A443-L472 HydrophobicContact CB-CD1 4.35Å; A443-I473 HydrophobicContact CB-CD1 4.45Å; A443-I473 HydrophobicContact CB-CG1 4Å; A443-I473 VanDerWaalsContact O-CD1 3.3Å; A443-I473 WeakPolarHBondContact O-CD1 3.28Å
444	H	53.2	Low	53.7	Low	89 Å²	89	65.8 Å²	65.8	41%	0.412	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-28.8	179.3	-142.1	-38.9	0	0	0	113.6	K440 T441 L442 N448 I473	K440-H444 WeakPolarHBondContact O-CB 3.21Å; K440-H444 PolarHBondContact O-N 2.65Å; T441-H444 PolarHBondContact O-N 2.74Å; L442-H444 VanDerWaalsContact C-N 3.33Å; H444-N448 PolarHBondContact ND1-ND2 3.06Å; H444-N448 WeakPolarHBondContact O-CB 3.17Å; H444-N448 PolarHBondContact O-ND2 3.39Å; H444-I473 HydrophobicContact CB-CG1 4.14Å
445	M	53.4	Low	53.8	Low	115 Å²	115	62.8 Å²	62.8	57%	0.567	33%	0.329	S	S	*	.	H	α-helix	trans	-71.9	-48.9	164.3	-72.2	-171.8	-173.4	0	0	111.4	T441 L442 A443 V447 N448 V449	T441-M445 PolarHBondContact O-N 2.8Å; L442-M445 PolarHBondContact O-N 2.9Å; A443-M445 VanDerWaalsContact C-N 3.28Å; A443-M445 PolarHBondContact O-N 2.97Å; M445-V447 PolarHBondContact O-N 3.25Å; M445-N448 PolarHBondContact O-N 3.12Å; M445-V449 VanDerWaalsContact O-CG2 3.3Å; M445-V449 WeakPolarHBondContact O-CG2 3.32Å; M445-V449 PolarHBondContact O-N 3.22Å
446	Y	57.8	Low	53.8	Low	60 Å²	60	61.1 Å²	61.1	24%	0.235	32%	0.323	C	S	.	.	H	α-helix	trans	-55.6	-51.8	-174.5	-174.7	-87.6	0	0	0	112.2	L442 A443 V449 D450 I455 A469	L442-Y446 VanDerWaalsContact O-CB 3.31Å; L442-Y446 WeakPolarHBondContact O-CB 3.42Å; L442-Y446 PolarHBondContact O-N 3.43Å; A443-Y446 WeakPolarHBondContact O-CA 3.37Å; A443-Y446 WeakPolarHBondContact O-CB 3.25Å; A443-Y446 PolarHBondContact O-N 2.91Å; Y446-V449 PolarHBondContact O-N 2.94Å; Y446-D450 HydrophobicContact CD1-CB 4.5Å; Y446-D450 HydrophobicContact CE1-CB 4.33Å; Y446-D450 VanDerWaalsContact O-CB 3.26Å; Y446-D450 WeakPolarHBondContact O-CB 3.36Å; Y446-D450 PolarHBondContact O-N 3.34Å; Y446-I455 HydrophobicContact CE2-CG2 4.11Å; Y446-A469 HydrophobicContact CD1-CB 3.79Å; Y446-A469 HydrophobicContact CE1-CB 4.48Å
447	V	59	Low	53.7	Low	12 Å²	12	62.4 Å²	62.4	7%	0.073	34%	0.337	C	S	.	.	H	α-helix	trans	-69.4	-38.6	-179.9	173.8	0	0	0	0	112.3	A443 M445 V449 D450 D451 A469 E470 I473	A443-V447 PolarHBondContact O-N 2.67Å; M445-V447 PolarHBondContact O-N 3.25Å; V447-V449 PolarHBondContact O-N 3.26Å; V447-D450 PolarHBondContact O-N 3.28Å; V447-D451 WeakPolarHBondContact O-CB 3.46Å; V447-D451 PolarHBondContact O-N 3.35Å; V447-A469 HydrophobicContact CG2-CB 3.49Å; V447-A469 VanDerWaalsContact CG2-CB 3.49Å; V447-E470 HydrophobicContact CG1-CG 4.17Å; V447-E470 HydrophobicContact CG2-CG 4.07Å; V447-I473 HydrophobicContact CB-CD1 3.42Å; V447-I473 VanDerWaalsContact CB-CD1 3.42Å; V447-I473 HydrophobicContact CG1-CD1 4.17Å; V447-I473 HydrophobicContact CG2-CD1 3.39Å
448	N	55.9	Low	53.5	Low	83 Å²	83	62 Å²	62	44%	0.444	34%	0.338	S	S	.	.	H	α-helix	trans	-64.6	-22.1	176	-85.7	-38.9	0	0	0	113.7	H444 M445	H444-N448 PolarHBondContact ND1-ND2 3.06Å; H444-N448 WeakPolarHBondContact O-CB 3.17Å; H444-N448 PolarHBondContact O-ND2 3.39Å; M445-N448 PolarHBondContact O-N 3.12Å
449	V	55.2	Low	53.4	Low	48 Å²	48	62.4 Å²	62.4	29%	0.291	34%	0.336	S	S	.	.	H	α-helix	trans	-92.2	-40.4	172.6	-178.4	0	0	0	0	110.9	F216 M445 Y446 V447 D451 K452 V453 I455	F216-V449 HydrophobicContact CZ-CG1 4.06Å; M445-V449 VanDerWaalsContact O-CG2 3.3Å; M445-V449 WeakPolarHBondContact O-CG2 3.32Å; M445-V449 PolarHBondContact O-N 3.22Å; Y446-V449 PolarHBondContact O-N 2.94Å; V447-V449 PolarHBondContact O-N 3.26Å; V449-D451 PolarHBondContact O-N 3.23Å; V449-K452 CarbonylContact O-C 2.85Å; V449-K452 PolarHBondContact O-N 3.16Å; V449-V453 HydrophobicContact CG1-CB 4.29Å; V449-V453 HydrophobicContact CG1-CG2 3.88Å; V449-V453 WeakPolarHBondContact O-CB 3.43Å; V449-V453 WeakPolarHBondContact O-CG2 3.5Å; V449-V453 PolarHBondContact O-N 3Å; V449-I455 HydrophobicContact CB-CD1 4.23Å; V449-I455 HydrophobicContact CG1-CD1 3.71Å
450	D	52.4	Low	53.2	Low	2 Å²	2	64.3 Å²	64.3	1%	0.011	35%	0.354	C	S	.	.	H	α-helix	trans	-60.1	-45.1	177.6	-169.6	40.9	0	0	0	111.7	Y446 V447 K452 V453 D454 I455 S456 R466	Y446-D450 HydrophobicContact CD1-CB 4.5Å; Y446-D450 HydrophobicContact CE1-CB 4.33Å; Y446-D450 VanDerWaalsContact O-CB 3.26Å; Y446-D450 WeakPolarHBondContact O-CB 3.36Å; Y446-D450 PolarHBondContact O-N 3.34Å; V447-D450 PolarHBondContact O-N 3.28Å; D450-K452 PolarHBondContact O-N 3.28Å; D450-V453 PolarHBondContact O-N 3.43Å; D450-D454 VanDerWaalsContact O-CA 3.31Å; D450-D454 WeakPolarHBondContact O-CA 3.4Å; D450-D454 PolarHBondContact O-N 2.75Å; D450-I455 HydrophobicContact CB-CB 4.48Å; D450-I455 WeakPolarHBondContact OD1-CA 3.4Å; D450-I455 WeakPolarHBondContact OD1-CB 3.45Å; D450-I455 PolarHBondContact OD1-N 3.02Å; D450-S456 PolarHBondContact OD1-N 3.27Å; D450-R466 IonicContact OD2-NH1 3.86Å
451	D	53.6	Low	53.2	Low	98 Å²	98	66 Å²	66	52%	0.524	37%	0.365	S	S	.	.	H	α-helix	trans	-63.8	-6.7	174.5	-89.2	-26.7	0	0	0	114.7	V447 V449 R466	V447-D451 WeakPolarHBondContact O-CB 3.46Å; V447-D451 PolarHBondContact O-N 3.35Å; V449-D451 PolarHBondContact O-N 3.23Å; D451-R466 IonicContact OD1-CZ 3.09Å; D451-R466 IonicContact OD1-NH1 2.64Å; D451-R466 PolarHBondContact OD1-NH1 3.07Å; D451-R466 IonicContact OD1-NH2 2.97Å; D451-R466 PolarHBondContact OD1-NH2 3.09Å; D451-R466 IonicContact OD2-NH2 3.05Å
452	K	51	Low	53.1	Low	136 Å²	136	63.2 Å²	63.2	59%	0.591	35%	0.349	S	S	*	.	H	α-helix	trans	-121	-14.7	179.3	-70.9	176.5	-177.3	149.6	0	114.5	L212 V449 D450	L212-K452 HydrophobicContact CD1-CD 3.67Å; L212-K452 VanDerWaalsContact CD1-NZ 3.26Å; V449-K452 CarbonylContact O-C 2.85Å; V449-K452 PolarHBondContact O-N 3.16Å; D450-K452 PolarHBondContact O-N 3.28Å
453	V	53.8	Low	53	Low	76 Å²	76	66.3 Å²	66.3	46%	0.461	36%	0.361	S	S	.	.	H	α-helix	trans	-131.4	-12.1	-172.4	-173.5	0	0	0	0	112.3	F216 V449 D450 I455	F216-V453 HydrophobicContact CE2-CG2 4.05Å; F216-V453 HydrophobicContact CZ-CG2 3.9Å; V449-V453 HydrophobicContact CG1-CB 4.29Å; V449-V453 HydrophobicContact CG1-CG2 3.88Å; V449-V453 WeakPolarHBondContact O-CB 3.43Å; V449-V453 WeakPolarHBondContact O-CG2 3.5Å; V449-V453 PolarHBondContact O-N 3Å; D450-V453 PolarHBondContact O-N 3.43Å; V453-I455 HydrophobicContact CB-CG1 4.39Å; V453-I455 HydrophobicContact CG1-CG1 4.45Å
454	D	52.3	Low	52.9	Low	89 Å²	89	69 Å²	69	48%	0.476	37%	0.371	S	S	.	.			trans	52.2	53.8	-179.1	-152.3	-1.9	0	0	0	113.4	D450 S456 S457	D450-D454 VanDerWaalsContact O-CA 3.31Å; D450-D454 WeakPolarHBondContact O-CA 3.4Å; D450-D454 PolarHBondContact O-N 2.75Å; D454-S456 PolarHBondContact O-N 3.24Å; D454-S456 WeakPolarHBondContact OD1-CB 3.33Å; D454-S456 PolarHBondContact OD1-OG 3.02Å; D454-S457 PolarHBondContact O-N 3.22Å; D454-S457 VanDerWaalsContact O-N 3.14Å; D454-S457 PolarHBondContact O-OG 3.05Å
455	I	53.1	Low	52.9	Low	41 Å²	41	65.7 Å²	65.7	21%	0.21	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-58.4	-25.8	174.4	-59.8	172.5	0	0	0	110.3	Y446 V449 D450 V453 S457 V458	Y446-I455 HydrophobicContact CE2-CG2 4.11Å; V449-I455 HydrophobicContact CB-CD1 4.23Å; V449-I455 HydrophobicContact CG1-CD1 3.71Å; D450-I455 HydrophobicContact CB-CB 4.48Å; D450-I455 WeakPolarHBondContact OD1-CA 3.4Å; D450-I455 WeakPolarHBondContact OD1-CB 3.45Å; D450-I455 PolarHBondContact OD1-N 3.02Å; V453-I455 HydrophobicContact CB-CG1 4.39Å; V453-I455 HydrophobicContact CG1-CG1 4.45Å; I455-S457 PolarHBondContact O-N 3.26Å; I455-S457 VanDerWaalsContact O-N 3.08Å; I455-V458 WeakPolarHBondContact O-CA 3.3Å; I455-V458 PolarHBondContact O-N 2.96Å
456	S	53	Low	53.1	Low	32 Å²	32	63.2 Å²	63.2	22%	0.224	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-51.4	-28.7	173.8	93.7	0	0	0	0	113.8	D450 D454 V458 G462	D450-S456 PolarHBondContact OD1-N 3.27Å; D454-S456 PolarHBondContact O-N 3.24Å; D454-S456 WeakPolarHBondContact OD1-CB 3.33Å; D454-S456 PolarHBondContact OD1-OG 3.02Å; S456-V458 VanDerWaalsContact C-N 3.32Å; S456-V458 PolarHBondContact O-N 3.38Å; S456-G462 WeakPolarHBondContact O-CA 3.41Å
457	S	51.4	Low	52.9	Low	64 Å²	64	67 Å²	67	45%	0.448	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-75.2	-14.6	175.2	67.6	0	0	0	0	114.8	D454 I455 V1499	D454-S457 PolarHBondContact O-N 3.22Å; D454-S457 VanDerWaalsContact O-N 3.14Å; D454-S457 PolarHBondContact O-OG 3.05Å; I455-S457 PolarHBondContact O-N 3.26Å; I455-S457 VanDerWaalsContact O-N 3.08Å; S457-V1499 WeakPolarHBondContact O-CG1 3.4Å
458	V	50.3	Low	52.5	Low	95 Å²	95	69.1 Å²	69.1	58%	0.576	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-104.8	9.3	-174.4	-167.5	0	0	0	0	111.7	I455 S456 W1500	I455-V458 WeakPolarHBondContact O-CA 3.3Å; I455-V458 PolarHBondContact O-N 2.96Å; S456-V458 VanDerWaalsContact C-N 3.32Å; S456-V458 PolarHBondContact O-N 3.38Å; V458-W1500 VanDerWaalsContact O-CZ2 3.26Å; V458-W1500 WeakPolarHBondContact O-CZ2 3.16Å
459	L	51	Low	52.5	Low	39 Å²	39	65.5 Å²	65.5	20%	0.204	35%	0.35	C	S	.	.	S	Bend	trans	-136.4	133.8	174.1	-76.8	166.9	0	0	0	109.5	D461 G462 Y465	L459-D461 PolarHBondContact O-N 2.87Å; L459-D461 VanDerWaalsContact O-N 3.08Å; L459-G462 PolarHBondContact O-N 2.85Å; L459-Y465 HydrophobicContact CB-CD2 4.46Å; L459-Y465 HydrophobicContact CD1-CD2 4.2Å; L459-Y465 HydrophobicContact CD1-CG 4.43Å
460	A	48.2	Very low	52.6	Low	74 Å²	74	66.2 Å²	66.2	61%	0.612	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.5	-173.1	0	0	0	0	0	113.9	W1500	A460-W1500 HydrophobicContact CB-CG 4.32Å; A460-W1500 VanDerWaalsContact N-NE1 3.1Å
461	D	51.1	Low	52.5	Low	75 Å²	75	67.6 Å²	67.6	40%	0.401	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	36.3	175.4	-86.1	-62.1	0	0	0	111.7	L459 Q463 F464 Y465	L459-D461 PolarHBondContact O-N 2.87Å; L459-D461 VanDerWaalsContact O-N 3.08Å; D461-Q463 VanDerWaalsContact C-N 3.26Å; D461-Q463 PolarHBondContact O-N 3.44Å; D461-Q463 VanDerWaalsContact O-N 3.1Å; D461-F464 HydrophobicContact CB-CB 4.21Å; D461-F464 WeakPolarHBondContact O-CA 3.44Å; D461-F464 WeakPolarHBondContact O-CB 3.4Å; D461-F464 PolarHBondContact O-N 3.27Å; D461-Y465 HydrophobicContact CB-CD2 4.33Å; D461-Y465 HydrophobicContact CB-CE2 4.2Å; D461-Y465 WeakPolarHBondContact O-CD2 3.4Å; D461-Y465 PolarHBondContact O-N 3.37Å; D461-Y465 VanDerWaalsContact O-N 3.16Å
462	G	52.3	Low	52.3	Low	5 Å²	5	65.1 Å²	65.1	5%	0.052	35%	0.346	C	S	.	.	H	α-helix	trans	-50.3	-37.9	-175.2	0	0	0	0	0	115.3	S456 L459 F464 Y465 R466	S456-G462 WeakPolarHBondContact O-CA 3.41Å; L459-G462 PolarHBondContact O-N 2.85Å; G462-F464 VanDerWaalsContact C-N 3.34Å; G462-F464 PolarHBondContact O-N 2.86Å; G462-Y465 PolarHBondContact O-N 3.26Å; G462-R466 VanDerWaalsContact O-CB 3.26Å; G462-R466 WeakPolarHBondContact O-CB 3.35Å; G462-R466 PolarHBondContact O-N 3.19Å
463	Q	51.9	Low	52.4	Low	153 Å²	153	59.9 Å²	59.9	72%	0.715	33%	0.325	S	S	*	.	H	α-helix	trans	-64.9	-32.4	173.7	-78.3	-167.1	1.5	0	0	113.9	D461 K467	D461-Q463 VanDerWaalsContact C-N 3.26Å; D461-Q463 PolarHBondContact O-N 3.44Å; D461-Q463 VanDerWaalsContact O-N 3.1Å; Q463-K467 WeakPolarHBondContact O-CB 3.12Å; Q463-K467 WeakPolarHBondContact O-CG 3.24Å; Q463-K467 PolarHBondContact O-N 3.3Å
464	F	50.2	Low	52.2	Low	62 Å²	62	59.6 Å²	59.6	27%	0.272	32%	0.323	S	S	.	.	H	α-helix	trans	-71.1	-46.2	175.2	176.1	-94	0	0	0	110.2	P247 D461 G462 R466 K467 L468	P247-F464 HydrophobicContact CB-CD1 4.18Å; P247-F464 HydrophobicContact CB-CD2 4.44Å; P247-F464 HydrophobicContact CB-CE1 3.68Å; P247-F464 HydrophobicContact CB-CE2 3.96Å; P247-F464 HydrophobicContact CB-CZ 3.56Å; P247-F464 HydrophobicContact CG-CD1 4.12Å; P247-F464 HydrophobicContact CG-CE1 3.29Å; P247-F464 HydrophobicContact CG-CE2 4.29Å; P247-F464 HydrophobicContact CG-CZ 3.4Å; P247-F464 VanDerWaalsContact CG-CZ 3.4Å; D461-F464 HydrophobicContact CB-CB 4.21Å; D461-F464 WeakPolarHBondContact O-CA 3.44Å; D461-F464 WeakPolarHBondContact O-CB 3.4Å; D461-F464 PolarHBondContact O-N 3.27Å; G462-F464 VanDerWaalsContact C-N 3.34Å; G462-F464 PolarHBondContact O-N 2.86Å; F464-R466 PolarHBondContact O-N 3.28Å; F464-K467 PolarHBondContact O-N 2.98Å; F464-L468 HydrophobicContact CE1-CD1 4.27Å; F464-L468 HydrophobicContact CZ-CD1 4.04Å; F464-L468 VanDerWaalsContact O-CB 3.3Å; F464-L468 WeakPolarHBondContact O-CB 3.47Å; F464-L468 PolarHBondContact O-N 3.37Å
465	Y	54.3	Low	51.9	Low	20 Å²	20	59.8 Å²	59.8	8%	0.078	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-40.1	177.2	-74.5	-70	0	0	0	112.9	S240 N241 L459 D461 G462 L468 A469	S240-Y465 WeakPolarHBondContact OG-CE1 3.25Å; S240-Y465 PolarHBondContact OG-OH 3.26Å; S240-Y465 VanDerWaalsContact OG-OH 3.09Å; N241-Y465 PolarHBondContact OD1-OH 2.88Å; L459-Y465 HydrophobicContact CB-CD2 4.46Å; L459-Y465 HydrophobicContact CD1-CD2 4.2Å; L459-Y465 HydrophobicContact CD1-CG 4.43Å; D461-Y465 HydrophobicContact CB-CD2 4.33Å; D461-Y465 HydrophobicContact CB-CE2 4.2Å; D461-Y465 WeakPolarHBondContact O-CD2 3.4Å; D461-Y465 PolarHBondContact O-N 3.37Å; D461-Y465 VanDerWaalsContact O-N 3.16Å; G462-Y465 PolarHBondContact O-N 3.26Å; Y465-L468 PolarHBondContact O-N 3.23Å; Y465-A469 WeakPolarHBondContact O-CB 3.39Å; Y465-A469 PolarHBondContact O-N 3.04Å
466	R	56.9	Low	51.5	Low	64 Å²	64	60.6 Å²	60.6	24%	0.242	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-50.6	172.1	-178.4	179.7	167.2	116.5	18.2	111.4	D450 D451 G462 F464 L468 A469 E470	D450-R466 IonicContact OD2-NH1 3.86Å; D451-R466 IonicContact OD1-CZ 3.09Å; D451-R466 IonicContact OD1-NH1 2.64Å; D451-R466 PolarHBondContact OD1-NH1 3.07Å; D451-R466 IonicContact OD1-NH2 2.97Å; D451-R466 PolarHBondContact OD1-NH2 3.09Å; D451-R466 IonicContact OD2-NH2 3.05Å; G462-R466 VanDerWaalsContact O-CB 3.26Å; G462-R466 WeakPolarHBondContact O-CB 3.35Å; G462-R466 PolarHBondContact O-N 3.19Å; F464-R466 PolarHBondContact O-N 3.28Å; R466-L468 VanDerWaalsContact C-N 3.33Å; R466-L468 PolarHBondContact O-N 2.83Å; R466-A469 PolarHBondContact O-N 3.43Å; R466-E470 HydrophobicContact CG-CG 4.26Å; R466-E470 IonicContact CZ-OE1 2.62Å; R466-E470 VanDerWaalsContact CZ-OE1 3.23Å; R466-E470 IonicContact NE-OE1 3.86Å; R466-E470 PolarHBondContact NE-OE1 3.34Å; R466-E470 IonicContact NH2-OE1 2.63Å; R466-E470 PolarHBondContact NH2-OE1 3.18Å; R466-E470 WeakPolarHBondContact O-CB 3.45Å; R466-E470 VanDerWaalsContact O-CG 3.3Å; R466-E470 WeakPolarHBondContact O-CG 3.47Å; R466-E470 PolarHBondContact O-N 3.37Å
467	K	53.8	Low	51	Low	138 Å²	138	65.1 Å²	65.1	60%	0.6	34%	0.343	S	S	*	.	H	α-helix	trans	-61.2	-38.4	175.9	-79.8	179.9	176	178.8	0	113.1	Q463 F464 S471	Q463-K467 WeakPolarHBondContact O-CB 3.12Å; Q463-K467 WeakPolarHBondContact O-CG 3.24Å; Q463-K467 PolarHBondContact O-N 3.3Å; F464-K467 PolarHBondContact O-N 2.98Å; K467-S471 WeakPolarHBondContact O-CB 3.28Å; K467-S471 PolarHBondContact O-N 2.89Å; K467-S471 PolarHBondContact O-OG 2.82Å
468	L	51.2	Low	50.3	Low	57 Å²	57	68 Å²	68	30%	0.298	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-49.6	175.7	-168.8	87	0	0	0	110	F464 Y465 R466 S471 L472	F464-L468 HydrophobicContact CE1-CD1 4.27Å; F464-L468 HydrophobicContact CZ-CD1 4.04Å; F464-L468 VanDerWaalsContact O-CB 3.3Å; F464-L468 WeakPolarHBondContact O-CB 3.47Å; F464-L468 PolarHBondContact O-N 3.37Å; Y465-L468 PolarHBondContact O-N 3.23Å; R466-L468 VanDerWaalsContact C-N 3.33Å; R466-L468 PolarHBondContact O-N 2.83Å; L468-S471 PolarHBondContact O-N 3.45Å; L468-S471 PolarHBondContact O-OG 3.09Å; L468-L472 HydrophobicContact CG-CD1 4.28Å; L468-L472 WeakPolarHBondContact O-CG 3.33Å; L468-L472 PolarHBondContact O-N 3.39Å
469	A	56	Low	49.7	Very low	7 Å²	7	70 Å²	70	6%	0.058	36%	0.355	C	S	.	.	H	α-helix	trans	-69.1	-42.5	179.9	0	0	0	0	0	112.5	A443 Y446 V447 Y465 R466 S471 L472 I473	A443-A469 HydrophobicContact CB-CB 4.15Å; Y446-A469 HydrophobicContact CD1-CB 3.79Å; Y446-A469 HydrophobicContact CE1-CB 4.48Å; V447-A469 HydrophobicContact CG2-CB 3.49Å; V447-A469 VanDerWaalsContact CG2-CB 3.49Å; Y465-A469 WeakPolarHBondContact O-CB 3.39Å; Y465-A469 PolarHBondContact O-N 3.04Å; R466-A469 PolarHBondContact O-N 3.43Å; A469-S471 VanDerWaalsContact C-N 3.28Å; A469-S471 PolarHBondContact O-N 3.24Å; A469-L472 PolarHBondContact O-N 3.48Å; A469-I473 VanDerWaalsContact O-CD1 3.28Å; A469-I473 WeakPolarHBondContact O-CD1 3.41Å; A469-I473 WeakPolarHBondContact O-CG1 3.47Å; A469-I473 PolarHBondContact O-N 3.07Å
470	E	56.4	Low	49.1	Very low	63 Å²	63	71.2 Å²	71.2	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-55.2	-45.3	170.8	-76.2	172.1	166.4	0	0	110.4	V447 R466 L472 I473 T474	V447-E470 HydrophobicContact CG1-CG 4.17Å; V447-E470 HydrophobicContact CG2-CG 4.07Å; R466-E470 HydrophobicContact CG-CG 4.26Å; R466-E470 IonicContact CZ-OE1 2.62Å; R466-E470 VanDerWaalsContact CZ-OE1 3.23Å; R466-E470 IonicContact NE-OE1 3.86Å; R466-E470 PolarHBondContact NE-OE1 3.34Å; R466-E470 IonicContact NH2-OE1 2.63Å; R466-E470 PolarHBondContact NH2-OE1 3.18Å; R466-E470 WeakPolarHBondContact O-CB 3.45Å; R466-E470 VanDerWaalsContact O-CG 3.3Å; R466-E470 WeakPolarHBondContact O-CG 3.47Å; R466-E470 PolarHBondContact O-N 3.37Å; E470-L472 PolarHBondContact O-N 3.02Å; E470-I473 PolarHBondContact O-N 3.1Å; E470-T474 PolarHBondContact O-N 3.37Å; E470-T474 PolarHBondContact O-OG1 3.46Å; E470-T474 VanDerWaalsContact O-OG1 3.1Å
471	S	50.3	Low	48.4	Very low	32 Å²	32	70.3 Å²	70.3	22%	0.224	35%	0.35	C	S	.	.	H	α-helix	trans	-66.7	-34.8	178.5	77.5	0	0	0	0	113.5	K467 L468 A469 I473 W477	K467-S471 WeakPolarHBondContact O-CB 3.28Å; K467-S471 PolarHBondContact O-N 2.89Å; K467-S471 PolarHBondContact O-OG 2.82Å; L468-S471 PolarHBondContact O-N 3.45Å; L468-S471 PolarHBondContact O-OG 3.09Å; A469-S471 VanDerWaalsContact C-N 3.28Å; A469-S471 PolarHBondContact O-N 3.24Å; S471-I473 VanDerWaalsContact C-N 3.29Å; S471-I473 PolarHBondContact O-N 2.94Å; S471-W477 PolarHBondContact O-NE1 3.18Å
472	L	50.7	Low	47.8	Very low	45 Å²	45	76.1 Å²	76.1	24%	0.236	37%	0.367	C	S	.	.	H	α-helix	trans	-72.8	-20.1	174.7	-72.6	165.2	0	0	0	113.1	A443 L468 A469 E470	A443-L472 HydrophobicContact CB-CB 3.81Å; A443-L472 HydrophobicContact CB-CD1 4.35Å; L468-L472 HydrophobicContact CG-CD1 4.28Å; L468-L472 WeakPolarHBondContact O-CG 3.33Å; L468-L472 PolarHBondContact O-N 3.39Å; A469-L472 PolarHBondContact O-N 3.48Å; E470-L472 PolarHBondContact O-N 3.02Å
473	I	53	Low	47.1	Very low	27 Å²	27	80.6 Å²	80.6	14%	0.138	39%	0.39	C	S	.	.	H	α-helix	trans	-89.5	-48.2	179.3	-69.1	161.6	0	0	0	111.6	A443 H444 V447 A469 E470 S471 E475	A443-I473 HydrophobicContact CB-CD1 4.45Å; A443-I473 HydrophobicContact CB-CG1 4Å; A443-I473 VanDerWaalsContact O-CD1 3.3Å; A443-I473 WeakPolarHBondContact O-CD1 3.28Å; H444-I473 HydrophobicContact CB-CG1 4.14Å; V447-I473 HydrophobicContact CB-CD1 3.42Å; V447-I473 VanDerWaalsContact CB-CD1 3.42Å; V447-I473 HydrophobicContact CG1-CD1 4.17Å; V447-I473 HydrophobicContact CG2-CD1 3.39Å; A469-I473 VanDerWaalsContact O-CD1 3.28Å; A469-I473 WeakPolarHBondContact O-CD1 3.41Å; A469-I473 WeakPolarHBondContact O-CG1 3.47Å; A469-I473 PolarHBondContact O-N 3.07Å; E470-I473 PolarHBondContact O-N 3.1Å; S471-I473 VanDerWaalsContact C-N 3.29Å; S471-I473 PolarHBondContact O-N 2.94Å; I473-E475 PolarHBondContact O-N 3.04Å
474	T	48.1	Very low	46.4	Very low	70 Å²	70	78.7 Å²	78.7	43%	0.429	38%	0.381	S	S	.	.	S	Bend	trans	-64.8	120.2	-177	49.5	0	0	0	0	109.9	E470 S476	E470-T474 PolarHBondContact O-N 3.37Å; E470-T474 PolarHBondContact O-OG1 3.46Å; E470-T474 VanDerWaalsContact O-OG1 3.1Å; T474-S476 WeakPolarHBondContact CB-OG 3.41Å; T474-S476 PolarHBondContact O-N 3.21Å; T474-S476 PolarHBondContact O-OG 2.77Å; T474-S476 PolarHBondContact OG1-OG 2.95Å
475	E	47	Very low	45.8	Very low	93 Å²	93	77.5 Å²	77.5	44%	0.435	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	18.8	172.2	-57.9	-152.8	135.4	0	0	113.4	K440 I473 W477 K478 N479	K440-E475 IonicContact NZ-OE1 2.66Å; K440-E475 PolarHBondContact NZ-OE1 2.87Å; I473-E475 PolarHBondContact O-N 3.04Å; E475-W477 PolarHBondContact O-N 2.88Å; E475-K478 HydrophobicContact CB-CB 4.42Å; E475-K478 WeakPolarHBondContact O-CA 3.18Å; E475-K478 PolarHBondContact O-N 3.24Å; E475-N479 PolarHBondContact O-N 2.73Å
476	S	44.3	Very low	45	Very low	57 Å²	57	80.6 Å²	80.6	40%	0.399	39%	0.391	S	S	.	.	H	α-helix	trans	-57.4	-19.9	164.3	52.6	0	0	0	0	112.2	T474 K478 I480	T474-S476 WeakPolarHBondContact CB-OG 3.41Å; T474-S476 PolarHBondContact O-N 3.21Å; T474-S476 PolarHBondContact O-OG 2.77Å; T474-S476 PolarHBondContact OG1-OG 2.95Å; S476-K478 VanDerWaalsContact C-N 3.28Å; S476-I480 WeakPolarHBondContact O-CD1 3.49Å; S476-I480 WeakPolarHBondContact O-CG1 3.39Å
477	W	43.2	Very low	44.1	Very low	128 Å²	128	82 Å²	82	49%	0.485	40%	0.403	S	S	.	.	H	α-helix	trans	-83.4	-1.5	172	-58.8	47.8	0	0	0	112.8	S471 E475 L485	S471-W477 PolarHBondContact O-NE1 3.18Å; E475-W477 PolarHBondContact O-N 2.88Å; W477-L485 WeakPolarHBondContact O-CD1 3.47Å; W477-L485 VanDerWaalsContact O-CD2 3.24Å; W477-L485 WeakPolarHBondContact O-CD2 3.32Å
478	K	36.4	Very low	43.3	Very low	124 Å²	124	77.6 Å²	77.6	54%	0.539	39%	0.39	S	S	.	.	H	α-helix	trans	-125.5	-28.2	-180	-74.6	-167.2	172.8	-167.7	0	114.9	E475 S476	E475-K478 HydrophobicContact CB-CB 4.42Å; E475-K478 WeakPolarHBondContact O-CA 3.18Å; E475-K478 PolarHBondContact O-N 3.24Å; S476-K478 VanDerWaalsContact C-N 3.28Å
479	N	36.9	Very low	42.5	Very low	138 Å²	138	78.8 Å²	78.8	74%	0.738	40%	0.396	S	S	*	.	H	α-helix	trans	-92.7	-4.4	177.5	-81	-15.6	0	0	0	114	E475	E475-N479 PolarHBondContact O-N 2.73Å
480	I	39.8	Very low	41.8	Very low	63 Å²	63	82 Å²	82	32%	0.323	41%	0.412	S	S	.	.	S	Bend	trans	-66.4	128.8	154.7	-66.4	170.8	0	0	0	106.1	S476 E484 L485	S476-I480 WeakPolarHBondContact O-CD1 3.49Å; S476-I480 WeakPolarHBondContact O-CG1 3.39Å; I480-E484 HydrophobicContact CG2-CB 3.28Å; I480-L485 HydrophobicContact CB-CB 4.22Å; I480-L485 HydrophobicContact CB-CD1 3.99Å; I480-L485 HydrophobicContact CD1-CD1 4.02Å; I480-L485 HydrophobicContact CG2-CB 3.9Å; I480-L485 HydrophobicContact CG2-CD1 4.24Å
481	S	31.9	Very low	40.9	Very low	55 Å²	55	83.2 Å²	83.2	39%	0.385	42%	0.418	S	S	.	.			trans	-55	153.3	-174.1	64	0	0	0	0	111.6	D483 E484 L485	S481-D483 PolarHBondContact O-N 2.7Å; S481-E484 CarbonylContact O-C 3.57Å; S481-E484 PolarHBondContact O-N 2.92Å; S481-E484 WeakPolarHBondContact OG-CB 3.11Å; S481-E484 WeakPolarHBondContact OG-CG 3.38Å; S481-E484 PolarHBondContact OG-N 2.79Å; S481-E484 VanDerWaalsContact OG-N 3.15Å; S481-E484 PolarHBondContact OG-OE2 3.45Å; S481-L485 PolarHBondContact O-N 3.22Å
482	Y	39.5	Very low	40.6	Very low	197 Å²	197	83.3 Å²	83.3	77%	0.773	42%	0.418	S	S	*	.	H	α-helix	trans	-53.4	-34.5	179.4	-178.1	-99.5	0	0	0	111.1	K486	Y482-K486 HydrophobicContact CD1-CD 4.27Å; Y482-K486 HydrophobicContact CE1-CD 3.99Å; Y482-K486 WeakPolarHBondContact O-CB 3.46Å; Y482-K486 PolarHBondContact O-N 3.47Å
483	D	37.4	Very low	40.1	Very low	99 Å²	99	85.9 Å²	85.9	53%	0.529	43%	0.428	S	S	.	.	H	α-helix	trans	-78.6	-21.1	174.5	-79	-46.8	0	0	0	115.4	S481 K486 L487	S481-D483 PolarHBondContact O-N 2.7Å; D483-K486 WeakPolarHBondContact OD1-CD 3.44Å; D483-K486 IonicContact OD1-NZ 2.66Å; D483-K486 PolarHBondContact OD1-NZ 3.19Å; D483-L487 WeakPolarHBondContact O-CA 3.49Å; D483-L487 WeakPolarHBondContact O-CB 3.49Å; D483-L487 PolarHBondContact O-N 2.87Å
484	E	37.3	Very low	39.5	Very low	114 Å²	114	85.7 Å²	85.7	53%	0.533	43%	0.427	S	S	.	.	H	α-helix	trans	-92.2	-25.3	172.6	-75	170.1	126.5	0	0	114.4	I480 S481 L487 S488	I480-E484 HydrophobicContact CG2-CB 3.28Å; S481-E484 CarbonylContact O-C 3.57Å; S481-E484 PolarHBondContact O-N 2.92Å; S481-E484 WeakPolarHBondContact OG-CB 3.11Å; S481-E484 WeakPolarHBondContact OG-CG 3.38Å; S481-E484 PolarHBondContact OG-N 2.79Å; S481-E484 VanDerWaalsContact OG-N 3.15Å; S481-E484 PolarHBondContact OG-OE2 3.45Å; E484-L487 CarbonylContact O-C 3.54Å; E484-L487 PolarHBondContact O-N 2.7Å; E484-S488 WeakPolarHBondContact O-CB 3.48Å; E484-S488 PolarHBondContact O-N 2.8Å; E484-S488 PolarHBondContact O-OG 3.05Å
485	L	36.7	Very low	39.1	Very low	37 Å²	37	84.1 Å²	84.1	19%	0.194	42%	0.416	C	S	.	.	H	α-helix	trans	-79.8	-38.1	171	-162.4	89.7	0	0	0	108.1	W477 I480 S481 L487 S488 L489	W477-L485 WeakPolarHBondContact O-CD1 3.47Å; W477-L485 VanDerWaalsContact O-CD2 3.24Å; W477-L485 WeakPolarHBondContact O-CD2 3.32Å; I480-L485 HydrophobicContact CB-CB 4.22Å; I480-L485 HydrophobicContact CB-CD1 3.99Å; I480-L485 HydrophobicContact CD1-CD1 4.02Å; I480-L485 HydrophobicContact CG2-CB 3.9Å; I480-L485 HydrophobicContact CG2-CD1 4.24Å; S481-L485 PolarHBondContact O-N 3.22Å; L485-L487 VanDerWaalsContact C-N 3.33Å; L485-S488 WeakPolarHBondContact CA-OG 3.36Å; L485-S488 PolarHBondContact O-N 3.13Å; L485-L489 HydrophobicContact CD2-CD1 4Å; L485-L489 HydrophobicContact CG-CD1 4.04Å; L485-L489 VanDerWaalsContact O-CB 3.28Å; L485-L489 WeakPolarHBondContact O-CB 3.29Å; L485-L489 PolarHBondContact O-N 2.97Å
486	K	37.5	Very low	39.1	Very low	85 Å²	85	82.1 Å²	82.1	37%	0.37	41%	0.41	S	S	.	.	H	α-helix	trans	-58.1	-43.9	156.9	-175.8	-176.7	168.2	-159.4	0	109.8	Y482 D483 S488 L490	Y482-K486 HydrophobicContact CD1-CD 4.27Å; Y482-K486 HydrophobicContact CE1-CD 3.99Å; Y482-K486 WeakPolarHBondContact O-CB 3.46Å; Y482-K486 PolarHBondContact O-N 3.47Å; D483-K486 WeakPolarHBondContact OD1-CD 3.44Å; D483-K486 IonicContact OD1-NZ 2.66Å; D483-K486 PolarHBondContact OD1-NZ 3.19Å; K486-S488 VanDerWaalsContact C-N 3.34Å; K486-S488 PolarHBondContact O-N 3.49Å; K486-L490 HydrophobicContact CB-CD1 4.13Å; K486-L490 HydrophobicContact CG-CD1 3.6Å; K486-L490 HydrophobicContact CG-CD2 3.79Å; K486-L490 HydrophobicContact CG-CG 4.2Å; K486-L490 CarbonylContact O-C 3.58Å; K486-L490 WeakPolarHBondContact O-CA 3.39Å; K486-L490 WeakPolarHBondContact O-CB 3.4Å; K486-L490 VanDerWaalsContact O-CD1 3.22Å; K486-L490 WeakPolarHBondContact O-CD1 3.49Å; K486-L490 PolarHBondContact O-N 2.71Å
487	L	38.1	Very low	38.9	Very low	93 Å²	93	83.2 Å²	83.2	49%	0.487	41%	0.405	S	S	.	.	H	α-helix	trans	-66.5	-30.8	177.7	-140.7	77.7	0	0	0	113.4	D483 E484 L485 L490 Q491	D483-L487 WeakPolarHBondContact O-CA 3.49Å; D483-L487 WeakPolarHBondContact O-CB 3.49Å; D483-L487 PolarHBondContact O-N 2.87Å; E484-L487 CarbonylContact O-C 3.54Å; E484-L487 PolarHBondContact O-N 2.7Å; L485-L487 VanDerWaalsContact C-N 3.33Å; L487-L490 CarbonylContact O-C 3.59Å; L487-Q491 HydrophobicContact CG-CG 4.48Å; L487-Q491 WeakPolarHBondContact O-CA 3.31Å; L487-Q491 WeakPolarHBondContact O-CB 3.01Å; L487-Q491 WeakPolarHBondContact O-CG 2.97Å; L487-Q491 PolarHBondContact O-N 2.77Å; L487-Q491 PolarHBondContact O-OE1 3.29Å
488	S	36.8	Very low	38.9	Very low	46 Å²	46	82 Å²	82	32%	0.322	41%	0.412	S	S	.	.	H	α-helix	trans	-93.9	-30.3	-175.2	53.7	0	0	0	0	113.8	E484 L485 K486 Q491 S492	E484-S488 WeakPolarHBondContact O-CB 3.48Å; E484-S488 PolarHBondContact O-N 2.8Å; E484-S488 PolarHBondContact O-OG 3.05Å; L485-S488 WeakPolarHBondContact CA-OG 3.36Å; L485-S488 PolarHBondContact O-N 3.13Å; K486-S488 VanDerWaalsContact C-N 3.34Å; K486-S488 PolarHBondContact O-N 3.49Å; S488-Q491 PolarHBondContact O-N 3.27Å; S488-S492 WeakPolarHBondContact O-CB 3.47Å; S488-S492 PolarHBondContact O-N 3.37Å; S488-S492 PolarHBondContact O-OG 2.75Å
489	L	36	Very low	39.3	Very low	81 Å²	81	82 Å²	82	42%	0.424	42%	0.417	S	S	.	.	H	α-helix	trans	-78.9	-40.2	163	-71.5	164.7	0	0	0	110.7	L485 Q491 S492 F493 N494	L485-L489 HydrophobicContact CD2-CD1 4Å; L485-L489 HydrophobicContact CG-CD1 4.04Å; L485-L489 VanDerWaalsContact O-CB 3.28Å; L485-L489 WeakPolarHBondContact O-CB 3.29Å; L485-L489 PolarHBondContact O-N 2.97Å; L489-Q491 PolarHBondContact O-N 3.28Å; L489-S492 WeakPolarHBondContact CA-OG 3.1Å; L489-F493 HydrophobicContact CD2-CD2 4.46Å; L489-F493 WeakPolarHBondContact O-CA 3.32Å; L489-F493 VanDerWaalsContact O-CB 3.22Å; L489-F493 WeakPolarHBondContact O-CB 3.41Å; L489-F493 PolarHBondContact O-N 3.18Å; L489-N494 PolarHBondContact O-N 3.5Å
490	L	40.6	Very low	39.9	Very low	75 Å²	75	77.7 Å²	77.7	39%	0.393	40%	0.398	S	S	.	.	H	α-helix	trans	-82.4	38.3	158.4	-54.3	59.8	0	0	0	112.1	K486 L487 N494	K486-L490 HydrophobicContact CB-CD1 4.13Å; K486-L490 HydrophobicContact CG-CD1 3.6Å; K486-L490 HydrophobicContact CG-CD2 3.79Å; K486-L490 HydrophobicContact CG-CG 4.2Å; K486-L490 CarbonylContact O-C 3.58Å; K486-L490 WeakPolarHBondContact O-CA 3.39Å; K486-L490 WeakPolarHBondContact O-CB 3.4Å; K486-L490 VanDerWaalsContact O-CD1 3.22Å; K486-L490 WeakPolarHBondContact O-CD1 3.49Å; K486-L490 PolarHBondContact O-N 2.71Å; L487-L490 CarbonylContact O-C 3.59Å; L490-N494 HydrophobicContact CB-CB 3.8Å; L490-N494 VanDerWaalsContact CD2-OD1 3.32Å; L490-N494 WeakPolarHBondContact CD2-OD1 3.14Å; L490-N494 HydrophobicContact CG-CB 4.37Å; L490-N494 WeakPolarHBondContact CG-ND2 3.49Å; L490-N494 VanDerWaalsContact CG-OD1 3.23Å; L490-N494 WeakPolarHBondContact CG-OD1 3.37Å; L490-N494 VanDerWaalsContact O-CA 3.26Å; L490-N494 WeakPolarHBondContact O-CA 3.45Å
491	Q	38.2	Very low	40.2	Very low	89 Å²	89	78.2 Å²	78.2	42%	0.416	40%	0.4	S	S	.	.	H	α-helix	trans	-131.4	-49.1	151.3	-88.1	160.4	-12	0	0	109.3	L487 S488 L489 F493 N494 L495	L487-Q491 HydrophobicContact CG-CG 4.48Å; L487-Q491 WeakPolarHBondContact O-CA 3.31Å; L487-Q491 WeakPolarHBondContact O-CB 3.01Å; L487-Q491 WeakPolarHBondContact O-CG 2.97Å; L487-Q491 PolarHBondContact O-N 2.77Å; L487-Q491 PolarHBondContact O-OE1 3.29Å; S488-Q491 PolarHBondContact O-N 3.27Å; L489-Q491 PolarHBondContact O-N 3.28Å; Q491-F493 VanDerWaalsContact C-N 3.27Å; Q491-F493 PolarHBondContact O-N 3.3Å; Q491-N494 PolarHBondContact O-N 3.39Å; Q491-L495 WeakPolarHBondContact O-CB 3.46Å; Q491-L495 PolarHBondContact O-N 2.9Å
492	S	42.9	Very low	40.6	Very low	34 Å²	34	80.6 Å²	80.6	24%	0.238	40%	0.404	C	S	.	.	H	α-helix	trans	-58	-39.4	171.5	56.1	0	0	0	0	112.2	S488 L489	S488-S492 WeakPolarHBondContact O-CB 3.47Å; S488-S492 PolarHBondContact O-N 3.37Å; S488-S492 PolarHBondContact O-OG 2.75Å; L489-S492 WeakPolarHBondContact CA-OG 3.1Å
493	F	40.3	Very low	41.1	Very low	98 Å²	98	74.8 Å²	74.8	43%	0.43	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-35.3	165	-64.4	-88.2	0	0	0	113.4	M423 L489 Q491 V496 Y497	M423-F493 HydrophobicContact CE-CE1 3.69Å; M423-F493 HydrophobicContact CE-CZ 4.35Å; M423-F493 HydrophobicContact SD-CE1 4.03Å; L489-F493 HydrophobicContact CD2-CD2 4.46Å; L489-F493 WeakPolarHBondContact O-CA 3.32Å; L489-F493 VanDerWaalsContact O-CB 3.22Å; L489-F493 WeakPolarHBondContact O-CB 3.41Å; L489-F493 PolarHBondContact O-N 3.18Å; Q491-F493 VanDerWaalsContact C-N 3.27Å; Q491-F493 PolarHBondContact O-N 3.3Å; F493-V496 WeakPolarHBondContact O-CB 3.46Å; F493-Y497 WeakPolarHBondContact O-CA 3.19Å; F493-Y497 WeakPolarHBondContact O-CB 3.49Å; F493-Y497 PolarHBondContact O-N 3.4Å
494	N	40.1	Very low	41.7	Very low	24 Å²	24	71.8 Å²	71.8	13%	0.128	38%	0.375	C	S	.	.	H	α-helix	trans	-58.3	-46.2	174.3	22	160	0	0	0	119	L489 L490 Q491 V496 Y497 V498	L489-N494 PolarHBondContact O-N 3.5Å; L490-N494 HydrophobicContact CB-CB 3.8Å; L490-N494 VanDerWaalsContact CD2-OD1 3.32Å; L490-N494 WeakPolarHBondContact CD2-OD1 3.14Å; L490-N494 HydrophobicContact CG-CB 4.37Å; L490-N494 WeakPolarHBondContact CG-ND2 3.49Å; L490-N494 VanDerWaalsContact CG-OD1 3.23Å; L490-N494 WeakPolarHBondContact CG-OD1 3.37Å; L490-N494 VanDerWaalsContact O-CA 3.26Å; L490-N494 WeakPolarHBondContact O-CA 3.45Å; Q491-N494 PolarHBondContact O-N 3.39Å; N494-V496 PolarHBondContact O-N 2.84Å; N494-Y497 HydrophobicContact CB-CD1 4.01Å; N494-Y497 HydrophobicContact CB-CG 4.28Å; N494-Y497 VanDerWaalsContact CG-CD1 3.43Å; N494-Y497 PolarHBondContact O-N 2.98Å; N494-Y497 WeakPolarHBondContact OD1-CD1 3.22Å; N494-V498 HydrophobicContact CB-CB 4.2Å; N494-V498 HydrophobicContact CB-CG2 3.68Å; N494-V498 PolarHBondContact O-N 3.46Å
495	L	41.1	Very low	42.4	Very low	37 Å²	37	67.3 Å²	67.3	19%	0.194	36%	0.355	C	S	.	.	I	π-helix	trans	-64	-32.8	-177.5	-152.4	75.7	0	0	0	109.5	E261 V264 Q491 S500	E261-L495 HydrophobicContact CG-CD2 4.4Å; V264-L495 HydrophobicContact CB-CD1 4.07Å; V264-L495 HydrophobicContact CB-CD2 4.04Å; V264-L495 HydrophobicContact CB-CG 4.3Å; V264-L495 HydrophobicContact CG1-CD1 3.83Å; V264-L495 HydrophobicContact CG1-CG 4.44Å; V264-L495 HydrophobicContact CG2-CD2 4.06Å; V264-L495 HydrophobicContact CG2-CG 4.3Å; Q491-L495 WeakPolarHBondContact O-CB 3.46Å; Q491-L495 PolarHBondContact O-N 2.9Å; L495-S500 PolarHBondContact O-N 3.1Å; L495-S500 PolarHBondContact O-OG 3.35Å
496	V	45.2	Very low	43	Very low	50 Å²	50	68.7 Å²	68.7	30%	0.303	37%	0.368	S	S	.	.	I	π-helix	trans	-68.7	-53.1	164.1	169.4	0	0	0	0	111.7	F493 N494 S500 M501	F493-V496 WeakPolarHBondContact O-CB 3.46Å; N494-V496 PolarHBondContact O-N 2.84Å; V496-S500 WeakPolarHBondContact CA-OG 3.37Å; V496-M501 HydrophobicContact CG1-CB 3.8Å; V496-M501 HydrophobicContact CG1-CG 3.87Å; V496-M501 WeakPolarHBondContact O-CA 3.3Å; V496-M501 VanDerWaalsContact O-CB 3.32Å; V496-M501 WeakPolarHBondContact O-CB 3.32Å; V496-M501 PolarHBondContact O-N 2.99Å
497	Y	42	Very low	43.7	Very low	80 Å²	80	67.6 Å²	67.6	31%	0.314	37%	0.366	S	S	.	.	I	π-helix	trans	-84.7	-17.6	-164.8	176.5	-79.5	0	0	0	116.3	Y420 F493 N494 K502	Y420-Y497 HydrophobicContact CE1-CD2 4.23Å; Y420-Y497 HydrophobicContact CE1-CE2 4.47Å; Y420-Y497 HydrophobicContact CE2-CD2 4.43Å; Y420-Y497 AromaticContact CZ-CD2 3.74Å; Y420-Y497 WeakPolarHBondContact OH-CA 3.48Å; Y420-Y497 WeakPolarHBondContact OH-CD2 3.27Å; F493-Y497 WeakPolarHBondContact O-CA 3.19Å; F493-Y497 WeakPolarHBondContact O-CB 3.49Å; F493-Y497 PolarHBondContact O-N 3.4Å; N494-Y497 HydrophobicContact CB-CD1 4.01Å; N494-Y497 HydrophobicContact CB-CG 4.28Å; N494-Y497 VanDerWaalsContact CG-CD1 3.43Å; N494-Y497 PolarHBondContact O-N 2.98Å; N494-Y497 WeakPolarHBondContact OD1-CD1 3.22Å; Y497-K502 VanDerWaalsContact O-CB 3.28Å; Y497-K502 WeakPolarHBondContact O-CB 3.48Å
498	V	43.2	Very low	44.4	Very low	103 Å²	103	65.2 Å²	65.2	62%	0.624	35%	0.354	S	S	*	.	I	π-helix	trans	-110.8	-34.4	-180	172.2	0	0	0	0	114.1	N494	N494-V498 HydrophobicContact CB-CB 4.2Å; N494-V498 HydrophobicContact CB-CG2 3.68Å; N494-V498 PolarHBondContact O-N 3.46Å
499	L	43.6	Very low	45.4	Very low	124 Å²	124	66.1 Å²	66.1	65%	0.649	35%	0.352	S	S	*	.	I	π-helix	trans	-115.1	-30.8	-174.6	-82.3	162.9	0	0	0	115.8
500	S	49	Very low	46.4	Very low	47 Å²	47	65.2 Å²	65.2	33%	0.329	35%	0.352	S	S	.	.	I	π-helix	trans	-126.2	-12.4	-164.2	67.5	0	0	0	0	118	L495 V496 I504	L495-S500 PolarHBondContact O-N 3.1Å; L495-S500 PolarHBondContact O-OG 3.35Å; V496-S500 WeakPolarHBondContact CA-OG 3.37Å; S500-I504 WeakPolarHBondContact O-CB 3.31Å; S500-I504 WeakPolarHBondContact O-CD1 3.46Å; S500-I504 WeakPolarHBondContact O-CG1 3.39Å
501	M	47.3	Very low	47.2	Very low	75 Å²	75	63 Å²	63	37%	0.369	34%	0.343	S	S	.	.	S	Bend	trans	-131.2	-27.8	179.5	-70.2	-75.2	-134.8	0	0	115	V496 V505	V496-M501 HydrophobicContact CG1-CB 3.8Å; V496-M501 HydrophobicContact CG1-CG 3.87Å; V496-M501 WeakPolarHBondContact O-CA 3.3Å; V496-M501 VanDerWaalsContact O-CB 3.32Å; V496-M501 WeakPolarHBondContact O-CB 3.32Å; V496-M501 PolarHBondContact O-N 2.99Å; M501-V505 HydrophobicContact CB-CG2 3.94Å; M501-V505 HydrophobicContact CE-CG2 4.46Å; M501-V505 HydrophobicContact CG-CG2 4.26Å; M501-V505 WeakPolarHBondContact O-CA 3.37Å; M501-V505 WeakPolarHBondContact O-CB 3.4Å; M501-V505 WeakPolarHBondContact O-CG2 3.31Å; M501-V505 PolarHBondContact O-N 3.47Å; M501-V505 HydrophobicContact SD-CG2 3.35Å; M501-V505 WeakPolarHBondContact SD-CG2 3.44Å
502	K	40.4	Very low	48.7	Very low	105 Å²	105	58.9 Å²	58.9	46%	0.457	32%	0.324	S	S	.	.	H	α-helix	trans	-70.3	-41.7	179.3	-161.5	169.5	-175.2	171.8	0	113.3	Y420 Y497 S506	Y420-K502 HydrophobicContact CE1-CG 4.22Å; Y420-K502 WeakPolarHBondContact OH-CB 3.48Å; Y497-K502 VanDerWaalsContact O-CB 3.28Å; Y497-K502 WeakPolarHBondContact O-CB 3.48Å; K502-S506 WeakPolarHBondContact O-CB 3.35Å
503	S	49.8	Very low	50	Low	74 Å²	74	58.5 Å²	58.5	52%	0.517	32%	0.318	S	S	.	.	H	α-helix	trans	-74.6	-46.7	169.5	62.9	0	0	0	0	110.4	L507	S503-L507 WeakPolarHBondContact O-CB 3.42Å; S503-L507 PolarHBondContact O-N 3.17Å
504	I	50.2	Low	51.5	Low	36 Å²	36	56.3 Å²	56.3	19%	0.185	31%	0.307	C	S	.	.	H	α-helix	trans	-66.8	-52.4	-172.8	-65.8	-162.4	0	0	0	112.2	S500 L507 L508	S500-I504 WeakPolarHBondContact O-CB 3.31Å; S500-I504 WeakPolarHBondContact O-CD1 3.46Å; S500-I504 WeakPolarHBondContact O-CG1 3.39Å; I504-L507 PolarHBondContact O-N 3.2Å; I504-L508 HydrophobicContact CB-CD1 4.32Å; I504-L508 HydrophobicContact CG2-CD1 3.24Å; I504-L508 VanDerWaalsContact O-CB 3.27Å; I504-L508 WeakPolarHBondContact O-CB 3.34Å; I504-L508 WeakPolarHBondContact O-CD1 3.48Å; I504-L508 PolarHBondContact O-N 3.33Å
505	V	50.5	Low	52.7	Low	20 Å²	20	57.4 Å²	57.4	12%	0.121	32%	0.315	C	S	.	.	H	α-helix	trans	-67.3	-40.1	178.6	-179.9	0	0	0	0	112	F416 M501 F509	F416-V505 HydrophobicContact CD1-CG1 4.08Å; F416-V505 HydrophobicContact CE1-CG1 3.96Å; M501-V505 HydrophobicContact CB-CG2 3.94Å; M501-V505 HydrophobicContact CE-CG2 4.46Å; M501-V505 HydrophobicContact CG-CG2 4.26Å; M501-V505 WeakPolarHBondContact O-CA 3.37Å; M501-V505 WeakPolarHBondContact O-CB 3.4Å; M501-V505 WeakPolarHBondContact O-CG2 3.31Å; M501-V505 PolarHBondContact O-N 3.47Å; M501-V505 HydrophobicContact SD-CG2 3.35Å; M501-V505 WeakPolarHBondContact SD-CG2 3.44Å; V505-F509 HydrophobicContact CG1-CD2 4.07Å; V505-F509 WeakPolarHBondContact O-CB 3.36Å; V505-F509 PolarHBondContact O-N 3.45Å
506	S	50	Low	54.3	Low	67 Å²	67	58.9 Å²	58.9	47%	0.469	33%	0.329	S	S	.	.	H	α-helix	trans	-61	-46.6	175.5	-167	0	0	0	0	110.6	K502 S510	K502-S506 WeakPolarHBondContact O-CB 3.35Å; S506-S510 WeakPolarHBondContact O-CA 3.46Å; S506-S510 WeakPolarHBondContact O-CB 3.22Å; S506-S510 PolarHBondContact O-N 3.33Å; S506-S510 PolarHBondContact O-OG 3.08Å
507	L	52.2	Low	56.1	Low	61 Å²	61	57.2 Å²	57.2	32%	0.319	32%	0.317	S	S	.	.	H	α-helix	trans	-76.6	-33.3	-179	-155.4	98.3	0	0	0	113.4	A360 W364 S503 I504 C511 C512	A360-L507 HydrophobicContact CB-CD1 4.38Å; A360-L507 HydrophobicContact CB-CD2 4.22Å; W364-L507 HydrophobicContact CB-CD2 4.36Å; S503-L507 WeakPolarHBondContact O-CB 3.42Å; S503-L507 PolarHBondContact O-N 3.17Å; I504-L507 PolarHBondContact O-N 3.2Å; L507-C511 HydrophobicContact CG-CB 4.26Å; L507-C511 CarbonylContact O-C 3.43Å; L507-C511 WeakPolarHBondContact O-CA 3.44Å; L507-C511 WeakPolarHBondContact O-CB 3.34Å; L507-C511 PolarHBondContact O-N 3.44Å; L507-C512 PolarHBondContact O-N 2.83Å
508	L	53.7	Low	58.1	Low	43 Å²	43	54 Å²	54	23%	0.225	31%	0.305	C	S	.	.	I	π-helix	trans	-61.9	-62.6	170.7	-99.8	109.5	0	0	0	109.8	W364 I504 C512 F513	W364-L508 HydrophobicContact CD2-CD1 4.31Å; W364-L508 HydrophobicContact CD2-CG 4.38Å; W364-L508 VanDerWaalsContact CE2-CD1 3.45Å; W364-L508 HydrophobicContact CE3-CG 4.45Å; W364-L508 HydrophobicContact CH2-CD1 3.97Å; W364-L508 HydrophobicContact CH2-CD2 3.64Å; W364-L508 HydrophobicContact CH2-CG 3.73Å; W364-L508 HydrophobicContact CZ2-CD1 3.3Å; W364-L508 HydrophobicContact CZ2-CD2 3.82Å; W364-L508 HydrophobicContact CZ2-CG 3.6Å; W364-L508 HydrophobicContact CZ3-CD2 4.29Å; W364-L508 HydrophobicContact CZ3-CG 4.13Å; I504-L508 HydrophobicContact CB-CD1 4.32Å; I504-L508 HydrophobicContact CG2-CD1 3.24Å; I504-L508 VanDerWaalsContact O-CB 3.27Å; I504-L508 WeakPolarHBondContact O-CB 3.34Å; I504-L508 WeakPolarHBondContact O-CD1 3.48Å; I504-L508 PolarHBondContact O-N 3.33Å; L508-C512 WeakPolarHBondContact O-CA 3.1Å; L508-C512 WeakPolarHBondContact O-CB 3.46Å; L508-C512 PolarHBondContact O-N 2.67Å; L508-F513 PolarHBondContact O-N 3.05Å
509	F	56.7	Low	60.2	Low	66 Å²	66	52.5 Å²	52.5	29%	0.289	29%	0.291	S	S	.	.	I	π-helix	trans	-86.2	-32.1	-164.9	-83	-85.8	0	0	0	112.5	I409 R413 V505	I409-F509 HydrophobicContact CG2-CD1 4.49Å; I409-F509 HydrophobicContact CG2-CE1 4.19Å; R413-F509 HydrophobicContact CB-CB 4.49Å; R413-F509 HydrophobicContact CB-CD1 4.22Å; R413-F509 WeakPolarHBondContact CD-O 3.45Å; R413-F509 HydrophobicContact CG-CB 3.77Å; R413-F509 HydrophobicContact CG-CD1 4.4Å; R413-F509 HydrophobicContact CG-CG 4.43Å; V505-F509 HydrophobicContact CG1-CD2 4.07Å; V505-F509 WeakPolarHBondContact O-CB 3.36Å; V505-F509 PolarHBondContact O-N 3.45Å
510	S	57.1	Low	62.2	Low	61 Å²	61	48.9 Å²	48.9	43%	0.427	27%	0.274	S	S	.	.	I	π-helix	trans	-91.7	-11.8	176	104.3	0	0	0	0	114.1	S506	S506-S510 WeakPolarHBondContact O-CA 3.46Å; S506-S510 WeakPolarHBondContact O-CB 3.22Å; S506-S510 PolarHBondContact O-N 3.33Å; S506-S510 PolarHBondContact O-OG 3.08Å
511	C	59	Low	63.9	Low	30 Å²	30	47.7 Å²	47.7	20%	0.203	26%	0.263	C	S	.	.	I	π-helix	trans	-127.4	-34.4	-176.8	-73.6	0	0	0	0	115.5	I357 R383 L507	I357-C511 HydrophobicContact CG2-CB 3.7Å; I357-C511 VanDerWaalsContact CG2-O 3.32Å; I357-C511 WeakPolarHBondContact CG2-O 3.29Å; R383-C511 PolarHBondContact NH1-O 3.38Å; L507-C511 HydrophobicContact CG-CB 4.26Å; L507-C511 CarbonylContact O-C 3.43Å; L507-C511 WeakPolarHBondContact O-CA 3.44Å; L507-C511 WeakPolarHBondContact O-CB 3.34Å; L507-C511 PolarHBondContact O-N 3.44Å
512	C	68.1	Low	65.5	Low	1 Å²	1	51.5 Å²	51.5	1%	0.007	28%	0.278	C	S	.	.	I	π-helix	trans	-82.9	-46.5	177.4	-82.8	0	0	0	0	113.8	C361 L507 L508 R514	C361-C512 WeakPolarHBondContact CA-SG 3.3Å; C361-C512 HydrophobicContact CB-CB 4.12Å; C361-C512 WeakPolarHBondContact CB-SG 3.36Å; C361-C512 WeakPolarHBondContact SG-CA 3.44Å; C361-C512 WeakPolarHBondContact SG-CB 3.42Å; C361-C512 CovalentContact SG-SG 2.03Å; C361-C512 PolarHBondContact SG-SG 3.1Å; L507-C512 PolarHBondContact O-N 2.83Å; L508-C512 WeakPolarHBondContact O-CA 3.1Å; L508-C512 WeakPolarHBondContact O-CB 3.46Å; L508-C512 PolarHBondContact O-N 2.67Å; C512-R514 PolarHBondContact O-N 3.4Å
513	F	70.3	Confident	67.6	Low	26 Å²	26	51 Å²	51	11%	0.114	28%	0.28	C	S	.	.			trans	-76.7	121.6	-175.2	-169.7	-92.9	0	0	0	111.8	L382 I409 L508 P515	L382-F513 HydrophobicContact CD2-CD2 4.03Å; L382-F513 WeakPolarHBondContact O-CA 3.14Å; I409-F513 HydrophobicContact CB-CE1 4.11Å; I409-F513 HydrophobicContact CB-CZ 4.13Å; I409-F513 HydrophobicContact CD1-CE1 4.24Å; I409-F513 HydrophobicContact CD1-CE2 3.63Å; I409-F513 HydrophobicContact CD1-CZ 3.4Å; I409-F513 HydrophobicContact CG1-CZ 4.35Å; I409-F513 HydrophobicContact CG2-CD1 4.19Å; I409-F513 HydrophobicContact CG2-CE1 3.99Å; I409-F513 HydrophobicContact CG2-CE2 4.43Å; I409-F513 HydrophobicContact CG2-CZ 4.13Å; L508-F513 PolarHBondContact O-N 3.05Å; F513-P515 WeakPolarHBondContact O-CD 3.18Å
514	R	72	Confident	69.2	Low	52 Å²	52	50 Å²	50	20%	0.196	27%	0.267	C	S	.	.			trans	-95.6	116.3	175.6	-172	173.9	-177.2	144.3	3.6	109.6	L382 R383 C512 S516 R517 H519	L382-R514 PolarHBondContact O-N 3.27Å; R383-R514 HydrophobicContact CG-CB 4.33Å; C512-R514 PolarHBondContact O-N 3.4Å; R514-S516 PolarHBondContact NE-O 2.92Å; R514-R517 HydrophobicContact CB-CG 4.29Å; R514-R517 HydrophobicContact CG-CG 4.36Å; R514-R517 WeakPolarHBondContact O-CG 3.15Å; R514-R517 PolarHBondContact O-NE 2.79Å; R514-H519 PolarHBondContact NE-NE2 2.86Å; R514-H519 PolarHBondContact NH2-NE2 3.1Å; R514-H519 VanDerWaalsContact NH2-NE2 3.19Å
515	P	65.4	Low	70.6	Confident	47 Å²	47	55 Å²	55	31%	0.305	29%	0.287	S	S	.	.	S	Bend	trans	-73.6	-49.1	179.4	26.1	-31.8	0	0	0	112.1	F513 R517	F513-P515 WeakPolarHBondContact O-CD 3.18Å; P515-R517 PolarHBondContact O-N 3.13Å
516	S	74	Confident	72.1	Confident	69 Å²	69	56 Å²	56	48%	0.483	30%	0.296	S	S	.	.			trans	-88.6	91.7	178.7	-47.3	0	0	0	0	111.4	R514 H519	R514-S516 PolarHBondContact NE-O 2.92Å; S516-H519 PolarHBondContact O-NE2 2.98Å
517	R	83.2	Confident	73.7	Confident	15 Å²	15	52.9 Å²	52.9	6%	0.057	27%	0.274	C	S	.	.			trans	-102.5	-29	-175.3	-58.3	-169.5	-173.6	-173.9	6.7	115	L381 L382 I386 N403 L406 R514 P515 H519	L381-R517 PolarHBondContact O-NH1 3.04Å; L381-R517 PolarHBondContact O-NH2 2.92Å; L382-R517 VanDerWaalsContact C-NH2 3.35Å; L382-R517 PolarHBondContact O-NH2 3.38Å; I386-R517 PolarHBondContact N-O 3.46Å; N403-R517 PolarHBondContact OD1-N 2.88Å; L406-R517 HydrophobicContact CD1-CB 4.4Å; L406-R517 HydrophobicContact CD1-CG 4.22Å; R514-R517 HydrophobicContact CB-CG 4.29Å; R514-R517 HydrophobicContact CG-CG 4.36Å; R514-R517 WeakPolarHBondContact O-CG 3.15Å; R514-R517 PolarHBondContact O-NE 2.79Å; P515-R517 PolarHBondContact O-N 3.13Å; R517-H519 PolarHBondContact O-CD2 3.29Å
518	F	85.4	Confident	75	Confident	12 Å²	12	53.7 Å²	53.7	5%	0.053	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	113.2	-177.4	-66.4	-86.8	0	0	0	109.9	I386 V388 V399 L402 L406	I386-F518 HydrophobicContact CB-CD1 3.79Å; I386-F518 HydrophobicContact CB-CE1 4Å; I386-F518 HydrophobicContact CB-CG 4.39Å; I386-F518 HydrophobicContact CD1-CD1 4.12Å; I386-F518 HydrophobicContact CD1-CE1 3.55Å; I386-F518 HydrophobicContact CD1-CE2 4.15Å; I386-F518 HydrophobicContact CD1-CZ 3.56Å; I386-F518 HydrophobicContact CG1-CE1 4.36Å; I386-F518 HydrophobicContact CG2-CD1 3.52Å; I386-F518 HydrophobicContact CG2-CE1 3.6Å; I386-F518 CarbonylContact O-C 3.57Å; I386-F518 WeakPolarHBondContact O-CA 3.24Å; V388-F518 HydrophobicContact CG2-CB 4.44Å; V388-F518 HydrophobicContact CG2-CD1 3.97Å; V399-F518 HydrophobicContact CB-CB 4.46Å; V399-F518 HydrophobicContact CG1-CB 3.73Å; V399-F518 HydrophobicContact CG2-CB 4.18Å; L402-F518 HydrophobicContact CB-CD2 3.82Å; L402-F518 HydrophobicContact CB-CE1 4.42Å; L402-F518 HydrophobicContact CB-CE2 3.73Å; L402-F518 HydrophobicContact CB-CG 4.22Å; L402-F518 HydrophobicContact CB-CZ 4.05Å; L402-F518 HydrophobicContact CD1-CD1 3.96Å; L402-F518 HydrophobicContact CD1-CE1 3.8Å; L402-F518 HydrophobicContact CD1-CG 4.43Å; L402-F518 HydrophobicContact CD1-CZ 4.14Å; L402-F518 HydrophobicContact CD2-CE1 4.22Å; L402-F518 HydrophobicContact CD2-CE2 4.23Å; L402-F518 HydrophobicContact CD2-CZ 3.79Å; L402-F518 HydrophobicContact CG-CE1 4.39Å; L402-F518 HydrophobicContact CG-CE2 4.41Å; L402-F518 HydrophobicContact CG-CZ 4.23Å; L406-F518 HydrophobicContact CD1-CD2 4.23Å; L406-F518 HydrophobicContact CD1-CE2 3.77Å
519	H	86	Confident	76	Confident	72 Å²	72	56.7 Å²	56.7	33%	0.333	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.6	-180	-74.7	-86.6	0	0	0	110.6	I386 L387 V388 R514 S516 R517	I386-H519 PolarHBondContact O-N 3.13Å; L387-H519 CarbonylContact C-O 3.48Å; L387-H519 WeakPolarHBondContact CA-O 3.37Å; L387-H519 HydrophobicContact CD2-CB 4.23Å; V388-H519 PolarHBondContact N-O 3.4Å; R514-H519 PolarHBondContact NE-NE2 2.86Å; R514-H519 PolarHBondContact NH2-NE2 3.1Å; R514-H519 VanDerWaalsContact NH2-NE2 3.19Å; S516-H519 PolarHBondContact O-NE2 2.98Å; R517-H519 PolarHBondContact O-CD2 3.29Å
520	V	85.8	Confident	77.1	Confident	48 Å²	48	54.3 Å²	54.3	29%	0.291	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.6	-177.1	-175.5	0	0	0	0	110.6	V388 K396 V399	V388-V520 CarbonylContact O-C 3.53Å; V388-V520 WeakPolarHBondContact O-CA 3.12Å; K396-V520 HydrophobicContact CG-CG2 4.47Å; V399-V520 HydrophobicContact CB-CG2 4.2Å; V399-V520 HydrophobicContact CG1-CG2 4.12Å; V399-V520 HydrophobicContact CG2-CG2 3.93Å
521	I	85.8	Confident	78.1	Confident	22 Å²	22	51.4 Å²	51.4	11%	0.113	26%	0.259	C	S	.	.			trans	-107.3	152.9	175.8	-69	-173.4	0	0	0	109.8	L387 V388 P390 S391 L527 T530	L387-I521 HydrophobicContact CB-CD1 4.12Å; L387-I521 HydrophobicContact CD1-CD1 3.8Å; L387-I521 HydrophobicContact CD2-CD1 3.82Å; L387-I521 HydrophobicContact CD2-CG1 4.46Å; L387-I521 HydrophobicContact CG-CD1 4.12Å; V388-I521 PolarHBondContact O-N 2.84Å; P390-I521 CarbonylContact C-O 3.55Å; S391-I521 PolarHBondContact N-O 3.38Å; S391-I521 VanDerWaalsContact N-O 3.08Å; I521-L527 HydrophobicContact CD1-CB 4.27Å; I521-L527 HydrophobicContact CG2-CB 4.24Å; I521-T530 HydrophobicContact CD1-CG2 4.28Å
522	K	80.8	Confident	78.7	Confident	155 Å²	155	51 Å²	51	67%	0.674	26%	0.257	S	S	*	.	S	Bend	trans	-61.5	-58	-179.6	-62.7	-178.9	-177.8	178.1	0	112.2	P390 S391	P390-K522 VanDerWaalsContact CA-O 3.29Å; P390-K522 WeakPolarHBondContact CA-O 3.21Å; P390-K522 WeakPolarHBondContact CB-O 3.27Å; S391-K522 PolarHBondContact N-O 3.27Å
523	D	83.3	Confident	79	Confident	93 Å²	93	52.4 Å²	52.4	50%	0.497	27%	0.267	S	S	.	.			trans	-136	155.5	-167.7	-52.8	-64	0	0	0	113.1	S389 K525 S526 L527	S389-D523 VanDerWaalsContact OG-C 3.26Å; D523-K525 PolarHBondContact O-N 3.31Å; D523-S526 PolarHBondContact O-N 3.02Å; D523-L527 PolarHBondContact O-N 2.87Å
524	E	84.2	Confident	79.2	Confident	54 Å²	54	51.4 Å²	51.4	25%	0.252	26%	0.262	S	S	.	.	H	α-helix	trans	-58	-33.6	-178.1	-178.3	165.4	-152.4	0	0	112.6	S389 L527 E528 V545 K563 R565	S389-E524 PolarHBondContact OG-N 3.27Å; E524-L527 WeakPolarHBondContact O-CB 3.39Å; E524-L527 PolarHBondContact O-N 3.07Å; E524-E528 PolarHBondContact O-N 2.9Å; E524-E528 VanDerWaalsContact O-N 3.09Å; E524-V545 HydrophobicContact CB-CG1 4.15Å; E524-V545 HydrophobicContact CG-CG1 4.1Å; E524-V545 HydrophobicContact CG-CG2 4.07Å; E524-K563 WeakPolarHBondContact OE1-CD 3.44Å; E524-K563 IonicContact OE1-NZ 3.86Å; E524-K563 PolarHBondContact OE1-NZ 2.86Å; E524-K563 IonicContact OE2-NZ 3.89Å; E524-K563 PolarHBondContact OE2-NZ 2.82Å; E524-R565 VanDerWaalsContact CD-NH2 3.3Å; E524-R565 IonicContact OE1-CZ 2.79Å; E524-R565 IonicContact OE1-NE 2.89Å; E524-R565 PolarHBondContact OE1-NE 3.4Å; E524-R565 IonicContact OE1-NH2 3.84Å; E524-R565 PolarHBondContact OE1-NH2 3.26Å
525	K	78.8	Confident	79.2	Confident	140 Å²	140	49.7 Å²	49.7	61%	0.609	26%	0.258	S	S	*	.	H	α-helix	trans	-69.2	-44.2	178.3	-170.5	-179.1	179.6	-170.9	0	112.9	D523 L527 E528 E529	D523-K525 PolarHBondContact O-N 3.31Å; K525-L527 PolarHBondContact O-N 2.93Å; K525-E528 WeakPolarHBondContact O-CB 3.42Å; K525-E528 PolarHBondContact O-N 3.12Å; K525-E528 VanDerWaalsContact O-N 3.13Å; K525-E529 VanDerWaalsContact CE-OE1 3.25Å; K525-E529 WeakPolarHBondContact CE-OE1 3.32Å; K525-E529 IonicContact NZ-OE1 3.26Å; K525-E529 PolarHBondContact O-N 2.72Å
526	S	81.9	Confident	79.1	Confident	43 Å²	43	49.6 Å²	49.6	30%	0.301	26%	0.261	S	S	.	.	H	α-helix	trans	-66.5	-26.6	175.6	-59.4	0	0	0	0	111.8	D523 T530	D523-S526 PolarHBondContact O-N 3.02Å; S526-T530 VanDerWaalsContact O-CB 3.27Å; S526-T530 WeakPolarHBondContact O-CB 3.18Å; S526-T530 PolarHBondContact O-N 2.93Å; S526-T530 PolarHBondContact O-OG1 3.34Å
527	L	84.9	Confident	78.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69.3	-38	171.4	176.5	153.7	0	0	0	111.9	L387 I521 D523 E524 K525 G531 V545	L387-L527 HydrophobicContact CB-CD1 3.66Å; L387-L527 HydrophobicContact CB-CG 3.81Å; L387-L527 HydrophobicContact CD1-CG 4.25Å; I521-L527 HydrophobicContact CD1-CB 4.27Å; I521-L527 HydrophobicContact CG2-CB 4.24Å; D523-L527 PolarHBondContact O-N 2.87Å; E524-L527 WeakPolarHBondContact O-CB 3.39Å; E524-L527 PolarHBondContact O-N 3.07Å; K525-L527 PolarHBondContact O-N 2.93Å; L527-G531 WeakPolarHBondContact O-CA 3.3Å; L527-G531 PolarHBondContact O-N 3.09Å; L527-V545 HydrophobicContact CD1-CG2 4.07Å; L527-V545 HydrophobicContact CD2-CG2 4.33Å
528	E	78.6	Confident	78.1	Confident	78 Å²	78	52.9 Å²	52.9	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-64.5	-48.3	172.4	-71	178.4	160.6	0	0	111.8	E524 K525 G531 S532 R565	E524-E528 PolarHBondContact O-N 2.9Å; E524-E528 VanDerWaalsContact O-N 3.09Å; K525-E528 WeakPolarHBondContact O-CB 3.42Å; K525-E528 PolarHBondContact O-N 3.12Å; K525-E528 VanDerWaalsContact O-N 3.13Å; E528-G531 PolarHBondContact O-N 3.06Å; E528-S532 WeakPolarHBondContact O-CB 3.24Å; E528-S532 PolarHBondContact O-N 3.08Å; E528-R565 IonicContact OE1-CZ 3.01Å; E528-R565 IonicContact OE1-NH1 2.71Å; E528-R565 PolarHBondContact OE1-NH1 2.9Å; E528-R565 IonicContact OE1-NH2 3.09Å; E528-R565 PolarHBondContact OE1-NH2 3.01Å
529	E	75.6	Confident	77.7	Confident	106 Å²	106	52.7 Å²	52.7	50%	0.495	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-48.3	178.6	-68.8	167	-177.3	0	0	111.7	K525 C533	K525-E529 VanDerWaalsContact CE-OE1 3.25Å; K525-E529 WeakPolarHBondContact CE-OE1 3.32Å; K525-E529 IonicContact NZ-OE1 3.26Å; K525-E529 PolarHBondContact O-N 2.72Å; E529-C533 PolarHBondContact O-N 3.09Å
530	T	79	Confident	77.5	Confident	16 Å²	16	49.5 Å²	49.5	10%	0.098	25%	0.25	C	C	.	.	H	α-helix	trans	-69.2	-43.5	178.9	-50.2	0	0	0	0	111.7	F352 L387 I521 S526 S532 C533 L534	F352-T530 HydrophobicContact CE2-CG2 4.18Å; L387-T530 HydrophobicContact CD1-CG2 4.07Å; I521-T530 HydrophobicContact CD1-CG2 4.28Å; S526-T530 VanDerWaalsContact O-CB 3.27Å; S526-T530 WeakPolarHBondContact O-CB 3.18Å; S526-T530 PolarHBondContact O-N 2.93Å; S526-T530 PolarHBondContact O-OG1 3.34Å; T530-S532 PolarHBondContact O-N 3.49Å; T530-C533 PolarHBondContact O-N 2.8Å; T530-L534 HydrophobicContact CG2-CD1 4.12Å; T530-L534 WeakPolarHBondContact O-CG 3.48Å; T530-L534 PolarHBondContact O-N 3.16Å
531	G	78.2	Confident	77.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.9	-40.5	179.7	0	0	0	0	0	112.2	L527 E528 C533 L534 S535	L527-G531 WeakPolarHBondContact O-CA 3.3Å; L527-G531 PolarHBondContact O-N 3.09Å; E528-G531 PolarHBondContact O-N 3.06Å; G531-C533 VanDerWaalsContact C-N 3.34Å; G531-C533 PolarHBondContact O-N 2.9Å; G531-L534 PolarHBondContact O-N 2.98Å; G531-S535 WeakPolarHBondContact O-CB 3.26Å; G531-S535 PolarHBondContact O-N 2.81Å
532	S	71.3	Confident	77.6	Confident	21 Å²	21	46.8 Å²	46.8	15%	0.147	23%	0.233	C	C	.	.	H	α-helix	trans	-67.2	-33.9	176.1	-166.5	0	0	0	0	112.9	E528 T530 I1650	E528-S532 WeakPolarHBondContact O-CB 3.24Å; E528-S532 PolarHBondContact O-N 3.08Å; T530-S532 PolarHBondContact O-N 3.49Å; S532-I1650 WeakPolarHBondContact OG-CD1 3.21Å; S532-I1650 VanDerWaalsContact OG-CG1 3.29Å; S532-I1650 WeakPolarHBondContact OG-CG1 3.46Å
533	C	74.2	Confident	78	Confident	32 Å²	32	39.4 Å²	39.4	22%	0.216	20%	0.201	C	C	.	.	H	α-helix	trans	-67.1	-47.6	173.3	-162.6	0	0	0	0	111.2	C349 E529 T530 G531 S535 A536 Y537	C349-C533 HydrophobicContact CB-CB 4.2Å; C349-C533 WeakPolarHBondContact CB-SG 3.38Å; C349-C533 WeakPolarHBondContact SG-CB 3.39Å; C349-C533 CovalentContact SG-SG 2.03Å; C349-C533 PolarHBondContact SG-SG 2.88Å; E529-C533 PolarHBondContact O-N 3.09Å; T530-C533 PolarHBondContact O-N 2.8Å; G531-C533 VanDerWaalsContact C-N 3.34Å; G531-C533 PolarHBondContact O-N 2.9Å; C533-S535 VanDerWaalsContact C-N 3.26Å; C533-S535 PolarHBondContact O-N 3.33Å; C533-A536 WeakPolarHBondContact O-CB 3.45Å; C533-A536 PolarHBondContact O-N 2.88Å; C533-Y537 VanDerWaalsContact O-CD2 3.24Å; C533-Y537 WeakPolarHBondContact O-CD2 3.34Å
534	L	75.3	Confident	78.3	Confident	4 Å²	4	35 Å²	35	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-63.8	-29.5	178.1	-69.4	173.8	0	0	0	112.9	F352 V385 L387 T530 G531 A536 Y537 F538 Q539 F540	F352-L534 HydrophobicContact CB-CD2 4Å; F352-L534 HydrophobicContact CG-CD2 4.33Å; V385-L534 HydrophobicContact CB-CD1 4.15Å; V385-L534 HydrophobicContact CG1-CD1 4.05Å; L387-L534 HydrophobicContact CD1-CD1 4.32Å; L387-L534 HydrophobicContact CD2-CD1 4.35Å; T530-L534 HydrophobicContact CG2-CD1 4.12Å; T530-L534 WeakPolarHBondContact O-CG 3.48Å; T530-L534 PolarHBondContact O-N 3.16Å; G531-L534 PolarHBondContact O-N 2.98Å; L534-A536 VanDerWaalsContact C-N 3.33Å; L534-A536 PolarHBondContact O-N 3.39Å; L534-Y537 PolarHBondContact O-N 3.06Å; L534-F538 PolarHBondContact O-N 2.93Å; L534-Q539 HydrophobicContact CB-CB 4.46Å; L534-Q539 HydrophobicContact CD2-CB 4.2Å; L534-Q539 PolarHBondContact O-N 2.84Å; L534-F540 HydrophobicContact CB-CB 3.83Å; L534-F540 PolarHBondContact O-N 2.77Å
535	S	71.9	Confident	78.6	Confident	17 Å²	17	32.7 Å²	32.7	12%	0.119	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-31.3	176.4	-170.2	0	0	0	0	112.9	G531 C533 Y537 F538	G531-S535 WeakPolarHBondContact O-CB 3.26Å; G531-S535 PolarHBondContact O-N 2.81Å; C533-S535 VanDerWaalsContact C-N 3.26Å; C533-S535 PolarHBondContact O-N 3.33Å; S535-Y537 PolarHBondContact O-N 3.21Å; S535-F538 PolarHBondContact O-N 3.19Å
536	A	62.6	Low	79.2	Confident	44 Å²	44	26.3 Å²	26.3	36%	0.364	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.7	177.1	0	0	0	0	0	113.3	Y328 C533 L534	Y328-A536 PolarHBondContact OH-O 2.78Å; C533-A536 WeakPolarHBondContact O-CB 3.45Å; C533-A536 PolarHBondContact O-N 2.88Å; L534-A536 VanDerWaalsContact C-N 3.33Å; L534-A536 PolarHBondContact O-N 3.39Å
537	Y	67.4	Low	79.1	Confident	107 Å²	107	27 Å²	27	42%	0.42	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	12.5	-179.7	-57	-74.8	0	0	0	113.2	F353 C533 L534 S535 Q539	F353-Y537 AromaticContact CE2-CD1 3.9Å; F353-Y537 HydrophobicContact CE2-CD1 3.9Å; F353-Y537 AromaticContact CE2-CD2 3.53Å; F353-Y537 HydrophobicContact CE2-CD2 3.53Å; F353-Y537 HydrophobicContact CE2-CE1 4.13Å; F353-Y537 AromaticContact CE2-CE2 3.79Å; F353-Y537 HydrophobicContact CE2-CE2 3.79Å; F353-Y537 AromaticContact CE2-CG 3.57Å; F353-Y537 HydrophobicContact CE2-CG 3.57Å; F353-Y537 AromaticContact CZ-CD1 3.47Å; F353-Y537 HydrophobicContact CZ-CD1 3.47Å; F353-Y537 VanDerWaalsContact CZ-CD1 3.47Å; F353-Y537 HydrophobicContact CZ-CD2 4.01Å; F353-Y537 AromaticContact CZ-CE1 3.8Å; F353-Y537 HydrophobicContact CZ-CE1 3.8Å; F353-Y537 HydrophobicContact CZ-CE2 4.3Å; F353-Y537 AromaticContact CZ-CG 3.56Å; F353-Y537 HydrophobicContact CZ-CG 3.56Å; C533-Y537 VanDerWaalsContact O-CD2 3.24Å; C533-Y537 WeakPolarHBondContact O-CD2 3.34Å; L534-Y537 PolarHBondContact O-N 3.06Å; S535-Y537 PolarHBondContact O-N 3.21Å; Y537-Q539 PolarHBondContact O-N 2.82Å
538	F	69.9	Low	78.8	Confident	47 Å²	47	30.4 Å²	30.4	21%	0.206	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	29	-173.6	-56.3	-76.9	0	0	0	113.9	V376 Y379 T380 L534 S535	V376-F538 HydrophobicContact CB-CD1 4.45Å; V376-F538 HydrophobicContact CG1-CB 4.35Å; V376-F538 HydrophobicContact CG1-CD1 3.49Å; V376-F538 VanDerWaalsContact CG1-CD1 3.49Å; V376-F538 HydrophobicContact CG1-CE1 4.1Å; V376-F538 HydrophobicContact CG1-CG 4.16Å; V376-F538 HydrophobicContact CG2-CD1 4.01Å; V376-F538 HydrophobicContact CG2-CE1 4.12Å; V376-F538 HydrophobicContact CG2-CG 4.38Å; Y379-F538 HydrophobicContact CD1-CB 4.22Å; Y379-F538 VanDerWaalsContact CD1-O 3.29Å; Y379-F538 WeakPolarHBondContact CD1-O 3.42Å; Y379-F538 HydrophobicContact CE1-CB 4.39Å; Y379-F538 WeakPolarHBondContact CE1-O 3.36Å; T380-F538 VanDerWaalsContact CG2-O 3.27Å; T380-F538 WeakPolarHBondContact CG2-O 3.34Å; L534-F538 PolarHBondContact O-N 2.93Å; S535-F538 PolarHBondContact O-N 3.19Å
539	Q	76.1	Confident	78.9	Confident	8 Å²	8	27 Å²	27	4%	0.037	14%	0.142	C	C	.	.			trans	-101.5	-11.9	178.9	-64.7	-172.5	6.5	0	0	113.4	E358 Y379 G384 V385 L534 Y537	E358-Q539 PolarHBondContact OE2-NE2 3.02Å; Y379-Q539 HydrophobicContact CE1-CG 4.34Å; G384-Q539 CarbonylContact C-O 3.54Å; G384-Q539 WeakPolarHBondContact CA-O 3.45Å; V385-Q539 PolarHBondContact N-O 3.09Å; L534-Q539 HydrophobicContact CB-CB 4.46Å; L534-Q539 HydrophobicContact CD2-CB 4.2Å; L534-Q539 PolarHBondContact O-N 2.84Å; Y537-Q539 PolarHBondContact O-N 2.82Å
540	F	81.5	Confident	79.1	Confident	5 Å²	5	27.3 Å²	27.3	2%	0.022	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	118.9	175.1	-176.7	-114.4	0	0	0	110.7	L387 L534 S542 R565 M1647	L387-F540 HydrophobicContact CD1-CD2 4.27Å; L387-F540 HydrophobicContact CD1-CE2 4Å; L387-F540 HydrophobicContact CG-CE2 4.26Å; L534-F540 HydrophobicContact CB-CB 3.83Å; L534-F540 PolarHBondContact O-N 2.77Å; F540-S542 VanDerWaalsContact CE2-C 3.47Å; F540-S542 WeakPolarHBondContact CE2-O 2.95Å; F540-S542 VanDerWaalsContact CZ-C 3.45Å; F540-R565 WeakPolarHBondContact CZ-O 3.36Å; F540-M1647 HydrophobicContact CD1-CE 4.42Å; F540-M1647 HydrophobicContact CE1-CE 4.22Å; F540-M1647 HydrophobicContact CE1-SD 3.87Å; F540-M1647 HydrophobicContact CZ-SD 3.96Å
541	F	85.1	Confident	78.9	Confident	12 Å²	12	30.2 Å²	30.2	5%	0.053	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-56.7	171.4	-174.8	-100.9	0	0	0	110.8	T380 L381 V385 I386 M566 L611	T380-F541 WeakPolarHBondContact O-CD2 3.37Å; L381-F541 HydrophobicContact CD1-CE2 4.16Å; L381-F541 HydrophobicContact CD1-CZ 4.3Å; V385-F541 PolarHBondContact O-N 2.99Å; I386-F541 HydrophobicContact CD1-CD1 3.98Å; I386-F541 HydrophobicContact CG1-CB 4.16Å; I386-F541 HydrophobicContact CG1-CD1 3.82Å; I386-F541 HydrophobicContact CG1-CG 4.4Å; F541-M566 HydrophobicContact CE1-CE 4.38Å; F541-M566 HydrophobicContact CE2-CE 4.43Å; F541-M566 HydrophobicContact CZ-CE 4.31Å; F541-M566 VanDerWaalsContact O-CE 3.24Å; F541-M566 WeakPolarHBondContact O-CE 3.42Å; F541-L611 HydrophobicContact CD1-CD1 4.12Å; F541-L611 HydrophobicContact CE1-CD1 3.88Å
542	S	88.5	Confident	78.9	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	165.6	176.5	72.9	0	0	0	0	112.9	I386 L387 F540 R565 L611	I386-S542 VanDerWaalsContact CA-O 3.32Å; I386-S542 WeakPolarHBondContact CA-O 3.43Å; L387-S542 PolarHBondContact N-O 3.48Å; F540-S542 VanDerWaalsContact CE2-C 3.47Å; F540-S542 WeakPolarHBondContact CE2-O 2.95Å; F540-S542 VanDerWaalsContact CZ-C 3.45Å; S542-R565 CarbonylContact C-O 3.53Å; S542-R565 WeakPolarHBondContact CA-O 3.43Å; S542-L611 WeakPolarHBondContact OG-CD1 3.44Å
543	G	89.2	Confident	79.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.6	167.4	0	0	0	0	0	111.5	L387 R565	L387-G543 CarbonylContact O-C 3.47Å; L387-G543 VanDerWaalsContact O-CA 3.23Å; L387-G543 WeakPolarHBondContact O-CA 3.18Å; G543-R565 PolarHBondContact N-O 2.69Å; G543-R565 WeakPolarHBondContact O-CB 3.38Å; G543-R565 PolarHBondContact O-N 2.97Å
544	V	91.1	Very high	79.5	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119.1	175.6	-175.8	0	0	0	0	109	I386 L387 V388 S389 F546 Y562 K563 L611	I386-V544 HydrophobicContact CG2-CG2 4.15Å; L387-V544 PolarHBondContact O-N 3.32Å; V388-V544 CarbonylContact C-O 3.55Å; V388-V544 WeakPolarHBondContact CA-O 3.33Å; V388-V544 HydrophobicContact CG1-CB 4.39Å; V388-V544 HydrophobicContact CG2-CB 4.39Å; S389-V544 PolarHBondContact N-O 2.79Å; V544-F546 HydrophobicContact CG1-CE2 3.92Å; V544-F546 HydrophobicContact CG1-CZ 4Å; V544-Y562 HydrophobicContact CG1-CD2 3.94Å; V544-K563 WeakPolarHBondContact CA-O 3.49Å; V544-L611 HydrophobicContact CG2-CD2 3.77Å
545	V	90.2	Very high	79.8	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.03	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	113.1	-179.4	-174.8	0	0	0	0	110.3	S389 E524 L527 Y562 K563	S389-V545 WeakPolarHBondContact O-CA 3.17Å; E524-V545 HydrophobicContact CB-CG1 4.15Å; E524-V545 HydrophobicContact CG-CG1 4.1Å; E524-V545 HydrophobicContact CG-CG2 4.07Å; L527-V545 HydrophobicContact CD1-CG2 4.07Å; L527-V545 HydrophobicContact CD2-CG2 4.33Å; V545-Y562 CarbonylContact O-C 2.95Å; V545-Y562 VanDerWaalsContact O-CA 3.29Å; V545-Y562 WeakPolarHBondContact O-CA 3.44Å; V545-K563 HydrophobicContact CB-CB 4.27Å; V545-K563 HydrophobicContact CB-CD 4.27Å; V545-K563 PolarHBondContact N-O 3.17Å; V545-K563 PolarHBondContact O-N 3.46Å
546	F	89.9	Confident	80.3	Confident	6 Å²	6	44.3 Å²	44.3	3%	0.026	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	114.6	172.6	-64.6	-79.4	0	0	0	109.5	V388 S389 V395 I398 V544 L549 L560 Y562 V615	V388-F546 HydrophobicContact CG1-CD2 4.27Å; V388-F546 HydrophobicContact CG1-CE2 3.79Å; S389-F546 PolarHBondContact O-N 2.74Å; V395-F546 HydrophobicContact CG1-CD2 4.19Å; V395-F546 HydrophobicContact CG1-CE2 4.15Å; V395-F546 HydrophobicContact CG2-CD2 4.08Å; I398-F546 HydrophobicContact CD1-CZ 4.43Å; I398-F546 HydrophobicContact CG2-CZ 4.46Å; V544-F546 HydrophobicContact CG1-CE2 3.92Å; V544-F546 HydrophobicContact CG1-CZ 4Å; F546-L549 HydrophobicContact CB-CB 4.28Å; F546-L549 HydrophobicContact CB-CD1 3.87Å; F546-L549 HydrophobicContact CB-CG 4.24Å; F546-L549 HydrophobicContact CD1-CD1 4.47Å; F546-L549 HydrophobicContact CG-CD1 4.11Å; F546-L560 HydrophobicContact CD1-CD1 4.18Å; F546-L560 HydrophobicContact CD1-CD2 4.08Å; F546-L560 HydrophobicContact CD1-CG 4.34Å; F546-L560 HydrophobicContact CE1-CD2 4.01Å; F546-Y562 HydrophobicContact CD1-CG 4.43Å; F546-Y562 HydrophobicContact CE1-CD1 4.39Å; F546-Y562 HydrophobicContact CE1-CG 4.19Å; F546-V615 HydrophobicContact CZ-CG1 4.45Å
547	T	81.1	Confident	81.2	Confident	57 Å²	57	44.2 Å²	44.2	35%	0.35	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-18	-167.3	59.2	0	0	0	0	114.3	E561 K563	T547-E561 PolarHBondContact N-O 2.74Å; T547-E561 PolarHBondContact OG1-O 2.74Å; T547-E561 VanDerWaalsContact OG1-O 3.07Å; T547-K563 HydrophobicContact CG2-CD 3.96Å; T547-K563 HydrophobicContact CG2-CG 3.92Å
548	Q	77.7	Confident	81.9	Confident	71 Å²	71	43.4 Å²	43.4	33%	0.332	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-0.8	-172.5	-66.1	166	-17.6	0	0	113.3	A559	Q548-A559 PolarHBondContact OE1-O 2.72Å
549	L	81.1	Confident	82.3	Confident	7 Å²	7	41.8 Å²	41.8	4%	0.037	25%	0.248	C	C	.	.			trans	-103	136.3	177.7	-64.5	176.5	0	0	0	109.3	P390 V395 F546 P557 L560	P390-L549 HydrophobicContact CG-CB 4.46Å; P390-L549 WeakPolarHBondContact CG-O 3.42Å; V395-L549 HydrophobicContact CG2-CD1 3.64Å; F546-L549 HydrophobicContact CB-CB 4.28Å; F546-L549 HydrophobicContact CB-CD1 3.87Å; F546-L549 HydrophobicContact CB-CG 4.24Å; F546-L549 HydrophobicContact CD1-CD1 4.47Å; F546-L549 HydrophobicContact CG-CD1 4.11Å; L549-P557 HydrophobicContact CD2-CG 4.44Å; L549-L560 HydrophobicContact CD1-CD1 4.48Å; L549-L560 HydrophobicContact CG-CD1 4.49Å
550	N	79.7	Confident	82.7	Confident	113 Å²	113	41.5 Å²	41.5	60%	0.604	25%	0.247	S	C	*	.			trans	-100.9	166.1	165.3	-69.1	-12.3	0	0	0	110.2	S392 S552 S553	S392-N550 WeakPolarHBondContact CB-O 3.21Å; N550-S552 PolarHBondContact O-N 3.3Å; N550-S553 PolarHBondContact N-OG 3.03Å; N550-S553 WeakPolarHBondContact O-CB 3.45Å; N550-S553 PolarHBondContact O-N 3.04Å; N550-S553 PolarHBondContact O-OG 3.17Å
551	S	75.9	Confident	82.9	Confident	77 Å²	77	42.4 Å²	42.4	54%	0.538	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.8	179.5	51.6	0	0	0	0	115.2	S392	S392-S551 WeakPolarHBondContact CA-O 3.02Å
552	S	78.2	Confident	83.2	Confident	98 Å²	98	41.9 Å²	41.9	69%	0.685	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-1.2	177	54	0	0	0	0	115.4	N550 T554	N550-S552 PolarHBondContact O-N 3.3Å; S552-T554 PolarHBondContact O-N 2.79Å
553	S	79.1	Confident	83.3	Confident	26 Å²	26	43.7 Å²	43.7	18%	0.182	26%	0.257	C	S	.	.			trans	-71.1	129.4	-170.7	-44.6	0	0	0	0	112.5	S392 P393 V394 N550	S392-S553 PolarHBondContact OG-O 3.3Å; P393-S553 WeakPolarHBondContact CD-O 3.21Å; P393-S553 WeakPolarHBondContact CG-O 3.38Å; V394-S553 WeakPolarHBondContact CG2-O 3.37Å; N550-S553 PolarHBondContact N-OG 3.03Å; N550-S553 WeakPolarHBondContact O-CB 3.45Å; N550-S553 PolarHBondContact O-N 3.04Å; N550-S553 PolarHBondContact O-OG 3.17Å
554	T	78	Confident	83.3	Confident	118 Å²	118	43.7 Å²	43.7	72%	0.724	26%	0.257	S	S	*	.			trans	-110.3	-7.7	-176	53.2	0	0	0	0	115.3	P393 V394 S552	P393-T554 HydrophobicContact CG-CG2 4.32Å; V394-T554 VanDerWaalsContact CG2-O 3.32Å; V394-T554 WeakPolarHBondContact CG2-O 3.35Å; S552-T554 PolarHBondContact O-N 2.79Å
555	S	81.1	Confident	83.1	Confident	87 Å²	87	44 Å²	44	61%	0.608	26%	0.258	S	S	*	.	S	Bend	trans	-139.8	157.9	174.8	54.3	0	0	0	0	112.3
556	L	82.4	Confident	82.8	Confident	40 Å²	40	43.8 Å²	43.8	21%	0.209	26%	0.257	C	S	.	.			trans	-76.5	129.7	176.1	-87.7	157.3	0	0	0	110.8	V394 I398 L560 L622 Q623	V394-L556 HydrophobicContact CG1-CD1 4.44Å; V394-L556 HydrophobicContact CG1-CD2 4.28Å; V394-L556 HydrophobicContact CG1-CG 3.78Å; I398-L556 HydrophobicContact CD1-CD2 4.26Å; L556-L560 HydrophobicContact CD2-CD1 4.38Å; L556-L560 HydrophobicContact CD2-CD2 3.77Å; L556-L622 HydrophobicContact CD1-CB 3.79Å; L556-L622 HydrophobicContact CD1-CD1 4.17Å; L556-Q623 HydrophobicContact CD1-CG 4.36Å
557	P	83	Confident	82	Confident	42 Å²	42	43.5 Å²	43.5	27%	0.273	26%	0.256	S	S	.	.			trans	-66.3	150.3	170.4	29.8	-35.9	0	0	0	111	L549 A559 L560 Q623	L549-P557 HydrophobicContact CD2-CG 4.44Å; P557-A559 WeakPolarHBondContact CB-O 3.42Å; P557-A559 WeakPolarHBondContact CG-O 3.47Å; P557-A559 PolarHBondContact O-N 3.25Å; P557-L560 HydrophobicContact CG-CD1 3.73Å; P557-Q623 PolarHBondContact O-NE2 2.73Å
558	K	80.2	Confident	81.4	Confident	91 Å²	91	42.3 Å²	42.3	40%	0.396	25%	0.247	S	C	.	.	S	Bend	trans	-60.1	-43.6	-177.8	-62.9	-173.9	-179.3	-177.6	0	112.4	Q623 E1637 Y1638 S1639	K558-Q623 PolarHBondContact O-NE2 3.32Å; K558-E1637 HydrophobicContact CD-CB 4.04Å; K558-E1637 VanDerWaalsContact CD-OE2 3.23Å; K558-E1637 WeakPolarHBondContact CD-OE2 3.13Å; K558-E1637 WeakPolarHBondContact CE-OE2 3.15Å; K558-E1637 IonicContact NZ-OE2 3.15Å; K558-E1637 PolarHBondContact NZ-OE2 3.11Å; K558-Y1638 HydrophobicContact CB-CD1 4.14Å; K558-Y1638 HydrophobicContact CB-CD2 4.4Å; K558-Y1638 HydrophobicContact CB-CE1 4.07Å; K558-Y1638 HydrophobicContact CB-CE2 4.31Å; K558-Y1638 HydrophobicContact CB-CG 4.31Å; K558-Y1638 HydrophobicContact CD-CE2 3.87Å; K558-Y1638 HydrophobicContact CG-CE1 4.05Å; K558-Y1638 HydrophobicContact CG-CE2 4.1Å; K558-Y1638 WeakPolarHBondContact O-CA 3.15Å; K558-Y1638 WeakPolarHBondContact O-CD1 3.42Å; K558-S1639 PolarHBondContact O-N 3.28Å
559	A	79.4	Confident	80.9	Confident	12 Å²	12	41.6 Å²	41.6	10%	0.099	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132	164.8	0	0	0	0	0	109	Q548 P557 H1383 S1639	Q548-A559 PolarHBondContact OE1-O 2.72Å; P557-A559 WeakPolarHBondContact CB-O 3.42Å; P557-A559 WeakPolarHBondContact CG-O 3.47Å; P557-A559 PolarHBondContact O-N 3.25Å; A559-H1383 WeakPolarHBondContact CB-CE1 3.46Å; A559-S1639 CarbonylContact C-O 3.57Å; A559-S1639 WeakPolarHBondContact CA-O 3.34Å; A559-S1639 WeakPolarHBondContact CB-OG 3.21Å
560	L	85	Confident	80.5	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134.7	-178.8	-174.9	70.1	0	0	0	110.4	F546 L549 L556 P557 I619 S1639 I1640 A1641	F546-L560 HydrophobicContact CD1-CD1 4.18Å; F546-L560 HydrophobicContact CD1-CD2 4.08Å; F546-L560 HydrophobicContact CD1-CG 4.34Å; F546-L560 HydrophobicContact CE1-CD2 4.01Å; L549-L560 HydrophobicContact CD1-CD1 4.48Å; L549-L560 HydrophobicContact CG-CD1 4.49Å; L556-L560 HydrophobicContact CD2-CD1 4.38Å; L556-L560 HydrophobicContact CD2-CD2 3.77Å; P557-L560 HydrophobicContact CG-CD1 3.73Å; L560-I619 HydrophobicContact CD2-CD1 3.72Å; L560-I619 HydrophobicContact CD2-CG1 3.9Å; L560-I619 HydrophobicContact CD2-CG2 3.93Å; L560-S1639 PolarHBondContact N-O 3.3Å; L560-I1640 WeakPolarHBondContact O-CA 3.33Å; L560-A1641 PolarHBondContact O-N 3.12Å
561	E	85.9	Confident	80.4	Confident	25 Å²	25	36 Å²	36	12%	0.117	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.2	175.3	-179.1	164.2	-156.5	0	0	111.4	T547 R1317 A1641 I1643	T547-E561 PolarHBondContact N-O 2.74Å; T547-E561 PolarHBondContact OG1-O 2.74Å; T547-E561 VanDerWaalsContact OG1-O 3.07Å; E561-R1317 WeakPolarHBondContact OE1-CD 3.31Å; E561-R1317 IonicContact OE1-CZ 3.01Å; E561-R1317 VanDerWaalsContact OE1-CZ 3.24Å; E561-R1317 IonicContact OE1-NE 3.6Å; E561-R1317 IonicContact OE1-NH1 3.66Å; E561-R1317 PolarHBondContact OE1-NH1 3.28Å; E561-R1317 IonicContact OE2-CZ 3.63Å; E561-R1317 IonicContact OE2-NH1 3.41Å; E561-R1317 PolarHBondContact OE2-NH1 2.88Å; E561-R1317 IonicContact OE2-NH2 3.61Å; E561-A1641 WeakPolarHBondContact CA-O 3Å; E561-A1641 HydrophobicContact CB-CB 4.28Å; E561-A1641 HydrophobicContact CG-CB 4.21Å; E561-I1643 HydrophobicContact CG-CD1 3.82Å; E561-I1643 HydrophobicContact CG-CG1 4.1Å; E561-I1643 WeakPolarHBondContact OE1-CD1 3.26Å
562	Y	90.6	Very high	80.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	145.1	178.6	74.3	-89.6	0	0	0	112.7	V544 V545 F546 I564 V615 D616 I619 I1640 A1641 T1642 I1643	V544-Y562 HydrophobicContact CG1-CD2 3.94Å; V545-Y562 CarbonylContact O-C 2.95Å; V545-Y562 VanDerWaalsContact O-CA 3.29Å; V545-Y562 WeakPolarHBondContact O-CA 3.44Å; F546-Y562 HydrophobicContact CD1-CG 4.43Å; F546-Y562 HydrophobicContact CE1-CD1 4.39Å; F546-Y562 HydrophobicContact CE1-CG 4.19Å; Y562-I564 HydrophobicContact CD2-CG1 4.12Å; Y562-I564 HydrophobicContact CE2-CD1 3.94Å; Y562-I564 HydrophobicContact CE2-CG1 3.74Å; Y562-V615 HydrophobicContact CD1-CG1 4.39Å; Y562-V615 HydrophobicContact CD2-CG1 4.32Å; Y562-V615 HydrophobicContact CE1-CG1 3.79Å; Y562-V615 HydrophobicContact CE2-CB 4.22Å; Y562-V615 HydrophobicContact CE2-CG1 3.7Å; Y562-V615 VanDerWaalsContact CZ-CG1 3.4Å; Y562-D616 PolarHBondContact OH-OD1 2.88Å; Y562-I619 HydrophobicContact CD1-CD1 4.12Å; Y562-I619 HydrophobicContact CE1-CD1 3.79Å; Y562-I1640 HydrophobicContact CD1-CG2 4.4Å; Y562-I1640 HydrophobicContact CE1-CG2 3.92Å; Y562-A1641 PolarHBondContact N-O 3.5Å; Y562-T1642 HydrophobicContact CD1-CG2 4.43Å; Y562-T1642 HydrophobicContact CE1-CG2 3.62Å; Y562-T1642 HydrophobicContact CE2-CG2 4.2Å; Y562-T1642 VanDerWaalsContact CZ-CG2 3.49Å; Y562-T1642 WeakPolarHBondContact OH-CG2 3.41Å; Y562-I1643 PolarHBondContact O-N 3.24Å
563	K	89.7	Confident	79.8	Confident	38 Å²	38	31.3 Å²	31.3	17%	0.165	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137	174.8	-58.7	161.3	179.1	168	0	109.4	E524 V544 V545 T547 I1643	E524-K563 WeakPolarHBondContact OE1-CD 3.44Å; E524-K563 IonicContact OE1-NZ 3.86Å; E524-K563 PolarHBondContact OE1-NZ 2.86Å; E524-K563 IonicContact OE2-NZ 3.89Å; E524-K563 PolarHBondContact OE2-NZ 2.82Å; V544-K563 WeakPolarHBondContact CA-O 3.49Å; V545-K563 HydrophobicContact CB-CB 4.27Å; V545-K563 HydrophobicContact CB-CD 4.27Å; V545-K563 PolarHBondContact N-O 3.17Å; V545-K563 PolarHBondContact O-N 3.46Å; T547-K563 HydrophobicContact CG2-CD 3.96Å; T547-K563 HydrophobicContact CG2-CG 3.92Å; K563-I1643 CarbonylContact C-O 3.56Å; K563-I1643 WeakPolarHBondContact CA-O 3.39Å; K563-I1643 HydrophobicContact CB-CB 4.48Å; K563-I1643 HydrophobicContact CG-CB 4.15Å; K563-I1643 HydrophobicContact CG-CD1 3.91Å; K563-I1643 HydrophobicContact CG-CG1 4.47Å
564	I	90.1	Very high	79.4	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.4	160.7	-59.1	170.5	0	0	0	107	Y562 M566 F608 L611 Q612 I1643 H1645	Y562-I564 HydrophobicContact CD2-CG1 4.12Å; Y562-I564 HydrophobicContact CE2-CD1 3.94Å; Y562-I564 HydrophobicContact CE2-CG1 3.74Å; I564-M566 HydrophobicContact CG2-CG 4.07Å; I564-M566 HydrophobicContact CG2-SD 4.5Å; I564-F608 HydrophobicContact CB-CD2 4.34Å; I564-F608 HydrophobicContact CB-CE2 3.56Å; I564-F608 HydrophobicContact CB-CZ 3.69Å; I564-F608 HydrophobicContact CD1-CD1 4.36Å; I564-F608 HydrophobicContact CD1-CE1 3.83Å; I564-F608 HydrophobicContact CD1-CE2 4.24Å; I564-F608 HydrophobicContact CD1-CZ 3.75Å; I564-F608 HydrophobicContact CG1-CE2 4.49Å; I564-F608 HydrophobicContact CG1-CZ 4.23Å; I564-F608 HydrophobicContact CG2-CD2 3.78Å; I564-F608 HydrophobicContact CG2-CE2 3.48Å; I564-F608 VanDerWaalsContact CG2-CE2 3.48Å; I564-F608 HydrophobicContact CG2-CZ 4.06Å; I564-L611 HydrophobicContact CD1-CD2 3.65Å; I564-L611 HydrophobicContact CG1-CD2 3.77Å; I564-L611 HydrophobicContact CG2-CD2 4.08Å; I564-Q612 HydrophobicContact CD1-CB 4.31Å; I564-I1643 PolarHBondContact N-O 3.1Å; I564-H1645 PolarHBondContact O-N 3.13Å; I564-H1645 VanDerWaalsContact O-N 3.09Å
565	R	86.5	Confident	78.5	Confident	8 Å²	8	27.4 Å²	27.4	3%	0.03	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	102.8	179.8	-67.8	169.4	156.6	-100.3	10.4	109.3	E524 E528 F540 S542 G543 H1645	E524-R565 VanDerWaalsContact CD-NH2 3.3Å; E524-R565 IonicContact OE1-CZ 2.79Å; E524-R565 IonicContact OE1-NE 2.89Å; E524-R565 PolarHBondContact OE1-NE 3.4Å; E524-R565 IonicContact OE1-NH2 3.84Å; E524-R565 PolarHBondContact OE1-NH2 3.26Å; E528-R565 IonicContact OE1-CZ 3.01Å; E528-R565 IonicContact OE1-NH1 2.71Å; E528-R565 PolarHBondContact OE1-NH1 2.9Å; E528-R565 IonicContact OE1-NH2 3.09Å; E528-R565 PolarHBondContact OE1-NH2 3.01Å; F540-R565 WeakPolarHBondContact CZ-O 3.36Å; S542-R565 CarbonylContact C-O 3.53Å; S542-R565 WeakPolarHBondContact CA-O 3.43Å; G543-R565 PolarHBondContact N-O 2.69Å; G543-R565 WeakPolarHBondContact O-CB 3.38Å; G543-R565 PolarHBondContact O-N 2.97Å; R565-H1645 VanDerWaalsContact CA-O 3.29Å; R565-H1645 WeakPolarHBondContact CA-O 3.36Å; R565-H1645 HydrophobicContact CG-CB 4.44Å; R565-H1645 WeakPolarHBondContact CG-O 3.2Å
566	M	83.8	Confident	77.3	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	14%	0.136	C	C	.	.			trans	-109	166	170.4	-61.1	-175	83.9	0	0	109.4	F541 I564 L570 V571 F606 F608 P1646 M1647	F541-M566 HydrophobicContact CE1-CE 4.38Å; F541-M566 HydrophobicContact CE2-CE 4.43Å; F541-M566 HydrophobicContact CZ-CE 4.31Å; F541-M566 VanDerWaalsContact O-CE 3.24Å; F541-M566 WeakPolarHBondContact O-CE 3.42Å; I564-M566 HydrophobicContact CG2-CG 4.07Å; I564-M566 HydrophobicContact CG2-SD 4.5Å; M566-L570 HydrophobicContact CB-CB 4.38Å; M566-L570 HydrophobicContact CE-CB 4.42Å; M566-L570 HydrophobicContact CE-CD1 4.3Å; M566-V571 HydrophobicContact CB-CG1 4.11Å; M566-V571 HydrophobicContact SD-CG1 4.14Å; M566-F606 WeakPolarHBondContact CE-O 3.15Å; M566-F608 HydrophobicContact CG-CD2 4.36Å; M566-F608 HydrophobicContact SD-CB 3.9Å; M566-F608 HydrophobicContact SD-CD2 3.72Å; M566-F608 HydrophobicContact SD-CG 4.28Å; M566-P1646 WeakPolarHBondContact O-CA 3.49Å; M566-M1647 PolarHBondContact O-N 2.68Å
567	A	74	Confident	76.4	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.008	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-63.8	145.1	171.1	0	0	0	0	0	110.5	Y569 L570	A567-Y569 VanDerWaalsContact C-N 3.27Å; A567-Y569 HydrophobicContact CB-CD1 3.82Å; A567-Y569 HydrophobicContact CB-CE1 3.38Å; A567-Y569 PolarHBondContact O-N 2.88Å; A567-Y569 VanDerWaalsContact O-N 3.16Å; A567-L570 HydrophobicContact CB-CD1 4.16Å; A567-L570 HydrophobicContact CB-CG 4.42Å; A567-L570 WeakPolarHBondContact O-CB 3.42Å; A567-L570 PolarHBondContact O-N 3.31Å
568	D	68.4	Low	75.3	Confident	32 Å²	32	23.1 Å²	23.1	17%	0.171	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-56.7	-35.5	-169.6	-168.3	51.5	0	0	0	113.9	L570 V571 P1646 H1657	D568-L570 VanDerWaalsContact C-N 3.32Å; D568-L570 PolarHBondContact O-N 3.32Å; D568-V571 PolarHBondContact O-N 3.15Å; D568-P1646 HydrophobicContact CB-CB 4.29Å; D568-H1657 IonicContact OD2-CD2 3.13Å
569	Y	67.5	Low	73.9	Confident	56 Å²	56	20.5 Å²	20.5	22%	0.22	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-67.3	-26.4	176.9	63.3	-86.1	0	0	0	114.5	A567 V571 K602 E1653	A567-Y569 VanDerWaalsContact C-N 3.27Å; A567-Y569 HydrophobicContact CB-CD1 3.82Å; A567-Y569 HydrophobicContact CB-CE1 3.38Å; A567-Y569 PolarHBondContact O-N 2.88Å; A567-Y569 VanDerWaalsContact O-N 3.16Å; Y569-V571 VanDerWaalsContact C-N 3.33Å; Y569-K602 PolarHBondContact O-NZ 2.85Å; Y569-E1653 WeakPolarHBondContact CB-OE2 3.35Å; Y569-E1653 WeakPolarHBondContact CD1-OE2 3.41Å
570	L	72.4	Confident	72.4	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-80.9	-10.4	-178	-62.3	174.8	0	0	0	113.5	M566 A567 D568 F606	M566-L570 HydrophobicContact CB-CB 4.38Å; M566-L570 HydrophobicContact CE-CB 4.42Å; M566-L570 HydrophobicContact CE-CD1 4.3Å; A567-L570 HydrophobicContact CB-CD1 4.16Å; A567-L570 HydrophobicContact CB-CG 4.42Å; A567-L570 WeakPolarHBondContact O-CB 3.42Å; A567-L570 PolarHBondContact O-N 3.31Å; D568-L570 VanDerWaalsContact C-N 3.32Å; D568-L570 PolarHBondContact O-N 3.32Å; L570-F606 HydrophobicContact CB-CB 4.2Å; L570-F606 HydrophobicContact CB-CG 4.29Å; L570-F606 HydrophobicContact CD2-CB 4.28Å; L570-F606 HydrophobicContact CD2-CD1 3.5Å; L570-F606 VanDerWaalsContact CD2-CD1 3.5Å; L570-F606 HydrophobicContact CD2-CE1 3.93Å; L570-F606 HydrophobicContact CD2-CG 3.86Å; L570-F606 WeakPolarHBondContact O-CB 3.31Å; L570-F606 VanDerWaalsContact O-CD2 3.22Å; L570-F606 WeakPolarHBondContact O-CD2 3.5Å
571	V	76.5	Confident	70.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-125.8	165	178.6	-75.9	0	0	0	0	110.7	M566 D568 Y569 K602 Y603 F608 P1646	M566-V571 HydrophobicContact CB-CG1 4.11Å; M566-V571 HydrophobicContact SD-CG1 4.14Å; D568-V571 PolarHBondContact O-N 3.15Å; Y569-V571 VanDerWaalsContact C-N 3.33Å; V571-K602 VanDerWaalsContact C-CD 3.42Å; V571-K602 WeakPolarHBondContact O-CD 3.43Å; V571-K602 PolarHBondContact O-NZ 2.87Å; V571-Y603 HydrophobicContact CG1-CE1 4.28Å; V571-F608 HydrophobicContact CG1-CD2 3.61Å; V571-F608 HydrophobicContact CG1-CE2 4.25Å; V571-F608 HydrophobicContact CG1-CG 4.39Å; V571-P1646 HydrophobicContact CG2-CB 4.29Å; V571-P1646 HydrophobicContact CG2-CG 3.99Å
572	D	74.1	Confident	67.8	Low	7 Å²	7	38.2 Å²	38.2	4%	0.037	18%	0.181	C	C	.	.			trans	-76.7	143.4	170.3	-75.6	-42.2	0	0	0	110.1	T574 R594 K602 Y603 W1610	D572-T574 PolarHBondContact O-N 3.39Å; D572-R594 IonicContact OD1-NH2 2.8Å; D572-R594 IonicContact OD2-NH1 3.29Å; D572-K602 WeakPolarHBondContact OD1-CD 3.49Å; D572-Y603 HydrophobicContact CB-CD2 4.46Å; D572-Y603 HydrophobicContact CB-CE2 3.72Å; D572-W1610 HydrophobicContact CB-CB 4.33Å; D572-W1610 HydrophobicContact CB-CD2 4.48Å; D572-W1610 HydrophobicContact CB-CE3 3.87Å
573	K	67.9	Low	65	Low	69 Å²	69	45 Å²	45	30%	0.3	21%	0.212	S	C	.	.			trans	-60.9	118.5	-176.1	-58	-171.5	179.6	-167.4	0	110.7	G575 Q576 W1610 H1657	K573-G575 PolarHBondContact O-N 3.36Å; K573-Q576 PolarHBondContact O-N 3.4Å; K573-W1610 HydrophobicContact CB-CZ3 4.21Å; K573-H1657 WeakPolarHBondContact CE-NE2 3.33Å; K573-H1657 PolarHBondContact NZ-CD2 2.82Å; K573-H1657 VanDerWaalsContact NZ-CD2 3.35Å; K573-H1657 PolarHBondContact NZ-NE2 3.32Å
574	T	70.4	Confident	62.3	Low	8 Å²	8	49.3 Å²	49.3	5%	0.049	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.2	-176	50.6	0	0	0	0	115.3	D572 Q576 Q1314 L1316 N1644 P1646	D572-T574 PolarHBondContact O-N 3.39Å; T574-Q576 VanDerWaalsContact C-N 3.27Å; T574-Q576 PolarHBondContact O-N 3.21Å; T574-Q1314 WeakPolarHBondContact CB-O 3.27Å; T574-Q1314 PolarHBondContact OG1-O 2.93Å; T574-L1316 HydrophobicContact CG2-CB 3.85Å; T574-N1644 HydrophobicContact CG2-CB 4.22Å; T574-N1644 WeakPolarHBondContact CG2-ND2 3.46Å; T574-P1646 HydrophobicContact CG2-CG 3.92Å
575	G	58.8	Low	59.7	Low	55 Å²	55	51.4 Å²	51.4	57%	0.567	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-4.1	173.7	0	0	0	0	0	115	K573	K573-G575 PolarHBondContact O-N 3.36Å
576	Q	57.8	Low	57.2	Low	39 Å²	39	53 Å²	53	18%	0.182	25%	0.253	C	S	.	.			trans	-135.1	131.8	174.1	-78.5	168.2	-97.6	0	0	109.4	K573 T574 K582 W1610	K573-Q576 PolarHBondContact O-N 3.4Å; T574-Q576 VanDerWaalsContact C-N 3.27Å; T574-Q576 PolarHBondContact O-N 3.21Å; Q576-K582 HydrophobicContact CG-CD 4.37Å; Q576-W1610 HydrophobicContact CB-CE3 3.9Å; Q576-W1610 HydrophobicContact CB-CH2 3.67Å; Q576-W1610 HydrophobicContact CB-CZ2 4.28Å; Q576-W1610 HydrophobicContact CB-CZ3 3.45Å; Q576-W1610 VanDerWaalsContact CB-CZ3 3.45Å; Q576-W1610 HydrophobicContact CG-CH2 4.47Å
577	I	62.4	Low	55.1	Low	25 Å²	25	56.3 Å²	56.3	13%	0.128	27%	0.271	C	S	.	.			trans	-115.4	-18.8	-166.8	-57.7	-176.4	0	0	0	111.6	L1316 Y1323 W1610 V1611	I577-L1316 HydrophobicContact CD1-CD1 3.95Å; I577-L1316 HydrophobicContact CD1-CD2 4.18Å; I577-L1316 HydrophobicContact CG1-CD2 4.06Å; I577-Y1323 HydrophobicContact CG2-CD2 3.66Å; I577-Y1323 HydrophobicContact CG2-CE2 4.11Å; I577-W1610 PolarHBondContact O-N 2.95Å; I577-V1611 HydrophobicContact CG2-CG2 3.58Å
578	V	59.5	Low	53.4	Low	15 Å²	15	59 Å²	59	9%	0.091	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-144.8	155.4	-178.9	179.4	0	0	0	0	107.5	R580 Y1323 H1327	V578-R580 PolarHBondContact O-N 3.3Å; V578-Y1323 HydrophobicContact CG2-CE2 3.62Å; V578-H1327 WeakPolarHBondContact CG2-NE2 3.29Å
579	D	52	Low	52.3	Low	36 Å²	36	60.6 Å²	60.6	19%	0.193	29%	0.291	C	S	.	.			trans	-61.7	77.2	162.4	-93.2	11.7	0	0	0	111.3	S590 R594 Q1608 W1610	D579-S590 PolarHBondContact OD2-OG 3.24Å; D579-R594 IonicContact OD1-NE 2.93Å; D579-R594 WeakPolarHBondContact OD2-CD 3.39Å; D579-Q1608 PolarHBondContact N-O 3.5Å; D579-W1610 PolarHBondContact OD1-NE1 3.47Å
580	R	47.4	Very low	51.4	Low	125 Å²	125	59.1 Å²	59.1	47%	0.472	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-93.2	122.4	151.8	-71	-176.3	177.7	-168.3	-4.6	106.5	V578 K582 H1327	V578-R580 PolarHBondContact O-N 3.3Å; R580-K582 PolarHBondContact O-N 3.3Å; R580-H1327 PolarHBondContact NH2-ND1 2.86Å
581	Y	41	Very low	50.5	Low	179 Å²	179	62 Å²	62	70%	0.702	31%	0.307	S	S	*	.			trans	-54	117.7	164.3	-121.6	-91.4	0	0	0	107.7	H583	Y581-H583 PolarHBondContact O-N 3.12Å
582	K	32.9	Very low	49.8	Very low	106 Å²	106	64.7 Å²	64.7	46%	0.461	32%	0.32	S	S	.	.	S	Bend	trans	-81.2	54.5	-167.5	-152.3	-165.8	-159.7	164.2	0	112.8	Q576 R580	Q576-K582 HydrophobicContact CG-CD 4.37Å; R580-K582 PolarHBondContact O-N 3.3Å
583	H	32.6	Very low	49.4	Very low	143 Å²	143	65 Å²	65	66%	0.662	32%	0.322	S	S	*	.	S	Bend	trans	-108.2	137.7	145.5	-84.6	-86	0	0	0	106.9	Y581 V585	Y581-H583 PolarHBondContact O-N 3.12Å; H583-V585 HydrophobicContact CB-CB 4.01Å; H583-V585 HydrophobicContact CB-CG2 4.01Å; H583-V585 PolarHBondContact O-N 3.13Å
584	E	32.6	Very low	49.5	Very low	129 Å²	129	62.3 Å²	62.3	60%	0.603	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	26.1	176.2	-58.6	173.5	132.4	0	0	112.5	P778	E584-P778 WeakPolarHBondContact O-CB 3.42Å; E584-P778 WeakPolarHBondContact O-CG 3.5Å
585	V	34.6	Very low	49.6	Very low	43 Å²	43	63 Å²	63	26%	0.261	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.4	-16.3	-157.2	-173	0	0	0	0	111.6	H583 E774 P778	H583-V585 HydrophobicContact CB-CB 4.01Å; H583-V585 HydrophobicContact CB-CG2 4.01Å; H583-V585 PolarHBondContact O-N 3.13Å; V585-E774 VanDerWaalsContact CG1-O 3.29Å; V585-E774 WeakPolarHBondContact CG1-O 3.45Å; V585-P778 VanDerWaalsContact C-CB 3.41Å; V585-P778 VanDerWaalsContact CA-CB 3.46Å; V585-P778 WeakPolarHBondContact O-CA 3.46Å; V585-P778 WeakPolarHBondContact O-CB 3.46Å; V585-P778 WeakPolarHBondContact O-CD 3.29Å
586	H	34.8	Very low	50	Low	43 Å²	43	65 Å²	65	20%	0.199	30%	0.304	C	S	.	.			trans	-156.6	127.3	172.5	-89.2	-59.7	0	0	0	116.4	V588 N777	H586-V588 HydrophobicContact CB-CB 4.36Å; H586-V588 HydrophobicContact CB-CG2 4.05Å; H586-V588 PolarHBondContact O-N 2.89Å; H586-N777 WeakPolarHBondContact CE1-CB 3.46Å; H586-N777 PolarHBondContact CE1-ND2 3.5Å; H586-N777 WeakPolarHBondContact NE2-CB 3.34Å; H586-N777 VanDerWaalsContact NE2-CG 3.34Å; H586-N777 PolarHBondContact NE2-ND2 3.37Å
587	N	39.1	Very low	50.2	Low	70 Å²	70	64.8 Å²	64.8	37%	0.374	31%	0.306	S	S	.	.			trans	-73	46.7	163.1	-73	-52.2	0	0	0	112.5
588	V	38.9	Very low	50.3	Low	56 Å²	56	65 Å²	65	34%	0.339	31%	0.306	S	S	.	.			trans	-100.2	112.4	175	175.6	0	0	0	0	108.6	H586	H586-V588 HydrophobicContact CB-CB 4.36Å; H586-V588 HydrophobicContact CB-CG2 4.05Å; H586-V588 PolarHBondContact O-N 2.89Å
589	W	45.3	Very low	50.6	Low	67 Å²	67	68.7 Å²	68.7	25%	0.254	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-86.1	132.2	-175.7	-168.6	75.6	0	0	0	109.8	R1467 W1473 Q1608	W589-R1467 HydrophobicContact CZ3-CG 4.39Å; W589-W1473 AromaticContact CH2-CH2 3.47Å; W589-W1473 HydrophobicContact CH2-CH2 3.47Å; W589-W1473 VanDerWaalsContact CH2-CH2 3.47Å; W589-W1473 AromaticContact CH2-CZ2 3.16Å; W589-W1473 HydrophobicContact CH2-CZ2 3.16Å; W589-W1473 AromaticContact CZ2-CE2 3.66Å; W589-W1473 AromaticContact CZ2-CH2 3.96Å; W589-W1473 HydrophobicContact CZ2-CH2 3.96Å; W589-W1473 AromaticContact CZ2-CZ2 3.17Å; W589-W1473 HydrophobicContact CZ2-CZ2 3.17Å; W589-W1473 AromaticContact CZ2-NE1 3.83Å; W589-W1473 HydrophobicContact CZ3-CH2 4.32Å; W589-W1473 HydrophobicContact CZ3-CZ2 4.1Å; W589-Q1608 HydrophobicContact CH2-CG 4.5Å; W589-Q1608 HydrophobicContact CZ2-CB 3.85Å; W589-Q1608 HydrophobicContact CZ2-CG 4.04Å
590	S	49.1	Very low	51.6	Low	24 Å²	24	67.4 Å²	67.4	17%	0.168	32%	0.318	C	S	.	.			trans	-66.7	127.1	-179.1	41.2	0	0	0	0	110.1	D579 Q592	D579-S590 PolarHBondContact OD2-OG 3.24Å; S590-Q592 PolarHBondContact O-N 3.41Å; S590-Q592 VanDerWaalsContact O-N 3.11Å
591	P	52.9	Low	53.1	Low	62 Å²	62	61.6 Å²	61.6	40%	0.403	30%	0.296	S	S	.	.			trans	-72.6	-0.4	177.6	30.4	-36	0	0	0	113.4	R1467	P591-R1467 VanDerWaalsContact CB-NH1 3.31Å; P591-R1467 PolarHBondContact O-NH2 3.28Å
592	Q	61.2	Low	54.9	Low	57 Å²	57	54.8 Å²	54.8	27%	0.266	27%	0.27	S	S	.	.	S	Bend	trans	-79.7	135.3	-177.1	-178.7	175.9	-6.9	0	0	111.1	S590 Y642 Q1608	S590-Q592 PolarHBondContact O-N 3.41Å; S590-Q592 VanDerWaalsContact O-N 3.11Å; Q592-Y642 HydrophobicContact CB-CE2 4.29Å; Q592-Y642 HydrophobicContact CG-CE2 3.96Å; Q592-Q1608 PolarHBondContact O-NE2 2.77Å
593	P	65.4	Low	57.3	Low	14 Å²	14	50.1 Å²	50.1	9%	0.091	25%	0.25	C	C	.	.			trans	-71.1	138.6	166.9	30.6	-33.5	0	0	0	110.8	Y11 D595 Y642	Y11-P593 WeakPolarHBondContact OH-CB 3.45Å; P593-D595 PolarHBondContact O-N 3.23Å; P593-D595 VanDerWaalsContact O-N 3.14Å; P593-Y642 HydrophobicContact CG-CD1 4.13Å; P593-Y642 HydrophobicContact CG-CE1 3.45Å; P593-Y642 VanDerWaalsContact CG-CE1 3.45Å
594	R	72	Confident	59.6	Low	12 Å²	12	43.5 Å²	43.5	5%	0.045	22%	0.219	C	C	.	.			trans	-83.7	76.7	173.2	-76.1	-164.1	77.1	-143.2	14.1	109.9	D572 D579 D600 N1607	D572-R594 IonicContact OD1-NH2 2.8Å; D572-R594 IonicContact OD2-NH1 3.29Å; D579-R594 IonicContact OD1-NE 2.93Å; D579-R594 WeakPolarHBondContact OD2-CD 3.39Å; R594-D600 HydrophobicContact CB-CB 4.01Å; R594-D600 IonicContact CZ-OD1 3.93Å; R594-D600 VanDerWaalsContact CZ-OD1 3.26Å; R594-D600 IonicContact NE-OD1 2.64Å; R594-D600 PolarHBondContact NE-OD1 3.26Å; R594-D600 PolarHBondContact NH1-O 3.49Å; R594-D600 IonicContact NH2-OD1 2.69Å; R594-D600 PolarHBondContact NH2-OD1 3.3Å; R594-N1607 HydrophobicContact CB-CB 4.29Å; R594-N1607 WeakPolarHBondContact CD-O 3.45Å; R594-N1607 PolarHBondContact NH1-O 3.29Å; R594-N1607 PolarHBondContact O-ND2 3.01Å
595	D	71.6	Confident	61.8	Low	24 Å²	24	37.4 Å²	37.4	13%	0.128	19%	0.191	C	C	.	.			trans	-114.4	0.9	-172.3	59.9	5.9	0	0	0	115.4	Y11 N34 P593	Y11-D595 HydrophobicContact CD1-CB 4.48Å; Y11-D595 HydrophobicContact CE1-CB 3.49Å; Y11-D595 VanDerWaalsContact CE1-CB 3.49Å; Y11-D595 WeakPolarHBondContact OH-CB 3.47Å; Y11-D595 PolarHBondContact OH-OD2 3.28Å; N34-D595 PolarHBondContact ND2-O 3.44Å; P593-D595 PolarHBondContact O-N 3.23Å; P593-D595 VanDerWaalsContact O-N 3.14Å
596	R	67	Low	63.8	Low	96 Å²	96	36.1 Å²	36.1	36%	0.362	18%	0.182	S	C	.	.			trans	-67.9	122.7	178.9	-67.6	176.1	-67.1	-179.8	0.9	111.2	L599 D600	R596-L599 HydrophobicContact CB-CB 4.46Å; R596-D600 HydrophobicContact CB-CB 4.35Å; R596-D600 IonicContact CZ-OD2 3.72Å; R596-D600 IonicContact NE-OD2 3.98Å; R596-D600 PolarHBondContact NE-OD2 3.07Å; R596-D600 IonicContact NH2-OD1 3.51Å; R596-D600 PolarHBondContact NH2-OD1 3.26Å; R596-D600 IonicContact NH2-OD2 3.71Å; R596-D600 PolarHBondContact NH2-OD2 3.18Å; R596-D600 PolarHBondContact O-N 3.42Å; R596-D600 VanDerWaalsContact O-N 3.14Å
597	P	62.1	Low	66.1	Low	34 Å²	34	34.1 Å²	34.1	22%	0.221	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	152.4	171.5	29.1	-34.3	0	0	0	110.3	L32 N34 L599 Y605	L32-P597 WeakPolarHBondContact O-CB 3.42Å; N34-P597 HydrophobicContact CB-CB 4.47Å; P597-L599 PolarHBondContact O-N 2.99Å; P597-Y605 HydrophobicContact CB-CD2 4.28Å; P597-Y605 HydrophobicContact CB-CE1 4.44Å; P597-Y605 HydrophobicContact CB-CE2 3.65Å
598	F	65.6	Low	68.4	Low	29 Å²	29	30.8 Å²	30.8	13%	0.127	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	-38.8	-178.1	-37.8	-64.7	0	0	0	116.8	L32 L374 Y605 F606	L32-F598 HydrophobicContact CD2-CZ 3.85Å; L32-F598 HydrophobicContact CG-CZ 4.09Å; L374-F598 HydrophobicContact CB-CZ 4.43Å; L374-F598 HydrophobicContact CD1-CE1 3.84Å; L374-F598 HydrophobicContact CD1-CZ 3.94Å; F598-Y605 HydrophobicContact CD1-CD1 4.39Å; F598-Y605 HydrophobicContact CD1-CG 4.29Å; F598-Y605 AromaticContact CE1-CD1 3.88Å; F598-Y605 HydrophobicContact CE1-CD1 3.88Å; F598-Y605 HydrophobicContact CE1-CE1 4.37Å; F598-Y605 HydrophobicContact CE1-CG 4.23Å; F598-F606 HydrophobicContact CB-CZ 4.33Å; F598-F606 WeakPolarHBondContact O-CE2 3.4Å
599	L	64.9	Low	70.7	Confident	93 Å²	93	28.1 Å²	28.1	49%	0.487	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-45.8	179.9	-151.5	83	0	0	0	113.1	R596 P597	R596-L599 HydrophobicContact CB-CB 4.46Å; P597-L599 PolarHBondContact O-N 2.99Å
600	D	72.5	Confident	72.7	Confident	10 Å²	10	25.3 Å²	25.3	5%	0.053	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-16.1	-172.3	-76.5	-42.8	0	0	0	114.6	R594 R596 N1607	R594-D600 HydrophobicContact CB-CB 4.01Å; R594-D600 IonicContact CZ-OD1 3.93Å; R594-D600 VanDerWaalsContact CZ-OD1 3.26Å; R594-D600 IonicContact NE-OD1 2.64Å; R594-D600 PolarHBondContact NE-OD1 3.26Å; R594-D600 PolarHBondContact NH1-O 3.49Å; R594-D600 IonicContact NH2-OD1 2.69Å; R594-D600 PolarHBondContact NH2-OD1 3.3Å; R596-D600 HydrophobicContact CB-CB 4.35Å; R596-D600 IonicContact CZ-OD2 3.72Å; R596-D600 IonicContact NE-OD2 3.98Å; R596-D600 PolarHBondContact NE-OD2 3.07Å; R596-D600 IonicContact NH2-OD1 3.51Å; R596-D600 PolarHBondContact NH2-OD1 3.26Å; R596-D600 IonicContact NH2-OD2 3.71Å; R596-D600 PolarHBondContact NH2-OD2 3.18Å; R596-D600 PolarHBondContact O-N 3.42Å; R596-D600 VanDerWaalsContact O-N 3.14Å; D600-N1607 PolarHBondContact O-ND2 2.69Å
601	L	78.4	Confident	74.5	Confident	2 Å²	2	24.4 Å²	24.4	1%	0.01	12%	0.121	C	C	.	.			trans	-114.1	33.3	-173.2	-75.4	162.2	0	0	0	112.4	N34 Y603 I604 Y605 Y1605 N1607	N34-L601 HydrophobicContact CB-CD1 4.38Å; N34-L601 WeakPolarHBondContact ND2-CD1 3.3Å; L601-Y603 PolarHBondContact O-N 2.92Å; L601-I604 PolarHBondContact O-N 2.75Å; L601-I604 VanDerWaalsContact O-N 3.12Å; L601-Y605 HydrophobicContact CB-CD2 3.52Å; L601-Y605 HydrophobicContact CB-CE2 3.73Å; L601-Y605 HydrophobicContact CD1-CE2 4Å; L601-Y605 PolarHBondContact O-N 2.96Å; L601-Y1605 WeakPolarHBondContact CD2-OH 3.32Å; L601-N1607 HydrophobicContact CD2-CB 4.29Å; L601-N1607 VanDerWaalsContact CD2-ND2 3.27Å; L601-N1607 WeakPolarHBondContact CD2-ND2 3.39Å
602	K	79.6	Confident	76.3	Confident	37 Å²	37	21.4 Å²	21.4	16%	0.161	10%	0.102	C	C	.	.	H	α-helix	trans	-53.2	-47.2	-171	-63.6	-161	176.3	-165.2	0	113.8	Y569 V571 D572 I604 Y605 F606	Y569-K602 PolarHBondContact O-NZ 2.85Å; V571-K602 VanDerWaalsContact C-CD 3.42Å; V571-K602 WeakPolarHBondContact O-CD 3.43Å; V571-K602 PolarHBondContact O-NZ 2.87Å; D572-K602 WeakPolarHBondContact OD1-CD 3.49Å; K602-I604 PolarHBondContact O-N 2.85Å; K602-Y605 PolarHBondContact O-N 3.28Å; K602-F606 HydrophobicContact CB-CD2 3.88Å; K602-F606 HydrophobicContact CB-CE2 4.25Å; K602-F606 HydrophobicContact CD-CE2 4.32Å; K602-F606 HydrophobicContact CG-CD2 4.11Å; K602-F606 HydrophobicContact CG-CE2 3.96Å; K602-F606 PolarHBondContact O-N 3.29Å
603	Y	82.9	Confident	77.6	Confident	8 Å²	8	19.1 Å²	19.1	3%	0.031	9%	0.091	C	C	.	.	H	α-helix	trans	-60.9	-25.2	-178.2	-73.3	-71.4	0	0	0	114.4	V571 D572 L601 F608 S609 F1318 W1610 V1611 P1614 N1644	V571-Y603 HydrophobicContact CG1-CE1 4.28Å; D572-Y603 HydrophobicContact CB-CD2 4.46Å; D572-Y603 HydrophobicContact CB-CE2 3.72Å; L601-Y603 PolarHBondContact O-N 2.92Å; Y603-F608 HydrophobicContact CD1-CB 3.87Å; Y603-F608 AromaticContact CD1-CD1 3.63Å; Y603-F608 HydrophobicContact CD1-CD1 3.63Å; Y603-F608 HydrophobicContact CD1-CD2 4.21Å; Y603-F608 HydrophobicContact CD1-CE1 4.26Å; Y603-F608 AromaticContact CD1-CG 3.63Å; Y603-F608 HydrophobicContact CD1-CG 3.63Å; Y603-F608 HydrophobicContact CE1-CD1 4.07Å; Y603-F608 HydrophobicContact CE1-CD2 4.22Å; Y603-F608 HydrophobicContact CE1-CE1 4.29Å; Y603-F608 HydrophobicContact CE1-CE2 4.41Å; Y603-F608 HydrophobicContact CE1-CG 4.07Å; Y603-F608 HydrophobicContact CE1-CZ 4.47Å; Y603-S609 VanDerWaalsContact O-CB 3.3Å; Y603-S609 WeakPolarHBondContact O-CB 3.43Å; Y603-S609 PolarHBondContact O-N 3.09Å; Y603-S609 PolarHBondContact O-OG 3Å; Y603-F1318 AromaticContact CE1-CZ 3.88Å; Y603-F1318 HydrophobicContact CE1-CZ 3.88Å; Y603-W1610 WeakPolarHBondContact CD2-O 3.25Å; Y603-W1610 WeakPolarHBondContact CE2-O 3.3Å; Y603-V1611 HydrophobicContact CE2-CG1 4.27Å; Y603-P1614 HydrophobicContact CD1-CG 4.13Å; Y603-P1614 HydrophobicContact CD2-CG 4.39Å; Y603-P1614 HydrophobicContact CE1-CG 4.33Å; Y603-P1614 HydrophobicContact CG-CG 4.17Å; Y603-N1644 PolarHBondContact OH-ND2 2.84Å
604	I	81.5	Confident	78.6	Confident	3 Å²	3	19.7 Å²	19.7	2%	0.015	9%	0.093	C	C	.	.	H	α-helix	trans	-86.6	-60.2	170.1	-63.1	-173.7	0	0	0	109.5	K14 L601 K602 F606 G607 F610 A634 Y1605 L1613	K14-I604 HydrophobicContact CD-CD1 4.12Å; K14-I604 HydrophobicContact CD-CG2 3.89Å; L601-I604 PolarHBondContact O-N 2.75Å; L601-I604 VanDerWaalsContact O-N 3.12Å; K602-I604 PolarHBondContact O-N 2.85Å; I604-F606 PolarHBondContact O-N 3.15Å; I604-G607 WeakPolarHBondContact O-CA 3.26Å; I604-G607 PolarHBondContact O-N 3.13Å; I604-F610 HydrophobicContact CG2-CE1 4.16Å; I604-F610 HydrophobicContact CG2-CZ 3.87Å; I604-F610 WeakPolarHBondContact O-CE2 3.23Å; I604-F610 VanDerWaalsContact O-CZ 3.32Å; I604-F610 WeakPolarHBondContact O-CZ 3.32Å; I604-A634 HydrophobicContact CD1-CB 4.26Å; I604-Y1605 HydrophobicContact CD1-CE1 4.32Å; I604-Y1605 WeakPolarHBondContact CD1-OH 3.45Å; I604-L1613 HydrophobicContact CD1-CD2 3.6Å; I604-L1613 HydrophobicContact CG1-CD2 3.25Å
605	Y	77.6	Confident	79.4	Confident	1 Å²	1	19.1 Å²	19.1	0%	0.004	9%	0.092	C	C	.	.	H	α-helix	trans	-62.6	-47.9	-166	-84	-69.3	0	0	0	112.4	K14 Y28 T31 L32 Q377 P597 F598 L601 K602 G607	K14-Y605 VanDerWaalsContact NZ-CZ 3.27Å; K14-Y605 PolarHBondContact NZ-OH 2.94Å; Y28-Y605 HydrophobicContact CE2-CD1 4.13Å; Y28-Y605 PolarHBondContact OH-O 3.17Å; T31-Y605 PolarHBondContact O-OH 3.23Å; L32-Y605 PolarHBondContact O-OH 2.93Å; Q377-Y605 PolarHBondContact NE2-O 3.3Å; P597-Y605 HydrophobicContact CB-CD2 4.28Å; P597-Y605 HydrophobicContact CB-CE1 4.44Å; P597-Y605 HydrophobicContact CB-CE2 3.65Å; F598-Y605 HydrophobicContact CD1-CD1 4.39Å; F598-Y605 HydrophobicContact CD1-CG 4.29Å; F598-Y605 AromaticContact CE1-CD1 3.88Å; F598-Y605 HydrophobicContact CE1-CD1 3.88Å; F598-Y605 HydrophobicContact CE1-CE1 4.37Å; F598-Y605 HydrophobicContact CE1-CG 4.23Å; L601-Y605 HydrophobicContact CB-CD2 3.52Å; L601-Y605 HydrophobicContact CB-CE2 3.73Å; L601-Y605 HydrophobicContact CD1-CE2 4Å; L601-Y605 PolarHBondContact O-N 2.96Å; K602-Y605 PolarHBondContact O-N 3.28Å; Y605-G607 PolarHBondContact O-N 3.32Å
606	F	78.4	Confident	80.2	Confident	17 Å²	17	18 Å²	18	8%	0.075	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-0.9	177.8	-60	-64.1	0	0	0	113.5	Q377 M566 L570 F598 K602 I604	Q377-F606 HydrophobicContact CB-CD1 4.09Å; Q377-F606 HydrophobicContact CB-CE1 4.08Å; Q377-F606 HydrophobicContact CG-CD1 3.83Å; Q377-F606 HydrophobicContact CG-CE1 4.17Å; M566-F606 WeakPolarHBondContact CE-O 3.15Å; L570-F606 HydrophobicContact CB-CB 4.2Å; L570-F606 HydrophobicContact CB-CG 4.29Å; L570-F606 HydrophobicContact CD2-CB 4.28Å; L570-F606 HydrophobicContact CD2-CD1 3.5Å; L570-F606 VanDerWaalsContact CD2-CD1 3.5Å; L570-F606 HydrophobicContact CD2-CE1 3.93Å; L570-F606 HydrophobicContact CD2-CG 3.86Å; L570-F606 WeakPolarHBondContact O-CB 3.31Å; L570-F606 VanDerWaalsContact O-CD2 3.22Å; L570-F606 WeakPolarHBondContact O-CD2 3.5Å; F598-F606 HydrophobicContact CB-CZ 4.33Å; F598-F606 WeakPolarHBondContact O-CE2 3.4Å; K602-F606 HydrophobicContact CB-CD2 3.88Å; K602-F606 HydrophobicContact CB-CE2 4.25Å; K602-F606 HydrophobicContact CD-CE2 4.32Å; K602-F606 HydrophobicContact CG-CD2 4.11Å; K602-F606 HydrophobicContact CG-CE2 3.96Å; K602-F606 PolarHBondContact O-N 3.29Å; I604-F606 PolarHBondContact O-N 3.15Å
607	G	82.1	Confident	81.1	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.073	C	C	.	.	S	Bend	trans	86.4	12.3	166.1	0	0	0	0	0	117	I604 Y605 S609 F610 L611	I604-G607 WeakPolarHBondContact O-CA 3.26Å; I604-G607 PolarHBondContact O-N 3.13Å; Y605-G607 PolarHBondContact O-N 3.32Å; G607-S609 VanDerWaalsContact C-N 3.3Å; G607-S609 PolarHBondContact O-N 3.42Å; G607-F610 WeakPolarHBondContact O-CB 3.46Å; G607-F610 PolarHBondContact O-N 3.11Å; G607-L611 PolarHBondContact O-N 3.26Å
608	F	88.3	Confident	82.2	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-53.9	-47.1	172	-172	-75.8	0	0	0	111.8	I564 M566 V571 Y603 F610 L611 Q612 F1318 P1614 N1644	I564-F608 HydrophobicContact CB-CD2 4.34Å; I564-F608 HydrophobicContact CB-CE2 3.56Å; I564-F608 HydrophobicContact CB-CZ 3.69Å; I564-F608 HydrophobicContact CD1-CD1 4.36Å; I564-F608 HydrophobicContact CD1-CE1 3.83Å; I564-F608 HydrophobicContact CD1-CE2 4.24Å; I564-F608 HydrophobicContact CD1-CZ 3.75Å; I564-F608 HydrophobicContact CG1-CE2 4.49Å; I564-F608 HydrophobicContact CG1-CZ 4.23Å; I564-F608 HydrophobicContact CG2-CD2 3.78Å; I564-F608 HydrophobicContact CG2-CE2 3.48Å; I564-F608 VanDerWaalsContact CG2-CE2 3.48Å; I564-F608 HydrophobicContact CG2-CZ 4.06Å; M566-F608 HydrophobicContact CG-CD2 4.36Å; M566-F608 HydrophobicContact SD-CB 3.9Å; M566-F608 HydrophobicContact SD-CD2 3.72Å; M566-F608 HydrophobicContact SD-CG 4.28Å; V571-F608 HydrophobicContact CG1-CD2 3.61Å; V571-F608 HydrophobicContact CG1-CE2 4.25Å; V571-F608 HydrophobicContact CG1-CG 4.39Å; Y603-F608 HydrophobicContact CD1-CB 3.87Å; Y603-F608 AromaticContact CD1-CD1 3.63Å; Y603-F608 HydrophobicContact CD1-CD1 3.63Å; Y603-F608 HydrophobicContact CD1-CD2 4.21Å; Y603-F608 HydrophobicContact CD1-CE1 4.26Å; Y603-F608 AromaticContact CD1-CG 3.63Å; Y603-F608 HydrophobicContact CD1-CG 3.63Å; Y603-F608 HydrophobicContact CE1-CD1 4.07Å; Y603-F608 HydrophobicContact CE1-CD2 4.22Å; Y603-F608 HydrophobicContact CE1-CE1 4.29Å; Y603-F608 HydrophobicContact CE1-CE2 4.41Å; Y603-F608 HydrophobicContact CE1-CG 4.07Å; Y603-F608 HydrophobicContact CE1-CZ 4.47Å; F608-F610 VanDerWaalsContact C-N 3.34Å; F608-F610 PolarHBondContact O-N 2.59Å; F608-L611 PolarHBondContact O-N 3.13Å; F608-Q612 PolarHBondContact O-N 3.37Å; F608-F1318 AromaticContact CE1-CE2 3.53Å; F608-F1318 HydrophobicContact CE1-CE2 3.53Å; F608-F1318 AromaticContact CE1-CZ 3.96Å; F608-F1318 HydrophobicContact CE1-CZ 3.96Å; F608-F1318 AromaticContact CZ-CE2 3.58Å; F608-F1318 HydrophobicContact CZ-CE2 3.58Å; F608-F1318 HydrophobicContact CZ-CZ 4.03Å; F608-P1614 HydrophobicContact CE1-CB 4.4Å; F608-N1644 HydrophobicContact CE2-CB 3.95Å; F608-N1644 HydrophobicContact CZ-CB 3.83Å
609	S	87.1	Confident	83.3	Confident	0 Å²	0	11 Å²	11	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-70.3	-30	-179.1	-51.5	0	0	0	0	112.5	Y603 G607 Q612 D613	Y603-S609 VanDerWaalsContact O-CB 3.3Å; Y603-S609 WeakPolarHBondContact O-CB 3.43Å; Y603-S609 PolarHBondContact O-N 3.09Å; Y603-S609 PolarHBondContact O-OG 3Å; G607-S609 VanDerWaalsContact C-N 3.3Å; G607-S609 PolarHBondContact O-N 3.42Å; S609-Q612 PolarHBondContact O-N 2.99Å; S609-D613 WeakPolarHBondContact O-CB 3.37Å; S609-D613 PolarHBondContact O-N 3.46Å
610	F	86.9	Confident	84.2	Confident	8 Å²	8	6.9 Å²	6.9	4%	0.035	4%	0.035	C	C	.	.	H	α-helix	trans	-66.7	-43	174.3	-53.1	-33.2	0	0	0	110.9	M16 P17 M24 Y28 I604 G607 F608 D613 L614	M16-F610 HydrophobicContact SD-CD1 3.62Å; M16-F610 HydrophobicContact SD-CE1 3.87Å; P17-F610 HydrophobicContact CG-CB 3.79Å; P17-F610 HydrophobicContact CG-CG 4.43Å; M24-F610 HydrophobicContact CE-CB 4.22Å; M24-F610 HydrophobicContact CE-CD1 4Å; M24-F610 HydrophobicContact CE-CD2 3.26Å; M24-F610 HydrophobicContact CE-CE1 4.16Å; M24-F610 HydrophobicContact CE-CE2 3.47Å; M24-F610 VanDerWaalsContact CE-CE2 3.47Å; M24-F610 HydrophobicContact CE-CG 3.57Å; M24-F610 HydrophobicContact CE-CZ 3.93Å; Y28-F610 AromaticContact CD2-CE2 3.88Å; Y28-F610 HydrophobicContact CD2-CE2 3.88Å; Y28-F610 AromaticContact CD2-CZ 3.86Å; Y28-F610 HydrophobicContact CD2-CZ 3.86Å; Y28-F610 AromaticContact CE2-CE2 3.99Å; Y28-F610 HydrophobicContact CE2-CE2 3.99Å; Y28-F610 HydrophobicContact CE2-CZ 4.33Å; I604-F610 HydrophobicContact CG2-CE1 4.16Å; I604-F610 HydrophobicContact CG2-CZ 3.87Å; I604-F610 WeakPolarHBondContact O-CE2 3.23Å; I604-F610 VanDerWaalsContact O-CZ 3.32Å; I604-F610 WeakPolarHBondContact O-CZ 3.32Å; G607-F610 WeakPolarHBondContact O-CB 3.46Å; G607-F610 PolarHBondContact O-N 3.11Å; F608-F610 VanDerWaalsContact C-N 3.34Å; F608-F610 PolarHBondContact O-N 2.59Å; F610-D613 PolarHBondContact O-N 3.12Å; F610-L614 WeakPolarHBondContact O-CG 3.42Å; F610-L614 PolarHBondContact O-N 2.89Å
611	L	87.3	Confident	84.8	Confident	5 Å²	5	8.7 Å²	8.7	3%	0.026	5%	0.049	C	C	.	.	H	α-helix	trans	-69	-35.3	176.4	-167.9	134.8	0	0	0	111.9	I386 F541 S542 V544 I564 G607 F608 V615	I386-L611 HydrophobicContact CD1-CD1 3.76Å; I386-L611 HydrophobicContact CG1-CD1 4.29Å; I386-L611 HydrophobicContact CG2-CD1 4.22Å; F541-L611 HydrophobicContact CD1-CD1 4.12Å; F541-L611 HydrophobicContact CE1-CD1 3.88Å; S542-L611 WeakPolarHBondContact OG-CD1 3.44Å; V544-L611 HydrophobicContact CG2-CD2 3.77Å; I564-L611 HydrophobicContact CD1-CD2 3.65Å; I564-L611 HydrophobicContact CG1-CD2 3.77Å; I564-L611 HydrophobicContact CG2-CD2 4.08Å; G607-L611 PolarHBondContact O-N 3.26Å; F608-L611 PolarHBondContact O-N 3.13Å; L611-V615 HydrophobicContact CD2-CG2 4.26Å; L611-V615 HydrophobicContact CG-CG2 4.47Å; L611-V615 WeakPolarHBondContact O-CB 2.93Å; L611-V615 VanDerWaalsContact O-CG2 3.26Å; L611-V615 WeakPolarHBondContact O-CG2 3.46Å; L611-V615 PolarHBondContact O-N 2.81Å; L611-V615 VanDerWaalsContact O-N 3.09Å
612	Q	90.2	Very high	85.1	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-59.2	-52.5	170.2	177.6	170.4	1.3	0	0	111.7	I564 F608 S609 L614 V615 D616 P1614 T1642	I564-Q612 HydrophobicContact CD1-CB 4.31Å; F608-Q612 PolarHBondContact O-N 3.37Å; S609-Q612 PolarHBondContact O-N 2.99Å; Q612-L614 PolarHBondContact O-N 3.42Å; Q612-V615 PolarHBondContact O-N 3.29Å; Q612-D616 VanDerWaalsContact O-CB 3.28Å; Q612-D616 WeakPolarHBondContact O-CB 3.35Å; Q612-D616 PolarHBondContact O-N 2.92Å; Q612-P1614 PolarHBondContact NE2-O 3.32Å; Q612-P1614 VanDerWaalsContact OE1-CB 3.29Å; Q612-T1642 HydrophobicContact CG-CG2 4.17Å; Q612-T1642 PolarHBondContact NE2-OG1 3.16Å
613	D	88.5	Confident	85.4	Confident	8 Å²	8	11 Å²	11	4%	0.043	6%	0.062	C	C	.	.	H	α-helix	trans	-61.4	-39.7	-179.2	-175	54.3	0	0	0	113	M16 S18 S609 F610 G617 M1617	M16-D613 HydrophobicContact CB-CB 4.27Å; M16-D613 WeakPolarHBondContact CB-OD2 3.32Å; S18-D613 WeakPolarHBondContact CB-OD2 3.39Å; S18-D613 PolarHBondContact N-OD2 3.37Å; S18-D613 PolarHBondContact OG-OD1 2.88Å; S18-D613 PolarHBondContact OG-OD2 3.49Å; S609-D613 WeakPolarHBondContact O-CB 3.37Å; S609-D613 PolarHBondContact O-N 3.46Å; F610-D613 PolarHBondContact O-N 3.12Å; D613-G617 PolarHBondContact O-N 3.29Å; D613-M1617 HydrophobicContact CB-CE 3.94Å
614	L	86.6	Confident	85.3	Confident	26 Å²	26	11.3 Å²	11.3	14%	0.136	7%	0.065	C	C	.	.	H	α-helix	trans	-64.5	-47.7	175.8	-77.6	170.4	0	0	0	112.7	P17 L402 K405 F610 Q612 I618	P17-L614 HydrophobicContact CB-CD1 4.24Å; P17-L614 HydrophobicContact CB-CD2 3.65Å; P17-L614 HydrophobicContact CB-CG 3.71Å; P17-L614 HydrophobicContact CG-CD1 4.15Å; P17-L614 HydrophobicContact CG-CD2 4.39Å; P17-L614 HydrophobicContact CG-CG 3.9Å; L402-L614 HydrophobicContact CD2-CB 4.09Å; K405-L614 HydrophobicContact CD-CD2 3.99Å; F610-L614 WeakPolarHBondContact O-CG 3.42Å; F610-L614 PolarHBondContact O-N 2.89Å; Q612-L614 PolarHBondContact O-N 3.42Å; L614-I618 PolarHBondContact O-N 3Å
615	V	88.8	Confident	85.2	Confident	1 Å²	1	18 Å²	18	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-71.3	-48.4	-177.3	174.3	0	0	0	0	110.7	L402 F546 Y562 L611 Q612 G617 I618 I619	L402-V615 HydrophobicContact CD1-CG2 4.41Å; L402-V615 HydrophobicContact CD2-CG2 4.31Å; F546-V615 HydrophobicContact CZ-CG1 4.45Å; Y562-V615 HydrophobicContact CD1-CG1 4.39Å; Y562-V615 HydrophobicContact CD2-CG1 4.32Å; Y562-V615 HydrophobicContact CE1-CG1 3.79Å; Y562-V615 HydrophobicContact CE2-CB 4.22Å; Y562-V615 HydrophobicContact CE2-CG1 3.7Å; Y562-V615 VanDerWaalsContact CZ-CG1 3.4Å; L611-V615 HydrophobicContact CD2-CG2 4.26Å; L611-V615 HydrophobicContact CG-CG2 4.47Å; L611-V615 WeakPolarHBondContact O-CB 2.93Å; L611-V615 VanDerWaalsContact O-CG2 3.26Å; L611-V615 WeakPolarHBondContact O-CG2 3.46Å; L611-V615 PolarHBondContact O-N 2.81Å; L611-V615 VanDerWaalsContact O-N 3.09Å; Q612-V615 PolarHBondContact O-N 3.29Å; V615-G617 VanDerWaalsContact C-N 3.31Å; V615-G617 PolarHBondContact O-N 3.47Å; V615-I618 PolarHBondContact O-N 2.98Å; V615-I619 HydrophobicContact CG1-CD1 3.64Å; V615-I619 HydrophobicContact CG1-CG1 4.42Å; V615-I619 WeakPolarHBondContact O-CD1 3.3Å; V615-I619 VanDerWaalsContact O-CG1 3.29Å; V615-I619 WeakPolarHBondContact O-CG1 3.31Å; V615-I619 PolarHBondContact O-N 2.95Å
616	D	88.3	Confident	85	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-55.7	-46.8	174.2	-80.7	-15.5	0	0	0	110.6	Y562 Q612 I618 I619 I620 S1621 I1640	Y562-D616 PolarHBondContact OH-OD1 2.88Å; Q612-D616 VanDerWaalsContact O-CB 3.28Å; Q612-D616 WeakPolarHBondContact O-CB 3.35Å; Q612-D616 PolarHBondContact O-N 2.92Å; D616-I618 VanDerWaalsContact C-N 3.31Å; D616-I618 PolarHBondContact O-N 2.87Å; D616-I619 PolarHBondContact O-N 2.81Å; D616-I620 WeakPolarHBondContact O-CB 3.22Å; D616-I620 WeakPolarHBondContact O-CD1 3.46Å; D616-I620 WeakPolarHBondContact O-CG1 3.33Å; D616-I620 PolarHBondContact O-N 3Å; D616-S1621 WeakPolarHBondContact CB-OG 3.4Å; D616-S1621 VanDerWaalsContact CG-OG 3.28Å; D616-S1621 VanDerWaalsContact OD2-CB 3.25Å; D616-S1621 WeakPolarHBondContact OD2-CB 3.41Å; D616-S1621 PolarHBondContact OD2-OG 2.68Å; D616-I1640 VanDerWaalsContact OD1-CG2 3.24Å; D616-I1640 WeakPolarHBondContact OD1-CG2 3.34Å
617	G	86.1	Confident	84.5	Confident	10 Å²	10	25 Å²	25	10%	0.103	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-33.8	-179.1	0	0	0	0	0	114.4	D613 V615 S621	D613-G617 PolarHBondContact O-N 3.29Å; V615-G617 VanDerWaalsContact C-N 3.31Å; V615-G617 PolarHBondContact O-N 3.47Å; G617-S621 WeakPolarHBondContact O-CB 3.42Å; G617-S621 PolarHBondContact O-N 3.43Å; G617-S621 VanDerWaalsContact O-N 3.17Å
618	I	85.6	Confident	83.9	Confident	3 Å²	3	28.1 Å²	28.1	2%	0.015	16%	0.162	C	C	.	.	H	α-helix	trans	-81.1	-39.5	177.2	-73.8	166.5	0	0	0	111.5	I398 E401 L402 K405 L614 V615 D616 I620 S621 L622	I398-I618 HydrophobicContact CG2-CG2 4.27Å; E401-I618 HydrophobicContact CB-CD1 4.08Å; E401-I618 HydrophobicContact CB-CG1 4.43Å; E401-I618 HydrophobicContact CB-CG2 3.94Å; L402-I618 HydrophobicContact CB-CD1 4.22Å; L402-I618 HydrophobicContact CD2-CD1 3.54Å; L402-I618 HydrophobicContact CG-CD1 3.58Å; K405-I618 HydrophobicContact CD-CD1 4.25Å; L614-I618 PolarHBondContact O-N 3Å; V615-I618 PolarHBondContact O-N 2.98Å; D616-I618 VanDerWaalsContact C-N 3.31Å; D616-I618 PolarHBondContact O-N 2.87Å; I618-I620 VanDerWaalsContact C-N 3.27Å; I618-I620 PolarHBondContact O-N 3.47Å; I618-S621 WeakPolarHBondContact O-CB 3.41Å; I618-S621 PolarHBondContact O-N 2.86Å; I618-L622 HydrophobicContact CG2-CD1 3.89Å; I618-L622 HydrophobicContact CG2-CG 4.36Å; I618-L622 WeakPolarHBondContact O-CG 3.23Å; I618-L622 PolarHBondContact O-N 2.83Å
619	I	87.1	Confident	82.9	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.8	-44.6	173.2	-63.9	156.4	0	0	0	110.1	L560 Y562 V615 D616 L622 Q623 I1640	L560-I619 HydrophobicContact CD2-CD1 3.72Å; L560-I619 HydrophobicContact CD2-CG1 3.9Å; L560-I619 HydrophobicContact CD2-CG2 3.93Å; Y562-I619 HydrophobicContact CD1-CD1 4.12Å; Y562-I619 HydrophobicContact CE1-CD1 3.79Å; V615-I619 HydrophobicContact CG1-CD1 3.64Å; V615-I619 HydrophobicContact CG1-CG1 4.42Å; V615-I619 WeakPolarHBondContact O-CD1 3.3Å; V615-I619 VanDerWaalsContact O-CG1 3.29Å; V615-I619 WeakPolarHBondContact O-CG1 3.31Å; V615-I619 PolarHBondContact O-N 2.95Å; D616-I619 PolarHBondContact O-N 2.81Å; I619-L622 PolarHBondContact O-N 3.37Å; I619-Q623 HydrophobicContact CG2-CG 4.36Å; I619-Q623 WeakPolarHBondContact O-CB 3.18Å; I619-Q623 WeakPolarHBondContact O-CG 3.25Å; I619-Q623 PolarHBondContact O-N 3Å; I619-I1640 HydrophobicContact CB-CD1 4.04Å; I619-I1640 HydrophobicContact CD1-CG2 4.3Å; I619-I1640 HydrophobicContact CG2-CD1 3.64Å; I619-I1640 HydrophobicContact CG2-CG1 3.94Å
620	I	85.6	Confident	82.5	Confident	5 Å²	5	33.8 Å²	33.8	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-44.7	176.7	-67.5	166.1	0	0	0	111.1	D616 I618 L622 Q623 T624 S1621 R1624 L1625 I1640	D616-I620 WeakPolarHBondContact O-CB 3.22Å; D616-I620 WeakPolarHBondContact O-CD1 3.46Å; D616-I620 WeakPolarHBondContact O-CG1 3.33Å; D616-I620 PolarHBondContact O-N 3Å; I618-I620 VanDerWaalsContact C-N 3.27Å; I618-I620 PolarHBondContact O-N 3.47Å; I620-L622 PolarHBondContact O-N 3.35Å; I620-Q623 PolarHBondContact O-N 2.74Å; I620-T624 HydrophobicContact CG2-CG2 4.4Å; I620-T624 WeakPolarHBondContact O-CB 3.44Å; I620-T624 WeakPolarHBondContact O-CG2 3.34Å; I620-T624 PolarHBondContact O-N 2.95Å; I620-T624 PolarHBondContact O-OG1 2.89Å; I620-S1621 WeakPolarHBondContact CD1-O 3.33Å; I620-R1624 HydrophobicContact CD1-CB 4.19Å; I620-R1624 HydrophobicContact CD1-CG 4.22Å; I620-R1624 HydrophobicContact CG2-CG 4.13Å; I620-L1625 HydrophobicContact CG1-CB 4.16Å; I620-L1625 HydrophobicContact CG1-CD1 4.49Å; I620-I1640 HydrophobicContact CD1-CD1 4.36Å; I620-I1640 HydrophobicContact CG1-CD1 3.73Å
621	S	84.3	Confident	82.1	Confident	49 Å²	49	33.4 Å²	33.4	34%	0.343	19%	0.186	S	C	.	.	H	α-helix	trans	-58.2	-47.1	177.4	-166.1	0	0	0	0	111.5	G617 I618 N625	G617-S621 WeakPolarHBondContact O-CB 3.42Å; G617-S621 PolarHBondContact O-N 3.43Å; G617-S621 VanDerWaalsContact O-N 3.17Å; I618-S621 WeakPolarHBondContact O-CB 3.41Å; I618-S621 PolarHBondContact O-N 2.86Å; S621-N625 WeakPolarHBondContact O-CA 3.43Å; S621-N625 PolarHBondContact O-N 3.48Å
622	L	84.9	Confident	82	Confident	56 Å²	56	33.4 Å²	33.4	29%	0.293	19%	0.186	S	C	.	.	H	α-helix	trans	-71.7	-30.6	-179.5	-66.7	170.4	0	0	0	113.7	I398 L556 I618 I619 I620	I398-L622 HydrophobicContact CG1-CD1 3.58Å; L556-L622 HydrophobicContact CD1-CB 3.79Å; L556-L622 HydrophobicContact CD1-CD1 4.17Å; I618-L622 HydrophobicContact CG2-CD1 3.89Å; I618-L622 HydrophobicContact CG2-CG 4.36Å; I618-L622 WeakPolarHBondContact O-CG 3.23Å; I618-L622 PolarHBondContact O-N 2.83Å; I619-L622 PolarHBondContact O-N 3.37Å; I620-L622 PolarHBondContact O-N 3.35Å
623	Q	85.9	Confident	81.7	Confident	31 Å²	31	33.7 Å²	33.7	15%	0.145	19%	0.188	C	C	.	.	H	α-helix	trans	-82.9	-24.1	178	-74.9	-172	-31.7	0	0	113.8	L556 P557 K558 I619 I620 L1625	L556-Q623 HydrophobicContact CD1-CG 4.36Å; P557-Q623 PolarHBondContact O-NE2 2.73Å; K558-Q623 PolarHBondContact O-NE2 3.32Å; I619-Q623 HydrophobicContact CG2-CG 4.36Å; I619-Q623 WeakPolarHBondContact O-CB 3.18Å; I619-Q623 WeakPolarHBondContact O-CG 3.25Å; I619-Q623 PolarHBondContact O-N 3Å; I620-Q623 PolarHBondContact O-N 2.74Å; Q623-L1625 HydrophobicContact CB-CD1 4Å; Q623-L1625 VanDerWaalsContact OE1-CD1 3.3Å
624	T	81.4	Confident	81.5	Confident	15 Å²	15	33.4 Å²	33.4	9%	0.092	19%	0.186	C	C	.	.	H	α-helix	trans	-112.5	-16.3	-174.3	64.5	0	0	0	0	114.5	I620 S626 L1625 H1628 I1629	I620-T624 HydrophobicContact CG2-CG2 4.4Å; I620-T624 WeakPolarHBondContact O-CB 3.44Å; I620-T624 WeakPolarHBondContact O-CG2 3.34Å; I620-T624 PolarHBondContact O-N 2.95Å; I620-T624 PolarHBondContact O-OG1 2.89Å; T624-S626 PolarHBondContact O-N 2.87Å; T624-S626 VanDerWaalsContact O-N 3.09Å; T624-S626 PolarHBondContact OG1-N 2.85Å; T624-L1625 HydrophobicContact CG2-CD1 3.8Å; T624-H1628 HydrophobicContact CG2-CB 3.83Å; T624-I1629 HydrophobicContact CG2-CG1 4.09Å
625	N	79.6	Confident	81.3	Confident	143 Å²	143	32.7 Å²	32.7	77%	0.765	18%	0.182	S	C	*	.			trans	52.3	19.2	-167.2	-73.4	-10.5	0	0	0	114.2	S621	S621-N625 WeakPolarHBondContact O-CA 3.43Å; S621-N625 PolarHBondContact O-N 3.48Å
626	S	73.4	Confident	80.8	Confident	36 Å²	36	33 Å²	33	25%	0.252	18%	0.184	S	C	.	.			trans	-86.7	125.7	177.3	179.5	0	0	0	0	111.4	T624 L628 H1628	T624-S626 PolarHBondContact O-N 2.87Å; T624-S626 VanDerWaalsContact O-N 3.09Å; T624-S626 PolarHBondContact OG1-N 2.85Å; S626-L628 VanDerWaalsContact C-N 3.31Å; S626-L628 PolarHBondContact OG-N 3.23Å; S626-H1628 PolarHBondContact OG-CD2 2.7Å; S626-H1628 VanDerWaalsContact OG-CD2 3.25Å
627	T	66.6	Low	80.2	Confident	130 Å²	130	33.7 Å²	33.7	80%	0.798	19%	0.187	S	C	*	.			trans	-87.2	5.1	175.7	54.2	0	0	0	0	113.6	K629	T627-K629 PolarHBondContact O-N 3.47Å
628	L	69.2	Low	79.7	Confident	64 Å²	64	33.4 Å²	33.4	34%	0.335	18%	0.183	S	C	.	.			trans	-65.9	104.4	-175.5	-168.1	72.6	0	0	0	111.6	S626 V630 F1365 R1624 H1628	S626-L628 VanDerWaalsContact C-N 3.31Å; S626-L628 PolarHBondContact OG-N 3.23Å; L628-V630 HydrophobicContact CD2-CG2 4.4Å; L628-V630 HydrophobicContact CG-CG2 4.36Å; L628-F1365 HydrophobicContact CD2-CD2 3.94Å; L628-F1365 HydrophobicContact CD2-CE2 3.87Å; L628-R1624 PolarHBondContact O-NH2 3.21Å; L628-H1628 WeakPolarHBondContact CD2-NE2 3.38Å
629	K	68.9	Low	78.8	Confident	114 Å²	114	33.8 Å²	33.8	50%	0.496	19%	0.186	S	C	.	.			trans	-78.4	119.8	175.5	-64	-170.8	179	-170	0	110.2	T627 E1594	T627-K629 PolarHBondContact O-N 3.47Å; K629-E1594 IonicContact NZ-OE1 3.82Å; K629-E1594 PolarHBondContact NZ-OE1 3.11Å
630	V	78.5	Confident	77.8	Confident	5 Å²	5	34.1 Å²	34.1	3%	0.03	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	128	175.2	178.7	0	0	0	0	107.9	S18 L628 F1365 Y1369 H1599 V1601	S18-V630 WeakPolarHBondContact CB-O 3.25Å; L628-V630 HydrophobicContact CD2-CG2 4.4Å; L628-V630 HydrophobicContact CG-CG2 4.36Å; V630-F1365 HydrophobicContact CG1-CZ 4.06Å; V630-F1365 HydrophobicContact CG2-CE2 3.57Å; V630-F1365 HydrophobicContact CG2-CZ 3.72Å; V630-Y1369 WeakPolarHBondContact CG2-OH 3.41Å; V630-H1599 WeakPolarHBondContact CA-O 3.44Å; V630-V1601 HydrophobicContact CG1-CG2 3.81Å
631	G	78.8	Confident	76.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	138	177.6	0	0	0	0	0	112.3	S18 H1599 N1600 V1601	S18-G631 WeakPolarHBondContact O-CA 3.4Å; G631-H1599 PolarHBondContact N-O 3.13Å; G631-N1600 CarbonylContact O-C 3.47Å; G631-N1600 VanDerWaalsContact O-CA 3.26Å; G631-N1600 WeakPolarHBondContact O-CA 3.24Å; G631-V1601 PolarHBondContact O-N 3.23Å
632	V	84.2	Confident	75.4	Confident	6 Å²	6	34.8 Å²	34.8	4%	0.036	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.4	174.9	-173.6	0	0	0	0	110.4	M16 S18 V1601 V1603 M1617 L1620	M16-V632 HydrophobicContact CB-CB 4.18Å; M16-V632 WeakPolarHBondContact CB-O 3.22Å; M16-V632 HydrophobicContact CG-CB 4.28Å; M16-V632 HydrophobicContact CG-CG1 4.23Å; M16-V632 PolarHBondContact N-O 2.63Å; S18-V632 WeakPolarHBondContact OG-CB 3.42Å; S18-V632 WeakPolarHBondContact OG-CG2 3.14Å; S18-V632 PolarHBondContact OG-N 2.88Å; V632-V1601 WeakPolarHBondContact CA-O 3.25Å; V632-V1603 HydrophobicContact CG1-CG2 4.05Å; V632-M1617 HydrophobicContact CB-CE 4.45Å; V632-M1617 HydrophobicContact CG1-CE 3.88Å; V632-M1617 HydrophobicContact CG1-SD 3.7Å; V632-L1620 HydrophobicContact CG1-CD2 3.91Å; V632-L1620 HydrophobicContact CG2-CD2 3.9Å
633	F	83.7	Confident	73.9	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.7	172.5	-69.8	-92.6	0	0	0	109.7	K14 T23 L46 F1480 N1600 V1601 K1602 V1603	K14-F633 CarbonylContact O-C 3.49Å; K14-F633 WeakPolarHBondContact O-CA 3.31Å; T23-F633 HydrophobicContact CG2-CE1 4.18Å; T23-F633 HydrophobicContact CG2-CZ 4.06Å; L46-F633 HydrophobicContact CD2-CD1 3.92Å; L46-F633 HydrophobicContact CD2-CD2 4Å; L46-F633 HydrophobicContact CD2-CE1 3.68Å; L46-F633 HydrophobicContact CD2-CE2 3.77Å; L46-F633 HydrophobicContact CD2-CG 4.08Å; L46-F633 HydrophobicContact CD2-CZ 3.6Å; F633-F1480 HydrophobicContact CD2-CZ 4.11Å; F633-F1480 HydrophobicContact CE2-CZ 4.4Å; F633-N1600 HydrophobicContact CD2-CB 4.29Å; F633-N1600 HydrophobicContact CE2-CB 4.23Å; F633-V1601 PolarHBondContact N-O 2.92Å; F633-K1602 CarbonylContact O-C 3.43Å; F633-K1602 WeakPolarHBondContact O-CA 3.37Å; F633-V1603 PolarHBondContact O-N 2.68Å
634	A	83.8	Confident	72.2	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.017	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.2	172	0	0	0	0	0	110.3	K14 M16 I604 Y1605 L1613	K14-A634 PolarHBondContact N-O 3.14Å; K14-A634 PolarHBondContact O-N 3.09Å; M16-A634 HydrophobicContact CE-CB 3.45Å; M16-A634 VanDerWaalsContact CE-CB 3.45Å; I604-A634 HydrophobicContact CD1-CB 4.26Å; A634-Y1605 HydrophobicContact CB-CD1 4.38Å; A634-Y1605 HydrophobicContact CB-CE1 3.97Å; A634-L1613 HydrophobicContact CB-CD1 3.72Å; A634-L1613 HydrophobicContact CB-CD2 4.34Å
635	Q	82.3	Confident	70.7	Confident	10 Å²	10	45.1 Å²	45.1	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.1	-178.5	176.6	59.4	54.6	0	0	109.8	Y11 P13 K1602 V1603 W1604 Y1605	Y11-Q635 PolarHBondContact O-NE2 3.16Å; Y11-Q635 PolarHBondContact O-OE1 3.15Å; P13-Q635 VanDerWaalsContact CB-OE1 3.31Å; Q635-K1602 HydrophobicContact CB-CD 3.97Å; Q635-K1602 HydrophobicContact CB-CG 3.63Å; Q635-K1602 HydrophobicContact CG-CD 4.15Å; Q635-K1602 HydrophobicContact CG-CG 4.35Å; Q635-V1603 PolarHBondContact N-O 3.49Å; Q635-W1604 HydrophobicContact CB-CD2 4.09Å; Q635-W1604 HydrophobicContact CB-CE3 4.28Å; Q635-W1604 HydrophobicContact CB-CG 4.31Å; Q635-W1604 HydrophobicContact CG-CD2 3.51Å; Q635-W1604 HydrophobicContact CG-CE3 3.32Å; Q635-W1604 HydrophobicContact CG-CG 4.23Å; Q635-W1604 HydrophobicContact CG-CH2 3.8Å; Q635-W1604 HydrophobicContact CG-CZ2 3.97Å; Q635-W1604 HydrophobicContact CG-CZ3 3.46Å; Q635-W1604 VanDerWaalsContact CG-CZ3 3.46Å; Q635-W1604 CarbonylContact O-C 3.28Å; Q635-W1604 WeakPolarHBondContact O-CA 3.33Å; Q635-Y1605 WeakPolarHBondContact O-CD1 3.42Å; Q635-Y1605 PolarHBondContact O-N 2.89Å
636	Q	78.1	Confident	69.4	Low	9 Å²	9	44.9 Å²	44.9	4%	0.042	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	141.9	173.3	-72	-179.3	70.4	0	0	110.5	Y11 N34 Y1605	Y11-Q636 HydrophobicContact CD2-CB 3.72Å; Y11-Q636 HydrophobicContact CG-CB 4.02Å; N34-Q636 PolarHBondContact ND2-NE2 3.16Å; N34-Q636 PolarHBondContact OD1-NE2 3.02Å; Q636-Y1605 HydrophobicContact CG-CE1 3.78Å; Q636-Y1605 HydrophobicContact CG-CE2 4.1Å; Q636-Y1605 VanDerWaalsContact CG-CZ 3.43Å; Q636-Y1605 WeakPolarHBondContact CG-OH 3.31Å
637	F	77.1	Confident	68.6	Low	13 Å²	13	45.5 Å²	45.5	6%	0.057	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-55.6	137	168.3	-90.2	34.7	0	0	0	110.3	Y11 I1459 P1474 W1604 Y1605 N1606	Y11-F637 WeakPolarHBondContact CD2-O 3.28Å; Y11-F637 WeakPolarHBondContact CE2-O 3.38Å; F637-I1459 HydrophobicContact CD1-CD1 4.08Å; F637-I1459 HydrophobicContact CD2-CD1 4.32Å; F637-I1459 HydrophobicContact CD2-CG2 3.46Å; F637-I1459 VanDerWaalsContact CD2-CG2 3.46Å; F637-I1459 HydrophobicContact CE1-CD1 3.87Å; F637-I1459 HydrophobicContact CE2-CD1 4.11Å; F637-I1459 HydrophobicContact CE2-CG1 4.17Å; F637-I1459 HydrophobicContact CE2-CG2 3.71Å; F637-I1459 HydrophobicContact CG-CD1 4.28Å; F637-I1459 HydrophobicContact CG-CG2 4.09Å; F637-I1459 HydrophobicContact CZ-CD1 3.84Å; F637-I1459 HydrophobicContact CZ-CG1 4.22Å; F637-P1474 WeakPolarHBondContact CZ-O 3.38Å; F637-W1604 HydrophobicContact CD1-CB 4.07Å; F637-W1604 HydrophobicContact CE1-CB 3.66Å; F637-Y1605 VanDerWaalsContact CD1-C 3.42Å; F637-Y1605 WeakPolarHBondContact CD1-O 3.48Å; F637-Y1605 PolarHBondContact N-O 3.49Å; F637-N1606 HydrophobicContact CB-CB 4.35Å; F637-N1606 HydrophobicContact CD2-CB 4.05Å; F637-N1606 HydrophobicContact CG-CB 4.09Å
638	P	74.7	Confident	68.1	Low	4 Å²	4	43.7 Å²	43.7	3%	0.026	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-71.7	141.2	178.6	35	-38.3	0	0	0	109.7	G9 T10 T1456 I1459 M1460	G9-P638 CarbonylContact O-C 3.49Å; G9-P638 WeakPolarHBondContact O-CA 3.43Å; T10-P638 HydrophobicContact CG2-CB 4.1Å; P638-T1456 HydrophobicContact CB-CG2 4.2Å; P638-T1456 HydrophobicContact CG-CG2 4Å; P638-I1459 HydrophobicContact CG-CB 4.44Å; P638-I1459 HydrophobicContact CG-CG2 4.23Å; P638-M1460 HydrophobicContact CB-CE 3.72Å; P638-M1460 HydrophobicContact CB-CG 4.42Å; P638-M1460 HydrophobicContact CB-SD 4.26Å; P638-M1460 HydrophobicContact CG-CE 4.23Å; P638-M1460 HydrophobicContact CG-CG 3.91Å; P638-M1460 HydrophobicContact CG-SD 4.27Å
639	S	67.4	Low	67.5	Low	12 Å²	12	41.2 Å²	41.2	8%	0.084	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-99.6	136.5	-175.1	60.7	0	0	0	0	112.8	G9 Y11 M1460	G9-S639 PolarHBondContact N-O 3.18Å; G9-S639 PolarHBondContact O-N 2.91Å; Y11-S639 PolarHBondContact OH-OG 2.77Å; S639-M1460 WeakPolarHBondContact O-CE 3.32Å
640	N	66.2	Low	67	Low	6 Å²	6	39.3 Å²	39.3	3%	0.032	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-70.8	151.1	173.1	-69.7	-32.3	0	0	0	111	Y642 F1426 E1463	N640-Y642 PolarHBondContact O-N 2.9Å; N640-F1426 HydrophobicContact CB-CD2 4.4Å; N640-F1426 HydrophobicContact CB-CG 4.3Å; N640-F1426 WeakPolarHBondContact OD1-CZ 3.16Å; N640-E1463 PolarHBondContact ND2-OE2 3.25Å
641	C	63.6	Low	66.7	Low	17 Å²	17	41.3 Å²	41.3	12%	0.115	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-56.2	126.4	173.7	-65.8	0	0	0	0	110.8	C1420	C641-C1420 HydrophobicContact CB-CB 3.88Å; C641-C1420 WeakPolarHBondContact CB-SG 3.49Å; C641-C1420 WeakPolarHBondContact SG-CB 2.99Å; C641-C1420 CovalentContact SG-SG 2.03Å; C641-C1420 PolarHBondContact SG-SG 2.81Å
642	Y	56	Low	66.7	Low	52 Å²	52	42.4 Å²	42.4	20%	0.204	22%	0.219	C	C	.	.			trans	-132.4	142.7	-175.9	68.3	-78.5	0	0	0	110	Q592 P593 N640 I644 M1424	Q592-Y642 HydrophobicContact CB-CE2 4.29Å; Q592-Y642 HydrophobicContact CG-CE2 3.96Å; P593-Y642 HydrophobicContact CG-CD1 4.13Å; P593-Y642 HydrophobicContact CG-CE1 3.45Å; P593-Y642 VanDerWaalsContact CG-CE1 3.45Å; N640-Y642 PolarHBondContact O-N 2.9Å; Y642-I644 HydrophobicContact CD2-CG1 3.97Å; Y642-I644 HydrophobicContact CE2-CD1 3.98Å; Y642-I644 HydrophobicContact CE2-CG1 3.69Å; Y642-M1424 WeakPolarHBondContact O-CE 3.5Å
643	R	52.6	Low	66.7	Low	125 Å²	125	42.1 Å²	42.1	47%	0.472	22%	0.217	S	C	.	.			trans	-105.5	131.8	172.4	-175	173.6	161.5	165.1	-9.9	108.4	D645 M1424	R643-D645 VanDerWaalsContact CD-OD2 3.23Å; R643-D645 WeakPolarHBondContact CD-OD2 3.01Å; R643-D645 WeakPolarHBondContact CG-OD2 3.42Å; R643-D645 IonicContact CZ-OD1 2.72Å; R643-D645 IonicContact CZ-OD2 3.96Å; R643-D645 VanDerWaalsContact NE-CG 3.34Å; R643-D645 IonicContact NE-OD1 3.88Å; R643-D645 PolarHBondContact NE-OD1 3.38Å; R643-D645 IonicContact NE-OD2 3.99Å; R643-D645 PolarHBondContact NE-OD2 3.18Å; R643-D645 VanDerWaalsContact NE-OD2 3.08Å; R643-D645 IonicContact NH2-OD1 2.74Å; R643-D645 PolarHBondContact NH2-OD1 2.71Å; R643-D645 PolarHBondContact O-N 2.78Å; R643-M1424 HydrophobicContact CB-CE 4.38Å
644	I	49.8	Very low	66.6	Low	98 Å²	98	43.7 Å²	43.7	50%	0.503	23%	0.227	S	C	.	.			trans	-88.4	80.2	176.4	-51.3	175	0	0	0	107.7	Y642	Y642-I644 HydrophobicContact CD2-CG1 3.97Å; Y642-I644 HydrophobicContact CE2-CD1 3.98Å; Y642-I644 HydrophobicContact CE2-CG1 3.69Å
645	D	50.5	Low	66.6	Low	95 Å²	95	50.3 Å²	50.3	51%	0.508	26%	0.256	S	S	.	.			trans	-87.8	129.4	165.7	-64.1	-51.1	0	0	0	108.4	R643	R643-D645 VanDerWaalsContact CD-OD2 3.23Å; R643-D645 WeakPolarHBondContact CD-OD2 3.01Å; R643-D645 WeakPolarHBondContact CG-OD2 3.42Å; R643-D645 IonicContact CZ-OD1 2.72Å; R643-D645 IonicContact CZ-OD2 3.96Å; R643-D645 VanDerWaalsContact NE-CG 3.34Å; R643-D645 IonicContact NE-OD1 3.88Å; R643-D645 PolarHBondContact NE-OD1 3.38Å; R643-D645 IonicContact NE-OD2 3.99Å; R643-D645 PolarHBondContact NE-OD2 3.18Å; R643-D645 VanDerWaalsContact NE-OD2 3.08Å; R643-D645 IonicContact NH2-OD1 2.74Å; R643-D645 PolarHBondContact NH2-OD1 2.71Å; R643-D645 PolarHBondContact O-N 2.78Å
646	L	52	Low	66.7	Low	138 Å²	138	50.4 Å²	50.4	72%	0.723	26%	0.257	S	S	*	.			trans	-57.8	141.5	171.6	-107.3	76.2	0	0	0	108.7	I648	L646-I648 WeakPolarHBondContact O-CG1 3.33Å; L646-I648 PolarHBondContact O-N 2.81Å
647	S	56.6	Low	67.1	Low	50 Å²	50	50 Å²	50	35%	0.35	26%	0.255	S	S	.	.			trans	-74.6	59.2	-173.7	-162.5	0	0	0	0	112.9	G649 K650	S647-G649 PolarHBondContact O-N 3.38Å; S647-K650 PolarHBondContact O-N 2.68Å
648	I	56	Low	67.4	Low	92 Å²	92	53.6 Å²	53.6	47%	0.472	28%	0.275	S	S	.	.	H	α-helix	trans	-54.2	-35.9	178.5	-67.2	161.2	0	0	0	110.6	L646 K650 S651 I652 I721	L646-I648 WeakPolarHBondContact O-CG1 3.33Å; L646-I648 PolarHBondContact O-N 2.81Å; I648-K650 PolarHBondContact O-N 2.86Å; I648-K650 VanDerWaalsContact O-N 3.12Å; I648-S651 PolarHBondContact O-N 3.47Å; I648-I652 HydrophobicContact CG2-CD1 4.44Å; I648-I652 HydrophobicContact CG2-CG1 4.28Å; I648-I652 PolarHBondContact O-N 2.95Å; I648-I721 HydrophobicContact CG2-CG2 3.94Å
649	G	56.4	Low	68	Low	11 Å²	11	56.4 Å²	56.4	11%	0.113	29%	0.294	C	S	.	.	H	α-helix	trans	-56.7	-26.7	-178.8	0	0	0	0	0	115.3	S647	S647-G649 PolarHBondContact O-N 3.38Å
650	K	59.2	Low	69.1	Low	74 Å²	74	56 Å²	56	32%	0.322	29%	0.291	S	S	.	.	H	α-helix	trans	-77	-27.8	174.1	-68.2	178	-177.3	169.4	0	113.1	S647 I648	S647-K650 PolarHBondContact O-N 2.68Å; I648-K650 PolarHBondContact O-N 2.86Å; I648-K650 VanDerWaalsContact O-N 3.12Å
651	S	72	Confident	70.1	Confident	47 Å²	47	58.8 Å²	58.8	33%	0.329	31%	0.305	S	S	.	.	H	α-helix	trans	-90.1	-21.4	-174	-48.3	0	0	0	0	114	I648 T654 F655	I648-S651 PolarHBondContact O-N 3.47Å; S651-T654 WeakPolarHBondContact O-CB 3.33Å; S651-T654 PolarHBondContact O-N 3.34Å; S651-F655 WeakPolarHBondContact O-CD2 3.21Å; S651-F655 PolarHBondContact O-N 3.05Å
652	I	78.2	Confident	71.2	Confident	23 Å²	23	63.9 Å²	63.9	12%	0.118	33%	0.325	C	S	.	.	H	α-helix	trans	-48.9	-53.4	177.6	-67.4	172.8	0	0	0	113.1	I648 T654 F655 V656 L722 F730	I648-I652 HydrophobicContact CG2-CD1 4.44Å; I648-I652 HydrophobicContact CG2-CG1 4.28Å; I648-I652 PolarHBondContact O-N 2.95Å; I652-T654 VanDerWaalsContact C-N 3.33Å; I652-T654 PolarHBondContact O-N 3.34Å; I652-F655 PolarHBondContact O-N 2.72Å; I652-V656 HydrophobicContact CG2-CG2 4.47Å; I652-V656 WeakPolarHBondContact O-CG2 3.48Å; I652-V656 PolarHBondContact O-N 3.27Å; I652-L722 HydrophobicContact CD1-CD2 4.21Å; I652-F730 HydrophobicContact CG2-CE2 4.38Å; I652-F730 HydrophobicContact CG2-CZ 4.35Å
653	P	83.7	Confident	72.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.3	-39.4	-176.6	23.6	-31.9	0	0	0	111.8	F655 V656 V657 F770 Y773 F799 C803	P653-F655 PolarHBondContact O-N 2.8Å; P653-V656 PolarHBondContact O-N 2.84Å; P653-V657 WeakPolarHBondContact O-CB 3.19Å; P653-V657 VanDerWaalsContact O-CG2 3.27Å; P653-V657 WeakPolarHBondContact O-CG2 3.37Å; P653-V657 PolarHBondContact O-N 3.45Å; P653-F770 HydrophobicContact CB-CE2 4.21Å; P653-F770 HydrophobicContact CB-CZ 4.41Å; P653-Y773 HydrophobicContact CB-CE1 4.49Å; P653-Y773 HydrophobicContact CG-CE1 4.09Å; P653-F799 HydrophobicContact CB-CD1 4.39Å; P653-F799 HydrophobicContact CB-CE1 4.04Å; P653-C803 HydrophobicContact CB-CB 3.98Å; P653-C803 HydrophobicContact CG-CB 3.93Å
654	T	81.4	Confident	74.6	Confident	40 Å²	40	56.4 Å²	56.4	25%	0.245	30%	0.3	C	S	.	.	H	α-helix	trans	-59.7	-45.5	177.1	-33.3	0	0	0	0	111.4	S651 I652 L658 F770 E774	S651-T654 WeakPolarHBondContact O-CB 3.33Å; S651-T654 PolarHBondContact O-N 3.34Å; I652-T654 VanDerWaalsContact C-N 3.33Å; I652-T654 PolarHBondContact O-N 3.34Å; T654-L658 HydrophobicContact CG2-CD1 4.4Å; T654-L658 WeakPolarHBondContact O-CB 3.43Å; T654-L658 PolarHBondContact O-N 2.84Å; T654-F770 HydrophobicContact CG2-CE1 4.1Å; T654-E774 PolarHBondContact OG1-OE1 2.97Å
655	F	84	Confident	76.5	Confident	141 Å²	141	52.3 Å²	52.3	62%	0.618	28%	0.28	S	S	*	.	H	α-helix	trans	-67.9	-42.3	178.5	-68.2	-47.9	0	0	0	113.2	S651 I652 P653 L658 S659	S651-F655 WeakPolarHBondContact O-CD2 3.21Å; S651-F655 PolarHBondContact O-N 3.05Å; I652-F655 PolarHBondContact O-N 2.72Å; P653-F655 PolarHBondContact O-N 2.8Å; F655-L658 PolarHBondContact O-N 3.26Å; F655-S659 WeakPolarHBondContact O-CB 3.28Å; F655-S659 PolarHBondContact O-N 3.39Å
656	V	85.4	Confident	78.3	Confident	11 Å²	11	50.5 Å²	50.5	7%	0.067	27%	0.269	C	S	.	.	H	α-helix	trans	-63.2	-45.6	177.2	173.6	0	0	0	0	110.5	I652 P653 L658 S659 W660 L734 F799	I652-V656 HydrophobicContact CG2-CG2 4.47Å; I652-V656 WeakPolarHBondContact O-CG2 3.48Å; I652-V656 PolarHBondContact O-N 3.27Å; P653-V656 PolarHBondContact O-N 2.84Å; V656-L658 PolarHBondContact O-N 3.4Å; V656-S659 PolarHBondContact O-N 2.83Å; V656-S659 PolarHBondContact O-OG 3.36Å; V656-W660 PolarHBondContact O-N 3.05Å; V656-L734 HydrophobicContact CG1-CD2 3.8Å; V656-L734 HydrophobicContact CG2-CD2 4.47Å; V656-F799 HydrophobicContact CB-CE1 3.94Å; V656-F799 HydrophobicContact CB-CZ 3.84Å; V656-F799 HydrophobicContact CG1-CE1 3.91Å; V656-F799 HydrophobicContact CG1-CZ 3.66Å; V656-F799 HydrophobicContact CG2-CZ 4.18Å
657	V	86.2	Confident	80.1	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-48.2	175.9	169.6	0	0	0	0	110.9	P653 S659 W660 M661 Y766 F770 F799	P653-V657 WeakPolarHBondContact O-CB 3.19Å; P653-V657 VanDerWaalsContact O-CG2 3.27Å; P653-V657 WeakPolarHBondContact O-CG2 3.37Å; P653-V657 PolarHBondContact O-N 3.45Å; V657-S659 VanDerWaalsContact C-N 3.32Å; V657-S659 PolarHBondContact O-N 3.49Å; V657-W660 PolarHBondContact O-N 3.19Å; V657-M661 PolarHBondContact O-N 2.93Å; V657-Y766 HydrophobicContact CG1-CD1 4.44Å; V657-Y766 HydrophobicContact CG1-CE1 3.76Å; V657-Y766 WeakPolarHBondContact O-CE1 3.21Å; V657-F770 HydrophobicContact CB-CD2 4.42Å; V657-F770 HydrophobicContact CB-CG 4.48Å; V657-F770 HydrophobicContact CG1-CB 3.99Å; V657-F770 HydrophobicContact CG1-CD1 4.48Å; V657-F770 HydrophobicContact CG1-CD2 4.37Å; V657-F770 HydrophobicContact CG1-CG 4.03Å; V657-F770 HydrophobicContact CG2-CD2 3.75Å; V657-F770 HydrophobicContact CG2-CE2 4.06Å; V657-F770 HydrophobicContact CG2-CG 4.25Å; V657-F799 HydrophobicContact CG2-CD1 4.45Å; V657-F799 HydrophobicContact CG2-CE1 4.45Å
658	L	84.2	Confident	81.7	Confident	89 Å²	89	42 Å²	42	47%	0.466	22%	0.221	S	C	.	.	H	α-helix	trans	-57.5	-42	175.8	-106.1	137.6	0	0	0	112.8	T654 F655 V656 W660 M661	T654-L658 HydrophobicContact CG2-CD1 4.4Å; T654-L658 WeakPolarHBondContact O-CB 3.43Å; T654-L658 PolarHBondContact O-N 2.84Å; F655-L658 PolarHBondContact O-N 3.26Å; V656-L658 PolarHBondContact O-N 3.4Å; L658-W660 VanDerWaalsContact C-N 3.35Å; L658-W660 PolarHBondContact O-N 3.49Å; L658-M661 WeakPolarHBondContact O-CB 3.37Å; L658-M661 PolarHBondContact O-N 3.06Å
659	S	86.9	Confident	83.3	Confident	62 Å²	62	40.6 Å²	40.6	43%	0.434	21%	0.211	S	C	.	.	H	α-helix	trans	-63.4	-37.8	-179	78.2	0	0	0	0	113.2	F655 V656 V657	F655-S659 WeakPolarHBondContact O-CB 3.28Å; F655-S659 PolarHBondContact O-N 3.39Å; V656-S659 PolarHBondContact O-N 2.83Å; V656-S659 PolarHBondContact O-OG 3.36Å; V657-S659 VanDerWaalsContact C-N 3.32Å; V657-S659 PolarHBondContact O-N 3.49Å
660	W	90.9	Very high	84.8	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.015	22%	0.22	C	C	.	.	H	α-helix	trans	-88.2	-7.7	-175.8	-72.3	8.8	0	0	0	114.1	V656 V657 L658 F662 S663 V664 L705 S708 V709 L734 Y737 I741	V656-W660 PolarHBondContact O-N 3.05Å; V657-W660 PolarHBondContact O-N 3.19Å; L658-W660 VanDerWaalsContact C-N 3.35Å; L658-W660 PolarHBondContact O-N 3.49Å; W660-F662 PolarHBondContact O-N 3.33Å; W660-S663 PolarHBondContact O-N 2.89Å; W660-S663 VanDerWaalsContact O-N 3.09Å; W660-V664 WeakPolarHBondContact O-CG2 3.49Å; W660-V664 PolarHBondContact O-N 2.81Å; W660-L705 HydrophobicContact CD2-CD2 4.03Å; W660-L705 HydrophobicContact CE3-CD2 4.29Å; W660-L705 HydrophobicContact CG-CD2 4.31Å; W660-L705 HydrophobicContact CZ3-CD1 4.37Å; W660-S708 PolarHBondContact NE1-OG 3.46Å; W660-S708 VanDerWaalsContact NE1-OG 3.12Å; W660-V709 HydrophobicContact CH2-CG2 4.06Å; W660-V709 HydrophobicContact CZ2-CG2 3.72Å; W660-L734 HydrophobicContact CH2-CB 4.28Å; W660-L734 HydrophobicContact CH2-CD2 4.47Å; W660-L734 WeakPolarHBondContact CH2-O 3.46Å; W660-Y737 HydrophobicContact CE3-CD1 4.12Å; W660-Y737 HydrophobicContact CE3-CE1 4.1Å; W660-Y737 HydrophobicContact CH2-CD1 4.42Å; W660-Y737 AromaticContact CZ3-CD1 3.62Å; W660-Y737 HydrophobicContact CZ3-CD1 3.62Å; W660-Y737 HydrophobicContact CZ3-CE1 4.08Å; W660-Y737 HydrophobicContact CZ3-CG 4.44Å; W660-I741 HydrophobicContact CE3-CD1 3.51Å; W660-I741 HydrophobicContact CZ3-CD1 3.66Å
661	M	87.5	Confident	86.2	Confident	65 Å²	65	39.4 Å²	39.4	32%	0.32	21%	0.206	S	C	.	.	H	α-helix	trans	-53	-38	175.8	-173	-178.9	67.1	0	0	112.6	V657 L658 A665 A763 Y766	V657-M661 PolarHBondContact O-N 2.93Å; L658-M661 WeakPolarHBondContact O-CB 3.37Å; L658-M661 PolarHBondContact O-N 3.06Å; M661-A665 WeakPolarHBondContact O-CB 3.4Å; M661-A665 PolarHBondContact O-N 2.98Å; M661-A763 HydrophobicContact CG-CB 3.59Å; M661-A763 HydrophobicContact SD-CB 3.98Å; M661-Y766 HydrophobicContact CB-CD1 4.32Å; M661-Y766 HydrophobicContact CG-CD1 4.5Å
662	F	86.4	Confident	87	Confident	123 Å²	123	37.1 Å²	37.1	54%	0.539	19%	0.19	S	C	.	.	H	α-helix	trans	-70.1	-43.7	176.7	179.7	-99.6	0	0	0	112.8	W660 A665 M666	W660-F662 PolarHBondContact O-N 3.33Å; F662-A665 PolarHBondContact O-N 3.49Å; F662-M666 HydrophobicContact CD1-CG 4.47Å; F662-M666 HydrophobicContact CE1-CG 4.01Å; F662-M666 HydrophobicContact CE2-CE 4.2Å; F662-M666 HydrophobicContact CE2-CG 4.15Å; F662-M666 HydrophobicContact CZ-CE 3.75Å; F662-M666 HydrophobicContact CZ-CG 3.84Å; F662-M666 PolarHBondContact O-N 3.44Å
663	S	89.7	Confident	87.4	Confident	17 Å²	17	38.2 Å²	38.2	12%	0.119	20%	0.198	C	C	.	.	H	α-helix	trans	-60.6	-47.1	177.5	-53	0	0	0	0	111.1	W660 A665 M666 I667	W660-S663 PolarHBondContact O-N 2.89Å; W660-S663 VanDerWaalsContact O-N 3.09Å; S663-A665 PolarHBondContact O-N 3.32Å; S663-M666 PolarHBondContact O-N 3.49Å; S663-I667 WeakPolarHBondContact O-CG1 3.2Å; S663-I667 PolarHBondContact O-N 3.15Å
664	V	90.5	Very high	87.4	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.024	20%	0.204	C	C	.	.	H	α-helix	trans	-56.4	-48.6	173.6	162.3	0	0	0	0	111.5	W660 M666 I667 M668 I741 T745 Y766	W660-V664 WeakPolarHBondContact O-CG2 3.49Å; W660-V664 PolarHBondContact O-N 2.81Å; V664-M666 VanDerWaalsContact C-N 3.32Å; V664-M666 PolarHBondContact O-N 3.28Å; V664-I667 PolarHBondContact O-N 3.21Å; V664-M668 WeakPolarHBondContact O-CB 3.45Å; V664-M668 PolarHBondContact O-N 3.05Å; V664-I741 HydrophobicContact CG2-CG2 3.61Å; V664-T745 HydrophobicContact CB-CG2 4.15Å; V664-T745 HydrophobicContact CG1-CG2 3.59Å; V664-T745 HydrophobicContact CG2-CG2 3.92Å; V664-Y766 HydrophobicContact CB-CG 4.46Å; V664-Y766 HydrophobicContact CG1-CD2 4.34Å; V664-Y766 HydrophobicContact CG1-CG 4.02Å; V664-Y766 HydrophobicContact CG2-CD1 4.39Å; V664-Y766 HydrophobicContact CG2-CD2 4.12Å; V664-Y766 HydrophobicContact CG2-CE1 4.37Å; V664-Y766 HydrophobicContact CG2-CE2 4.13Å; V664-Y766 HydrophobicContact CG2-CG 4.27Å
665	A	88.4	Confident	87.5	Confident	12 Å²	12	40.3 Å²	40.3	10%	0.099	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-39.7	178.9	0	0	0	0	0	112.6	M661 F662 S663 K669 A759 A763	M661-A665 WeakPolarHBondContact O-CB 3.4Å; M661-A665 PolarHBondContact O-N 2.98Å; F662-A665 PolarHBondContact O-N 3.49Å; S663-A665 PolarHBondContact O-N 3.32Å; A665-K669 WeakPolarHBondContact O-CB 3.43Å; A665-K669 PolarHBondContact O-N 3.15Å; A665-A759 WeakPolarHBondContact CB-O 3.23Å; A665-A763 HydrophobicContact CB-CB 4.22Å
666	M	88.5	Confident	87.3	Confident	56 Å²	56	38.4 Å²	38.4	28%	0.276	20%	0.197	S	C	.	.	H	α-helix	trans	-75.5	-40.2	-179.8	-74.6	-60.6	-134.5	0	0	113.3	F662 S663 V664 M668 K669 N670	F662-M666 HydrophobicContact CD1-CG 4.47Å; F662-M666 HydrophobicContact CE1-CG 4.01Å; F662-M666 HydrophobicContact CE2-CE 4.2Å; F662-M666 HydrophobicContact CE2-CG 4.15Å; F662-M666 HydrophobicContact CZ-CE 3.75Å; F662-M666 HydrophobicContact CZ-CG 3.84Å; F662-M666 PolarHBondContact O-N 3.44Å; S663-M666 PolarHBondContact O-N 3.49Å; V664-M666 VanDerWaalsContact C-N 3.32Å; V664-M666 PolarHBondContact O-N 3.28Å; M666-M668 VanDerWaalsContact C-N 3.35Å; M666-K669 PolarHBondContact O-N 3.21Å; M666-K669 HydrophobicContact SD-CD 3.96Å; M666-N670 WeakPolarHBondContact O-CB 3.48Å; M666-N670 PolarHBondContact O-N 3.31Å; M666-N670 PolarHBondContact O-ND2 2.97Å; M666-N670 PolarHBondContact O-OD1 3.21Å
667	I	90.5	Very high	87	Confident	10 Å²	10	42 Å²	42	5%	0.051	22%	0.216	C	C	.	.	H	α-helix	trans	-57.9	-50.5	172.1	-68	167.8	0	0	0	109.4	S663 V664 K669 N670 V671 I742 F746	S663-I667 WeakPolarHBondContact O-CG1 3.2Å; S663-I667 PolarHBondContact O-N 3.15Å; V664-I667 PolarHBondContact O-N 3.21Å; I667-K669 PolarHBondContact O-N 2.69Å; I667-N670 PolarHBondContact O-N 3.06Å; I667-V671 WeakPolarHBondContact O-CG2 3.18Å; I667-V671 PolarHBondContact O-N 2.89Å; I667-I742 HydrophobicContact CD1-CG1 4.46Å; I667-F746 HydrophobicContact CG2-CD1 4.41Å; I667-F746 HydrophobicContact CG2-CE1 3.83Å
668	M	90.7	Very high	86.6	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-67.2	-36.4	-179.1	-155.5	172.1	81.4	0	0	112.6	V664 M666 V672 L748 F752 A758	V664-M668 WeakPolarHBondContact O-CB 3.45Å; V664-M668 PolarHBondContact O-N 3.05Å; M666-M668 VanDerWaalsContact C-N 3.35Å; M668-V672 WeakPolarHBondContact O-CB 3.5Å; M668-V672 WeakPolarHBondContact O-CG2 3.45Å; M668-V672 PolarHBondContact O-N 2.8Å; M668-V672 VanDerWaalsContact O-N 3.11Å; M668-L748 HydrophobicContact SD-CB 3.61Å; M668-F752 HydrophobicContact CE-CD2 3.55Å; M668-F752 HydrophobicContact CE-CE2 3.4Å; M668-F752 VanDerWaalsContact CE-CE2 3.4Å; M668-F752 HydrophobicContact CE-CG 4.46Å; M668-F752 HydrophobicContact CE-CZ 4.21Å; M668-F752 HydrophobicContact SD-CD2 4.2Å; M668-F752 HydrophobicContact SD-CE2 4.2Å; M668-A758 HydrophobicContact CE-CB 3.81Å; M668-A758 WeakPolarHBondContact CE-O 3.34Å
669	K	88	Confident	86.6	Confident	61 Å²	61	42.7 Å²	42.7	27%	0.265	21%	0.212	S	C	.	.	H	α-helix	trans	-57.6	-50.4	172.5	-174.9	-174.8	177	-172.8	0	111.3	A665 M666 I667 V672 T673 A755 N756 A759	A665-K669 WeakPolarHBondContact O-CB 3.43Å; A665-K669 PolarHBondContact O-N 3.15Å; M666-K669 PolarHBondContact O-N 3.21Å; M666-K669 HydrophobicContact SD-CD 3.96Å; I667-K669 PolarHBondContact O-N 2.69Å; K669-V672 CarbonylContact O-C 3.52Å; K669-V672 PolarHBondContact O-N 3.01Å; K669-T673 PolarHBondContact O-N 2.9Å; K669-T673 PolarHBondContact O-OG1 3.22Å; K669-T673 VanDerWaalsContact O-OG1 3.06Å; K669-A755 HydrophobicContact CG-CB 4.18Å; K669-N756 WeakPolarHBondContact CE-OD1 3.4Å; K669-A759 HydrophobicContact CB-CB 3.89Å; K669-A759 HydrophobicContact CD-CB 4.19Å; K669-A759 HydrophobicContact CG-CB 4.11Å
670	N	88.8	Confident	86.3	Confident	55 Å²	55	40.5 Å²	40.5	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-64.7	-46.6	-172.5	-68.8	-13.5	0	0	0	111.6	M666 I667 V672 T673 E674 W697	M666-N670 WeakPolarHBondContact O-CB 3.48Å; M666-N670 PolarHBondContact O-N 3.31Å; M666-N670 PolarHBondContact O-ND2 2.97Å; M666-N670 PolarHBondContact O-OD1 3.21Å; I667-N670 PolarHBondContact O-N 3.06Å; N670-V672 VanDerWaalsContact C-N 3.31Å; N670-V672 PolarHBondContact O-N 3.29Å; N670-T673 VanDerWaalsContact C-OG1 3.31Å; N670-T673 VanDerWaalsContact CA-OG1 3.25Å; N670-T673 WeakPolarHBondContact CA-OG1 3.24Å; N670-T673 PolarHBondContact O-N 2.89Å; N670-T673 PolarHBondContact O-OG1 3.05Å; N670-E674 PolarHBondContact O-N 3.34Å; N670-W697 HydrophobicContact CB-CH2 3.53Å; N670-W697 HydrophobicContact CB-CZ2 4.22Å; N670-W697 HydrophobicContact CB-CZ3 3.85Å
671	V	89.1	Confident	85.8	Confident	5 Å²	5	42 Å²	42	3%	0.03	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-41.4	174.2	175.1	0	0	0	0	111.3	I667 K675 W694 W697 F746	I667-V671 WeakPolarHBondContact O-CG2 3.18Å; I667-V671 PolarHBondContact O-N 2.89Å; V671-K675 PolarHBondContact O-N 3.28Å; V671-W694 HydrophobicContact CG1-CH2 4.08Å; V671-W694 HydrophobicContact CG1-CZ3 3.92Å; V671-W697 HydrophobicContact CG2-CD2 3.89Å; V671-W697 HydrophobicContact CG2-CE3 4.39Å; V671-W697 HydrophobicContact CG2-CG 3.95Å; V671-F746 HydrophobicContact CG2-CE1 4.36Å
672	V	88.3	Confident	85.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-76.1	-27.3	179.3	-178.5	0	0	0	0	112.3	M668 K669 N670 K675 Q676 F752 Q754 A755 A758	M668-V672 WeakPolarHBondContact O-CB 3.5Å; M668-V672 WeakPolarHBondContact O-CG2 3.45Å; M668-V672 PolarHBondContact O-N 2.8Å; M668-V672 VanDerWaalsContact O-N 3.11Å; K669-V672 CarbonylContact O-C 3.52Å; K669-V672 PolarHBondContact O-N 3.01Å; N670-V672 VanDerWaalsContact C-N 3.31Å; N670-V672 PolarHBondContact O-N 3.29Å; V672-K675 PolarHBondContact O-N 3.4Å; V672-Q676 VanDerWaalsContact O-CB 3.27Å; V672-Q676 WeakPolarHBondContact O-CB 3.36Å; V672-Q676 PolarHBondContact O-N 3.08Å; V672-F752 HydrophobicContact CG1-CB 4.13Å; V672-F752 HydrophobicContact CG2-CB 4.01Å; V672-Q754 VanDerWaalsContact CG1-C 3.48Å; V672-A755 HydrophobicContact CB-CB 4.31Å; V672-A755 HydrophobicContact CG1-CB 4.25Å; V672-A758 HydrophobicContact CB-CB 3.98Å; V672-A758 HydrophobicContact CG1-CB 4.05Å; V672-A758 HydrophobicContact CG2-CB 3.81Å
673	T	85.5	Confident	85.6	Confident	46 Å²	46	33.2 Å²	33.2	28%	0.282	16%	0.162	S	C	.	.	H	α-helix	trans	-63.1	-44.4	170.5	26.6	0	0	0	0	111.6	K669 N670 K675 Q676 L677 A755	K669-T673 PolarHBondContact O-N 2.9Å; K669-T673 PolarHBondContact O-OG1 3.22Å; K669-T673 VanDerWaalsContact O-OG1 3.06Å; N670-T673 VanDerWaalsContact C-OG1 3.31Å; N670-T673 VanDerWaalsContact CA-OG1 3.25Å; N670-T673 WeakPolarHBondContact CA-OG1 3.24Å; N670-T673 PolarHBondContact O-N 2.89Å; N670-T673 PolarHBondContact O-OG1 3.05Å; T673-K675 VanDerWaalsContact C-N 3.29Å; T673-K675 PolarHBondContact O-N 3.33Å; T673-Q676 PolarHBondContact O-N 2.84Å; T673-L677 WeakPolarHBondContact O-CB 3.33Å; T673-L677 WeakPolarHBondContact O-CG 3.44Å; T673-L677 PolarHBondContact O-N 2.76Å; T673-A755 HydrophobicContact CG2-CB 3.33Å
674	E	85.4	Confident	85.1	Confident	27 Å²	27	33.3 Å²	33.3	13%	0.126	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-37.8	177.6	-68.5	-168.6	132.6	0	0	112.1	N670 R678 L679 H693 W697	N670-E674 PolarHBondContact O-N 3.34Å; E674-R678 CarbonylContact O-C 3.57Å; E674-R678 PolarHBondContact O-N 3.04Å; E674-L679 HydrophobicContact CB-CB 4.29Å; E674-L679 PolarHBondContact O-N 3.35Å; E674-H693 IonicContact OE2-CE1 3.72Å; E674-H693 PolarHBondContact OE2-CE1 3.11Å; E674-H693 VanDerWaalsContact OE2-CE1 3.26Å; E674-W697 HydrophobicContact CG-CZ2 4.43Å; E674-W697 PolarHBondContact OE2-NE1 3.19Å
675	K	82.1	Confident	84.6	Confident	57 Å²	57	33.5 Å²	33.5	25%	0.248	16%	0.161	C	C	.	.	H	α-helix	trans	-66.5	-43.2	173.9	-170.3	-176.2	-177.4	-172.1	0	112	V671 V672 T673 R678 S749 V750 F752	V671-K675 PolarHBondContact O-N 3.28Å; V672-K675 PolarHBondContact O-N 3.4Å; T673-K675 VanDerWaalsContact C-N 3.29Å; T673-K675 PolarHBondContact O-N 3.33Å; K675-R678 PolarHBondContact O-N 2.84Å; K675-S749 PolarHBondContact NZ-O 2.84Å; K675-V750 PolarHBondContact NZ-O 3.04Å; K675-F752 PolarHBondContact NZ-O 3.43Å
676	Q	79.5	Confident	84.3	Confident	100 Å²	100	32.9 Å²	32.9	47%	0.467	16%	0.156	S	C	.	.	H	α-helix	trans	-64.5	-40.7	178.4	-176.8	-179.4	-27.7	0	0	111.9	V672 T673 R678	V672-Q676 VanDerWaalsContact O-CB 3.27Å; V672-Q676 WeakPolarHBondContact O-CB 3.36Å; V672-Q676 PolarHBondContact O-N 3.08Å; T673-Q676 PolarHBondContact O-N 2.84Å; Q676-R678 VanDerWaalsContact C-N 3.27Å; Q676-R678 PolarHBondContact O-N 3.3Å
677	L	78.9	Confident	83.8	Confident	88 Å²	88	31.1 Å²	31.1	46%	0.461	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-2	176.1	-64.7	174.8	0	0	0	113.4	T673 L679	T673-L677 WeakPolarHBondContact O-CB 3.33Å; T673-L677 WeakPolarHBondContact O-CG 3.44Å; T673-L677 PolarHBondContact O-N 2.76Å; L677-L679 HydrophobicContact CB-CD1 3.76Å; L677-L679 HydrophobicContact CB-CG 3.97Å; L677-L679 HydrophobicContact CD1-CD1 3.83Å; L677-L679 HydrophobicContact CG-CD1 4.46Å; L677-L679 PolarHBondContact O-N 3.21Å
678	R	79.4	Confident	83.4	Confident	98 Å²	98	32.6 Å²	32.6	37%	0.37	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	11.7	-176.8	-49.6	178.5	-172.6	179.6	-1.7	115.3	E674 K675 Q676 K680 E681 F682 Y862 I996	E674-R678 CarbonylContact O-C 3.57Å; E674-R678 PolarHBondContact O-N 3.04Å; K675-R678 PolarHBondContact O-N 2.84Å; Q676-R678 VanDerWaalsContact C-N 3.27Å; Q676-R678 PolarHBondContact O-N 3.3Å; R678-K680 VanDerWaalsContact C-N 3.27Å; R678-K680 PolarHBondContact O-N 3.25Å; R678-E681 PolarHBondContact O-N 3.13Å; R678-F682 PolarHBondContact O-N 3.29Å; R678-F682 VanDerWaalsContact O-N 3.07Å; R678-Y862 VanDerWaalsContact CZ-OH 3.32Å; R678-Y862 PolarHBondContact NH1-OH 2.97Å; R678-Y862 PolarHBondContact NH2-OH 3.13Å; R678-I996 HydrophobicContact CB-CD1 4.11Å
679	L	82.8	Confident	83	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-56.2	-41.2	178.1	-71	160.3	0	0	0	111.5	E674 L677 E681 F682 M683 I996 F998	E674-L679 HydrophobicContact CB-CB 4.29Å; E674-L679 PolarHBondContact O-N 3.35Å; L677-L679 HydrophobicContact CB-CD1 3.76Å; L677-L679 HydrophobicContact CB-CG 3.97Å; L677-L679 HydrophobicContact CD1-CD1 3.83Å; L677-L679 HydrophobicContact CG-CD1 4.46Å; L677-L679 PolarHBondContact O-N 3.21Å; L679-E681 PolarHBondContact O-N 3.34Å; L679-F682 PolarHBondContact O-N 3.05Å; L679-M683 WeakPolarHBondContact O-CG 3.15Å; L679-M683 PolarHBondContact O-N 2.96Å; L679-I996 HydrophobicContact CD2-CG2 3.66Å; L679-I996 HydrophobicContact CG-CG2 4.09Å; L679-F998 HydrophobicContact CB-CE1 4.32Å; L679-F998 HydrophobicContact CB-CZ 4.41Å; L679-F998 HydrophobicContact CD1-CD1 3.74Å; L679-F998 HydrophobicContact CD1-CE1 3.73Å; L679-F998 HydrophobicContact CD1-CG 4.49Å; L679-F998 HydrophobicContact CD1-CZ 4.49Å; L679-F998 HydrophobicContact CD2-CD1 3.99Å; L679-F998 HydrophobicContact CD2-CD2 4.05Å; L679-F998 HydrophobicContact CD2-CE1 3.88Å; L679-F998 HydrophobicContact CD2-CE2 3.95Å; L679-F998 HydrophobicContact CD2-CG 4.08Å; L679-F998 HydrophobicContact CD2-CZ 3.86Å; L679-F998 HydrophobicContact CG-CD1 4.45Å; L679-F998 HydrophobicContact CG-CE1 4.2Å; L679-F998 HydrophobicContact CG-CZ 4.48Å
680	K	82.4	Confident	82.6	Confident	17 Å²	17	41.2 Å²	41.2	7%	0.074	20%	0.197	C	C	.	.	H	α-helix	trans	-57.8	-48.9	178.9	-179.2	173	-178.2	167.4	0	113.6	R678 F682 K684 H693 W694 E855	R678-K680 VanDerWaalsContact C-N 3.27Å; R678-K680 PolarHBondContact O-N 3.25Å; K680-F682 VanDerWaalsContact C-N 3.35Å; K680-K684 PolarHBondContact O-N 2.67Å; K680-K684 VanDerWaalsContact O-N 3.1Å; K680-H693 VanDerWaalsContact CD-NE2 3.3Å; K680-H693 WeakPolarHBondContact CD-NE2 3.49Å; K680-H693 VanDerWaalsContact CE-CD2 3.42Å; K680-H693 WeakPolarHBondContact CE-CD2 3.46Å; K680-H693 VanDerWaalsContact CE-NE2 3.31Å; K680-H693 WeakPolarHBondContact CE-NE2 3.45Å; K680-W694 VanDerWaalsContact NZ-CE2 3.34Å; K680-E855 WeakPolarHBondContact CE-OE1 3.32Å; K680-E855 IonicContact NZ-OE1 3.35Å; K680-E855 PolarHBondContact NZ-OE1 2.88Å; K680-E855 IonicContact NZ-OE2 2.87Å
681	E	79.3	Confident	82.4	Confident	34 Å²	34	46 Å²	46	16%	0.159	22%	0.216	C	C	.	.	H	α-helix	trans	-74.3	-29.6	179.8	-61.7	-51.5	126.3	0	0	111.5	R678 L679 K684 M685	R678-E681 PolarHBondContact O-N 3.13Å; L679-E681 PolarHBondContact O-N 3.34Å; E681-K684 PolarHBondContact O-N 3.3Å; E681-K684 IonicContact OE1-NZ 3.09Å; E681-K684 PolarHBondContact OE1-NZ 2.64Å; E681-K684 VanDerWaalsContact OE2-CD 3.24Å; E681-K684 WeakPolarHBondContact OE2-CD 3.43Å; E681-K684 IonicContact OE2-NZ 2.71Å; E681-K684 PolarHBondContact OE2-NZ 3.03Å; E681-M685 WeakPolarHBondContact O-CG 3.47Å; E681-M685 PolarHBondContact O-N 2.96Å
682	F	84.6	Confident	82.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-44.2	171.9	-171.4	-103.9	0	0	0	112.6	R678 L679 K680 K684 M685 M686 F990 P992 I996 Y1010 I1057	R678-F682 PolarHBondContact O-N 3.29Å; R678-F682 VanDerWaalsContact O-N 3.07Å; L679-F682 PolarHBondContact O-N 3.05Å; K680-F682 VanDerWaalsContact C-N 3.35Å; F682-K684 PolarHBondContact O-N 2.9Å; F682-M685 HydrophobicContact CB-CE 4.33Å; F682-M685 HydrophobicContact CD2-CE 3.97Å; F682-M685 PolarHBondContact O-N 3.45Å; F682-M686 HydrophobicContact CE1-CE 4.08Å; F682-M686 HydrophobicContact CE1-CG 4.39Å; F682-M686 HydrophobicContact CE2-CE 3.76Å; F682-M686 HydrophobicContact CZ-CE 3.41Å; F682-M686 VanDerWaalsContact CZ-CE 3.41Å; F682-M686 WeakPolarHBondContact O-CG 3.45Å; F682-M686 PolarHBondContact O-N 3.31Å; F682-F990 HydrophobicContact CE2-CD1 4.47Å; F682-F990 WeakPolarHBondContact CE2-O 3.46Å; F682-P992 HydrophobicContact CD2-CG 4.35Å; F682-P992 HydrophobicContact CE2-CG 4.17Å; F682-I996 HydrophobicContact CB-CD1 4.21Å; F682-I996 HydrophobicContact CB-CG2 4.01Å; F682-I996 HydrophobicContact CD1-CG2 4.31Å; F682-I996 HydrophobicContact CD2-CD1 4.13Å; F682-I996 HydrophobicContact CG-CB 4.35Å; F682-I996 HydrophobicContact CG-CD1 4.35Å; F682-I996 HydrophobicContact CG-CG2 4.11Å; F682-Y1010 AromaticContact CD1-CE1 3.89Å; F682-Y1010 HydrophobicContact CD1-CE1 3.89Å; F682-Y1010 AromaticContact CD1-CZ 3.79Å; F682-Y1010 WeakPolarHBondContact CD1-OH 3.37Å; F682-Y1010 AromaticContact CE1-CE1 3.81Å; F682-Y1010 HydrophobicContact CE1-CE1 3.81Å; F682-Y1010 HydrophobicContact CE1-CE2 4.29Å; F682-Y1010 AromaticContact CE1-CZ 3.64Å; F682-I1057 HydrophobicContact CE1-CG2 3.96Å; F682-I1057 HydrophobicContact CZ-CG2 4.01Å
683	M	85.5	Confident	82.3	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-40.6	172.2	-69	-170.4	-61.3	0	0	112.4	L679 M685 M686 G687 L688 F998 F1009 Y1010 I1013	L679-M683 WeakPolarHBondContact O-CG 3.15Å; L679-M683 PolarHBondContact O-N 2.96Å; M683-M685 VanDerWaalsContact C-N 3.34Å; M683-M685 PolarHBondContact O-N 2.9Å; M683-M686 PolarHBondContact O-N 2.78Å; M683-G687 PolarHBondContact O-N 2.82Å; M683-L688 HydrophobicContact CB-CB 4.13Å; M683-L688 HydrophobicContact CB-CD2 3.83Å; M683-L688 HydrophobicContact CE-CD2 4.1Å; M683-L688 VanDerWaalsContact O-CB 3.24Å; M683-L688 WeakPolarHBondContact O-CB 3.48Å; M683-L688 PolarHBondContact O-N 2.71Å; M683-L688 HydrophobicContact SD-CD2 4.02Å; M683-F998 HydrophobicContact SD-CZ 4.23Å; M683-F1009 HydrophobicContact CG-CE1 4.3Å; M683-F1009 HydrophobicContact SD-CE1 3.76Å; M683-F1009 HydrophobicContact SD-CZ 3.65Å; M683-Y1010 HydrophobicContact CG-CE1 4.25Å; M683-I1013 HydrophobicContact CG-CD1 4.3Å; M683-I1013 HydrophobicContact SD-CD1 4.4Å
684	K	79.9	Confident	82.5	Confident	19 Å²	19	47.7 Å²	47.7	8%	0.083	23%	0.226	C	C	.	.	H	α-helix	trans	-61	-40	173.7	-80.2	173.3	-179.6	169.5	0	112.2	K680 E681 F682 M686 G687 S690 E855 R985	K680-K684 PolarHBondContact O-N 2.67Å; K680-K684 VanDerWaalsContact O-N 3.1Å; E681-K684 PolarHBondContact O-N 3.3Å; E681-K684 IonicContact OE1-NZ 3.09Å; E681-K684 PolarHBondContact OE1-NZ 2.64Å; E681-K684 VanDerWaalsContact OE2-CD 3.24Å; E681-K684 WeakPolarHBondContact OE2-CD 3.43Å; E681-K684 IonicContact OE2-NZ 2.71Å; E681-K684 PolarHBondContact OE2-NZ 3.03Å; F682-K684 PolarHBondContact O-N 2.9Å; K684-M686 VanDerWaalsContact C-N 3.33Å; K684-G687 PolarHBondContact O-N 2.77Å; K684-S690 WeakPolarHBondContact CE-OG 2.97Å; K684-E855 WeakPolarHBondContact CE-OE1 3.48Å; K684-E855 IonicContact NZ-OE1 3.53Å; K684-E855 PolarHBondContact NZ-OE1 3.35Å; K684-R985 WeakPolarHBondContact O-CD 3.4Å
685	M	78.7	Confident	82.8	Confident	7 Å²	7	49.8 Å²	49.8	3%	0.034	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-35.7	175.6	-76.2	-174.2	-69.5	0	0	112.5	E681 F682 M683 G687 C960 L962 R985 F990	E681-M685 WeakPolarHBondContact O-CG 3.47Å; E681-M685 PolarHBondContact O-N 2.96Å; F682-M685 HydrophobicContact CB-CE 4.33Å; F682-M685 HydrophobicContact CD2-CE 3.97Å; F682-M685 PolarHBondContact O-N 3.45Å; M683-M685 VanDerWaalsContact C-N 3.34Å; M683-M685 PolarHBondContact O-N 2.9Å; M685-G687 PolarHBondContact O-N 3.16Å; M685-C960 HydrophobicContact SD-CB 3.96Å; M685-L962 HydrophobicContact CE-CD1 4.13Å; M685-L962 HydrophobicContact CE-CD2 3.87Å; M685-L962 HydrophobicContact CE-CG 4.25Å; M685-L962 HydrophobicContact CG-CD2 4.42Å; M685-L962 HydrophobicContact SD-CD1 3.61Å; M685-L962 HydrophobicContact SD-CD2 3.64Å; M685-L962 HydrophobicContact SD-CG 3.47Å; M685-L962 WeakPolarHBondContact SD-CG 3.46Å; M685-R985 WeakPolarHBondContact O-CB 3.41Å; M685-R985 WeakPolarHBondContact O-CG 3.48Å; M685-F990 HydrophobicContact CE-CD1 3.6Å; M685-F990 HydrophobicContact CE-CE1 3.78Å; M685-F990 HydrophobicContact SD-CD1 3.62Å; M685-F990 HydrophobicContact SD-CE1 3.89Å; M685-F990 HydrophobicContact SD-CG 4.49Å
686	M	81.7	Confident	83.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	4.1	176.1	-65.9	-64.2	178.6	0	0	114.3	F682 M683 K684 F990 Y1010 I1013 I1057	F682-M686 HydrophobicContact CE1-CE 4.08Å; F682-M686 HydrophobicContact CE1-CG 4.39Å; F682-M686 HydrophobicContact CE2-CE 3.76Å; F682-M686 HydrophobicContact CZ-CE 3.41Å; F682-M686 VanDerWaalsContact CZ-CE 3.41Å; F682-M686 WeakPolarHBondContact O-CG 3.45Å; F682-M686 PolarHBondContact O-N 3.31Å; M683-M686 PolarHBondContact O-N 2.78Å; K684-M686 VanDerWaalsContact C-N 3.33Å; M686-F990 HydrophobicContact CE-CB 4.47Å; M686-F990 VanDerWaalsContact CE-O 3.26Å; M686-F990 WeakPolarHBondContact CE-O 3.33Å; M686-Y1010 HydrophobicContact CB-CD1 4.27Å; M686-Y1010 HydrophobicContact CG-CD1 4.11Å; M686-Y1010 HydrophobicContact CG-CE1 4.32Å; M686-I1013 HydrophobicContact CB-CG2 4.43Å; M686-I1057 HydrophobicContact CE-CG2 4.14Å
687	G	78.3	Confident	83.8	Confident	19 Å²	19	46.5 Å²	46.5	20%	0.196	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	111.8	-2.1	172.8	0	0	0	0	0	116.4	M683 K684 M685 R689	M683-G687 PolarHBondContact O-N 2.82Å; K684-G687 PolarHBondContact O-N 2.77Å; M685-G687 PolarHBondContact O-N 3.16Å; G687-R689 PolarHBondContact O-N 2.77Å
688	L	83	Confident	84.5	Confident	41 Å²	41	45.6 Å²	45.6	22%	0.215	22%	0.224	C	C	.	.			trans	-68.5	126.4	-178.7	-169.2	68.6	0	0	0	112.1	M683 A692 H693 I1013	M683-L688 HydrophobicContact CB-CB 4.13Å; M683-L688 HydrophobicContact CB-CD2 3.83Å; M683-L688 HydrophobicContact CE-CD2 4.1Å; M683-L688 VanDerWaalsContact O-CB 3.24Å; M683-L688 WeakPolarHBondContact O-CB 3.48Å; M683-L688 PolarHBondContact O-N 2.71Å; M683-L688 HydrophobicContact SD-CD2 4.02Å; L688-A692 HydrophobicContact CD1-CB 4.24Å; L688-H693 HydrophobicContact CD2-CB 3.94Å; L688-I1013 HydrophobicContact CB-CG2 4.11Å
689	R	80.9	Confident	85.2	Confident	200 Å²	200	45.2 Å²	45.2	76%	0.755	23%	0.228	S	C	*	.			trans	-72.4	134.5	173	-64.5	-177.6	179.7	-176.2	0.1	110.7	G687 F691 A692 H693	G687-R689 PolarHBondContact O-N 2.77Å; R689-F691 PolarHBondContact O-N 3.3Å; R689-F691 VanDerWaalsContact O-N 3.12Å; R689-A692 PolarHBondContact O-N 3.26Å; R689-H693 PolarHBondContact O-N 3Å
690	S	80.2	Confident	85.6	Confident	43 Å²	43	50 Å²	50	30%	0.301	25%	0.25	S	C	.	.	H	α-helix	trans	-53.9	-35.7	-179.4	-48.5	0	0	0	0	113.9	K684 H693 W694	K684-S690 WeakPolarHBondContact CE-OG 2.97Å; S690-H693 PolarHBondContact O-N 2.96Å; S690-W694 VanDerWaalsContact O-CD1 3.24Å; S690-W694 PolarHBondContact O-N 3.1Å
691	F	84.9	Confident	86	Confident	155 Å²	155	49.3 Å²	49.3	68%	0.68	25%	0.247	S	C	*	.	H	α-helix	trans	-62.3	-44.4	177.6	178.4	-102.8	0	0	0	112.5	R689 H693 W694 L695	R689-F691 PolarHBondContact O-N 3.3Å; R689-F691 VanDerWaalsContact O-N 3.12Å; F691-H693 VanDerWaalsContact C-N 3.28Å; F691-H693 PolarHBondContact O-N 3.47Å; F691-W694 PolarHBondContact O-N 2.86Å; F691-L695 HydrophobicContact CE1-CD2 3.92Å; F691-L695 HydrophobicContact CZ-CD2 4.34Å; F691-L695 VanDerWaalsContact O-CB 3.27Å; F691-L695 WeakPolarHBondContact O-CB 3.37Å; F691-L695 PolarHBondContact O-N 3.31Å
692	A	88.3	Confident	86.6	Confident	45 Å²	45	49.1 Å²	49.1	37%	0.372	25%	0.247	S	C	.	.	H	α-helix	trans	-63.3	-36.5	179.9	0	0	0	0	0	111.9	L688 R689 A696	L688-A692 HydrophobicContact CD1-CB 4.24Å; R689-A692 PolarHBondContact O-N 3.26Å; A692-A696 WeakPolarHBondContact O-CB 3.4Å; A692-A696 PolarHBondContact O-N 3.05Å
693	H	87.8	Confident	86.8	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.056	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-47.4	175.9	173.1	77.6	0	0	0	112.8	E674 K680 L688 R689 S690 F691 A696 W697	E674-H693 IonicContact OE2-CE1 3.72Å; E674-H693 PolarHBondContact OE2-CE1 3.11Å; E674-H693 VanDerWaalsContact OE2-CE1 3.26Å; K680-H693 VanDerWaalsContact CD-NE2 3.3Å; K680-H693 WeakPolarHBondContact CD-NE2 3.49Å; K680-H693 VanDerWaalsContact CE-CD2 3.42Å; K680-H693 WeakPolarHBondContact CE-CD2 3.46Å; K680-H693 VanDerWaalsContact CE-NE2 3.31Å; K680-H693 WeakPolarHBondContact CE-NE2 3.45Å; L688-H693 HydrophobicContact CD2-CB 3.94Å; R689-H693 PolarHBondContact O-N 3Å; S690-H693 PolarHBondContact O-N 2.96Å; F691-H693 VanDerWaalsContact C-N 3.28Å; F691-H693 PolarHBondContact O-N 3.47Å; H693-A696 PolarHBondContact O-N 3.46Å; H693-W697 AromaticContact CE1-CD1 3.72Å; H693-W697 AromaticContact CE1-NE1 3.59Å; H693-W697 AromaticContact NE2-CD1 3.9Å; H693-W697 PolarHBondContact O-N 3.19Å
694	W	89.5	Confident	87	Confident	29 Å²	29	58 Å²	58	11%	0.11	29%	0.292	C	S	.	.	H	α-helix	trans	-70	-35.2	176.4	-70.3	118	0	0	0	112.7	V671 K680 S690 F691 W697 Y698 F746 T851 E855	V671-W694 HydrophobicContact CG1-CH2 4.08Å; V671-W694 HydrophobicContact CG1-CZ3 3.92Å; K680-W694 VanDerWaalsContact NZ-CE2 3.34Å; S690-W694 VanDerWaalsContact O-CD1 3.24Å; S690-W694 PolarHBondContact O-N 3.1Å; F691-W694 PolarHBondContact O-N 2.86Å; W694-W697 PolarHBondContact O-N 3.08Å; W694-Y698 VanDerWaalsContact O-CB 3.32Å; W694-Y698 WeakPolarHBondContact O-CB 3.44Å; W694-Y698 PolarHBondContact O-N 3.09Å; W694-F746 HydrophobicContact CD2-CD2 4.44Å; W694-F746 HydrophobicContact CE3-CB 4.05Å; W694-F746 HydrophobicContact CE3-CD1 4.13Å; W694-F746 AromaticContact CE3-CD2 3.56Å; W694-F746 HydrophobicContact CE3-CD2 3.56Å; W694-F746 HydrophobicContact CE3-CE1 4.46Å; W694-F746 AromaticContact CE3-CE2 3.94Å; W694-F746 HydrophobicContact CE3-CE2 3.94Å; W694-F746 AromaticContact CE3-CG 3.67Å; W694-F746 HydrophobicContact CE3-CG 3.67Å; W694-F746 HydrophobicContact CE3-CZ 4.38Å; W694-F746 HydrophobicContact CH2-CB 4.11Å; W694-F746 HydrophobicContact CH2-CG 4.5Å; W694-F746 HydrophobicContact CZ3-CB 3.58Å; W694-F746 AromaticContact CZ3-CD1 3.8Å; W694-F746 HydrophobicContact CZ3-CD1 3.8Å; W694-F746 AromaticContact CZ3-CD2 3.93Å; W694-F746 HydrophobicContact CZ3-CD2 3.93Å; W694-F746 HydrophobicContact CZ3-CE1 4.44Å; W694-F746 AromaticContact CZ3-CG 3.51Å; W694-F746 HydrophobicContact CZ3-CG 3.51Å; W694-T851 HydrophobicContact CD2-CG2 4.34Å; W694-T851 HydrophobicContact CH2-CG2 3.94Å; W694-T851 HydrophobicContact CZ2-CG2 3.67Å; W694-T851 HydrophobicContact CZ3-CG2 4.39Å; W694-E855 PolarHBondContact NE1-OE2 2.88Å
695	L	90.9	Very high	87.4	Confident	72 Å²	72	57.4 Å²	57.4	38%	0.377	29%	0.29	S	S	.	.	H	α-helix	trans	-63.5	-41.3	175.2	-177	64.7	0	0	0	111.5	F691 Y698 I699	F691-L695 HydrophobicContact CE1-CD2 3.92Å; F691-L695 HydrophobicContact CZ-CD2 4.34Å; F691-L695 VanDerWaalsContact O-CB 3.27Å; F691-L695 WeakPolarHBondContact O-CB 3.37Å; F691-L695 PolarHBondContact O-N 3.31Å; L695-Y698 PolarHBondContact O-N 2.78Å; L695-I699 HydrophobicContact CD1-CD1 4.17Å; L695-I699 HydrophobicContact CD1-CG1 4.37Å; L695-I699 HydrophobicContact CG-CD1 3.92Å; L695-I699 VanDerWaalsContact O-CG1 3.3Å; L695-I699 WeakPolarHBondContact O-CG1 3.37Å; L695-I699 PolarHBondContact O-N 2.8Å
696	A	91.6	Very high	88	Confident	58 Å²	58	59.4 Å²	59.4	48%	0.479	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-48.3	174.8	0	0	0	0	0	111.7	A692 H693 Y698 I699 Q700	A692-A696 WeakPolarHBondContact O-CB 3.4Å; A692-A696 PolarHBondContact O-N 3.05Å; H693-A696 PolarHBondContact O-N 3.46Å; A696-Y698 VanDerWaalsContact C-N 3.31Å; A696-Y698 PolarHBondContact O-N 2.91Å; A696-I699 PolarHBondContact O-N 3.22Å; A696-Q700 WeakPolarHBondContact O-CB 3.47Å; A696-Q700 PolarHBondContact O-N 3.35Å
697	W	91.7	Very high	88.3	Confident	29 Å²	29	63.3 Å²	63.3	11%	0.11	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-35.5	174.5	-82.6	119.2	0	0	0	112.7	N670 V671 E674 H693 W694 G701 F746	N670-W697 HydrophobicContact CB-CH2 3.53Å; N670-W697 HydrophobicContact CB-CZ2 4.22Å; N670-W697 HydrophobicContact CB-CZ3 3.85Å; V671-W697 HydrophobicContact CG2-CD2 3.89Å; V671-W697 HydrophobicContact CG2-CE3 4.39Å; V671-W697 HydrophobicContact CG2-CG 3.95Å; E674-W697 HydrophobicContact CG-CZ2 4.43Å; E674-W697 PolarHBondContact OE2-NE1 3.19Å; H693-W697 AromaticContact CE1-CD1 3.72Å; H693-W697 AromaticContact CE1-NE1 3.59Å; H693-W697 AromaticContact NE2-CD1 3.9Å; H693-W697 PolarHBondContact O-N 3.19Å; W694-W697 PolarHBondContact O-N 3.08Å; W697-G701 PolarHBondContact O-N 2.88Å; W697-F746 HydrophobicContact CB-CE1 4.04Å; W697-F746 HydrophobicContact CB-CE2 4.5Å; W697-F746 HydrophobicContact CB-CZ 3.65Å
698	Y	93.2	Very high	88.9	Confident	70 Å²	70	63.8 Å²	63.8	28%	0.275	33%	0.33	S	S	.	.	H	α-helix	trans	-66.2	-47.4	177.1	-178.6	-93.7	0	0	0	111.6	W694 L695 A696 Q700 G701 M702 I742 P743	W694-Y698 VanDerWaalsContact O-CB 3.32Å; W694-Y698 WeakPolarHBondContact O-CB 3.44Å; W694-Y698 PolarHBondContact O-N 3.09Å; L695-Y698 PolarHBondContact O-N 2.78Å; A696-Y698 VanDerWaalsContact C-N 3.31Å; A696-Y698 PolarHBondContact O-N 2.91Å; Y698-Q700 PolarHBondContact O-N 3.08Å; Y698-G701 PolarHBondContact O-N 3.22Å; Y698-M702 HydrophobicContact CD1-CG 4.2Å; Y698-M702 HydrophobicContact CE1-CE 4.27Å; Y698-M702 HydrophobicContact CE1-CG 3.82Å; Y698-M702 HydrophobicContact CE2-CE 4.4Å; Y698-M702 WeakPolarHBondContact O-CB 3.39Å; Y698-M702 PolarHBondContact O-N 3.32Å; Y698-M702 VanDerWaalsContact OH-CE 3.23Å; Y698-M702 WeakPolarHBondContact OH-CE 3.46Å; Y698-I742 HydrophobicContact CD2-CB 4.17Å; Y698-I742 HydrophobicContact CD2-CG2 3.71Å; Y698-I742 HydrophobicContact CE2-CB 4.37Å; Y698-I742 HydrophobicContact CE2-CG2 4.4Å; Y698-I742 HydrophobicContact CG-CG2 4.45Å; Y698-P743 HydrophobicContact CD2-CG 4.4Å; Y698-P743 HydrophobicContact CE2-CG 4.15Å
699	I	93.4	Very high	89.3	Confident	89 Å²	89	62 Å²	62	46%	0.456	32%	0.321	S	S	.	.	H	α-helix	trans	-61.2	-45	176.6	-68.6	166.2	0	0	0	110.4	L695 A696 M702 I703	L695-I699 HydrophobicContact CD1-CD1 4.17Å; L695-I699 HydrophobicContact CD1-CG1 4.37Å; L695-I699 HydrophobicContact CG-CD1 3.92Å; L695-I699 VanDerWaalsContact O-CG1 3.3Å; L695-I699 WeakPolarHBondContact O-CG1 3.37Å; L695-I699 PolarHBondContact O-N 2.8Å; A696-I699 PolarHBondContact O-N 3.22Å; I699-M702 PolarHBondContact O-N 3.39Å; I699-I703 HydrophobicContact CG2-CD1 3.88Å; I699-I703 WeakPolarHBondContact O-CG1 3.41Å; I699-I703 PolarHBondContact O-N 2.87Å
700	Q	92	Very high	89.7	Confident	106 Å²	106	56.7 Å²	56.7	50%	0.495	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-40.8	178.8	-173.3	171.5	-0.8	0	0	112.4	A696 Y698 M702 M704	A696-Q700 WeakPolarHBondContact O-CB 3.47Å; A696-Q700 PolarHBondContact O-N 3.35Å; Y698-Q700 PolarHBondContact O-N 3.08Å; Q700-M702 VanDerWaalsContact C-N 3.35Å; Q700-M704 PolarHBondContact O-N 2.87Å
701	G	90.3	Very high	90.1	Very high	2 Å²	2	61.8 Å²	61.8	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-41.4	172.1	0	0	0	0	0	112.2	W697 Y698 M704 L705 I742	W697-G701 PolarHBondContact O-N 2.88Å; Y698-G701 PolarHBondContact O-N 3.22Å; G701-M704 PolarHBondContact O-N 3.47Å; G701-L705 PolarHBondContact O-N 3.1Å; G701-I742 VanDerWaalsContact C-CD1 3.48Å
702	M	91.2	Very high	90.2	Very high	31 Å²	31	56 Å²	56	15%	0.153	30%	0.304	C	S	.	.	H	α-helix	trans	-64.1	-43.7	178.6	-91.7	-60.6	-168	0	0	113	Y698 I699 Q700 M704 L705 C706 I742	Y698-M702 HydrophobicContact CD1-CG 4.2Å; Y698-M702 HydrophobicContact CE1-CE 4.27Å; Y698-M702 HydrophobicContact CE1-CG 3.82Å; Y698-M702 HydrophobicContact CE2-CE 4.4Å; Y698-M702 WeakPolarHBondContact O-CB 3.39Å; Y698-M702 PolarHBondContact O-N 3.32Å; Y698-M702 VanDerWaalsContact OH-CE 3.23Å; Y698-M702 WeakPolarHBondContact OH-CE 3.46Å; I699-M702 PolarHBondContact O-N 3.39Å; Q700-M702 VanDerWaalsContact C-N 3.35Å; M702-M704 VanDerWaalsContact C-N 3.3Å; M702-M704 PolarHBondContact O-N 2.83Å; M702-L705 PolarHBondContact O-N 3.36Å; M702-C706 WeakPolarHBondContact O-CB 3.4Å; M702-C706 PolarHBondContact O-N 2.98Å; M702-C706 PolarHBondContact O-SG 3.03Å; M702-I742 HydrophobicContact CB-CD1 4.38Å; M702-I742 HydrophobicContact CG-CD1 3.79Å; M702-I742 HydrophobicContact SD-CD1 4.02Å
703	I	90.8	Very high	90.1	Very high	106 Å²	106	54.5 Å²	54.5	54%	0.544	29%	0.291	S	S	.	.	H	α-helix	trans	-60.1	-44.4	175.3	-68	163.7	0	0	0	109.9	I699 L705 C706 C707	I699-I703 HydrophobicContact CG2-CD1 3.88Å; I699-I703 WeakPolarHBondContact O-CG1 3.41Å; I699-I703 PolarHBondContact O-N 2.87Å; I703-L705 PolarHBondContact O-N 3.35Å; I703-C706 PolarHBondContact O-N 2.96Å; I703-C707 PolarHBondContact O-N 3.44Å; I703-C707 PolarHBondContact O-SG 3.3Å; I703-C707 VanDerWaalsContact O-SG 3.33Å
704	M	88.6	Confident	90	Very high	86 Å²	86	58.3 Å²	58.3	42%	0.424	31%	0.311	S	S	.	.	H	α-helix	trans	-61.5	-42.2	178	-177.8	176.3	-74.4	0	0	112.7	Q700 G701 M702	Q700-M704 PolarHBondContact O-N 2.87Å; G701-M704 PolarHBondContact O-N 3.47Å; M702-M704 VanDerWaalsContact C-N 3.3Å; M702-M704 PolarHBondContact O-N 2.83Å
705	L	89	Confident	89.9	Confident	6 Å²	6	61.7 Å²	61.7	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-76.6	-37.4	178.5	-65.9	-175.5	0	0	0	113	W660 G701 M702 I703 C707 S708 V709 I742	W660-L705 HydrophobicContact CD2-CD2 4.03Å; W660-L705 HydrophobicContact CE3-CD2 4.29Å; W660-L705 HydrophobicContact CG-CD2 4.31Å; W660-L705 HydrophobicContact CZ3-CD1 4.37Å; G701-L705 PolarHBondContact O-N 3.1Å; M702-L705 PolarHBondContact O-N 3.36Å; I703-L705 PolarHBondContact O-N 3.35Å; L705-C707 VanDerWaalsContact C-N 3.28Å; L705-C707 PolarHBondContact O-N 3.03Å; L705-S708 PolarHBondContact O-N 3.47Å; L705-S708 PolarHBondContact O-OG 3.45Å; L705-V709 WeakPolarHBondContact O-CG2 3.4Å; L705-V709 PolarHBondContact O-N 2.84Å; L705-I742 HydrophobicContact CD1-CD1 3.91Å; L705-I742 HydrophobicContact CD1-CG1 3.91Å
706	C	90.3	Very high	89.5	Confident	49 Å²	49	58.9 Å²	58.9	33%	0.331	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-38.8	177.3	-69.9	0	0	0	0	111.6	M702 I703 S708 V709 V710	M702-C706 WeakPolarHBondContact O-CB 3.4Å; M702-C706 PolarHBondContact O-N 2.98Å; M702-C706 PolarHBondContact O-SG 3.03Å; I703-C706 PolarHBondContact O-N 2.96Å; C706-S708 VanDerWaalsContact C-N 3.31Å; C706-S708 PolarHBondContact O-N 2.87Å; C706-V709 PolarHBondContact O-N 3.43Å; C706-V710 WeakPolarHBondContact O-CG2 3.45Å; C706-V710 PolarHBondContact O-N 3.29Å
707	C	89.2	Confident	89.1	Confident	81 Å²	81	62.7 Å²	62.7	55%	0.547	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-37	173.3	-70.1	0	0	0	0	113	I703 L705 F711	I703-C707 PolarHBondContact O-N 3.44Å; I703-C707 PolarHBondContact O-SG 3.3Å; I703-C707 VanDerWaalsContact O-SG 3.33Å; L705-C707 VanDerWaalsContact C-N 3.28Å; L705-C707 PolarHBondContact O-N 3.03Å; C707-F711 PolarHBondContact O-N 3.27Å
708	S	90.2	Very high	88.7	Confident	29 Å²	29	68 Å²	68	20%	0.203	35%	0.348	C	S	.	.	H	α-helix	trans	-76	-34.4	176.2	71.8	0	0	0	0	112.4	W660 L705 C706 F711 I712	W660-S708 PolarHBondContact NE1-OG 3.46Å; W660-S708 VanDerWaalsContact NE1-OG 3.12Å; L705-S708 PolarHBondContact O-N 3.47Å; L705-S708 PolarHBondContact O-OG 3.45Å; C706-S708 VanDerWaalsContact C-N 3.31Å; C706-S708 PolarHBondContact O-N 2.87Å; S708-F711 PolarHBondContact O-N 3.29Å; S708-I712 VanDerWaalsContact O-CG1 3.3Å; S708-I712 WeakPolarHBondContact O-CG1 3.33Å; S708-I712 PolarHBondContact O-N 2.97Å
709	V	91.5	Very high	88	Confident	5 Å²	5	67.1 Å²	67.1	3%	0.03	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-45.6	172.7	175.2	0	0	0	0	111.4	W660 L705 C706 F711 I712 A713 L734 I735	W660-V709 HydrophobicContact CH2-CG2 4.06Å; W660-V709 HydrophobicContact CZ2-CG2 3.72Å; L705-V709 WeakPolarHBondContact O-CG2 3.4Å; L705-V709 PolarHBondContact O-N 2.84Å; C706-V709 PolarHBondContact O-N 3.43Å; V709-F711 VanDerWaalsContact C-N 3.32Å; V709-F711 PolarHBondContact O-N 3.06Å; V709-I712 PolarHBondContact O-N 3.22Å; V709-A713 WeakPolarHBondContact O-CB 3.21Å; V709-A713 PolarHBondContact O-N 3.4Å; V709-L734 HydrophobicContact CB-CB 4.5Å; V709-L734 HydrophobicContact CG1-CB 4.01Å; V709-L734 HydrophobicContact CG1-CD1 4.17Å; V709-L734 HydrophobicContact CG2-CB 3.68Å; V709-L734 HydrophobicContact CG2-CD1 4.45Å; V709-I735 HydrophobicContact CG1-CG1 4.26Å; V709-I735 HydrophobicContact CG2-CG1 4.49Å
710	V	89.1	Confident	87.2	Confident	88 Å²	88	70 Å²	70	53%	0.533	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-43.5	177.4	173.2	0	0	0	0	111.1	C706 A713 I714	C706-V710 WeakPolarHBondContact O-CG2 3.45Å; C706-V710 PolarHBondContact O-N 3.29Å; V710-A713 PolarHBondContact O-N 3.16Å; V710-I714 HydrophobicContact CG1-CD1 4.07Å; V710-I714 WeakPolarHBondContact O-CG1 3.38Å; V710-I714 PolarHBondContact O-N 2.82Å; V710-I714 VanDerWaalsContact O-N 3.08Å
711	F	88.8	Confident	86.5	Confident	150 Å²	150	68 Å²	68	66%	0.658	36%	0.361	S	S	*	.	H	α-helix	trans	-62.3	-45	175.8	-111.8	-81.7	0	0	0	112.8	C707 S708 V709 I714 I715	C707-F711 PolarHBondContact O-N 3.27Å; S708-F711 PolarHBondContact O-N 3.29Å; V709-F711 VanDerWaalsContact C-N 3.32Å; V709-F711 PolarHBondContact O-N 3.06Å; F711-I714 PolarHBondContact O-N 2.79Å; F711-I715 WeakPolarHBondContact O-CG1 3.17Å; F711-I715 PolarHBondContact O-N 3.17Å; F711-I715 VanDerWaalsContact O-N 3.08Å
712	I	87.7	Confident	86	Confident	33 Å²	33	68.9 Å²	68.9	17%	0.169	37%	0.365	C	S	.	.	H	α-helix	trans	-64.6	-41.3	177.8	-67.8	165.7	0	0	0	110.6	S708 V709 I714 I715 V716 F730 L734	S708-I712 VanDerWaalsContact O-CG1 3.3Å; S708-I712 WeakPolarHBondContact O-CG1 3.33Å; S708-I712 PolarHBondContact O-N 2.97Å; V709-I712 PolarHBondContact O-N 3.22Å; I712-I714 VanDerWaalsContact C-N 3.35Å; I712-I714 PolarHBondContact O-N 2.91Å; I712-I715 PolarHBondContact O-N 3.2Å; I712-V716 HydrophobicContact CG2-CG2 4.26Å; I712-V716 WeakPolarHBondContact O-CG2 3Å; I712-V716 PolarHBondContact O-N 3.21Å; I712-F730 HydrophobicContact CG2-CE1 4.03Å; I712-L734 HydrophobicContact CB-CD1 4.46Å; I712-L734 HydrophobicContact CG2-CD1 3.96Å
713	A	85.5	Confident	85.3	Confident	14 Å²	14	72.1 Å²	72.1	12%	0.116	38%	0.38	C	S	.	.	H	α-helix	trans	-62.7	-39.5	178.4	0	0	0	0	0	112.4	V709 V710 K717	V709-A713 WeakPolarHBondContact O-CB 3.21Å; V709-A713 PolarHBondContact O-N 3.4Å; V710-A713 PolarHBondContact O-N 3.16Å; A713-K717 WeakPolarHBondContact O-CB 3.44Å; A713-K717 PolarHBondContact O-N 2.87Å; A713-K717 VanDerWaalsContact O-N 3.09Å
714	I	86	Confident	84.7	Confident	92 Å²	92	70.4 Å²	70.4	47%	0.472	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-48.7	172.8	-66.8	163.8	0	0	0	110.3	V710 F711 I712 V716 K717 E718	V710-I714 HydrophobicContact CG1-CD1 4.07Å; V710-I714 WeakPolarHBondContact O-CG1 3.38Å; V710-I714 PolarHBondContact O-N 2.82Å; V710-I714 VanDerWaalsContact O-N 3.08Å; F711-I714 PolarHBondContact O-N 2.79Å; I712-I714 VanDerWaalsContact C-N 3.35Å; I712-I714 PolarHBondContact O-N 2.91Å; I714-V716 PolarHBondContact O-N 2.8Å; I714-K717 PolarHBondContact O-N 2.94Å; I714-E718 HydrophobicContact CG2-CG 4.08Å; I714-E718 WeakPolarHBondContact O-CB 3.11Å; I714-E718 WeakPolarHBondContact O-CG 3.4Å; I714-E718 PolarHBondContact O-N 3.48Å
715	I	86.7	Confident	84.5	Confident	99 Å²	99	66.9 Å²	66.9	51%	0.508	35%	0.351	S	S	.	.	H	α-helix	trans	-60.9	-42.7	179.9	-68.4	166	0	0	0	111.8	F711 I712 G719 I721	F711-I715 WeakPolarHBondContact O-CG1 3.17Å; F711-I715 PolarHBondContact O-N 3.17Å; F711-I715 VanDerWaalsContact O-N 3.08Å; I712-I715 PolarHBondContact O-N 3.2Å; I715-G719 VanDerWaalsContact O-CA 3.31Å; I715-G719 WeakPolarHBondContact O-CA 3.42Å; I715-G719 PolarHBondContact O-N 3.24Å; I715-I721 HydrophobicContact CG2-CD1 4.37Å
716	V	82.9	Confident	84.3	Confident	14 Å²	14	69.3 Å²	69.3	9%	0.085	36%	0.364	C	S	.	.	H	α-helix	trans	-65.9	-38.8	179.2	168.4	0	0	0	0	111.7	I712 I714 K720 I721 L722 F730	I712-V716 HydrophobicContact CG2-CG2 4.26Å; I712-V716 WeakPolarHBondContact O-CG2 3Å; I712-V716 PolarHBondContact O-N 3.21Å; I714-V716 PolarHBondContact O-N 2.8Å; V716-K720 PolarHBondContact O-N 3.16Å; V716-I721 HydrophobicContact CG1-CB 4.47Å; V716-I721 PolarHBondContact O-N 3.41Å; V716-I721 VanDerWaalsContact O-N 3.15Å; V716-L722 HydrophobicContact CG1-CB 3.93Å; V716-L722 HydrophobicContact CG1-CD1 4.02Å; V716-L722 HydrophobicContact CG1-CG 4.05Å; V716-F730 HydrophobicContact CG2-CE1 3.95Å
717	K	82.2	Confident	84	Confident	138 Å²	138	68.9 Å²	68.9	60%	0.6	36%	0.361	S	S	*	.	H	α-helix	trans	-73.2	-53.9	179.8	-173.1	-174.2	176.6	-166.3	0	112.4	A713 I714 K720	A713-K717 WeakPolarHBondContact O-CB 3.44Å; A713-K717 PolarHBondContact O-N 2.87Å; A713-K717 VanDerWaalsContact O-N 3.09Å; I714-K717 PolarHBondContact O-N 2.94Å; K717-K720 PolarHBondContact O-N 2.82Å
718	E	83.9	Confident	83.8	Confident	141 Å²	141	71.1 Å²	71.1	66%	0.659	36%	0.362	S	S	*	.	H	α-helix	trans	-70.1	-34.4	-178.9	-62.1	-56.6	139.1	0	0	111.7	I714 K720	I714-E718 HydrophobicContact CG2-CG 4.08Å; I714-E718 WeakPolarHBondContact O-CB 3.11Å; I714-E718 WeakPolarHBondContact O-CG 3.4Å; I714-E718 PolarHBondContact O-N 3.48Å; E718-K720 PolarHBondContact O-N 3.49Å
719	G	78.3	Confident	83.7	Confident	50 Å²	50	69.9 Å²	69.9	52%	0.515	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-0.4	176.9	0	0	0	0	0	115	I715 I721	I715-G719 VanDerWaalsContact O-CA 3.31Å; I715-G719 WeakPolarHBondContact O-CA 3.42Å; I715-G719 PolarHBondContact O-N 3.24Å; G719-I721 PolarHBondContact O-N 3.4Å; G719-I721 VanDerWaalsContact O-N 3.17Å
720	K	77.5	Confident	83.5	Confident	149 Å²	149	70 Å²	70	65%	0.648	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	40.2	-177.3	-60.4	-168.8	172.1	-159.4	0	114	V716 K717 E718	V716-K720 PolarHBondContact O-N 3.16Å; K717-K720 PolarHBondContact O-N 2.82Å; E718-K720 PolarHBondContact O-N 3.49Å
721	I	77.1	Confident	83.5	Confident	66 Å²	66	66.6 Å²	66.6	34%	0.338	33%	0.334	S	S	.	.	S	Bend	trans	-78.7	-35.1	-176.6	-56.1	179.2	0	0	0	110.8	I648 I715 V716 G719	I648-I721 HydrophobicContact CG2-CG2 3.94Å; I715-I721 HydrophobicContact CG2-CD1 4.37Å; V716-I721 HydrophobicContact CG1-CB 4.47Å; V716-I721 PolarHBondContact O-N 3.41Å; V716-I721 VanDerWaalsContact O-N 3.15Å; G719-I721 PolarHBondContact O-N 3.4Å; G719-I721 VanDerWaalsContact O-N 3.17Å
722	L	79.5	Confident	83.7	Confident	20 Å²	20	61.7 Å²	61.7	11%	0.105	31%	0.314	C	S	.	.	S	Bend	trans	-127.9	99.8	170.9	-62.4	175.7	0	0	0	106.5	I652 V716 F730 I806 E810	I652-L722 HydrophobicContact CD1-CD2 4.21Å; V716-L722 HydrophobicContact CG1-CB 3.93Å; V716-L722 HydrophobicContact CG1-CD1 4.02Å; V716-L722 HydrophobicContact CG1-CG 4.05Å; L722-F730 HydrophobicContact CD1-CD2 4.21Å; L722-F730 HydrophobicContact CD1-CE2 4.47Å; L722-F730 HydrophobicContact CD1-CG 4.32Å; L722-I806 HydrophobicContact CD1-CG2 4Å; L722-I806 HydrophobicContact CD2-CG2 4.04Å; L722-E810 VanDerWaalsContact C-OE1 3.31Å; L722-E810 WeakPolarHBondContact CA-OE1 3.45Å; L722-E810 HydrophobicContact CD2-CB 4.38Å; L722-E810 HydrophobicContact CD2-CG 3.88Å
723	E	76.7	Confident	83.8	Confident	99 Å²	99	60.1 Å²	60.1	46%	0.463	31%	0.306	S	S	.	.	S	Bend	trans	-87.6	-35.2	-174.2	-177.4	168	-119.8	0	0	111.9	E810	E723-E810 PolarHBondContact N-OE1 3.27Å
724	Y	77.5	Confident	84.1	Confident	70 Å²	70	59.5 Å²	59.5	28%	0.275	30%	0.301	S	S	.	.	S	Bend	trans	-97.3	-25	-174.4	-53.1	-80.9	0	0	0	112.9	E810 K813	Y724-E810 VanDerWaalsContact CD2-OE1 3.31Å; Y724-E810 WeakPolarHBondContact CD2-OE1 3.49Å; Y724-E810 PolarHBondContact N-OE1 3.25Å; Y724-K813 HydrophobicContact CD1-CB 4.03Å; Y724-K813 HydrophobicContact CD2-CB 3.95Å; Y724-K813 HydrophobicContact CD2-CD 4.26Å; Y724-K813 HydrophobicContact CD2-CG 4.24Å; Y724-K813 HydrophobicContact CE1-CB 4.13Å; Y724-K813 HydrophobicContact CE1-CD 4.02Å; Y724-K813 HydrophobicContact CE2-CB 4.11Å; Y724-K813 HydrophobicContact CE2-CD 3.57Å; Y724-K813 HydrophobicContact CE2-CG 4.03Å; Y724-K813 HydrophobicContact CG-CB 3.98Å; Y724-K813 VanDerWaalsContact CZ-CD 3.45Å
725	S	84.4	Confident	84.5	Confident	12 Å²	12	58.4 Å²	58.4	8%	0.084	30%	0.295	C	S	.	.	S	Bend	trans	-81.1	141.2	-180	-67.7	0	0	0	0	113.6	S727 E810 G815 L816	S725-S727 PolarHBondContact O-N 3.13Å; S725-E810 VanDerWaalsContact CB-OE2 3.29Å; S725-E810 WeakPolarHBondContact CB-OE2 3.06Å; S725-E810 PolarHBondContact N-OE2 3.06Å; S725-E810 VanDerWaalsContact N-OE2 3.09Å; S725-E810 PolarHBondContact OG-OE2 3.27Å; S725-G815 WeakPolarHBondContact OG-CA 3.21Å; S725-L816 PolarHBondContact OG-N 2.99Å
726	N	86.3	Confident	84.8	Confident	57 Å²	57	54.9 Å²	54.9	31%	0.305	28%	0.277	S	S	.	.			trans	-70.5	116.2	178.1	-172.4	-31.9	0	0	0	111.3	F728 C729 F730 L816	N726-F728 PolarHBondContact O-N 3.45Å; N726-F728 VanDerWaalsContact O-N 3.12Å; N726-F728 WeakPolarHBondContact OD1-CB 3.39Å; N726-F728 PolarHBondContact OD1-N 3.11Å; N726-C729 HydrophobicContact CB-CB 4.41Å; N726-C729 WeakPolarHBondContact O-CB 3.42Å; N726-C729 PolarHBondContact O-N 3.19Å; N726-F730 PolarHBondContact O-N 2.95Å; N726-L816 PolarHBondContact N-O 3.42Å
727	S	82.9	Confident	85.3	Confident	39 Å²	39	54.2 Å²	54.2	27%	0.273	27%	0.273	S	S	.	.	H	α-helix	trans	-52.8	-31.7	178.7	-178.5	0	0	0	0	113.8	S725 S731	S725-S727 PolarHBondContact O-N 3.13Å; S727-S731 WeakPolarHBondContact O-CB 3.36Å; S727-S731 PolarHBondContact O-N 2.64Å; S727-S731 PolarHBondContact O-OG 3.13Å
728	F	86.2	Confident	85.8	Confident	129 Å²	129	47.7 Å²	47.7	57%	0.566	25%	0.245	S	C	*	.	H	α-helix	trans	-69.6	-39.3	175.8	-172	-84.7	0	0	0	112.3	N726 F730 S731 L732 W818	N726-F728 PolarHBondContact O-N 3.45Å; N726-F728 VanDerWaalsContact O-N 3.12Å; N726-F728 WeakPolarHBondContact OD1-CB 3.39Å; N726-F728 PolarHBondContact OD1-N 3.11Å; F728-F730 VanDerWaalsContact C-N 3.32Å; F728-F730 PolarHBondContact O-N 3.41Å; F728-S731 PolarHBondContact O-N 3.2Å; F728-L732 WeakPolarHBondContact O-CB 3.41Å; F728-L732 PolarHBondContact O-N 3.03Å; F728-W818 HydrophobicContact CD1-CH2 4.41Å; F728-W818 AromaticContact CD1-CZ2 3.67Å; F728-W818 HydrophobicContact CD1-CZ2 3.67Å; F728-W818 HydrophobicContact CE1-CH2 4.32Å; F728-W818 AromaticContact CE1-CZ2 3.89Å; F728-W818 HydrophobicContact CE1-CZ2 3.89Å
729	C	87.2	Confident	86.1	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-39.6	176.3	-62	0	0	0	0	111.4	N726 L732 L733 L816 W818	N726-C729 HydrophobicContact CB-CB 4.41Å; N726-C729 WeakPolarHBondContact O-CB 3.42Å; N726-C729 PolarHBondContact O-N 3.19Å; C729-L732 PolarHBondContact O-N 2.72Å; C729-L733 PolarHBondContact O-N 3Å; C729-L816 HydrophobicContact CB-CD2 3.77Å; C729-L816 HydrophobicContact CB-CG 4.35Å; C729-W818 VanDerWaalsContact SG-CE2 3.59Å
730	F	87.3	Confident	86.9	Confident	6 Å²	6	39 Å²	39	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-67	-41.2	173.5	-177.4	-110.4	0	0	0	112.2	I652 I712 V716 L722 N726 F728 L732 L733 L734 I806	I652-F730 HydrophobicContact CG2-CE2 4.38Å; I652-F730 HydrophobicContact CG2-CZ 4.35Å; I712-F730 HydrophobicContact CG2-CE1 4.03Å; V716-F730 HydrophobicContact CG2-CE1 3.95Å; L722-F730 HydrophobicContact CD1-CD2 4.21Å; L722-F730 HydrophobicContact CD1-CE2 4.47Å; L722-F730 HydrophobicContact CD1-CG 4.32Å; N726-F730 PolarHBondContact O-N 2.95Å; F728-F730 VanDerWaalsContact C-N 3.32Å; F728-F730 PolarHBondContact O-N 3.41Å; F730-L732 VanDerWaalsContact C-N 3.34Å; F730-L732 PolarHBondContact O-N 3.45Å; F730-L733 WeakPolarHBondContact O-CB 3.27Å; F730-L733 PolarHBondContact O-N 2.63Å; F730-L734 HydrophobicContact CD1-CD1 4.09Å; F730-L734 HydrophobicContact CE1-CD1 3.62Å; F730-L734 HydrophobicContact CE1-CG 4.34Å; F730-L734 HydrophobicContact CZ-CD1 3.98Å; F730-L734 HydrophobicContact CZ-CD2 4.47Å; F730-L734 HydrophobicContact CZ-CG 4.33Å; F730-L734 WeakPolarHBondContact O-CG 3.37Å; F730-L734 PolarHBondContact O-N 3.25Å; F730-L734 VanDerWaalsContact O-N 3.08Å; F730-I806 HydrophobicContact CD2-CD1 4.02Å
731	S	89.5	Confident	87.6	Confident	18 Å²	18	32 Å²	32	13%	0.126	16%	0.162	C	C	.	.	H	α-helix	trans	-62.5	-40	174.9	-57.7	0	0	0	0	112	S727 F728 L734 I735	S727-S731 WeakPolarHBondContact O-CB 3.36Å; S727-S731 PolarHBondContact O-N 2.64Å; S727-S731 PolarHBondContact O-OG 3.13Å; F728-S731 PolarHBondContact O-N 3.2Å; S731-L734 PolarHBondContact O-N 3.39Å; S731-I735 WeakPolarHBondContact O-CG1 3.21Å; S731-I735 PolarHBondContact O-N 3.18Å
732	L	91.6	Very high	88.4	Confident	47 Å²	47	29 Å²	29	25%	0.246	15%	0.146	C	C	.	.	H	α-helix	trans	-63.3	-44.4	175	179.5	63.2	0	0	0	111.8	F728 C729 F730 L734 I735 L736 W818	F728-L732 WeakPolarHBondContact O-CB 3.41Å; F728-L732 PolarHBondContact O-N 3.03Å; C729-L732 PolarHBondContact O-N 2.72Å; F730-L732 VanDerWaalsContact C-N 3.34Å; F730-L732 PolarHBondContact O-N 3.45Å; L732-L734 VanDerWaalsContact C-N 3.31Å; L732-L734 PolarHBondContact O-N 3.35Å; L732-I735 PolarHBondContact O-N 3.22Å; L732-L736 HydrophobicContact CD1-CD1 4.47Å; L732-L736 HydrophobicContact CD1-CG 4.28Å; L732-L736 HydrophobicContact CG-CD1 4.5Å; L732-L736 WeakPolarHBondContact O-CG 3.34Å; L732-L736 PolarHBondContact O-N 3.2Å; L732-W818 HydrophobicContact CD2-CH2 3.93Å; L732-W818 HydrophobicContact CD2-CZ3 4.47Å
733	L	91.6	Very high	89.1	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-55.2	-46.8	173.5	173	66.1	0	0	0	111.2	C729 F730 L736 Y737 F799 A802 I806 F833 L837 L840	C729-L733 PolarHBondContact O-N 3Å; F730-L733 WeakPolarHBondContact O-CB 3.27Å; F730-L733 PolarHBondContact O-N 2.63Å; L733-L736 PolarHBondContact O-N 3.45Å; L733-Y737 VanDerWaalsContact O-CB 3.3Å; L733-Y737 WeakPolarHBondContact O-CB 3.32Å; L733-Y737 PolarHBondContact O-N 2.64Å; L733-F799 HydrophobicContact CD1-CD2 4.32Å; L733-F799 HydrophobicContact CD2-CD2 4.19Å; L733-F799 HydrophobicContact CD2-CE2 4.06Å; L733-F799 HydrophobicContact CG-CD2 4.11Å; L733-F799 HydrophobicContact CG-CE2 4.2Å; L733-A802 HydrophobicContact CD1-CB 3.52Å; L733-A802 HydrophobicContact CD2-CB 3.67Å; L733-A802 HydrophobicContact CG-CB 4.25Å; L733-I806 HydrophobicContact CD2-CD1 3.83Å; L733-F833 HydrophobicContact CB-CZ 4.25Å; L733-F833 HydrophobicContact CD1-CZ 4.29Å; L733-F833 HydrophobicContact CD2-CE2 4.34Å; L733-F833 HydrophobicContact CD2-CZ 4.07Å; L733-F833 HydrophobicContact CG-CZ 4.43Å; L733-L837 HydrophobicContact CB-CD2 4.24Å; L733-L837 HydrophobicContact CD1-CD2 3.85Å; L733-L840 HydrophobicContact CD1-CD1 3.71Å
734	L	91.9	Very high	89.8	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65.6	-40.9	178.8	-67.3	174.6	0	0	0	112.5	V656 W660 V709 I712 F730 S731 L732 Y737 G738 F799	V656-L734 HydrophobicContact CG1-CD2 3.8Å; V656-L734 HydrophobicContact CG2-CD2 4.47Å; W660-L734 HydrophobicContact CH2-CB 4.28Å; W660-L734 HydrophobicContact CH2-CD2 4.47Å; W660-L734 WeakPolarHBondContact CH2-O 3.46Å; V709-L734 HydrophobicContact CB-CB 4.5Å; V709-L734 HydrophobicContact CG1-CB 4.01Å; V709-L734 HydrophobicContact CG1-CD1 4.17Å; V709-L734 HydrophobicContact CG2-CB 3.68Å; V709-L734 HydrophobicContact CG2-CD1 4.45Å; I712-L734 HydrophobicContact CB-CD1 4.46Å; I712-L734 HydrophobicContact CG2-CD1 3.96Å; F730-L734 HydrophobicContact CD1-CD1 4.09Å; F730-L734 HydrophobicContact CE1-CD1 3.62Å; F730-L734 HydrophobicContact CE1-CG 4.34Å; F730-L734 HydrophobicContact CZ-CD1 3.98Å; F730-L734 HydrophobicContact CZ-CD2 4.47Å; F730-L734 HydrophobicContact CZ-CG 4.33Å; F730-L734 WeakPolarHBondContact O-CG 3.37Å; F730-L734 PolarHBondContact O-N 3.25Å; F730-L734 VanDerWaalsContact O-N 3.08Å; S731-L734 PolarHBondContact O-N 3.39Å; L732-L734 VanDerWaalsContact C-N 3.31Å; L732-L734 PolarHBondContact O-N 3.35Å; L734-Y737 PolarHBondContact O-N 3.41Å; L734-G738 PolarHBondContact O-N 3.27Å; L734-F799 HydrophobicContact CD2-CE2 3.72Å; L734-F799 HydrophobicContact CD2-CZ 3.92Å
735	I	93	Very high	90.5	Very high	69 Å²	69	20.3 Å²	20.3	35%	0.354	11%	0.108	S	C	.	.	H	α-helix	trans	-62.1	-45.4	176.4	-69.7	164.4	0	0	0	110.8	V709 S731 L732 G738 S739	V709-I735 HydrophobicContact CG1-CG1 4.26Å; V709-I735 HydrophobicContact CG2-CG1 4.49Å; S731-I735 WeakPolarHBondContact O-CG1 3.21Å; S731-I735 PolarHBondContact O-N 3.18Å; L732-I735 PolarHBondContact O-N 3.22Å; I735-G738 PolarHBondContact O-N 3.44Å; I735-S739 PolarHBondContact O-N 3.14Å
736	L	93.6	Very high	90.9	Very high	26 Å²	26	20.1 Å²	20.1	14%	0.136	11%	0.106	C	C	.	.	H	α-helix	trans	-67.2	-38.9	177.3	-66.2	-172.6	0	0	0	112.1	L732 L733 S739 A740 L837 L840 L841	L732-L736 HydrophobicContact CD1-CD1 4.47Å; L732-L736 HydrophobicContact CD1-CG 4.28Å; L732-L736 HydrophobicContact CG-CD1 4.5Å; L732-L736 WeakPolarHBondContact O-CG 3.34Å; L732-L736 PolarHBondContact O-N 3.2Å; L733-L736 PolarHBondContact O-N 3.45Å; L736-S739 WeakPolarHBondContact O-CA 3.31Å; L736-S739 WeakPolarHBondContact O-CB 3.43Å; L736-S739 PolarHBondContact O-N 2.67Å; L736-S739 VanDerWaalsContact O-N 3.11Å; L736-S739 PolarHBondContact O-OG 2.79Å; L736-A740 PolarHBondContact O-N 2.74Å; L736-A740 VanDerWaalsContact O-N 3.13Å; L736-L837 HydrophobicContact CD1-CB 4.07Å; L736-L837 HydrophobicContact CD1-CD2 4.13Å; L736-L840 HydrophobicContact CB-CB 4.31Å; L736-L841 HydrophobicContact CD1-CD1 4.4Å; L736-L841 HydrophobicContact CD2-CD1 4.22Å; L736-L841 HydrophobicContact CD2-CG 4.05Å
737	Y	93.7	Very high	91.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-44.3	173.2	179.9	-129.8	0	0	0	111.6	W660 L733 L734 S739 A740 I741 Y766 P795 F799 L840	W660-Y737 HydrophobicContact CE3-CD1 4.12Å; W660-Y737 HydrophobicContact CE3-CE1 4.1Å; W660-Y737 HydrophobicContact CH2-CD1 4.42Å; W660-Y737 AromaticContact CZ3-CD1 3.62Å; W660-Y737 HydrophobicContact CZ3-CD1 3.62Å; W660-Y737 HydrophobicContact CZ3-CE1 4.08Å; W660-Y737 HydrophobicContact CZ3-CG 4.44Å; L733-Y737 VanDerWaalsContact O-CB 3.3Å; L733-Y737 WeakPolarHBondContact O-CB 3.32Å; L733-Y737 PolarHBondContact O-N 2.64Å; L734-Y737 PolarHBondContact O-N 3.41Å; Y737-S739 VanDerWaalsContact C-N 3.25Å; Y737-S739 PolarHBondContact O-N 3.46Å; Y737-A740 PolarHBondContact O-N 2.96Å; Y737-A740 VanDerWaalsContact O-N 3.13Å; Y737-I741 HydrophobicContact CD1-CD1 3.6Å; Y737-I741 HydrophobicContact CD2-CD1 3.92Å; Y737-I741 HydrophobicContact CD2-CG1 4.09Å; Y737-I741 HydrophobicContact CE1-CD1 3.28Å; Y737-I741 HydrophobicContact CE1-CG1 4.3Å; Y737-I741 HydrophobicContact CE2-CD1 3.63Å; Y737-I741 HydrophobicContact CE2-CG1 3.73Å; Y737-I741 HydrophobicContact CG-CD1 3.89Å; Y737-I741 VanDerWaalsContact O-CG1 3.29Å; Y737-I741 WeakPolarHBondContact O-CG1 3.32Å; Y737-I741 PolarHBondContact O-N 3.24Å; Y737-Y766 PolarHBondContact OH-OH 3.18Å; Y737-P795 HydrophobicContact CD2-CB 4.24Å; Y737-P795 HydrophobicContact CE2-CB 3.97Å; Y737-P795 WeakPolarHBondContact CE2-O 3.33Å; Y737-F799 HydrophobicContact CD1-CB 4.24Å; Y737-F799 AromaticContact CD1-CD1 3.93Å; Y737-F799 HydrophobicContact CD1-CD1 3.93Å; Y737-F799 AromaticContact CD1-CD2 3.73Å; Y737-F799 HydrophobicContact CD1-CD2 3.73Å; Y737-F799 HydrophobicContact CD1-CE1 4.24Å; Y737-F799 HydrophobicContact CD1-CE2 4.07Å; Y737-F799 AromaticContact CD1-CG 3.67Å; Y737-F799 HydrophobicContact CD1-CG 3.67Å; Y737-F799 HydrophobicContact CD1-CZ 4.31Å; Y737-F799 HydrophobicContact CD2-CB 3.52Å; Y737-F799 HydrophobicContact CD2-CD2 4.33Å; Y737-F799 AromaticContact CD2-CG 3.91Å; Y737-F799 HydrophobicContact CD2-CG 3.91Å; Y737-F799 HydrophobicContact CE1-CB 4.33Å; Y737-F799 AromaticContact CE1-CD1 3.63Å; Y737-F799 HydrophobicContact CE1-CD1 3.63Å; Y737-F799 HydrophobicContact CE1-CD2 4.3Å; Y737-F799 AromaticContact CE1-CE1 3.99Å; Y737-F799 HydrophobicContact CE1-CE1 3.99Å; Y737-F799 AromaticContact CE1-CG 3.81Å; Y737-F799 HydrophobicContact CE1-CG 3.81Å; Y737-F799 HydrophobicContact CE1-CZ 4.48Å; Y737-F799 HydrophobicContact CE2-CB 3.62Å; Y737-F799 HydrophobicContact CE2-CD1 4.33Å; Y737-F799 HydrophobicContact CE2-CG 4.03Å; Y737-F799 HydrophobicContact CG-CB 3.87Å; Y737-F799 HydrophobicContact CG-CD1 4.43Å; Y737-F799 AromaticContact CG-CD2 3.77Å; Y737-F799 HydrophobicContact CG-CD2 3.77Å; Y737-F799 HydrophobicContact CG-CE2 4.48Å; Y737-F799 AromaticContact CG-CG 3.75Å; Y737-F799 HydrophobicContact CG-CG 3.75Å; Y737-F799 AromaticContact CZ-CD1 3.87Å; Y737-L840 HydrophobicContact CD2-CD2 4.15Å
738	G	91.4	Very high	91.4	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.01	9%	0.093	C	C	.	.	H	α-helix	trans	-58.4	-36.1	171.4	0	0	0	0	0	113.1	L734 I735 A740 I741 I742	L734-G738 PolarHBondContact O-N 3.27Å; I735-G738 PolarHBondContact O-N 3.44Å; G738-A740 VanDerWaalsContact C-N 3.32Å; G738-A740 PolarHBondContact O-N 3.46Å; G738-I741 PolarHBondContact O-N 2.84Å; G738-I742 WeakPolarHBondContact O-CG1 3.3Å; G738-I742 PolarHBondContact O-N 3.05Å; G738-I742 VanDerWaalsContact O-N 3.17Å
739	S	91.4	Very high	91.6	Very high	9 Å²	9	12.5 Å²	12.5	6%	0.063	7%	0.067	C	C	.	.	H	α-helix	trans	-65.4	-30.6	175.7	89.2	0	0	0	0	114.2	I735 L736 Y737 P743	I735-S739 PolarHBondContact O-N 3.14Å; L736-S739 WeakPolarHBondContact O-CA 3.31Å; L736-S739 WeakPolarHBondContact O-CB 3.43Å; L736-S739 PolarHBondContact O-N 2.67Å; L736-S739 VanDerWaalsContact O-N 3.11Å; L736-S739 PolarHBondContact O-OG 2.79Å; Y737-S739 VanDerWaalsContact C-N 3.25Å; Y737-S739 PolarHBondContact O-N 3.46Å; S739-P743 WeakPolarHBondContact O-CD 3.32Å; S739-P743 WeakPolarHBondContact O-CG 3.47Å
740	A	94.1	Very high	91.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-81.9	-39.6	175.4	0	0	0	0	0	112.2	L736 Y737 G738 P743 Q744 P795 L840 D843	L736-A740 PolarHBondContact O-N 2.74Å; L736-A740 VanDerWaalsContact O-N 3.13Å; Y737-A740 PolarHBondContact O-N 2.96Å; Y737-A740 VanDerWaalsContact O-N 3.13Å; G738-A740 VanDerWaalsContact C-N 3.32Å; G738-A740 PolarHBondContact O-N 3.46Å; A740-P743 WeakPolarHBondContact O-CD 3.23Å; A740-Q744 PolarHBondContact O-N 3.46Å; A740-P795 HydrophobicContact CB-CB 3.88Å; A740-P795 HydrophobicContact CB-CG 3.87Å; A740-L840 HydrophobicContact CB-CD2 4.41Å; A740-D843 HydrophobicContact CB-CB 4.04Å
741	I	93	Very high	91.3	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-63.7	-45.6	-179.2	-67.6	161.2	0	0	0	111.9	W660 V664 Y737 G738 Q744 T745 Y766	W660-I741 HydrophobicContact CE3-CD1 3.51Å; W660-I741 HydrophobicContact CZ3-CD1 3.66Å; V664-I741 HydrophobicContact CG2-CG2 3.61Å; Y737-I741 HydrophobicContact CD1-CD1 3.6Å; Y737-I741 HydrophobicContact CD2-CD1 3.92Å; Y737-I741 HydrophobicContact CD2-CG1 4.09Å; Y737-I741 HydrophobicContact CE1-CD1 3.28Å; Y737-I741 HydrophobicContact CE1-CG1 4.3Å; Y737-I741 HydrophobicContact CE2-CD1 3.63Å; Y737-I741 HydrophobicContact CE2-CG1 3.73Å; Y737-I741 HydrophobicContact CG-CD1 3.89Å; Y737-I741 VanDerWaalsContact O-CG1 3.29Å; Y737-I741 WeakPolarHBondContact O-CG1 3.32Å; Y737-I741 PolarHBondContact O-N 3.24Å; G738-I741 PolarHBondContact O-N 2.84Å; I741-Q744 CarbonylContact O-C 3.59Å; I741-Q744 WeakPolarHBondContact O-CA 3.36Å; I741-Q744 WeakPolarHBondContact O-CB 3.45Å; I741-Q744 PolarHBondContact O-N 3.32Å; I741-T745 HydrophobicContact CG2-CG2 3.94Å; I741-T745 WeakPolarHBondContact O-CG2 3.44Å; I741-T745 PolarHBondContact O-N 3.37Å; I741-Y766 HydrophobicContact CD1-CE2 4.32Å; I741-Y766 HydrophobicContact CG1-CE2 4.28Å; I741-Y766 HydrophobicContact CG2-CE2 4.23Å
742	I	93.6	Very high	91	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-57	-52.1	-174.7	-66.2	163	0	0	0	111.1	I667 Y698 G701 M702 L705 G738 Q744 T745 F746	I667-I742 HydrophobicContact CD1-CG1 4.46Å; Y698-I742 HydrophobicContact CD2-CB 4.17Å; Y698-I742 HydrophobicContact CD2-CG2 3.71Å; Y698-I742 HydrophobicContact CE2-CB 4.37Å; Y698-I742 HydrophobicContact CE2-CG2 4.4Å; Y698-I742 HydrophobicContact CG-CG2 4.45Å; G701-I742 VanDerWaalsContact C-CD1 3.48Å; M702-I742 HydrophobicContact CB-CD1 4.38Å; M702-I742 HydrophobicContact CG-CD1 3.79Å; M702-I742 HydrophobicContact SD-CD1 4.02Å; L705-I742 HydrophobicContact CD1-CD1 3.91Å; L705-I742 HydrophobicContact CD1-CG1 3.91Å; G738-I742 WeakPolarHBondContact O-CG1 3.3Å; G738-I742 PolarHBondContact O-N 3.05Å; G738-I742 VanDerWaalsContact O-N 3.17Å; I742-Q744 PolarHBondContact O-N 2.96Å; I742-T745 PolarHBondContact O-N 3.31Å; I742-T745 PolarHBondContact O-OG1 3.41Å; I742-F746 HydrophobicContact CG2-CD1 4.45Å; I742-F746 HydrophobicContact CG2-CD2 4.39Å; I742-F746 HydrophobicContact CG2-CE1 3.76Å; I742-F746 HydrophobicContact CG2-CE2 3.69Å; I742-F746 HydrophobicContact CG2-CZ 3.31Å; I742-F746 WeakPolarHBondContact O-CD1 3.4Å; I742-F746 WeakPolarHBondContact O-CG 3.33Å; I742-F746 PolarHBondContact O-N 2.95Å
743	P	93.3	Very high	90.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.3	-38	170.4	-26.9	37.1	0	0	0	114.8	Y698 S739 A740 T745 F746 L747 G844 S848 T851	Y698-P743 HydrophobicContact CD2-CG 4.4Å; Y698-P743 HydrophobicContact CE2-CG 4.15Å; S739-P743 WeakPolarHBondContact O-CD 3.32Å; S739-P743 WeakPolarHBondContact O-CG 3.47Å; A740-P743 WeakPolarHBondContact O-CD 3.23Å; P743-T745 VanDerWaalsContact C-N 3.33Å; P743-T745 PolarHBondContact O-N 3.26Å; P743-F746 WeakPolarHBondContact O-CB 3.23Å; P743-F746 PolarHBondContact O-N 2.87Å; P743-L747 PolarHBondContact O-N 3.36Å; P743-G844 WeakPolarHBondContact CG-O 3.15Å; P743-S848 WeakPolarHBondContact CB-OG 3.12Å; P743-S848 VanDerWaalsContact CG-OG 3.32Å; P743-S848 WeakPolarHBondContact CG-OG 3.48Å; P743-T851 PolarHBondContact O-OG1 3.42Å
744	Q	93.2	Very high	89.5	Confident	5 Å²	5	27 Å²	27	2%	0.023	13%	0.129	C	C	.	.	H	α-helix	trans	-60.6	-42	174.7	-166.8	-167.5	50.1	0	0	111.2	A740 I741 I742 L747 L748 Y847	A740-Q744 PolarHBondContact O-N 3.46Å; I741-Q744 CarbonylContact O-C 3.59Å; I741-Q744 WeakPolarHBondContact O-CA 3.36Å; I741-Q744 WeakPolarHBondContact O-CB 3.45Å; I741-Q744 PolarHBondContact O-N 3.32Å; I742-Q744 PolarHBondContact O-N 2.96Å; Q744-L747 PolarHBondContact O-N 2.86Å; Q744-L748 WeakPolarHBondContact O-CG 3.41Å; Q744-L748 PolarHBondContact O-N 3.32Å; Q744-L748 VanDerWaalsContact O-N 3.09Å; Q744-Y847 HydrophobicContact CB-CD1 4.32Å; Q744-Y847 HydrophobicContact CB-CD2 4.37Å; Q744-Y847 HydrophobicContact CB-CG 4.22Å; Q744-Y847 HydrophobicContact CG-CD1 4.24Å; Q744-Y847 HydrophobicContact CG-CE1 4.03Å; Q744-Y847 HydrophobicContact CG-CE2 4.47Å
745	T	91.9	Very high	88.9	Confident	2 Å²	2	27 Å²	27	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-68.2	-33	174.7	69.3	0	0	0	0	112.7	V664 I741 I742 P743 L748 S749	V664-T745 HydrophobicContact CB-CG2 4.15Å; V664-T745 HydrophobicContact CG1-CG2 3.59Å; V664-T745 HydrophobicContact CG2-CG2 3.92Å; I741-T745 HydrophobicContact CG2-CG2 3.94Å; I741-T745 WeakPolarHBondContact O-CG2 3.44Å; I741-T745 PolarHBondContact O-N 3.37Å; I742-T745 PolarHBondContact O-N 3.31Å; I742-T745 PolarHBondContact O-OG1 3.41Å; P743-T745 VanDerWaalsContact C-N 3.33Å; P743-T745 PolarHBondContact O-N 3.26Å; T745-L748 PolarHBondContact O-N 3.17Å; T745-S749 WeakPolarHBondContact O-CB 3.46Å; T745-S749 PolarHBondContact O-N 3.11Å
746	F	92.1	Very high	88.1	Confident	9 Å²	9	27 Å²	27	4%	0.039	13%	0.129	C	C	.	.	H	α-helix	trans	-64.9	-44.7	173.9	-64.8	-13.3	0	0	0	111.2	I667 V671 W694 W697 I742 P743 L748 S749 V750 T851	I667-F746 HydrophobicContact CG2-CD1 4.41Å; I667-F746 HydrophobicContact CG2-CE1 3.83Å; V671-F746 HydrophobicContact CG2-CE1 4.36Å; W694-F746 HydrophobicContact CD2-CD2 4.44Å; W694-F746 HydrophobicContact CE3-CB 4.05Å; W694-F746 HydrophobicContact CE3-CD1 4.13Å; W694-F746 AromaticContact CE3-CD2 3.56Å; W694-F746 HydrophobicContact CE3-CD2 3.56Å; W694-F746 HydrophobicContact CE3-CE1 4.46Å; W694-F746 AromaticContact CE3-CE2 3.94Å; W694-F746 HydrophobicContact CE3-CE2 3.94Å; W694-F746 AromaticContact CE3-CG 3.67Å; W694-F746 HydrophobicContact CE3-CG 3.67Å; W694-F746 HydrophobicContact CE3-CZ 4.38Å; W694-F746 HydrophobicContact CH2-CB 4.11Å; W694-F746 HydrophobicContact CH2-CG 4.5Å; W694-F746 HydrophobicContact CZ3-CB 3.58Å; W694-F746 AromaticContact CZ3-CD1 3.8Å; W694-F746 HydrophobicContact CZ3-CD1 3.8Å; W694-F746 AromaticContact CZ3-CD2 3.93Å; W694-F746 HydrophobicContact CZ3-CD2 3.93Å; W694-F746 HydrophobicContact CZ3-CE1 4.44Å; W694-F746 AromaticContact CZ3-CG 3.51Å; W694-F746 HydrophobicContact CZ3-CG 3.51Å; W697-F746 HydrophobicContact CB-CE1 4.04Å; W697-F746 HydrophobicContact CB-CE2 4.5Å; W697-F746 HydrophobicContact CB-CZ 3.65Å; I742-F746 HydrophobicContact CG2-CD1 4.45Å; I742-F746 HydrophobicContact CG2-CD2 4.39Å; I742-F746 HydrophobicContact CG2-CE1 3.76Å; I742-F746 HydrophobicContact CG2-CE2 3.69Å; I742-F746 HydrophobicContact CG2-CZ 3.31Å; I742-F746 WeakPolarHBondContact O-CD1 3.4Å; I742-F746 WeakPolarHBondContact O-CG 3.33Å; I742-F746 PolarHBondContact O-N 2.95Å; P743-F746 WeakPolarHBondContact O-CB 3.23Å; P743-F746 PolarHBondContact O-N 2.87Å; F746-L748 PolarHBondContact O-N 3.44Å; F746-S749 WeakPolarHBondContact O-CB 3.47Å; F746-S749 PolarHBondContact O-N 2.94Å; F746-S749 VanDerWaalsContact O-N 3.14Å; F746-S749 PolarHBondContact O-OG 3.13Å; F746-V750 PolarHBondContact O-N 3.06Å; F746-T851 HydrophobicContact CB-CG2 3.8Å
747	L	91	Very high	87.2	Confident	29 Å²	29	28 Å²	28	15%	0.152	14%	0.135	C	C	.	.	H	α-helix	trans	-58.1	-47.8	174.7	-179.8	62	0	0	0	111.1	P743 Q744 S749 V750 F751 Y847 F850 T851 A854	P743-L747 PolarHBondContact O-N 3.36Å; Q744-L747 PolarHBondContact O-N 2.86Å; L747-S749 VanDerWaalsContact C-N 3.3Å; L747-S749 PolarHBondContact O-N 3.38Å; L747-V750 WeakPolarHBondContact O-CB 3.49Å; L747-V750 PolarHBondContact O-N 3.36Å; L747-F751 HydrophobicContact CD1-CE2 4.32Å; L747-F751 HydrophobicContact CG-CE2 4.45Å; L747-F751 WeakPolarHBondContact O-CD2 3.14Å; L747-Y847 HydrophobicContact CD2-CD1 3.68Å; L747-Y847 HydrophobicContact CD2-CE1 4.01Å; L747-F850 HydrophobicContact CD1-CB 4.15Å; L747-F850 HydrophobicContact CD2-CB 4.11Å; L747-F850 HydrophobicContact CD2-CD2 4.38Å; L747-T851 WeakPolarHBondContact CA-OG1 3.49Å; L747-T851 PolarHBondContact N-OG1 2.89Å; L747-T851 VanDerWaalsContact N-OG1 3.16Å; L747-A854 HydrophobicContact CD1-CB 4Å
748	L	88.6	Confident	86.6	Confident	33 Å²	33	28 Å²	28	17%	0.173	14%	0.135	C	C	.	.	H	α-helix	trans	-59.8	-39	176.6	-68.4	172.6	0	0	0	112	M668 Q744 T745 F746 V750 F751 F752 L769	M668-L748 HydrophobicContact SD-CB 3.61Å; Q744-L748 WeakPolarHBondContact O-CG 3.41Å; Q744-L748 PolarHBondContact O-N 3.32Å; Q744-L748 VanDerWaalsContact O-N 3.09Å; T745-L748 PolarHBondContact O-N 3.17Å; F746-L748 PolarHBondContact O-N 3.44Å; L748-V750 PolarHBondContact O-N 3.19Å; L748-F751 PolarHBondContact O-N 3.22Å; L748-F752 VanDerWaalsContact O-CD2 3.24Å; L748-F752 WeakPolarHBondContact O-CD2 3.48Å; L748-L769 HydrophobicContact CD1-CD1 4.17Å
749	S	89.9	Confident	86.1	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.014	14%	0.142	C	C	.	.	H	α-helix	trans	-60.3	-28.5	178.4	86.1	0	0	0	0	113.9	K675 T745 F746 L747 F751 F752	K675-S749 PolarHBondContact NZ-O 2.84Å; T745-S749 WeakPolarHBondContact O-CB 3.46Å; T745-S749 PolarHBondContact O-N 3.11Å; F746-S749 WeakPolarHBondContact O-CB 3.47Å; F746-S749 PolarHBondContact O-N 2.94Å; F746-S749 VanDerWaalsContact O-N 3.14Å; F746-S749 PolarHBondContact O-OG 3.13Å; L747-S749 VanDerWaalsContact C-N 3.3Å; L747-S749 PolarHBondContact O-N 3.38Å; S749-F751 PolarHBondContact O-N 3.22Å; S749-F752 PolarHBondContact O-N 2.87Å
750	V	86.3	Confident	85.2	Confident	18 Å²	18	29.4 Å²	29.4	11%	0.109	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-30.4	-179.1	179	0	0	0	0	111.4	K675 F746 L747 L748 T851 A854	K675-V750 PolarHBondContact NZ-O 3.04Å; F746-V750 PolarHBondContact O-N 3.06Å; L747-V750 WeakPolarHBondContact O-CB 3.49Å; L747-V750 PolarHBondContact O-N 3.36Å; L748-V750 PolarHBondContact O-N 3.19Å; V750-T851 HydrophobicContact CG2-CG2 4.47Å; V750-A854 HydrophobicContact CG1-CB 4.23Å
751	F	83.3	Confident	84.3	Confident	140 Å²	140	33.4 Å²	33.4	61%	0.614	17%	0.169	S	C	*	.	H	α-helix	trans	-82	-20.2	-179	-60.3	-75.1	0	0	0	114.1	L747 L748 S749	L747-F751 HydrophobicContact CD1-CE2 4.32Å; L747-F751 HydrophobicContact CG-CE2 4.45Å; L747-F751 WeakPolarHBondContact O-CD2 3.14Å; L748-F751 PolarHBondContact O-N 3.22Å; S749-F751 PolarHBondContact O-N 3.22Å
752	F	81.9	Confident	83.7	Confident	24 Å²	24	33.3 Å²	33.3	11%	0.105	17%	0.168	C	C	.	.			trans	-89.2	149.2	-178.5	-67.3	-77.3	0	0	0	113.5	M668 V672 K675 L748 S749 L757 A758 M761 L765	M668-F752 HydrophobicContact CE-CD2 3.55Å; M668-F752 HydrophobicContact CE-CE2 3.4Å; M668-F752 VanDerWaalsContact CE-CE2 3.4Å; M668-F752 HydrophobicContact CE-CG 4.46Å; M668-F752 HydrophobicContact CE-CZ 4.21Å; M668-F752 HydrophobicContact SD-CD2 4.2Å; M668-F752 HydrophobicContact SD-CE2 4.2Å; V672-F752 HydrophobicContact CG1-CB 4.13Å; V672-F752 HydrophobicContact CG2-CB 4.01Å; K675-F752 PolarHBondContact NZ-O 3.43Å; L748-F752 VanDerWaalsContact O-CD2 3.24Å; L748-F752 WeakPolarHBondContact O-CD2 3.48Å; S749-F752 PolarHBondContact O-N 2.87Å; F752-L757 HydrophobicContact CD1-CD2 4.49Å; F752-A758 HydrophobicContact CB-CB 3.83Å; F752-A758 HydrophobicContact CD1-CB 4.29Å; F752-A758 HydrophobicContact CD2-CB 4.19Å; F752-A758 HydrophobicContact CG-CB 3.84Å; F752-M761 HydrophobicContact CE1-CB 3.95Å; F752-M761 HydrophobicContact CE1-CE 4.46Å; F752-M761 HydrophobicContact CE1-SD 4.01Å; F752-M761 HydrophobicContact CZ-CB 3.93Å; F752-L765 HydrophobicContact CE2-CD1 4.16Å; F752-L765 HydrophobicContact CZ-CD1 3.77Å
753	K	76.5	Confident	83.2	Confident	108 Å²	108	34 Å²	34	47%	0.47	17%	0.174	S	C	.	.	S	Bend	trans	-117	-17.9	174.9	-66.1	-168.8	174.8	-166.2	0	114.6	D861	K753-D861 IonicContact NZ-OD1 3.24Å; K753-D861 PolarHBondContact NZ-OD1 2.88Å; K753-D861 IonicContact NZ-OD2 2.76Å; K753-D861 PolarHBondContact NZ-OD2 2.86Å
754	Q	76	Confident	82.4	Confident	89 Å²	89	37.7 Å²	37.7	42%	0.416	20%	0.197	S	C	.	.			trans	-121.5	129.6	-179.6	-71.3	-174.7	-2.4	0	0	110.1	V672 L757 A758 S1790	V672-Q754 VanDerWaalsContact CG1-C 3.48Å; Q754-L757 HydrophobicContact CB-CB 4.03Å; Q754-L757 PolarHBondContact O-N 3.25Å; Q754-A758 WeakPolarHBondContact O-CB 3.45Å; Q754-A758 PolarHBondContact O-N 2.96Å; Q754-S1790 PolarHBondContact OE1-OG 2.88Å
755	A	78.8	Confident	81.8	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-71.6	-38.7	-169.6	0	0	0	0	0	114.5	K669 V672 T673 A758 A759	K669-A755 HydrophobicContact CG-CB 4.18Å; V672-A755 HydrophobicContact CB-CB 4.31Å; V672-A755 HydrophobicContact CG1-CB 4.25Å; T673-A755 HydrophobicContact CG2-CB 3.33Å; A755-A758 WeakPolarHBondContact O-CB 3.37Å; A755-A758 PolarHBondContact O-N 3.42Å; A755-A759 PolarHBondContact O-N 3.12Å
756	N	77	Confident	81.6	Confident	67 Å²	67	39.9 Å²	39.9	36%	0.358	21%	0.208	S	C	.	.	H	α-helix	trans	-71.7	-33.1	178.4	-67.9	-20.6	0	0	0	112	K669 G760 L1791	K669-N756 WeakPolarHBondContact CE-OD1 3.4Å; N756-G760 PolarHBondContact O-N 2.76Å; N756-L1791 HydrophobicContact CB-CD1 4.14Å
757	L	73.1	Confident	81.2	Confident	47 Å²	47	43.1 Å²	43.1	25%	0.246	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-46.1	171.1	-176.6	69.1	0	0	0	110.3	F752 Q754 M761 M1794	F752-L757 HydrophobicContact CD1-CD2 4.49Å; Q754-L757 HydrophobicContact CB-CB 4.03Å; Q754-L757 PolarHBondContact O-N 3.25Å; L757-M761 HydrophobicContact CD1-CG 3.99Å; L757-M761 HydrophobicContact CD1-SD 3.62Å; L757-M761 HydrophobicContact CD2-SD 4.42Å; L757-M761 HydrophobicContact CG-CG 4.36Å; L757-M761 HydrophobicContact CG-SD 3.9Å; L757-M761 VanDerWaalsContact O-CB 3.31Å; L757-M761 WeakPolarHBondContact O-CB 3.18Å; L757-M761 PolarHBondContact O-N 2.93Å; L757-M1794 HydrophobicContact CD1-CE 3.97Å
758	A	82.2	Confident	80.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.4	-50.7	174.8	0	0	0	0	0	111.5	M668 V672 F752 Q754 A755 G760 G762	M668-A758 HydrophobicContact CE-CB 3.81Å; M668-A758 WeakPolarHBondContact CE-O 3.34Å; V672-A758 HydrophobicContact CB-CB 3.98Å; V672-A758 HydrophobicContact CG1-CB 4.05Å; V672-A758 HydrophobicContact CG2-CB 3.81Å; F752-A758 HydrophobicContact CB-CB 3.83Å; F752-A758 HydrophobicContact CD1-CB 4.29Å; F752-A758 HydrophobicContact CD2-CB 4.19Å; F752-A758 HydrophobicContact CG-CB 3.84Å; Q754-A758 WeakPolarHBondContact O-CB 3.45Å; Q754-A758 PolarHBondContact O-N 2.96Å; A755-A758 WeakPolarHBondContact O-CB 3.37Å; A755-A758 PolarHBondContact O-N 3.42Å; A758-G760 PolarHBondContact O-N 3.19Å; A758-G762 VanDerWaalsContact O-CA 3.32Å; A758-G762 WeakPolarHBondContact O-CA 3.17Å; A758-G762 PolarHBondContact O-N 2.91Å
759	A	80.1	Confident	80.5	Confident	19 Å²	19	46.7 Å²	46.7	16%	0.157	24%	0.241	C	C	.	.	H	α-helix	trans	-51.9	-53.1	-178.8	0	0	0	0	0	112.8	A665 K669 A755 A763	A665-A759 WeakPolarHBondContact CB-O 3.23Å; K669-A759 HydrophobicContact CB-CB 3.89Å; K669-A759 HydrophobicContact CD-CB 4.19Å; K669-A759 HydrophobicContact CG-CB 4.11Å; A755-A759 PolarHBondContact O-N 3.12Å; A759-A763 PolarHBondContact O-N 3.46Å
760	G	72.9	Confident	80.3	Confident	22 Å²	22	46.7 Å²	46.7	23%	0.227	24%	0.241	C	C	.	.	H	α-helix	trans	-77.6	-41.8	-177.2	0	0	0	0	0	114.3	N756 A758 G762 V764	N756-G760 PolarHBondContact O-N 2.76Å; A758-G760 PolarHBondContact O-N 3.19Å; G760-G762 VanDerWaalsContact C-N 3.28Å; G760-G762 PolarHBondContact O-N 3.33Å; G760-V764 WeakPolarHBondContact O-CG2 3.45Å; G760-V764 PolarHBondContact O-N 3.26Å
761	M	75.6	Confident	79.9	Confident	83 Å²	83	49.4 Å²	49.4	41%	0.409	26%	0.255	S	S	.	.	H	α-helix	trans	-68.7	-28.7	175	-72.2	-168.6	68.1	0	0	112.5	F752 L757 V764 L765 M1794	F752-M761 HydrophobicContact CE1-CB 3.95Å; F752-M761 HydrophobicContact CE1-CE 4.46Å; F752-M761 HydrophobicContact CE1-SD 4.01Å; F752-M761 HydrophobicContact CZ-CB 3.93Å; L757-M761 HydrophobicContact CD1-CG 3.99Å; L757-M761 HydrophobicContact CD1-SD 3.62Å; L757-M761 HydrophobicContact CD2-SD 4.42Å; L757-M761 HydrophobicContact CG-CG 4.36Å; L757-M761 HydrophobicContact CG-SD 3.9Å; L757-M761 VanDerWaalsContact O-CB 3.31Å; L757-M761 WeakPolarHBondContact O-CB 3.18Å; L757-M761 PolarHBondContact O-N 2.93Å; M761-V764 PolarHBondContact O-N 2.92Å; M761-L765 VanDerWaalsContact O-CB 3.25Å; M761-L765 WeakPolarHBondContact O-CB 3.28Å; M761-L765 WeakPolarHBondContact O-CD1 3.26Å; M761-L765 VanDerWaalsContact O-CG 3.29Å; M761-L765 WeakPolarHBondContact O-CG 2.94Å; M761-L765 PolarHBondContact O-N 3.05Å; M761-M1794 HydrophobicContact CG-CE 4.31Å
762	G	81.4	Confident	79.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-69	-43.2	177.1	0	0	0	0	0	112.7	A758 G760 V764 L765 Y766	A758-G762 VanDerWaalsContact O-CA 3.32Å; A758-G762 WeakPolarHBondContact O-CA 3.17Å; A758-G762 PolarHBondContact O-N 2.91Å; G760-G762 VanDerWaalsContact C-N 3.28Å; G760-G762 PolarHBondContact O-N 3.33Å; G762-V764 VanDerWaalsContact C-N 3.34Å; G762-L765 PolarHBondContact O-N 2.9Å; G762-Y766 VanDerWaalsContact O-CB 3.25Å; G762-Y766 WeakPolarHBondContact O-CB 3.41Å; G762-Y766 PolarHBondContact O-N 3.48Å
763	A	81	Confident	80	Confident	15 Å²	15	44.2 Å²	44.2	12%	0.124	24%	0.237	C	C	.	.	H	α-helix	trans	-55.2	-50.1	169.7	0	0	0	0	0	111.4	M661 A665 A759 Y766 F767	M661-A763 HydrophobicContact CG-CB 3.59Å; M661-A763 HydrophobicContact SD-CB 3.98Å; A665-A763 HydrophobicContact CB-CB 4.22Å; A759-A763 PolarHBondContact O-N 3.46Å; A763-Y766 PolarHBondContact O-N 2.95Å; A763-F767 PolarHBondContact O-N 3.28Å; A763-F767 VanDerWaalsContact O-N 3.1Å
764	V	76.6	Confident	79.8	Confident	79 Å²	79	41.6 Å²	41.6	48%	0.479	23%	0.226	S	C	.	.	H	α-helix	trans	-64.9	-44.6	179.3	174.8	0	0	0	0	111.7	G760 M761 G762 F767 L768	G760-V764 WeakPolarHBondContact O-CG2 3.45Å; G760-V764 PolarHBondContact O-N 3.26Å; M761-V764 PolarHBondContact O-N 2.92Å; G762-V764 VanDerWaalsContact C-N 3.34Å; V764-F767 PolarHBondContact O-N 3.44Å; V764-L768 HydrophobicContact CG1-CD1 3.87Å; V764-L768 HydrophobicContact CG1-CG 4.21Å; V764-L768 WeakPolarHBondContact O-CB 3.48Å; V764-L768 VanDerWaalsContact O-CG 3.27Å; V764-L768 WeakPolarHBondContact O-CG 3.37Å; V764-L768 PolarHBondContact O-N 3.35Å
765	L	81.7	Confident	79.6	Confident	51 Å²	51	40.3 Å²	40.3	27%	0.267	23%	0.231	S	C	.	.	H	α-helix	trans	-61.4	-44.5	176.7	-82.9	162.4	0	0	0	111.6	F752 M761 G762 F767 L768 L769	F752-L765 HydrophobicContact CE2-CD1 4.16Å; F752-L765 HydrophobicContact CZ-CD1 3.77Å; M761-L765 VanDerWaalsContact O-CB 3.25Å; M761-L765 WeakPolarHBondContact O-CB 3.28Å; M761-L765 WeakPolarHBondContact O-CD1 3.26Å; M761-L765 VanDerWaalsContact O-CG 3.29Å; M761-L765 WeakPolarHBondContact O-CG 2.94Å; M761-L765 PolarHBondContact O-N 3.05Å; G762-L765 PolarHBondContact O-N 2.9Å; L765-F767 VanDerWaalsContact C-N 3.32Å; L765-F767 PolarHBondContact O-N 3.47Å; L765-L768 PolarHBondContact O-N 3.46Å; L765-L769 WeakPolarHBondContact O-CB 3.23Å; L765-L769 WeakPolarHBondContact O-CG 3.46Å; L765-L769 PolarHBondContact O-N 2.81Å
766	Y	87.4	Confident	79.3	Confident	1 Å²	1	42.8 Å²	42.8	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-38.7	177.5	173	-104.9	0	0	0	112.4	V657 M661 V664 Y737 I741 G762 A763 F770 Q796	V657-Y766 HydrophobicContact CG1-CD1 4.44Å; V657-Y766 HydrophobicContact CG1-CE1 3.76Å; V657-Y766 WeakPolarHBondContact O-CE1 3.21Å; M661-Y766 HydrophobicContact CB-CD1 4.32Å; M661-Y766 HydrophobicContact CG-CD1 4.5Å; V664-Y766 HydrophobicContact CB-CG 4.46Å; V664-Y766 HydrophobicContact CG1-CD2 4.34Å; V664-Y766 HydrophobicContact CG1-CG 4.02Å; V664-Y766 HydrophobicContact CG2-CD1 4.39Å; V664-Y766 HydrophobicContact CG2-CD2 4.12Å; V664-Y766 HydrophobicContact CG2-CE1 4.37Å; V664-Y766 HydrophobicContact CG2-CE2 4.13Å; V664-Y766 HydrophobicContact CG2-CG 4.27Å; Y737-Y766 PolarHBondContact OH-OH 3.18Å; I741-Y766 HydrophobicContact CD1-CE2 4.32Å; I741-Y766 HydrophobicContact CG1-CE2 4.28Å; I741-Y766 HydrophobicContact CG2-CE2 4.23Å; G762-Y766 VanDerWaalsContact O-CB 3.25Å; G762-Y766 WeakPolarHBondContact O-CB 3.41Å; G762-Y766 PolarHBondContact O-N 3.48Å; A763-Y766 PolarHBondContact O-N 2.95Å; Y766-F770 PolarHBondContact O-N 3.01Å; Y766-Q796 VanDerWaalsContact CD2-NE2 3.25Å; Y766-Q796 VanDerWaalsContact CE2-NE2 3.27Å
767	F	82.8	Confident	79	Confident	77 Å²	77	39.7 Å²	39.7	34%	0.338	23%	0.227	S	C	.	.	H	α-helix	trans	-70.4	-41.8	172.2	-177	-100.1	0	0	0	112.8	A763 V764 L765 L769 F770 L771	A763-F767 PolarHBondContact O-N 3.28Å; A763-F767 VanDerWaalsContact O-N 3.1Å; V764-F767 PolarHBondContact O-N 3.44Å; L765-F767 VanDerWaalsContact C-N 3.32Å; L765-F767 PolarHBondContact O-N 3.47Å; F767-L769 PolarHBondContact O-N 2.89Å; F767-F770 WeakPolarHBondContact O-CB 3.18Å; F767-F770 PolarHBondContact O-N 3.46Å; F767-L771 HydrophobicContact CE1-CD2 3.89Å; F767-L771 HydrophobicContact CE1-CG 4.35Å; F767-L771 HydrophobicContact CZ-CD2 4.05Å; F767-L771 PolarHBondContact O-N 3.47Å
768	L	78.6	Confident	78.2	Confident	91 Å²	91	38 Å²	38	48%	0.476	22%	0.218	S	C	.	.	H	α-helix	trans	-61.4	-33	175	-73.4	173.8	0	0	0	112.3	V764 L765 F770 L771 P772	V764-L768 HydrophobicContact CG1-CD1 3.87Å; V764-L768 HydrophobicContact CG1-CG 4.21Å; V764-L768 WeakPolarHBondContact O-CB 3.48Å; V764-L768 VanDerWaalsContact O-CG 3.27Å; V764-L768 WeakPolarHBondContact O-CG 3.37Å; V764-L768 PolarHBondContact O-N 3.35Å; L765-L768 PolarHBondContact O-N 3.46Å; L768-F770 PolarHBondContact O-N 2.97Å; L768-L771 HydrophobicContact CD2-CD1 3.81Å; L768-L771 PolarHBondContact O-N 3.37Å; L768-P772 WeakPolarHBondContact O-CD 3.25Å
769	L	86.7	Confident	77.4	Confident	47 Å²	47	44 Å²	44	25%	0.246	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-15.6	174.4	-71.4	169.8	0	0	0	112.6	L748 L765 F767 H794	L748-L769 HydrophobicContact CD1-CD1 4.17Å; L765-L769 WeakPolarHBondContact O-CB 3.23Å; L765-L769 WeakPolarHBondContact O-CG 3.46Å; L765-L769 PolarHBondContact O-N 2.81Å; F767-L769 PolarHBondContact O-N 2.89Å; L769-H794 WeakPolarHBondContact CD2-NE2 3.39Å; L769-H794 PolarHBondContact O-CE1 3.41Å
770	F	86.2	Confident	76.5	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.009	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-31.4	170.5	174.9	-103.6	0	0	0	113.2	P653 T654 V657 Y766 F767 L768 P772 Y773 E774 Q796	P653-F770 HydrophobicContact CB-CE2 4.21Å; P653-F770 HydrophobicContact CB-CZ 4.41Å; T654-F770 HydrophobicContact CG2-CE1 4.1Å; V657-F770 HydrophobicContact CB-CD2 4.42Å; V657-F770 HydrophobicContact CB-CG 4.48Å; V657-F770 HydrophobicContact CG1-CB 3.99Å; V657-F770 HydrophobicContact CG1-CD1 4.48Å; V657-F770 HydrophobicContact CG1-CD2 4.37Å; V657-F770 HydrophobicContact CG1-CG 4.03Å; V657-F770 HydrophobicContact CG2-CD2 3.75Å; V657-F770 HydrophobicContact CG2-CE2 4.06Å; V657-F770 HydrophobicContact CG2-CG 4.25Å; Y766-F770 PolarHBondContact O-N 3.01Å; F767-F770 WeakPolarHBondContact O-CB 3.18Å; F767-F770 PolarHBondContact O-N 3.46Å; L768-F770 PolarHBondContact O-N 2.97Å; F770-P772 VanDerWaalsContact C-CD 3.43Å; F770-P772 VanDerWaalsContact C-N 3.33Å; F770-Y773 HydrophobicContact CD2-CD1 4.17Å; F770-Y773 HydrophobicContact CE1-CD1 4.43Å; F770-Y773 AromaticContact CE2-CD1 3.37Å; F770-Y773 HydrophobicContact CE2-CD1 3.37Å; F770-Y773 AromaticContact CE2-CE1 3.93Å; F770-Y773 HydrophobicContact CE2-CE1 3.93Å; F770-Y773 HydrophobicContact CE2-CG 4.18Å; F770-Y773 AromaticContact CZ-CD1 3.54Å; F770-Y773 HydrophobicContact CZ-CD1 3.54Å; F770-Y773 AromaticContact CZ-CE1 3.89Å; F770-Y773 HydrophobicContact CZ-CE1 3.89Å; F770-Y773 WeakPolarHBondContact O-CB 3.48Å; F770-Y773 PolarHBondContact O-N 2.9Å; F770-E774 HydrophobicContact CD1-CG 4.36Å; F770-E774 HydrophobicContact CE1-CG 3.7Å; F770-E774 VanDerWaalsContact CE1-OE1 3.27Å; F770-E774 WeakPolarHBondContact CE1-OE1 3.48Å; F770-E774 HydrophobicContact CZ-CG 4.09Å; F770-E774 WeakPolarHBondContact CZ-OE1 3.49Å; F770-Q796 HydrophobicContact CB-CB 4.38Å; F770-Q796 HydrophobicContact CB-CG 4.22Å; F770-Q796 HydrophobicContact CD2-CB 4.31Å
771	L	78.8	Confident	75.7	Confident	75 Å²	75	47.2 Å²	47.2	39%	0.393	25%	0.253	S	S	.	.	H	α-helix	trans	-55	-34.1	-178.6	-61.2	179.6	0	0	0	115.5	F767 L768 Y773 E774 A775	F767-L771 HydrophobicContact CE1-CD2 3.89Å; F767-L771 HydrophobicContact CE1-CG 4.35Å; F767-L771 HydrophobicContact CZ-CD2 4.05Å; F767-L771 PolarHBondContact O-N 3.47Å; L768-L771 HydrophobicContact CD2-CD1 3.81Å; L768-L771 PolarHBondContact O-N 3.37Å; L771-Y773 VanDerWaalsContact C-N 3.25Å; L771-Y773 PolarHBondContact O-N 2.98Å; L771-E774 PolarHBondContact O-N 2.75Å; L771-A775 PolarHBondContact O-N 3.24Å
772	P	82.9	Confident	74.9	Confident	51 Å²	51	48.7 Å²	48.7	33%	0.331	26%	0.262	S	S	.	.	H	α-helix	trans	-58.1	-31.8	172.1	-29	36.3	0	0	0	114.3	L768 F770 A775 I776 I797	L768-P772 WeakPolarHBondContact O-CD 3.25Å; F770-P772 VanDerWaalsContact C-CD 3.43Å; F770-P772 VanDerWaalsContact C-N 3.33Å; P772-A775 PolarHBondContact O-N 3.26Å; P772-I776 HydrophobicContact CB-CD1 4.4Å; P772-I776 VanDerWaalsContact O-CB 3.26Å; P772-I776 WeakPolarHBondContact O-CB 3.4Å; P772-I776 WeakPolarHBondContact O-CD1 3.49Å; P772-I776 WeakPolarHBondContact O-CG1 3.24Å; P772-I776 PolarHBondContact O-N 3.14Å; P772-I797 HydrophobicContact CB-CD1 4.12Å
773	Y	83.3	Confident	74.2	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-56.3	173.6	160.2	-105.5	0	0	0	110.1	P653 F770 L771 A775 I776 N777 G800 W801	P653-Y773 HydrophobicContact CB-CE1 4.49Å; P653-Y773 HydrophobicContact CG-CE1 4.09Å; F770-Y773 HydrophobicContact CD2-CD1 4.17Å; F770-Y773 HydrophobicContact CE1-CD1 4.43Å; F770-Y773 AromaticContact CE2-CD1 3.37Å; F770-Y773 HydrophobicContact CE2-CD1 3.37Å; F770-Y773 AromaticContact CE2-CE1 3.93Å; F770-Y773 HydrophobicContact CE2-CE1 3.93Å; F770-Y773 HydrophobicContact CE2-CG 4.18Å; F770-Y773 AromaticContact CZ-CD1 3.54Å; F770-Y773 HydrophobicContact CZ-CD1 3.54Å; F770-Y773 AromaticContact CZ-CE1 3.89Å; F770-Y773 HydrophobicContact CZ-CE1 3.89Å; F770-Y773 WeakPolarHBondContact O-CB 3.48Å; F770-Y773 PolarHBondContact O-N 2.9Å; L771-Y773 VanDerWaalsContact C-N 3.25Å; L771-Y773 PolarHBondContact O-N 2.98Å; Y773-A775 PolarHBondContact O-N 3.44Å; Y773-I776 PolarHBondContact O-N 3.25Å; Y773-I776 VanDerWaalsContact O-N 3.1Å; Y773-N777 HydrophobicContact CE2-CB 4.49Å; Y773-N777 VanDerWaalsContact CE2-CG 3.45Å; Y773-N777 WeakPolarHBondContact CE2-ND2 3.5Å; Y773-N777 WeakPolarHBondContact CE2-OD1 3.35Å; Y773-N777 WeakPolarHBondContact O-CB 3.29Å; Y773-N777 PolarHBondContact O-N 3.47Å; Y773-N777 PolarHBondContact OH-ND2 2.62Å; Y773-G800 VanDerWaalsContact CZ-C 3.49Å; Y773-G800 VanDerWaalsContact CZ-CA 3.44Å; Y773-G800 PolarHBondContact OH-O 2.76Å; Y773-W801 AromaticContact CE2-CD1 3.67Å; Y773-W801 HydrophobicContact CE2-CG 4.45Å
774	E	73.3	Confident	73.8	Confident	53 Å²	53	53.1 Å²	53.1	25%	0.248	29%	0.286	C	S	.	.	H	α-helix	trans	-56.3	-40	178.8	-61.5	-68.8	176.8	0	0	111.2	V585 T654 F770 L771 P778	V585-E774 VanDerWaalsContact CG1-O 3.29Å; V585-E774 WeakPolarHBondContact CG1-O 3.45Å; T654-E774 PolarHBondContact OG1-OE1 2.97Å; F770-E774 HydrophobicContact CD1-CG 4.36Å; F770-E774 HydrophobicContact CE1-CG 3.7Å; F770-E774 VanDerWaalsContact CE1-OE1 3.27Å; F770-E774 WeakPolarHBondContact CE1-OE1 3.48Å; F770-E774 HydrophobicContact CZ-CG 4.09Å; F770-E774 WeakPolarHBondContact CZ-OE1 3.49Å; L771-E774 PolarHBondContact O-N 2.75Å; E774-P778 WeakPolarHBondContact O-CD 3.4Å
775	A	70.3	Confident	73.7	Confident	62 Å²	62	52.8 Å²	52.8	51%	0.512	28%	0.278	S	S	.	.	H	α-helix	trans	-70.7	-29.1	178.7	0	0	0	0	0	114.9	L771 P772 Y773 P778	L771-A775 PolarHBondContact O-N 3.24Å; P772-A775 PolarHBondContact O-N 3.26Å; Y773-A775 PolarHBondContact O-N 3.44Å; A775-P778 WeakPolarHBondContact O-CG 3.3Å
776	I	73.4	Confident	73.7	Confident	52 Å²	52	54.9 Å²	54.9	27%	0.267	29%	0.293	S	S	.	.	H	α-helix	trans	-93.2	-32	-176.3	-67.4	169.2	0	0	0	111.8	P772 Y773 P778 Y779 T780 I783 I797 W801	P772-I776 HydrophobicContact CB-CD1 4.4Å; P772-I776 VanDerWaalsContact O-CB 3.26Å; P772-I776 WeakPolarHBondContact O-CB 3.4Å; P772-I776 WeakPolarHBondContact O-CD1 3.49Å; P772-I776 WeakPolarHBondContact O-CG1 3.24Å; P772-I776 PolarHBondContact O-N 3.14Å; Y773-I776 PolarHBondContact O-N 3.25Å; Y773-I776 VanDerWaalsContact O-N 3.1Å; I776-P778 VanDerWaalsContact C-N 3.29Å; I776-P778 VanDerWaalsContact O-N 3.11Å; I776-Y779 PolarHBondContact O-N 3.09Å; I776-T780 PolarHBondContact O-N 3.05Å; I776-I783 HydrophobicContact CG2-CD1 3.51Å; I776-I797 HydrophobicContact CD1-CD1 4.17Å; I776-W801 HydrophobicContact CG2-CH2 4.45Å; I776-W801 HydrophobicContact CG2-CZ2 3.83Å
777	N	69.9	Low	73.4	Confident	3 Å²	3	59.8 Å²	59.8	2%	0.016	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-43.8	-37	177.1	-125	5	0	0	0	116.7	H586 Y773 T780 W801	H586-N777 WeakPolarHBondContact CE1-CB 3.46Å; H586-N777 PolarHBondContact CE1-ND2 3.5Å; H586-N777 WeakPolarHBondContact NE2-CB 3.34Å; H586-N777 VanDerWaalsContact NE2-CG 3.34Å; H586-N777 PolarHBondContact NE2-ND2 3.37Å; Y773-N777 HydrophobicContact CE2-CB 4.49Å; Y773-N777 VanDerWaalsContact CE2-CG 3.45Å; Y773-N777 WeakPolarHBondContact CE2-ND2 3.5Å; Y773-N777 WeakPolarHBondContact CE2-OD1 3.35Å; Y773-N777 WeakPolarHBondContact O-CB 3.29Å; Y773-N777 PolarHBondContact O-N 3.47Å; Y773-N777 PolarHBondContact OH-ND2 2.62Å; N777-T780 WeakPolarHBondContact O-CB 3.4Å; N777-T780 PolarHBondContact O-OG1 3.37Å; N777-W801 PolarHBondContact OD1-NE1 3.34Å; N777-W801 VanDerWaalsContact OD1-NE1 3.1Å
778	P	57.9	Low	73.1	Confident	10 Å²	10	57.3 Å²	57.3	7%	0.065	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-58.7	-47.8	172.6	11.2	-26.3	0	0	0	114.7	E584 V585 E774 A775 I776 T780	E584-P778 WeakPolarHBondContact O-CB 3.42Å; E584-P778 WeakPolarHBondContact O-CG 3.5Å; V585-P778 VanDerWaalsContact C-CB 3.41Å; V585-P778 VanDerWaalsContact CA-CB 3.46Å; V585-P778 WeakPolarHBondContact O-CA 3.46Å; V585-P778 WeakPolarHBondContact O-CB 3.46Å; V585-P778 WeakPolarHBondContact O-CD 3.29Å; E774-P778 WeakPolarHBondContact O-CD 3.4Å; A775-P778 WeakPolarHBondContact O-CG 3.3Å; I776-P778 VanDerWaalsContact C-N 3.29Å; I776-P778 VanDerWaalsContact O-N 3.11Å; P778-T780 PolarHBondContact O-N 2.95Å
779	Y	64.9	Low	73.3	Confident	126 Å²	126	56.9 Å²	56.9	49%	0.494	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-84.5	4.6	-169.6	-56.9	-69.6	0	0	0	111.9	I776 N781 D782 I783	I776-Y779 PolarHBondContact O-N 3.09Å; Y779-N781 PolarHBondContact O-N 3.08Å; Y779-D782 WeakPolarHBondContact O-CA 3.47Å; Y779-D782 PolarHBondContact O-N 3.45Å; Y779-I783 WeakPolarHBondContact O-CD1 3.43Å; Y779-I783 WeakPolarHBondContact O-CG1 3.02Å; Y779-I783 PolarHBondContact O-N 3.41Å
780	T	61.7	Low	73.2	Confident	36 Å²	36	60 Å²	60	22%	0.221	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-58.7	-23.5	-173.2	68.5	0	0	0	0	113.6	I776 N777 P778 Q788 W801	I776-T780 PolarHBondContact O-N 3.05Å; N777-T780 WeakPolarHBondContact O-CB 3.4Å; N777-T780 PolarHBondContact O-OG1 3.37Å; P778-T780 PolarHBondContact O-N 2.95Å; T780-Q788 PolarHBondContact O-NE2 3.31Å; T780-W801 HydrophobicContact CG2-CZ2 3.94Å
781	N	55.9	Low	73.1	Confident	73 Å²	73	60.7 Å²	60.7	39%	0.39	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-81.1	-24.3	170.5	-70.8	-16.4	0	0	0	115.1	Y779 L1330	Y779-N781 PolarHBondContact O-N 3.08Å; N781-L1330 HydrophobicContact CB-CD1 4.36Å; N781-L1330 HydrophobicContact CB-CD2 4.13Å
782	D	58.7	Low	73.6	Confident	115 Å²	115	57.1 Å²	57.1	62%	0.615	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-20.3	-176.4	-58.1	-45.3	0	0	0	112.2	Y779	Y779-D782 WeakPolarHBondContact O-CA 3.47Å; Y779-D782 PolarHBondContact O-N 3.45Å
783	I	66.6	Low	73.8	Confident	39 Å²	39	57.3 Å²	57.3	20%	0.2	30%	0.302	C	S	.	.	S	Bend	trans	-79.6	138	-177.8	-65.7	162.2	0	0	0	111.2	I776 Y779 E787 Q788	I776-I783 HydrophobicContact CG2-CD1 3.51Å; Y779-I783 WeakPolarHBondContact O-CD1 3.43Å; Y779-I783 WeakPolarHBondContact O-CG1 3.02Å; Y779-I783 PolarHBondContact O-N 3.41Å; I783-E787 HydrophobicContact CG2-CB 3.34Å; I783-E787 HydrophobicContact CG2-CG 4.44Å; I783-Q788 HydrophobicContact CB-CG 4.49Å; I783-Q788 HydrophobicContact CG2-CG 3.95Å
784	T	72.6	Confident	74.1	Confident	68 Å²	68	58.7 Å²	58.7	42%	0.417	31%	0.308	S	S	.	.			trans	-71.7	156	178.9	68.2	0	0	0	0	112.7	T786 E787 Q788	T784-T786 PolarHBondContact O-N 3.41Å; T784-T786 PolarHBondContact OG1-OG1 2.93Å; T784-T786 VanDerWaalsContact OG1-OG1 3.09Å; T784-E787 VanDerWaalsContact CB-OE2 3.27Å; T784-E787 WeakPolarHBondContact CB-OE2 3.33Å; T784-E787 WeakPolarHBondContact CG2-OE2 3.33Å; T784-E787 PolarHBondContact N-OE2 2.99Å; T784-E787 PolarHBondContact O-N 2.84Å; T784-E787 WeakPolarHBondContact OG1-CG 3.5Å; T784-E787 PolarHBondContact OG1-N 2.78Å; T784-E787 PolarHBondContact OG1-OE2 3.23Å; T784-Q788 WeakPolarHBondContact O-CG 3.41Å; T784-Q788 PolarHBondContact O-N 3.39Å
785	F	74.8	Confident	75	Confident	73 Å²	73	56.1 Å²	56.1	32%	0.32	30%	0.297	S	S	.	.	H	α-helix	trans	-55.5	-35.4	176.9	173.6	-106.1	0	0	0	113.5	Q788 F789 R830 L831	F785-Q788 PolarHBondContact O-N 2.83Å; F785-F789 HydrophobicContact CZ-CD2 4.4Å; F785-F789 WeakPolarHBondContact O-CB 3.43Å; F785-F789 PolarHBondContact O-N 3.25Å; F785-R830 HydrophobicContact CD1-CB 4.44Å; F785-R830 HydrophobicContact CD2-CB 3.66Å; F785-R830 HydrophobicContact CE1-CB 4.38Å; F785-R830 HydrophobicContact CE2-CB 3.57Å; F785-R830 HydrophobicContact CG-CB 4.1Å; F785-R830 HydrophobicContact CZ-CB 3.95Å; F785-L831 HydrophobicContact CE2-CD1 4.45Å
786	T	80.2	Confident	75.9	Confident	95 Å²	95	53.2 Å²	53.2	58%	0.583	27%	0.272	S	S	*	.	H	α-helix	trans	-65	-39.5	175.5	21.3	0	0	0	0	112.8	T784 F789 L790	T784-T786 PolarHBondContact O-N 3.41Å; T784-T786 PolarHBondContact OG1-OG1 2.93Å; T784-T786 VanDerWaalsContact OG1-OG1 3.09Å; T786-F789 PolarHBondContact O-N 3.29Å; T786-L790 VanDerWaalsContact O-CG 3.31Å; T786-L790 WeakPolarHBondContact O-CG 3.18Å; T786-L790 PolarHBondContact O-N 3.38Å
787	E	81.1	Confident	76.7	Confident	103 Å²	103	51.1 Å²	51.1	48%	0.481	26%	0.262	S	S	.	.	H	α-helix	trans	-73.7	-37.4	176.2	-68.7	158.9	143.6	0	0	111.1	I783 T784 L790 A791	I783-E787 HydrophobicContact CG2-CB 3.34Å; I783-E787 HydrophobicContact CG2-CG 4.44Å; T784-E787 VanDerWaalsContact CB-OE2 3.27Å; T784-E787 WeakPolarHBondContact CB-OE2 3.33Å; T784-E787 WeakPolarHBondContact CG2-OE2 3.33Å; T784-E787 PolarHBondContact N-OE2 2.99Å; T784-E787 PolarHBondContact O-N 2.84Å; T784-E787 WeakPolarHBondContact OG1-CG 3.5Å; T784-E787 PolarHBondContact OG1-N 2.78Å; T784-E787 PolarHBondContact OG1-OE2 3.23Å; E787-L790 PolarHBondContact O-N 3.49Å; E787-A791 WeakPolarHBondContact O-CB 3.29Å; E787-A791 PolarHBondContact O-N 2.75Å
788	Q	77.3	Confident	77.6	Confident	26 Å²	26	51 Å²	51	12%	0.121	26%	0.261	C	S	.	.	H	α-helix	trans	-59.4	-45.6	169.9	-68.6	175.9	-9.9	0	0	111.4	T780 I783 T784 F785 L790 A791 C792 W801	T780-Q788 PolarHBondContact O-NE2 3.31Å; I783-Q788 HydrophobicContact CB-CG 4.49Å; I783-Q788 HydrophobicContact CG2-CG 3.95Å; T784-Q788 WeakPolarHBondContact O-CG 3.41Å; T784-Q788 PolarHBondContact O-N 3.39Å; F785-Q788 PolarHBondContact O-N 2.83Å; Q788-L790 PolarHBondContact O-N 2.98Å; Q788-A791 PolarHBondContact O-N 3.42Å; Q788-C792 PolarHBondContact O-N 2.88Å; Q788-C792 PolarHBondContact O-SG 2.95Å; Q788-W801 HydrophobicContact CB-CH2 4.13Å; Q788-W801 HydrophobicContact CB-CZ3 3.99Å; Q788-W801 HydrophobicContact CG-CH2 4.1Å; Q788-W801 HydrophobicContact CG-CZ3 4.35Å; Q788-W801 WeakPolarHBondContact O-CZ3 3.42Å
789	F	83.7	Confident	79.2	Confident	81 Å²	81	50.5 Å²	50.5	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-60	-45.4	176	-175.6	-76.2	0	0	0	111.7	F785 T786 A791 C792 L793 M839	F785-F789 HydrophobicContact CZ-CD2 4.4Å; F785-F789 WeakPolarHBondContact O-CB 3.43Å; F785-F789 PolarHBondContact O-N 3.25Å; T786-F789 PolarHBondContact O-N 3.29Å; F789-A791 VanDerWaalsContact C-N 3.34Å; F789-A791 PolarHBondContact O-N 2.99Å; F789-C792 WeakPolarHBondContact O-CB 3.42Å; F789-C792 PolarHBondContact O-N 3.06Å; F789-L793 PolarHBondContact O-N 3.44Å; F789-M839 HydrophobicContact CD2-CE 3.97Å; F789-M839 HydrophobicContact CD2-SD 4.35Å; F789-M839 HydrophobicContact CE2-CE 3.29Å; F789-M839 HydrophobicContact CE2-SD 3.86Å; F789-M839 HydrophobicContact CZ-CE 3.83Å; F789-M839 HydrophobicContact CZ-SD 3.94Å
790	L	84.1	Confident	80.2	Confident	112 Å²	112	44.5 Å²	44.5	59%	0.586	23%	0.234	S	C	*	.	H	α-helix	trans	-66	-34.9	177.2	-73.2	169.3	0	0	0	112.6	T786 E787 Q788 L793	T786-L790 VanDerWaalsContact O-CG 3.31Å; T786-L790 WeakPolarHBondContact O-CG 3.18Å; T786-L790 PolarHBondContact O-N 3.38Å; E787-L790 PolarHBondContact O-N 3.49Å; Q788-L790 PolarHBondContact O-N 2.98Å; L790-L793 HydrophobicContact CD2-CD1 4Å; L790-L793 WeakPolarHBondContact O-CB 3.4Å; L790-L793 PolarHBondContact O-N 2.93Å
791	A	84.7	Confident	81.3	Confident	18 Å²	18	43 Å²	43	15%	0.149	22%	0.224	C	C	.	.	H	α-helix	trans	-69.9	-32	173	0	0	0	0	0	112.2	E787 Q788 F789 L793 H794 I797 W801	E787-A791 WeakPolarHBondContact O-CB 3.29Å; E787-A791 PolarHBondContact O-N 2.75Å; Q788-A791 PolarHBondContact O-N 3.42Å; F789-A791 VanDerWaalsContact C-N 3.34Å; F789-A791 PolarHBondContact O-N 2.99Å; A791-L793 PolarHBondContact O-N 2.96Å; A791-H794 WeakPolarHBondContact O-CB 3.28Å; A791-H794 PolarHBondContact O-N 3.42Å; A791-I797 HydrophobicContact CB-CD1 4.38Å; A791-I797 HydrophobicContact CB-CG2 4.25Å; A791-W801 HydrophobicContact CB-CH2 3.77Å; A791-W801 HydrophobicContact CB-CZ3 4.1Å
792	C	87.8	Confident	82.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.8	174.2	-70.3	0	0	0	0	114.4	Q788 F789 H794 A798 W801 M839	Q788-C792 PolarHBondContact O-N 2.88Å; Q788-C792 PolarHBondContact O-SG 2.95Å; F789-C792 WeakPolarHBondContact O-CB 3.42Å; F789-C792 PolarHBondContact O-N 3.06Å; C792-H794 PolarHBondContact O-N 3.33Å; C792-H794 VanDerWaalsContact O-N 3.14Å; C792-A798 HydrophobicContact CB-CB 4.46Å; C792-W801 VanDerWaalsContact SG-CE3 3.58Å; C792-W801 VanDerWaalsContact SG-CZ3 3.58Å; C792-M839 HydrophobicContact CB-CB 4.17Å; C792-M839 HydrophobicContact CB-CG 4Å
793	L	86.9	Confident	84.1	Confident	55 Å²	55	34.1 Å²	34.1	29%	0.288	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-0.5	169.4	-69	166.6	0	0	0	113.2	F789 L790 A791 D843	F789-L793 PolarHBondContact O-N 3.44Å; L790-L793 HydrophobicContact CD2-CD1 4Å; L790-L793 WeakPolarHBondContact O-CB 3.4Å; L790-L793 PolarHBondContact O-N 2.93Å; A791-L793 PolarHBondContact O-N 2.96Å; L793-D843 VanDerWaalsContact CA-OD1 3.25Å; L793-D843 WeakPolarHBondContact CA-OD1 3.26Å
794	H	89.6	Confident	84.6	Confident	32 Å²	32	33.8 Å²	33.8	15%	0.148	18%	0.178	C	C	.	.	S	Bend	trans	-113.8	111.6	178.3	-166.7	-79.9	0	0	0	109.6	L769 A791 C792 Q796 I797 A798	L769-H794 WeakPolarHBondContact CD2-NE2 3.39Å; L769-H794 PolarHBondContact O-CE1 3.41Å; A791-H794 WeakPolarHBondContact O-CB 3.28Å; A791-H794 PolarHBondContact O-N 3.42Å; C792-H794 PolarHBondContact O-N 3.33Å; C792-H794 VanDerWaalsContact O-N 3.14Å; H794-Q796 VanDerWaalsContact C-N 3.28Å; H794-Q796 PolarHBondContact CE1-OE1 3.02Å; H794-Q796 PolarHBondContact ND1-OE1 3.4Å; H794-Q796 PolarHBondContact O-N 2.78Å; H794-Q796 VanDerWaalsContact O-N 3.09Å; H794-I797 HydrophobicContact CB-CB 4.47Å; H794-I797 HydrophobicContact CB-CD1 3.91Å; H794-I797 HydrophobicContact CB-CG1 4.09Å; H794-I797 PolarHBondContact O-N 3.37Å; H794-A798 PolarHBondContact O-N 2.94Å
795	P	91.9	Very high	84.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-56.8	-38.4	-165.7	-28.7	32.9	0	0	0	114	Y737 A740 I797 A798 F799 L840 D843 Y847	Y737-P795 HydrophobicContact CD2-CB 4.24Å; Y737-P795 HydrophobicContact CE2-CB 3.97Å; Y737-P795 WeakPolarHBondContact CE2-O 3.33Å; A740-P795 HydrophobicContact CB-CB 3.88Å; A740-P795 HydrophobicContact CB-CG 3.87Å; P795-I797 VanDerWaalsContact C-N 3.3Å; P795-I797 PolarHBondContact O-N 3.34Å; P795-A798 PolarHBondContact O-N 3.05Å; P795-F799 VanDerWaalsContact O-CB 3.26Å; P795-F799 WeakPolarHBondContact O-CB 3.37Å; P795-F799 PolarHBondContact O-N 2.97Å; P795-L840 HydrophobicContact CB-CD2 4.32Å; P795-D843 WeakPolarHBondContact CD-OD2 3.44Å; P795-D843 HydrophobicContact CG-CB 4.1Å; P795-Y847 HydrophobicContact CG-CD2 4.27Å; P795-Y847 HydrophobicContact CG-CE2 3.73Å
796	Q	91.1	Very high	85.1	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.7	-33.1	178.8	-71.1	75	-1.7	0	0	112.5	Y766 F770 H794 G800	Y766-Q796 VanDerWaalsContact CD2-NE2 3.25Å; Y766-Q796 VanDerWaalsContact CE2-NE2 3.27Å; F770-Q796 HydrophobicContact CB-CB 4.38Å; F770-Q796 HydrophobicContact CB-CG 4.22Å; F770-Q796 HydrophobicContact CD2-CB 4.31Å; H794-Q796 VanDerWaalsContact C-N 3.28Å; H794-Q796 PolarHBondContact CE1-OE1 3.02Å; H794-Q796 PolarHBondContact ND1-OE1 3.4Å; H794-Q796 PolarHBondContact O-N 2.78Å; H794-Q796 VanDerWaalsContact O-N 3.09Å; Q796-G800 PolarHBondContact O-N 3Å
797	I	89	Confident	84.9	Confident	8 Å²	8	24.4 Å²	24.4	4%	0.041	13%	0.127	C	C	.	.	H	α-helix	trans	-78.9	-45.9	179.3	-54.3	179.2	0	0	0	109.6	P772 I776 A791 H794 P795 F799 G800 W801	P772-I797 HydrophobicContact CB-CD1 4.12Å; I776-I797 HydrophobicContact CD1-CD1 4.17Å; A791-I797 HydrophobicContact CB-CD1 4.38Å; A791-I797 HydrophobicContact CB-CG2 4.25Å; H794-I797 HydrophobicContact CB-CB 4.47Å; H794-I797 HydrophobicContact CB-CD1 3.91Å; H794-I797 HydrophobicContact CB-CG1 4.09Å; H794-I797 PolarHBondContact O-N 3.37Å; P795-I797 VanDerWaalsContact C-N 3.3Å; P795-I797 PolarHBondContact O-N 3.34Å; I797-F799 VanDerWaalsContact C-N 3.34Å; I797-F799 PolarHBondContact O-N 3.43Å; I797-G800 PolarHBondContact O-N 2.86Å; I797-W801 HydrophobicContact CG2-CD2 4.07Å; I797-W801 HydrophobicContact CG2-CE3 4.11Å; I797-W801 HydrophobicContact CG2-CH2 4.1Å; I797-W801 HydrophobicContact CG2-CZ2 4.06Å; I797-W801 HydrophobicContact CG2-CZ3 4.13Å; I797-W801 PolarHBondContact O-N 2.78Å
798	A	89.8	Confident	84.3	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-55.8	-47.3	173.3	0	0	0	0	0	111.6	C792 H794 P795 W801 A802 I836 L840	C792-A798 HydrophobicContact CB-CB 4.46Å; H794-A798 PolarHBondContact O-N 2.94Å; P795-A798 PolarHBondContact O-N 3.05Å; A798-W801 PolarHBondContact O-N 2.96Å; A798-A802 WeakPolarHBondContact O-CB 3.24Å; A798-A802 PolarHBondContact O-N 3.33Å; A798-I836 HydrophobicContact CB-CG2 4.06Å; A798-I836 VanDerWaalsContact O-CG2 3.24Å; A798-I836 WeakPolarHBondContact O-CG2 3.24Å; A798-L840 HydrophobicContact CB-CD2 3.79Å; A798-L840 HydrophobicContact CB-CG 4.17Å
799	F	90.6	Very high	84.1	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.2	-40.6	176.4	175.7	-109.7	0	0	0	113.2	P653 V656 V657 L733 L734 Y737 P795 I797 A802 C803	P653-F799 HydrophobicContact CB-CD1 4.39Å; P653-F799 HydrophobicContact CB-CE1 4.04Å; V656-F799 HydrophobicContact CB-CE1 3.94Å; V656-F799 HydrophobicContact CB-CZ 3.84Å; V656-F799 HydrophobicContact CG1-CE1 3.91Å; V656-F799 HydrophobicContact CG1-CZ 3.66Å; V656-F799 HydrophobicContact CG2-CZ 4.18Å; V657-F799 HydrophobicContact CG2-CD1 4.45Å; V657-F799 HydrophobicContact CG2-CE1 4.45Å; L733-F799 HydrophobicContact CD1-CD2 4.32Å; L733-F799 HydrophobicContact CD2-CD2 4.19Å; L733-F799 HydrophobicContact CD2-CE2 4.06Å; L733-F799 HydrophobicContact CG-CD2 4.11Å; L733-F799 HydrophobicContact CG-CE2 4.2Å; L734-F799 HydrophobicContact CD2-CE2 3.72Å; L734-F799 HydrophobicContact CD2-CZ 3.92Å; Y737-F799 HydrophobicContact CD1-CB 4.24Å; Y737-F799 AromaticContact CD1-CD1 3.93Å; Y737-F799 HydrophobicContact CD1-CD1 3.93Å; Y737-F799 AromaticContact CD1-CD2 3.73Å; Y737-F799 HydrophobicContact CD1-CD2 3.73Å; Y737-F799 HydrophobicContact CD1-CE1 4.24Å; Y737-F799 HydrophobicContact CD1-CE2 4.07Å; Y737-F799 AromaticContact CD1-CG 3.67Å; Y737-F799 HydrophobicContact CD1-CG 3.67Å; Y737-F799 HydrophobicContact CD1-CZ 4.31Å; Y737-F799 HydrophobicContact CD2-CB 3.52Å; Y737-F799 HydrophobicContact CD2-CD2 4.33Å; Y737-F799 AromaticContact CD2-CG 3.91Å; Y737-F799 HydrophobicContact CD2-CG 3.91Å; Y737-F799 HydrophobicContact CE1-CB 4.33Å; Y737-F799 AromaticContact CE1-CD1 3.63Å; Y737-F799 HydrophobicContact CE1-CD1 3.63Å; Y737-F799 HydrophobicContact CE1-CD2 4.3Å; Y737-F799 AromaticContact CE1-CE1 3.99Å; Y737-F799 HydrophobicContact CE1-CE1 3.99Å; Y737-F799 AromaticContact CE1-CG 3.81Å; Y737-F799 HydrophobicContact CE1-CG 3.81Å; Y737-F799 HydrophobicContact CE1-CZ 4.48Å; Y737-F799 HydrophobicContact CE2-CB 3.62Å; Y737-F799 HydrophobicContact CE2-CD1 4.33Å; Y737-F799 HydrophobicContact CE2-CG 4.03Å; Y737-F799 HydrophobicContact CG-CB 3.87Å; Y737-F799 HydrophobicContact CG-CD1 4.43Å; Y737-F799 AromaticContact CG-CD2 3.77Å; Y737-F799 HydrophobicContact CG-CD2 3.77Å; Y737-F799 HydrophobicContact CG-CE2 4.48Å; Y737-F799 AromaticContact CG-CG 3.75Å; Y737-F799 HydrophobicContact CG-CG 3.75Å; Y737-F799 AromaticContact CZ-CD1 3.87Å; P795-F799 VanDerWaalsContact O-CB 3.26Å; P795-F799 WeakPolarHBondContact O-CB 3.37Å; P795-F799 PolarHBondContact O-N 2.97Å; I797-F799 VanDerWaalsContact C-N 3.34Å; I797-F799 PolarHBondContact O-N 3.43Å; F799-A802 PolarHBondContact O-N 3.13Å; F799-C803 WeakPolarHBondContact CZ-SG 3.46Å; F799-C803 PolarHBondContact O-N 3.33Å; F799-C803 PolarHBondContact O-SG 3.25Å; F799-C803 VanDerWaalsContact O-SG 3.39Å
800	G	87	Confident	83.7	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-48.5	175.3	0	0	0	0	0	112.4	Y773 Q796 I797 A802 C803 S804	Y773-G800 VanDerWaalsContact CZ-C 3.49Å; Y773-G800 VanDerWaalsContact CZ-CA 3.44Å; Y773-G800 PolarHBondContact OH-O 2.76Å; Q796-G800 PolarHBondContact O-N 3Å; I797-G800 PolarHBondContact O-N 2.86Å; G800-A802 PolarHBondContact O-N 2.95Å; G800-C803 WeakPolarHBondContact O-CB 3.2Å; G800-C803 PolarHBondContact O-N 2.89Å; G800-S804 PolarHBondContact O-N 2.66Å
801	W	84.7	Confident	82.8	Confident	4 Å²	4	19.5 Å²	19.5	2%	0.015	11%	0.108	C	C	.	.	H	α-helix	trans	-66.9	-33.6	175.3	-71.7	-23.3	0	0	0	113.3	Y773 I776 N777 T780 Q788 A791 C792 I797 A798 C803 S804 V805 L831 I836	Y773-W801 AromaticContact CE2-CD1 3.67Å; Y773-W801 HydrophobicContact CE2-CG 4.45Å; I776-W801 HydrophobicContact CG2-CH2 4.45Å; I776-W801 HydrophobicContact CG2-CZ2 3.83Å; N777-W801 PolarHBondContact OD1-NE1 3.34Å; N777-W801 VanDerWaalsContact OD1-NE1 3.1Å; T780-W801 HydrophobicContact CG2-CZ2 3.94Å; Q788-W801 HydrophobicContact CB-CH2 4.13Å; Q788-W801 HydrophobicContact CB-CZ3 3.99Å; Q788-W801 HydrophobicContact CG-CH2 4.1Å; Q788-W801 HydrophobicContact CG-CZ3 4.35Å; Q788-W801 WeakPolarHBondContact O-CZ3 3.42Å; A791-W801 HydrophobicContact CB-CH2 3.77Å; A791-W801 HydrophobicContact CB-CZ3 4.1Å; C792-W801 VanDerWaalsContact SG-CE3 3.58Å; C792-W801 VanDerWaalsContact SG-CZ3 3.58Å; I797-W801 HydrophobicContact CG2-CD2 4.07Å; I797-W801 HydrophobicContact CG2-CE3 4.11Å; I797-W801 HydrophobicContact CG2-CH2 4.1Å; I797-W801 HydrophobicContact CG2-CZ2 4.06Å; I797-W801 HydrophobicContact CG2-CZ3 4.13Å; I797-W801 PolarHBondContact O-N 2.78Å; A798-W801 PolarHBondContact O-N 2.96Å; W801-C803 VanDerWaalsContact C-N 3.3Å; W801-C803 PolarHBondContact O-N 3.47Å; W801-S804 PolarHBondContact O-N 2.92Å; W801-S804 PolarHBondContact O-OG 3.1Å; W801-V805 WeakPolarHBondContact O-CB 3.44Å; W801-V805 VanDerWaalsContact O-CG2 3.28Å; W801-V805 WeakPolarHBondContact O-CG2 3.45Å; W801-V805 PolarHBondContact O-N 2.77Å; W801-L831 HydrophobicContact CE3-CD2 4.03Å; W801-L831 HydrophobicContact CZ3-CD2 4.49Å; W801-I836 HydrophobicContact CB-CD1 4.37Å
802	A	87.3	Confident	81.8	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.8	-42.6	170.8	0	0	0	0	0	111.5	L733 A798 F799 G800 V805 I806 F833 I836	L733-A802 HydrophobicContact CD1-CB 3.52Å; L733-A802 HydrophobicContact CD2-CB 3.67Å; L733-A802 HydrophobicContact CG-CB 4.25Å; A798-A802 WeakPolarHBondContact O-CB 3.24Å; A798-A802 PolarHBondContact O-N 3.33Å; F799-A802 PolarHBondContact O-N 3.13Å; G800-A802 PolarHBondContact O-N 2.95Å; A802-V805 PolarHBondContact O-N 2.87Å; A802-I806 WeakPolarHBondContact O-CG1 3.15Å; A802-I806 PolarHBondContact O-N 2.87Å; A802-F833 HydrophobicContact CB-CD2 4.44Å; A802-F833 HydrophobicContact CB-CE2 3.82Å; A802-F833 HydrophobicContact CB-CZ 4.48Å; A802-I836 HydrophobicContact CB-CG2 4.03Å
803	C	85.4	Confident	80.5	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.014	13%	0.128	C	C	.	.	H	α-helix	trans	-66.1	-40.5	175.1	-69.9	0	0	0	0	112.8	P653 F799 G800 W801 V805 I806 A807	P653-C803 HydrophobicContact CB-CB 3.98Å; P653-C803 HydrophobicContact CG-CB 3.93Å; F799-C803 WeakPolarHBondContact CZ-SG 3.46Å; F799-C803 PolarHBondContact O-N 3.33Å; F799-C803 PolarHBondContact O-SG 3.25Å; F799-C803 VanDerWaalsContact O-SG 3.39Å; G800-C803 WeakPolarHBondContact O-CB 3.2Å; G800-C803 PolarHBondContact O-N 2.89Å; W801-C803 VanDerWaalsContact C-N 3.3Å; W801-C803 PolarHBondContact O-N 3.47Å; C803-V805 VanDerWaalsContact C-N 3.35Å; C803-I806 PolarHBondContact O-N 3.18Å; C803-A807 WeakPolarHBondContact O-CB 3.36Å; C803-A807 PolarHBondContact O-N 3.37Å
804	S	77.2	Confident	79.7	Confident	32 Å²	32	23.4 Å²	23.4	22%	0.224	14%	0.135	C	C	.	.	H	α-helix	trans	-69.5	-31.9	177.9	77	0	0	0	0	112.8	G800 W801 S808	G800-S804 PolarHBondContact O-N 2.66Å; W801-S804 PolarHBondContact O-N 2.92Å; W801-S804 PolarHBondContact O-OG 3.1Å; S804-S808 WeakPolarHBondContact O-CB 3.44Å; S804-S808 PolarHBondContact O-N 2.97Å; S804-S808 PolarHBondContact O-OG 3.41Å
805	V	77.6	Confident	79	Confident	26 Å²	26	21.9 Å²	21.9	16%	0.158	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-46.7	170.3	166.4	0	0	0	0	111.1	W801 A802 C803 S808 L809 L825 F833	W801-V805 WeakPolarHBondContact O-CB 3.44Å; W801-V805 VanDerWaalsContact O-CG2 3.28Å; W801-V805 WeakPolarHBondContact O-CG2 3.45Å; W801-V805 PolarHBondContact O-N 2.77Å; A802-V805 PolarHBondContact O-N 2.87Å; C803-V805 VanDerWaalsContact C-N 3.35Å; V805-S808 PolarHBondContact O-N 3.49Å; V805-L809 HydrophobicContact CG1-CD1 4.13Å; V805-L809 WeakPolarHBondContact O-CG 3.38Å; V805-L809 PolarHBondContact O-N 2.78Å; V805-L825 HydrophobicContact CB-CD1 4.31Å; V805-L825 HydrophobicContact CG1-CD1 3.9Å; V805-L825 HydrophobicContact CG2-CD1 4.31Å; V805-F833 HydrophobicContact CB-CD2 4.34Å; V805-F833 HydrophobicContact CG1-CB 4.27Å; V805-F833 HydrophobicContact CG1-CD2 3.85Å
806	I	79.9	Confident	78.4	Confident	4 Å²	4	22 Å²	22	2%	0.021	13%	0.128	C	C	.	.	H	α-helix	trans	-59.6	-49.4	174.9	-70.5	167.5	0	0	0	110.3	L722 F730 L733 A802 C803 S808 L809 E810 L816 F833	L722-I806 HydrophobicContact CD1-CG2 4Å; L722-I806 HydrophobicContact CD2-CG2 4.04Å; F730-I806 HydrophobicContact CD2-CD1 4.02Å; L733-I806 HydrophobicContact CD2-CD1 3.83Å; A802-I806 WeakPolarHBondContact O-CG1 3.15Å; A802-I806 PolarHBondContact O-N 2.87Å; C803-I806 PolarHBondContact O-N 3.18Å; I806-S808 VanDerWaalsContact C-N 3.29Å; I806-S808 PolarHBondContact O-N 3.16Å; I806-L809 PolarHBondContact O-N 3.22Å; I806-L809 VanDerWaalsContact O-N 3.11Å; I806-E810 WeakPolarHBondContact O-CB 3.31Å; I806-E810 PolarHBondContact O-N 3.06Å; I806-L816 HydrophobicContact CD1-CD2 4.13Å; I806-L816 HydrophobicContact CG1-CB 4.32Å; I806-L816 HydrophobicContact CG1-CD2 3.94Å; I806-F833 HydrophobicContact CD1-CE2 3.71Å; I806-F833 HydrophobicContact CD1-CZ 3.94Å; I806-F833 HydrophobicContact CG1-CD2 4.46Å; I806-F833 HydrophobicContact CG1-CE2 3.73Å; I806-F833 HydrophobicContact CG1-CZ 4.32Å
807	A	75.4	Confident	78	Confident	9 Å²	9	26 Å²	26	7%	0.074	15%	0.147	C	C	.	.	H	α-helix	trans	-53.5	-45.5	176.9	0	0	0	0	0	112.2	C803 L809 E810 E811	C803-A807 WeakPolarHBondContact O-CB 3.36Å; C803-A807 PolarHBondContact O-N 3.37Å; A807-L809 PolarHBondContact O-N 3.06Å; A807-E810 PolarHBondContact O-N 3.46Å; A807-E811 WeakPolarHBondContact O-CB 3.31Å; A807-E811 WeakPolarHBondContact O-CG 3.5Å; A807-E811 PolarHBondContact O-N 3.03Å
808	S	70.2	Confident	77.7	Confident	45 Å²	45	31.2 Å²	31.2	32%	0.315	17%	0.166	S	C	.	.	H	α-helix	trans	-68.1	-32.4	-179.9	-56	0	0	0	0	113.1	S804 V805 I806 A812	S804-S808 WeakPolarHBondContact O-CB 3.44Å; S804-S808 PolarHBondContact O-N 2.97Å; S804-S808 PolarHBondContact O-OG 3.41Å; V805-S808 PolarHBondContact O-N 3.49Å; I806-S808 VanDerWaalsContact C-N 3.29Å; I806-S808 PolarHBondContact O-N 3.16Å; S808-A812 WeakPolarHBondContact O-CB 3.46Å; S808-A812 PolarHBondContact O-N 3.2Å
809	L	72.6	Confident	77.3	Confident	31 Å²	31	37.8 Å²	37.8	16%	0.162	20%	0.201	C	C	.	.	H	α-helix	trans	-77.7	-27.9	174.9	-69.1	173.3	0	0	0	112.7	V805 I806 A807 K813 T814 G815 L816 L825	V805-L809 HydrophobicContact CG1-CD1 4.13Å; V805-L809 WeakPolarHBondContact O-CG 3.38Å; V805-L809 PolarHBondContact O-N 2.78Å; I806-L809 PolarHBondContact O-N 3.22Å; I806-L809 VanDerWaalsContact O-N 3.11Å; A807-L809 PolarHBondContact O-N 3.06Å; L809-K813 PolarHBondContact O-N 3.14Å; L809-T814 PolarHBondContact O-N 2.83Å; L809-T814 VanDerWaalsContact O-N 3.08Å; L809-T814 PolarHBondContact O-OG1 2.95Å; L809-G815 PolarHBondContact O-N 3.32Å; L809-L816 HydrophobicContact CD1-CB 4.46Å; L809-L816 HydrophobicContact CD1-CD1 3.87Å; L809-L825 HydrophobicContact CD2-CD1 4.28Å; L809-L825 HydrophobicContact CG-CD1 4.11Å
810	E	75.3	Confident	76.6	Confident	26 Å²	26	40.1 Å²	40.1	12%	0.121	21%	0.214	C	C	.	.	H	α-helix	trans	-76.1	-43.1	174.4	-159.6	72.5	-168.2	0	0	111.1	L722 E723 Y724 S725 I806 A807 A812 K813	L722-E810 VanDerWaalsContact C-OE1 3.31Å; L722-E810 WeakPolarHBondContact CA-OE1 3.45Å; L722-E810 HydrophobicContact CD2-CB 4.38Å; L722-E810 HydrophobicContact CD2-CG 3.88Å; E723-E810 PolarHBondContact N-OE1 3.27Å; Y724-E810 VanDerWaalsContact CD2-OE1 3.31Å; Y724-E810 WeakPolarHBondContact CD2-OE1 3.49Å; Y724-E810 PolarHBondContact N-OE1 3.25Å; S725-E810 VanDerWaalsContact CB-OE2 3.29Å; S725-E810 WeakPolarHBondContact CB-OE2 3.06Å; S725-E810 PolarHBondContact N-OE2 3.06Å; S725-E810 VanDerWaalsContact N-OE2 3.09Å; S725-E810 PolarHBondContact OG-OE2 3.27Å; I806-E810 WeakPolarHBondContact O-CB 3.31Å; I806-E810 PolarHBondContact O-N 3.06Å; A807-E810 PolarHBondContact O-N 3.46Å; E810-A812 PolarHBondContact O-N 3.38Å; E810-K813 VanDerWaalsContact O-CA 3.26Å; E810-K813 WeakPolarHBondContact O-CA 3.42Å; E810-K813 PolarHBondContact O-N 3.19Å
811	E	64.7	Low	76.2	Confident	117 Å²	117	41 Å²	41	55%	0.547	22%	0.218	S	C	.	.	H	α-helix	trans	-61.3	-31.3	170.5	-75.1	178.4	-174.9	0	0	111.6	A807 K813	A807-E811 WeakPolarHBondContact O-CB 3.31Å; A807-E811 WeakPolarHBondContact O-CG 3.5Å; A807-E811 PolarHBondContact O-N 3.03Å; E811-K813 VanDerWaalsContact C-N 3.27Å
812	A	62.8	Low	75.8	Confident	47 Å²	47	45.6 Å²	45.6	39%	0.388	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-3.6	170.3	0	0	0	0	0	114.2	S808 E810 T814	S808-A812 WeakPolarHBondContact O-CB 3.46Å; S808-A812 PolarHBondContact O-N 3.2Å; E810-A812 PolarHBondContact O-N 3.38Å; A812-T814 PolarHBondContact O-N 3.05Å
813	K	62.3	Low	74.9	Confident	38 Å²	38	53 Å²	53	17%	0.165	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.9	18.5	-170.4	-40.9	-154.8	-137.8	150.8	0	117.2	Y724 L809 E810 E811 G815 D1423 H1425	Y724-K813 HydrophobicContact CD1-CB 4.03Å; Y724-K813 HydrophobicContact CD2-CB 3.95Å; Y724-K813 HydrophobicContact CD2-CD 4.26Å; Y724-K813 HydrophobicContact CD2-CG 4.24Å; Y724-K813 HydrophobicContact CE1-CB 4.13Å; Y724-K813 HydrophobicContact CE1-CD 4.02Å; Y724-K813 HydrophobicContact CE2-CB 4.11Å; Y724-K813 HydrophobicContact CE2-CD 3.57Å; Y724-K813 HydrophobicContact CE2-CG 4.03Å; Y724-K813 HydrophobicContact CG-CB 3.98Å; Y724-K813 VanDerWaalsContact CZ-CD 3.45Å; L809-K813 PolarHBondContact O-N 3.14Å; E810-K813 VanDerWaalsContact O-CA 3.26Å; E810-K813 WeakPolarHBondContact O-CA 3.42Å; E810-K813 PolarHBondContact O-N 3.19Å; E811-K813 VanDerWaalsContact C-N 3.27Å; K813-G815 VanDerWaalsContact C-N 3.31Å; K813-D1423 PolarHBondContact NZ-O 2.92Å; K813-H1425 WeakPolarHBondContact CD-NE2 3.29Å; K813-H1425 VanDerWaalsContact CE-CE1 3.47Å; K813-H1425 WeakPolarHBondContact CE-CE1 3.19Å; K813-H1425 WeakPolarHBondContact CE-NE2 3.39Å; K813-H1425 PolarHBondContact NZ-NE2 3.41Å
814	T	69.8	Low	73.8	Confident	71 Å²	71	55.7 Å²	55.7	44%	0.436	29%	0.293	S	S	.	.			trans	-75.3	-27.4	167.5	47.5	0	0	0	0	111.9	L809 A812	L809-T814 PolarHBondContact O-N 2.83Å; L809-T814 VanDerWaalsContact O-N 3.08Å; L809-T814 PolarHBondContact O-OG1 2.95Å; A812-T814 PolarHBondContact O-N 3.05Å
815	G	74	Confident	72.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.303	C	S	.	.			trans	63.5	165.4	-172.6	0	0	0	0	0	113.9	S725 L809 K813 Q817	S725-G815 WeakPolarHBondContact OG-CA 3.21Å; L809-G815 PolarHBondContact O-N 3.32Å; K813-G815 VanDerWaalsContact C-N 3.31Å; G815-Q817 PolarHBondContact O-N 3.09Å
816	L	79.5	Confident	71.4	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	31%	0.313	C	S	.	.			trans	-77.6	98.8	166.6	-172.9	72.3	0	0	0	109.9	S725 N726 C729 I806 L809 M821 F833	S725-L816 PolarHBondContact OG-N 2.99Å; N726-L816 PolarHBondContact N-O 3.42Å; C729-L816 HydrophobicContact CB-CD2 3.77Å; C729-L816 HydrophobicContact CB-CG 4.35Å; I806-L816 HydrophobicContact CD1-CD2 4.13Å; I806-L816 HydrophobicContact CG1-CB 4.32Å; I806-L816 HydrophobicContact CG1-CD2 3.94Å; L809-L816 HydrophobicContact CD1-CB 4.46Å; L809-L816 HydrophobicContact CD1-CD1 3.87Å; L816-M821 HydrophobicContact CD1-CG 4.45Å; L816-F833 HydrophobicContact CD1-CB 4.31Å; L816-F833 HydrophobicContact CD1-CD1 4.09Å; L816-F833 HydrophobicContact CD1-CD2 4.24Å; L816-F833 HydrophobicContact CD1-CE1 4.45Å; L816-F833 HydrophobicContact CD1-CG 3.95Å; L816-F833 HydrophobicContact CD2-CD1 3.96Å; L816-F833 HydrophobicContact CD2-CD2 4.29Å; L816-F833 HydrophobicContact CD2-CE1 3.48Å; L816-F833 VanDerWaalsContact CD2-CE1 3.48Å; L816-F833 HydrophobicContact CD2-CE2 3.87Å; L816-F833 HydrophobicContact CD2-CG 4.33Å; L816-F833 HydrophobicContact CD2-CZ 3.43Å; L816-F833 VanDerWaalsContact CD2-CZ 3.43Å
817	Q	83.2	Confident	69.5	Low	83 Å²	83	64.4 Å²	64.4	39%	0.388	33%	0.334	S	S	.	.			trans	-101.8	151.8	171.4	-62.2	-86.8	-25.7	0	0	109.8	G815 N819 N820 M821	G815-Q817 PolarHBondContact O-N 3.09Å; Q817-N819 PolarHBondContact O-N 3.37Å; Q817-N820 HydrophobicContact CB-CB 4.26Å; Q817-N820 PolarHBondContact O-N 2.92Å; Q817-M821 PolarHBondContact O-N 3.04Å
818	W	82.1	Confident	68.2	Low	119 Å²	119	69.4 Å²	69.4	45%	0.451	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-54.4	-40.3	176.7	-72.5	106.6	0	0	0	112.9	F728 C729 L732 N820 M821	F728-W818 HydrophobicContact CD1-CH2 4.41Å; F728-W818 AromaticContact CD1-CZ2 3.67Å; F728-W818 HydrophobicContact CD1-CZ2 3.67Å; F728-W818 HydrophobicContact CE1-CH2 4.32Å; F728-W818 AromaticContact CE1-CZ2 3.89Å; F728-W818 HydrophobicContact CE1-CZ2 3.89Å; C729-W818 VanDerWaalsContact SG-CE2 3.59Å; L732-W818 HydrophobicContact CD2-CH2 3.93Å; L732-W818 HydrophobicContact CD2-CZ3 4.47Å; W818-N820 PolarHBondContact O-N 3.43Å; W818-M821 HydrophobicContact CE3-SD 4.23Å; W818-M821 HydrophobicContact CZ3-CE 4.44Å; W818-M821 HydrophobicContact CZ3-SD 4.35Å; W818-M821 WeakPolarHBondContact O-CB 3.18Å; W818-M821 PolarHBondContact O-N 2.83Å
819	N	80.8	Confident	67.4	Low	137 Å²	137	68.5 Å²	68.5	73%	0.733	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-63.9	-26.4	178.5	-55.5	-4.2	0	0	0	112.5	Q817	Q817-N819 PolarHBondContact O-N 3.37Å
820	N	77.6	Confident	66.9	Low	50 Å²	50	76.1 Å²	76.1	27%	0.267	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-95.8	-10.1	-171.6	-56.9	2.5	0	0	0	111.9	Q817 W818 N822 F823	Q817-N820 HydrophobicContact CB-CB 4.26Å; Q817-N820 PolarHBondContact O-N 2.92Å; W818-N820 PolarHBondContact O-N 3.43Å; N820-N822 PolarHBondContact O-N 3.16Å; N820-N822 VanDerWaalsContact O-N 3.16Å; N820-F823 PolarHBondContact O-N 3.24Å
821	M	77	Confident	66.6	Low	19 Å²	19	76.4 Å²	76.4	9%	0.094	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-21.4	-167.3	-157	173	81.3	0	0	114.9	L816 Q817 W818 F833 N834 L837	L816-M821 HydrophobicContact CD1-CG 4.45Å; Q817-M821 PolarHBondContact O-N 3.04Å; W818-M821 HydrophobicContact CE3-SD 4.23Å; W818-M821 HydrophobicContact CZ3-CE 4.44Å; W818-M821 HydrophobicContact CZ3-SD 4.35Å; W818-M821 WeakPolarHBondContact O-CB 3.18Å; W818-M821 PolarHBondContact O-N 2.83Å; M821-F833 HydrophobicContact CG-CB 4.04Å; M821-F833 HydrophobicContact CG-CD1 3.56Å; M821-F833 HydrophobicContact CG-CE1 4.49Å; M821-F833 HydrophobicContact CG-CG 4.22Å; M821-F833 PolarHBondContact O-N 2.68Å; M821-F833 HydrophobicContact SD-CD1 3.96Å; M821-F833 HydrophobicContact SD-CE1 4.42Å; M821-N834 HydrophobicContact CE-CB 3.77Å; M821-N834 HydrophobicContact CG-CB 4.3Å; M821-N834 PolarHBondContact O-N 2.89Å; M821-L837 HydrophobicContact CE-CD1 3.93Å; M821-L837 HydrophobicContact SD-CD1 3.8Å
822	N	77.7	Confident	67.4	Low	99 Å²	99	71.8 Å²	71.8	53%	0.529	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-1.4	177.5	-71.8	-31.2	0	0	0	113.7	N820 T832 N834	N820-N822 PolarHBondContact O-N 3.16Å; N820-N822 VanDerWaalsContact O-N 3.16Å; N822-T832 VanDerWaalsContact O-CG2 3.26Å; N822-T832 WeakPolarHBondContact O-CG2 3.41Å; N822-N834 WeakPolarHBondContact OD1-CB 3.07Å; N822-N834 PolarHBondContact OD1-ND2 3.41Å
823	F	68.3	Low	68.5	Low	157 Å²	157	69.8 Å²	69.8	69%	0.689	35%	0.349	S	S	*	.			trans	-79.6	128.1	177.8	-84.7	-88.6	0	0	0	111.2	N820	N820-F823 PolarHBondContact O-N 3.24Å
824	P	62.4	Low	69.7	Low	58 Å²	58	70.6 Å²	70.6	38%	0.377	36%	0.355	S	S	.	.			trans	-74.8	136.4	173.7	30.4	-33.5	0	0	0	110.8	V826 G829 T832	P824-V826 VanDerWaalsContact C-N 3.32Å; P824-V826 PolarHBondContact O-N 3.09Å; P824-G829 WeakPolarHBondContact CB-O 3.35Å; P824-T832 HydrophobicContact CB-CG2 4.33Å
825	L	51.4	Low	70.5	Confident	83 Å²	83	69.3 Å²	69.3	44%	0.435	35%	0.347	S	S	.	.	S	Bend	trans	-76.3	-22.5	-173.4	-145.7	132	0	0	0	113.2	V805 L809	V805-L825 HydrophobicContact CB-CD1 4.31Å; V805-L825 HydrophobicContact CG1-CD1 3.9Å; V805-L825 HydrophobicContact CG2-CD1 4.31Å; L809-L825 HydrophobicContact CD2-CD1 4.28Å; L809-L825 HydrophobicContact CG-CD1 4.11Å
826	V	52	Low	71.2	Confident	61 Å²	61	69.3 Å²	69.3	37%	0.37	35%	0.347	S	S	.	.	S	Bend	trans	-117.4	135.7	175.7	179.8	0	0	0	0	108.3	P824 N828 G829 L1331	P824-V826 VanDerWaalsContact C-N 3.32Å; P824-V826 PolarHBondContact O-N 3.09Å; V826-N828 PolarHBondContact O-N 2.98Å; V826-G829 PolarHBondContact O-N 2.77Å; V826-L1331 HydrophobicContact CG1-CD1 3.32Å
827	Q	40.9	Very low	71.8	Confident	100 Å²	100	69.8 Å²	69.8	47%	0.467	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.2	-166.3	-135.4	-172.7	-2.1	0	0	115.7	K1469	Q827-K1469 VanDerWaalsContact CD-NZ 3.26Å; Q827-K1469 VanDerWaalsContact NE2-NZ 3.18Å; Q827-K1469 VanDerWaalsContact OE1-CE 3.24Å
828	N	46.9	Very low	72.1	Confident	114 Å²	114	69.3 Å²	69.3	61%	0.61	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	5.2	174.3	-77.3	-20.7	0	0	0	113.9	V826 L1331	V826-N828 PolarHBondContact O-N 2.98Å; N828-L1331 HydrophobicContact CB-CD2 4.05Å; N828-L1331 WeakPolarHBondContact ND2-CD2 3.17Å
829	G	53.5	Low	72.6	Confident	26 Å²	26	64.4 Å²	64.4	27%	0.268	33%	0.334	S	S	.	.			trans	-82.4	133.3	179.1	0	0	0	0	0	111.8	P824 V826	P824-G829 WeakPolarHBondContact CB-O 3.35Å; V826-G829 PolarHBondContact O-N 2.77Å
830	R	62.8	Low	73.1	Confident	191 Å²	191	57.9 Å²	57.9	72%	0.721	30%	0.299	S	S	*	.			trans	-88.9	-6.7	173.5	-72.2	-176.2	179.4	-179.6	-0.1	113.8	F785 T832	F785-R830 HydrophobicContact CD1-CB 4.44Å; F785-R830 HydrophobicContact CD2-CB 3.66Å; F785-R830 HydrophobicContact CE1-CB 4.38Å; F785-R830 HydrophobicContact CE2-CB 3.57Å; F785-R830 HydrophobicContact CG-CB 4.1Å; F785-R830 HydrophobicContact CZ-CB 3.95Å; R830-T832 PolarHBondContact O-N 3.37Å
831	L	69.6	Low	73.9	Confident	33 Å²	33	59.7 Å²	59.7	17%	0.173	31%	0.308	C	S	.	.			trans	-79.3	106.9	179.1	-161.3	76.3	0	0	0	109.8	F785 W801 V835 I836	F785-L831 HydrophobicContact CE2-CD1 4.45Å; W801-L831 HydrophobicContact CE3-CD2 4.03Å; W801-L831 HydrophobicContact CZ3-CD2 4.49Å; L831-V835 HydrophobicContact CD1-CG1 4.19Å; L831-I836 HydrophobicContact CD1-CG1 4.22Å; L831-I836 HydrophobicContact CD2-CD1 4.13Å; L831-I836 HydrophobicContact CD2-CG1 4.32Å; L831-I836 HydrophobicContact CG-CD1 4.24Å; L831-I836 HydrophobicContact CG-CG1 4.07Å
832	T	82	Confident	74.6	Confident	20 Å²	20	61.8 Å²	61.8	12%	0.123	32%	0.322	C	S	.	.			trans	-106.2	160.2	174.2	68.1	0	0	0	0	109.9	N822 P824 R830 N834 V835 I836	N822-T832 VanDerWaalsContact O-CG2 3.26Å; N822-T832 WeakPolarHBondContact O-CG2 3.41Å; P824-T832 HydrophobicContact CB-CG2 4.33Å; R830-T832 PolarHBondContact O-N 3.37Å; T832-N834 PolarHBondContact O-N 3.43Å; T832-V835 WeakPolarHBondContact O-CB 3.45Å; T832-V835 PolarHBondContact O-N 3.41Å; T832-V835 WeakPolarHBondContact OG1-CG2 3.45Å; T832-V835 PolarHBondContact OG1-N 2.85Å; T832-I836 PolarHBondContact O-N 3.28Å
833	F	85.2	Confident	75.4	Confident	5 Å²	5	57 Å²	57	2%	0.022	30%	0.297	C	S	.	.	H	α-helix	trans	-58.3	-39	179.6	-170.8	-90.2	0	0	0	111.9	L733 A802 V805 I806 L816 M821 V835 I836 L837	L733-F833 HydrophobicContact CB-CZ 4.25Å; L733-F833 HydrophobicContact CD1-CZ 4.29Å; L733-F833 HydrophobicContact CD2-CE2 4.34Å; L733-F833 HydrophobicContact CD2-CZ 4.07Å; L733-F833 HydrophobicContact CG-CZ 4.43Å; A802-F833 HydrophobicContact CB-CD2 4.44Å; A802-F833 HydrophobicContact CB-CE2 3.82Å; A802-F833 HydrophobicContact CB-CZ 4.48Å; V805-F833 HydrophobicContact CB-CD2 4.34Å; V805-F833 HydrophobicContact CG1-CB 4.27Å; V805-F833 HydrophobicContact CG1-CD2 3.85Å; I806-F833 HydrophobicContact CD1-CE2 3.71Å; I806-F833 HydrophobicContact CD1-CZ 3.94Å; I806-F833 HydrophobicContact CG1-CD2 4.46Å; I806-F833 HydrophobicContact CG1-CE2 3.73Å; I806-F833 HydrophobicContact CG1-CZ 4.32Å; L816-F833 HydrophobicContact CD1-CB 4.31Å; L816-F833 HydrophobicContact CD1-CD1 4.09Å; L816-F833 HydrophobicContact CD1-CD2 4.24Å; L816-F833 HydrophobicContact CD1-CE1 4.45Å; L816-F833 HydrophobicContact CD1-CG 3.95Å; L816-F833 HydrophobicContact CD2-CD1 3.96Å; L816-F833 HydrophobicContact CD2-CD2 4.29Å; L816-F833 HydrophobicContact CD2-CE1 3.48Å; L816-F833 VanDerWaalsContact CD2-CE1 3.48Å; L816-F833 HydrophobicContact CD2-CE2 3.87Å; L816-F833 HydrophobicContact CD2-CG 4.33Å; L816-F833 HydrophobicContact CD2-CZ 3.43Å; L816-F833 VanDerWaalsContact CD2-CZ 3.43Å; M821-F833 HydrophobicContact CG-CB 4.04Å; M821-F833 HydrophobicContact CG-CD1 3.56Å; M821-F833 HydrophobicContact CG-CE1 4.49Å; M821-F833 HydrophobicContact CG-CG 4.22Å; M821-F833 PolarHBondContact O-N 2.68Å; M821-F833 HydrophobicContact SD-CD1 3.96Å; M821-F833 HydrophobicContact SD-CE1 4.42Å; F833-V835 PolarHBondContact O-N 3.18Å; F833-I836 WeakPolarHBondContact O-CB 3.03Å; F833-I836 PolarHBondContact O-N 3.08Å; F833-I836 VanDerWaalsContact O-N 3.14Å; F833-L837 HydrophobicContact CD1-CD1 3.94Å; F833-L837 HydrophobicContact CD1-CD2 4.43Å; F833-L837 HydrophobicContact CD1-CG 3.97Å; F833-L837 HydrophobicContact CE1-CD1 3.77Å; F833-L837 HydrophobicContact CE1-CD2 3.74Å; F833-L837 HydrophobicContact CE1-CG 3.77Å; F833-L837 HydrophobicContact CZ-CD2 4.22Å; F833-L837 PolarHBondContact O-N 2.8Å
834	N	86.8	Confident	76.6	Confident	55 Å²	55	50 Å²	50	29%	0.294	27%	0.268	S	S	.	.	H	α-helix	trans	-61.2	-40.6	175.2	-168.1	17.7	0	0	0	112.9	M821 N822 T832 I836 L837 V838	M821-N834 HydrophobicContact CE-CB 3.77Å; M821-N834 HydrophobicContact CG-CB 4.3Å; M821-N834 PolarHBondContact O-N 2.89Å; N822-N834 WeakPolarHBondContact OD1-CB 3.07Å; N822-N834 PolarHBondContact OD1-ND2 3.41Å; T832-N834 PolarHBondContact O-N 3.43Å; N834-I836 VanDerWaalsContact C-N 3.27Å; N834-I836 PolarHBondContact O-N 2.9Å; N834-L837 PolarHBondContact O-N 3.12Å; N834-V838 WeakPolarHBondContact O-CG2 3.39Å; N834-V838 PolarHBondContact O-N 3.42Å
835	V	87	Confident	78.1	Confident	43 Å²	43	52.4 Å²	52.4	26%	0.261	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-39.5	174.1	170.6	0	0	0	0	110.8	L831 T832 F833 V838 M839	L831-V835 HydrophobicContact CD1-CG1 4.19Å; T832-V835 WeakPolarHBondContact O-CB 3.45Å; T832-V835 PolarHBondContact O-N 3.41Å; T832-V835 WeakPolarHBondContact OG1-CG2 3.45Å; T832-V835 PolarHBondContact OG1-N 2.85Å; F833-V835 PolarHBondContact O-N 3.18Å; V835-V838 PolarHBondContact O-N 2.96Å; V835-M839 HydrophobicContact CG1-CE 4.06Å; V835-M839 HydrophobicContact CG1-CG 4.5Å; V835-M839 WeakPolarHBondContact O-CG 3.39Å; V835-M839 PolarHBondContact O-N 3.03Å
836	I	89.3	Confident	80	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-41.5	177.6	-57.1	170.6	0	0	0	111.5	A798 W801 A802 L831 T832 F833 N834 V838 M839 L840	A798-I836 HydrophobicContact CB-CG2 4.06Å; A798-I836 VanDerWaalsContact O-CG2 3.24Å; A798-I836 WeakPolarHBondContact O-CG2 3.24Å; W801-I836 HydrophobicContact CB-CD1 4.37Å; A802-I836 HydrophobicContact CB-CG2 4.03Å; L831-I836 HydrophobicContact CD1-CG1 4.22Å; L831-I836 HydrophobicContact CD2-CD1 4.13Å; L831-I836 HydrophobicContact CD2-CG1 4.32Å; L831-I836 HydrophobicContact CG-CD1 4.24Å; L831-I836 HydrophobicContact CG-CG1 4.07Å; T832-I836 PolarHBondContact O-N 3.28Å; F833-I836 WeakPolarHBondContact O-CB 3.03Å; F833-I836 PolarHBondContact O-N 3.08Å; F833-I836 VanDerWaalsContact O-N 3.14Å; N834-I836 VanDerWaalsContact C-N 3.27Å; N834-I836 PolarHBondContact O-N 2.9Å; I836-V838 VanDerWaalsContact C-N 3.31Å; I836-V838 PolarHBondContact O-N 3.05Å; I836-M839 PolarHBondContact O-N 2.92Å; I836-L840 PolarHBondContact O-N 3.39Å
837	L	90.6	Very high	82	Confident	11 Å²	11	48.8 Å²	48.8	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-40.4	173.9	-63.9	177.9	0	0	0	112.1	L733 L736 M821 F833 N834 L840 L841	L733-L837 HydrophobicContact CB-CD2 4.24Å; L733-L837 HydrophobicContact CD1-CD2 3.85Å; L736-L837 HydrophobicContact CD1-CB 4.07Å; L736-L837 HydrophobicContact CD1-CD2 4.13Å; M821-L837 HydrophobicContact CE-CD1 3.93Å; M821-L837 HydrophobicContact SD-CD1 3.8Å; F833-L837 HydrophobicContact CD1-CD1 3.94Å; F833-L837 HydrophobicContact CD1-CD2 4.43Å; F833-L837 HydrophobicContact CD1-CG 3.97Å; F833-L837 HydrophobicContact CE1-CD1 3.77Å; F833-L837 HydrophobicContact CE1-CD2 3.74Å; F833-L837 HydrophobicContact CE1-CG 3.77Å; F833-L837 HydrophobicContact CZ-CD2 4.22Å; F833-L837 PolarHBondContact O-N 2.8Å; N834-L837 PolarHBondContact O-N 3.12Å; L837-L840 PolarHBondContact O-N 3.3Å; L837-L841 PolarHBondContact O-N 3.19Å
838	V	91.2	Very high	84.4	Confident	73 Å²	73	46.5 Å²	46.5	44%	0.442	25%	0.248	S	C	.	.	H	α-helix	trans	-65.6	-40.1	175.2	173.4	0	0	0	0	111.1	N834 V835 I836 L841 V842	N834-V838 WeakPolarHBondContact O-CG2 3.39Å; N834-V838 PolarHBondContact O-N 3.42Å; V835-V838 PolarHBondContact O-N 2.96Å; I836-V838 VanDerWaalsContact C-N 3.31Å; I836-V838 PolarHBondContact O-N 3.05Å; V838-L841 WeakPolarHBondContact O-CB 3.2Å; V838-L841 PolarHBondContact O-N 3.09Å; V838-V842 HydrophobicContact CG1-CG2 4.45Å; V838-V842 WeakPolarHBondContact O-CG2 3.42Å; V838-V842 PolarHBondContact O-N 3.38Å
839	M	90.9	Very high	86.6	Confident	17 Å²	17	44.6 Å²	44.6	8%	0.084	24%	0.241	C	C	.	.	H	α-helix	trans	-62	-42.5	175.3	-67.3	-54.3	135.6	0	0	112.2	F789 C792 V835 I836 L841 V842 D843	F789-M839 HydrophobicContact CD2-CE 3.97Å; F789-M839 HydrophobicContact CD2-SD 4.35Å; F789-M839 HydrophobicContact CE2-CE 3.29Å; F789-M839 HydrophobicContact CE2-SD 3.86Å; F789-M839 HydrophobicContact CZ-CE 3.83Å; F789-M839 HydrophobicContact CZ-SD 3.94Å; C792-M839 HydrophobicContact CB-CB 4.17Å; C792-M839 HydrophobicContact CB-CG 4Å; V835-M839 HydrophobicContact CG1-CE 4.06Å; V835-M839 HydrophobicContact CG1-CG 4.5Å; V835-M839 WeakPolarHBondContact O-CG 3.39Å; V835-M839 PolarHBondContact O-N 3.03Å; I836-M839 PolarHBondContact O-N 2.92Å; M839-L841 VanDerWaalsContact C-N 3.25Å; M839-L841 PolarHBondContact O-N 3.19Å; M839-V842 CarbonylContact O-C 3.45Å; M839-V842 WeakPolarHBondContact O-CA 3.38Å; M839-V842 WeakPolarHBondContact O-CB 3.43Å; M839-V842 PolarHBondContact O-N 2.98Å; M839-D843 PolarHBondContact O-N 2.73Å
840	L	93.1	Very high	88.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-34.5	175.8	-71.5	172.3	0	0	0	112.9	L733 L736 Y737 A740 P795 A798 I836 L837 G844	L733-L840 HydrophobicContact CD1-CD1 3.71Å; L736-L840 HydrophobicContact CB-CB 4.31Å; Y737-L840 HydrophobicContact CD2-CD2 4.15Å; A740-L840 HydrophobicContact CB-CD2 4.41Å; P795-L840 HydrophobicContact CB-CD2 4.32Å; A798-L840 HydrophobicContact CB-CD2 3.79Å; A798-L840 HydrophobicContact CB-CG 4.17Å; I836-L840 PolarHBondContact O-N 3.39Å; L837-L840 PolarHBondContact O-N 3.3Å; L840-G844 PolarHBondContact O-N 3.34Å; L840-G844 VanDerWaalsContact O-N 3.16Å
841	L	92.8	Very high	89.7	Confident	87 Å²	87	39.4 Å²	39.4	46%	0.455	22%	0.216	S	C	.	.	H	α-helix	trans	-69	-43.1	172.2	-101.8	163.8	0	0	0	112.4	L736 L837 V838 M839 D843 G844 I845	L736-L841 HydrophobicContact CD1-CD1 4.4Å; L736-L841 HydrophobicContact CD2-CD1 4.22Å; L736-L841 HydrophobicContact CD2-CG 4.05Å; L837-L841 PolarHBondContact O-N 3.19Å; V838-L841 WeakPolarHBondContact O-CB 3.2Å; V838-L841 PolarHBondContact O-N 3.09Å; M839-L841 VanDerWaalsContact C-N 3.25Å; M839-L841 PolarHBondContact O-N 3.19Å; L841-D843 VanDerWaalsContact C-N 3.33Å; L841-G844 PolarHBondContact O-N 2.98Å; L841-I845 WeakPolarHBondContact O-CG1 3.34Å; L841-I845 PolarHBondContact O-N 3.46Å
842	V	93.2	Very high	90.6	Very high	63 Å²	63	41.5 Å²	41.5	38%	0.382	22%	0.222	S	C	.	.	H	α-helix	trans	-61.1	-42.1	175.1	171	0	0	0	0	110.7	V838 M839 I845 M846	V838-V842 HydrophobicContact CG1-CG2 4.45Å; V838-V842 WeakPolarHBondContact O-CG2 3.42Å; V838-V842 PolarHBondContact O-N 3.38Å; M839-V842 CarbonylContact O-C 3.45Å; M839-V842 WeakPolarHBondContact O-CA 3.38Å; M839-V842 WeakPolarHBondContact O-CB 3.43Å; M839-V842 PolarHBondContact O-N 2.98Å; V842-I845 PolarHBondContact O-N 3.27Å; V842-M846 WeakPolarHBondContact O-CB 3.36Å; V842-M846 PolarHBondContact O-N 2.88Å
843	D	93.8	Very high	91	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.3	-50.2	176	-76.2	-4.4	0	0	0	111.7	A740 L793 P795 M839 L841 I845 M846 Y847	A740-D843 HydrophobicContact CB-CB 4.04Å; L793-D843 VanDerWaalsContact CA-OD1 3.25Å; L793-D843 WeakPolarHBondContact CA-OD1 3.26Å; P795-D843 WeakPolarHBondContact CD-OD2 3.44Å; P795-D843 HydrophobicContact CG-CB 4.1Å; M839-D843 PolarHBondContact O-N 2.73Å; L841-D843 VanDerWaalsContact C-N 3.33Å; D843-I845 VanDerWaalsContact C-N 3.26Å; D843-I845 PolarHBondContact O-N 2.74Å; D843-M846 PolarHBondContact O-N 2.87Å; D843-M846 VanDerWaalsContact O-N 3.1Å; D843-Y847 HydrophobicContact CB-CD2 4.23Å; D843-Y847 HydrophobicContact CB-CE2 4.32Å; D843-Y847 VanDerWaalsContact O-CD2 3.24Å; D843-Y847 WeakPolarHBondContact O-CD2 3.47Å; D843-Y847 PolarHBondContact O-N 3.33Å
844	G	92.8	Very high	91.1	Very high	8 Å²	8	44.7 Å²	44.7	8%	0.082	23%	0.234	C	C	.	.	H	α-helix	trans	-56.8	-40	178.2	0	0	0	0	0	112.9	P743 L840 L841 S848	P743-G844 WeakPolarHBondContact CG-O 3.15Å; L840-G844 PolarHBondContact O-N 3.34Å; L840-G844 VanDerWaalsContact O-N 3.16Å; L841-G844 PolarHBondContact O-N 2.98Å; G844-S848 VanDerWaalsContact O-CB 3.32Å; G844-S848 WeakPolarHBondContact O-CB 3.36Å; G844-S848 PolarHBondContact O-N 3.3Å; G844-S848 PolarHBondContact O-OG 3.32Å
845	I	93.4	Very high	90.8	Very high	109 Å²	109	42.8 Å²	42.8	56%	0.559	22%	0.223	S	C	*	.	H	α-helix	trans	-68.6	-47.4	173.7	-64	167.7	0	0	0	110.7	L841 V842 D843 S848 V849	L841-I845 WeakPolarHBondContact O-CG1 3.34Å; L841-I845 PolarHBondContact O-N 3.46Å; V842-I845 PolarHBondContact O-N 3.27Å; D843-I845 VanDerWaalsContact C-N 3.26Å; D843-I845 PolarHBondContact O-N 2.74Å; I845-S848 WeakPolarHBondContact O-CB 3.41Å; I845-S848 PolarHBondContact O-N 2.91Å; I845-S848 VanDerWaalsContact O-N 3.17Å; I845-V849 WeakPolarHBondContact O-CG2 3.42Å; I845-V849 PolarHBondContact O-N 3.09Å
846	M	93.2	Very high	90.5	Very high	40 Å²	40	42 Å²	42	20%	0.197	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-48.4	-176.5	179.5	-85.6	-73.8	0	0	112	V842 D843 S848 V849 F850	V842-M846 WeakPolarHBondContact O-CB 3.36Å; V842-M846 PolarHBondContact O-N 2.88Å; D843-M846 PolarHBondContact O-N 2.87Å; D843-M846 VanDerWaalsContact O-N 3.1Å; M846-S848 VanDerWaalsContact C-N 3.29Å; M846-S848 PolarHBondContact O-N 3.5Å; M846-V849 PolarHBondContact O-N 3.49Å; M846-F850 HydrophobicContact CG-CE2 4.27Å; M846-F850 HydrophobicContact CG-CZ 4.21Å; M846-F850 PolarHBondContact O-N 3.01Å; M846-F850 HydrophobicContact SD-CD2 3.46Å; M846-F850 WeakPolarHBondContact SD-CD2 3.43Å; M846-F850 HydrophobicContact SD-CE1 4.41Å; M846-F850 HydrophobicContact SD-CE2 3.23Å; M846-F850 WeakPolarHBondContact SD-CE2 3.13Å; M846-F850 HydrophobicContact SD-CG 4.17Å; M846-F850 HydrophobicContact SD-CZ 3.76Å
847	Y	93.8	Very high	90.2	Very high	29 Å²	29	43 Å²	43	11%	0.114	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-29.2	174.4	-76.6	-69.7	0	0	0	113	Q744 L747 P795 D843 T851	Q744-Y847 HydrophobicContact CB-CD1 4.32Å; Q744-Y847 HydrophobicContact CB-CD2 4.37Å; Q744-Y847 HydrophobicContact CB-CG 4.22Å; Q744-Y847 HydrophobicContact CG-CD1 4.24Å; Q744-Y847 HydrophobicContact CG-CE1 4.03Å; Q744-Y847 HydrophobicContact CG-CE2 4.47Å; L747-Y847 HydrophobicContact CD2-CD1 3.68Å; L747-Y847 HydrophobicContact CD2-CE1 4.01Å; P795-Y847 HydrophobicContact CG-CD2 4.27Å; P795-Y847 HydrophobicContact CG-CE2 3.73Å; D843-Y847 HydrophobicContact CB-CD2 4.23Å; D843-Y847 HydrophobicContact CB-CE2 4.32Å; D843-Y847 VanDerWaalsContact O-CD2 3.24Å; D843-Y847 WeakPolarHBondContact O-CD2 3.47Å; D843-Y847 PolarHBondContact O-N 3.33Å; Y847-T851 WeakPolarHBondContact O-CB 3.48Å; Y847-T851 PolarHBondContact O-N 3.4Å; Y847-T851 PolarHBondContact O-OG1 3.23Å
848	S	91.6	Very high	89.5	Confident	52 Å²	52	48.9 Å²	48.9	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-67.6	-43.6	172.1	-63.4	0	0	0	0	111.6	P743 G844 I845 M846 T851 W852	P743-S848 WeakPolarHBondContact CB-OG 3.12Å; P743-S848 VanDerWaalsContact CG-OG 3.32Å; P743-S848 WeakPolarHBondContact CG-OG 3.48Å; G844-S848 VanDerWaalsContact O-CB 3.32Å; G844-S848 WeakPolarHBondContact O-CB 3.36Å; G844-S848 PolarHBondContact O-N 3.3Å; G844-S848 PolarHBondContact O-OG 3.32Å; I845-S848 WeakPolarHBondContact O-CB 3.41Å; I845-S848 PolarHBondContact O-N 2.91Å; I845-S848 VanDerWaalsContact O-N 3.17Å; M846-S848 VanDerWaalsContact C-N 3.29Å; M846-S848 PolarHBondContact O-N 3.5Å; S848-T851 PolarHBondContact O-N 3.42Å; S848-W852 WeakPolarHBondContact O-CB 3.27Å; S848-W852 PolarHBondContact O-N 3.3Å
849	V	91.6	Very high	88.4	Confident	74 Å²	74	46.5 Å²	46.5	45%	0.448	24%	0.235	S	C	.	.	H	α-helix	trans	-63.6	-42.5	174	172.3	0	0	0	0	110.9	I845 M846 W852 Y853	I845-V849 WeakPolarHBondContact O-CG2 3.42Å; I845-V849 PolarHBondContact O-N 3.09Å; M846-V849 PolarHBondContact O-N 3.49Å; V849-W852 HydrophobicContact CG1-CE3 4.47Å; V849-W852 PolarHBondContact O-N 3.27Å; V849-Y853 WeakPolarHBondContact O-CB 3.24Å; V849-Y853 PolarHBondContact O-N 3.15Å
850	F	91.8	Very high	87.1	Confident	103 Å²	103	47.8 Å²	47.8	45%	0.452	25%	0.253	S	S	.	.	H	α-helix	trans	-65.3	-37.7	175.6	-74.6	-1.2	0	0	0	112.6	L747 M846 Y853 A854	L747-F850 HydrophobicContact CD1-CB 4.15Å; L747-F850 HydrophobicContact CD2-CB 4.11Å; L747-F850 HydrophobicContact CD2-CD2 4.38Å; M846-F850 HydrophobicContact CG-CE2 4.27Å; M846-F850 HydrophobicContact CG-CZ 4.21Å; M846-F850 PolarHBondContact O-N 3.01Å; M846-F850 HydrophobicContact SD-CD2 3.46Å; M846-F850 WeakPolarHBondContact SD-CD2 3.43Å; M846-F850 HydrophobicContact SD-CE1 4.41Å; M846-F850 HydrophobicContact SD-CE2 3.23Å; M846-F850 WeakPolarHBondContact SD-CE2 3.13Å; M846-F850 HydrophobicContact SD-CG 4.17Å; M846-F850 HydrophobicContact SD-CZ 3.76Å; F850-Y853 PolarHBondContact O-N 3.1Å; F850-A854 WeakPolarHBondContact O-CB 3.31Å; F850-A854 PolarHBondContact O-N 3.18Å
851	T	90	Very high	85.7	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-47.6	173.5	-62.1	0	0	0	0	110.9	W694 P743 F746 L747 V750 Y847 S848 Y853 A854 E855	W694-T851 HydrophobicContact CD2-CG2 4.34Å; W694-T851 HydrophobicContact CH2-CG2 3.94Å; W694-T851 HydrophobicContact CZ2-CG2 3.67Å; W694-T851 HydrophobicContact CZ3-CG2 4.39Å; P743-T851 PolarHBondContact O-OG1 3.42Å; F746-T851 HydrophobicContact CB-CG2 3.8Å; L747-T851 WeakPolarHBondContact CA-OG1 3.49Å; L747-T851 PolarHBondContact N-OG1 2.89Å; L747-T851 VanDerWaalsContact N-OG1 3.16Å; V750-T851 HydrophobicContact CG2-CG2 4.47Å; Y847-T851 WeakPolarHBondContact O-CB 3.48Å; Y847-T851 PolarHBondContact O-N 3.4Å; Y847-T851 PolarHBondContact O-OG1 3.23Å; S848-T851 PolarHBondContact O-N 3.42Å; T851-Y853 PolarHBondContact O-N 3.02Å; T851-A854 PolarHBondContact O-N 3.36Å; T851-E855 WeakPolarHBondContact O-CB 3.25Å; T851-E855 PolarHBondContact O-N 3.35Å
852	W	88.3	Confident	84.2	Confident	77 Å²	77	52.9 Å²	52.9	29%	0.292	28%	0.275	S	S	.	.	H	α-helix	trans	-58.9	-45.8	176	167.3	79.8	0	0	0	111.9	S848 V849 N856 F870 P871 Y876 W877	S848-W852 WeakPolarHBondContact O-CB 3.27Å; S848-W852 PolarHBondContact O-N 3.3Å; V849-W852 HydrophobicContact CG1-CE3 4.47Å; V849-W852 PolarHBondContact O-N 3.27Å; W852-N856 PolarHBondContact O-N 2.97Å; W852-N856 PolarHBondContact O-ND2 2.63Å; W852-F870 AromaticContact CH2-CE2 3.8Å; W852-F870 HydrophobicContact CH2-CE2 3.8Å; W852-F870 AromaticContact CH2-CZ 3.78Å; W852-F870 HydrophobicContact CH2-CZ 3.78Å; W852-F870 AromaticContact CZ2-CE2 3.6Å; W852-F870 HydrophobicContact CZ2-CE2 3.6Å; W852-F870 AromaticContact CZ2-CZ 3.72Å; W852-F870 HydrophobicContact CZ2-CZ 3.72Å; W852-F870 HydrophobicContact CZ3-CZ 4.25Å; W852-P871 HydrophobicContact CH2-CB 4.15Å; W852-P871 HydrophobicContact CH2-CG 4.08Å; W852-P871 HydrophobicContact CZ3-CG 4.23Å; W852-Y876 HydrophobicContact CH2-CE1 4.41Å; W852-Y876 AromaticContact CZ2-CE1 3.8Å; W852-Y876 HydrophobicContact CZ2-CE1 3.8Å; W852-W877 HydrophobicContact CH2-CZ2 4.46Å
853	Y	90.1	Very high	82.8	Confident	85 Å²	85	50.5 Å²	50.5	33%	0.333	26%	0.263	S	S	.	.	H	α-helix	trans	-63.7	-52.5	177.4	177.8	-100.8	0	0	0	111.8	V849 F850 T851 E855 N856 V857 F868 F870 P871	V849-Y853 WeakPolarHBondContact O-CB 3.24Å; V849-Y853 PolarHBondContact O-N 3.15Å; F850-Y853 PolarHBondContact O-N 3.1Å; T851-Y853 PolarHBondContact O-N 3.02Å; Y853-E855 VanDerWaalsContact C-N 3.32Å; Y853-E855 PolarHBondContact O-N 3.46Å; Y853-N856 PolarHBondContact O-N 3.08Å; Y853-V857 HydrophobicContact CD2-CG2 4.27Å; Y853-V857 HydrophobicContact CE1-CG2 4.17Å; Y853-V857 HydrophobicContact CE2-CG2 3.88Å; Y853-V857 WeakPolarHBondContact O-CG2 3.25Å; Y853-V857 PolarHBondContact O-N 2.85Å; Y853-F868 WeakPolarHBondContact CE2-O 3.37Å; Y853-F868 PolarHBondContact OH-O 2.75Å; Y853-F870 HydrophobicContact CD2-CE1 4.11Å; Y853-F870 HydrophobicContact CE2-CE1 4.47Å; Y853-P871 HydrophobicContact CD2-CG 4.26Å; Y853-P871 HydrophobicContact CE2-CG 4.44Å
854	A	86.9	Confident	81.6	Confident	8 Å²	8	53.9 Å²	53.9	7%	0.066	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-36.7	-178	0	0	0	0	0	112.6	L747 V750 F850 T851 F858	L747-A854 HydrophobicContact CD1-CB 4Å; V750-A854 HydrophobicContact CG1-CB 4.23Å; F850-A854 WeakPolarHBondContact O-CB 3.31Å; F850-A854 PolarHBondContact O-N 3.18Å; T851-A854 PolarHBondContact O-N 3.36Å; A854-F858 WeakPolarHBondContact O-CA 3.31Å; A854-F858 WeakPolarHBondContact O-CB 3.41Å; A854-F858 PolarHBondContact O-N 2.64Å
855	E	82.2	Confident	80.5	Confident	14 Å²	14	57 Å²	57	7%	0.065	30%	0.303	C	S	.	.	H	α-helix	trans	-66.4	-42.1	175.3	-172.5	-170.4	-168.6	0	0	112.3	K680 K684 W694 T851 Y853 F858	K680-E855 WeakPolarHBondContact CE-OE1 3.32Å; K680-E855 IonicContact NZ-OE1 3.35Å; K680-E855 PolarHBondContact NZ-OE1 2.88Å; K680-E855 IonicContact NZ-OE2 2.87Å; K684-E855 WeakPolarHBondContact CE-OE1 3.48Å; K684-E855 IonicContact NZ-OE1 3.53Å; K684-E855 PolarHBondContact NZ-OE1 3.35Å; W694-E855 PolarHBondContact NE1-OE2 2.88Å; T851-E855 WeakPolarHBondContact O-CB 3.25Å; T851-E855 PolarHBondContact O-N 3.35Å; Y853-E855 VanDerWaalsContact C-N 3.32Å; Y853-E855 PolarHBondContact O-N 3.46Å; E855-F858 CarbonylContact O-C 3.54Å
856	N	80.5	Confident	79.6	Confident	26 Å²	26	55.1 Å²	55.1	14%	0.139	29%	0.29	C	S	.	.	H	α-helix	trans	-70.7	-31.3	-179.9	-80.8	-89.5	0	0	0	112.5	W852 Y853 K866 F870	W852-N856 PolarHBondContact O-N 2.97Å; W852-N856 PolarHBondContact O-ND2 2.63Å; Y853-N856 PolarHBondContact O-N 3.08Å; N856-K866 HydrophobicContact CB-CD 4.18Å; N856-K866 PolarHBondContact O-N 3.46Å; N856-K866 VanDerWaalsContact OD1-CE 3.31Å; N856-K866 WeakPolarHBondContact OD1-CE 3.36Å; N856-K866 PolarHBondContact OD1-NZ 2.88Å; N856-F870 HydrophobicContact CB-CD1 4.4Å; N856-F870 HydrophobicContact CB-CE1 3.54Å; N856-F870 HydrophobicContact CB-CE2 4.49Å; N856-F870 HydrophobicContact CB-CZ 3.59Å
857	V	82.1	Confident	78.7	Confident	22 Å²	22	58.9 Å²	58.9	13%	0.133	31%	0.306	C	S	.	.	H	α-helix	trans	-85.1	-36.8	178.4	177.1	0	0	0	0	112.1	Y853 P859 F870	Y853-V857 HydrophobicContact CD2-CG2 4.27Å; Y853-V857 HydrophobicContact CE1-CG2 4.17Å; Y853-V857 HydrophobicContact CE2-CG2 3.88Å; Y853-V857 WeakPolarHBondContact O-CG2 3.25Å; Y853-V857 PolarHBondContact O-N 2.85Å; V857-P859 WeakPolarHBondContact O-CD 3.29Å; V857-F870 HydrophobicContact CG2-CD1 4.48Å; V857-F870 HydrophobicContact CG2-CE1 4.34Å
858	F	76.2	Confident	78.1	Confident	136 Å²	136	64.2 Å²	64.2	60%	0.596	33%	0.33	S	S	*	.			trans	-120.6	64.1	-179.7	-58.4	-75	0	0	0	113.3	A854 E855 G860	A854-F858 WeakPolarHBondContact O-CA 3.31Å; A854-F858 WeakPolarHBondContact O-CB 3.41Å; A854-F858 PolarHBondContact O-N 2.64Å; E855-F858 CarbonylContact O-C 3.54Å; F858-G860 PolarHBondContact O-N 3.44Å
859	P	67.3	Low	77.8	Confident	23 Å²	23	66.4 Å²	66.4	15%	0.149	33%	0.33	C	S	.	.			trans	-74.6	69.5	175.6	33.1	-36.2	0	0	0	112.1	V857 D861 Y862 P865	V857-P859 WeakPolarHBondContact O-CD 3.29Å; P859-D861 PolarHBondContact O-N 2.77Å; P859-Y862 CarbonylContact O-C 3.57Å; P859-Y862 PolarHBondContact O-N 3.43Å; P859-P865 HydrophobicContact CG-CB 3.99Å
860	G	65.1	Low	77.4	Confident	44 Å²	44	63 Å²	63	45%	0.454	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	-131.5	166.1	0	0	0	0	0	115.7	F858	F858-G860 PolarHBondContact O-N 3.44Å
861	D	61.9	Low	76.8	Confident	113 Å²	113	59.3 Å²	59.3	60%	0.604	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-1.4	170.8	-64.5	-51.1	0	0	0	112	K753 P859	K753-D861 IonicContact NZ-OD1 3.24Å; K753-D861 PolarHBondContact NZ-OD1 2.88Å; K753-D861 IonicContact NZ-OD2 2.76Å; K753-D861 PolarHBondContact NZ-OD2 2.86Å; P859-D861 PolarHBondContact O-N 2.77Å
862	Y	62	Low	76.5	Confident	80 Å²	80	67.8 Å²	67.8	31%	0.314	33%	0.333	S	S	.	.	S	Bend	trans	-149.9	132.3	-172.2	-62.8	-79.2	0	0	0	109.7	R678 P859	R678-Y862 VanDerWaalsContact CZ-OH 3.32Å; R678-Y862 PolarHBondContact NH1-OH 2.97Å; R678-Y862 PolarHBondContact NH2-OH 3.13Å; P859-Y862 CarbonylContact O-C 3.57Å; P859-Y862 PolarHBondContact O-N 3.43Å
863	G	64	Low	75.8	Confident	14 Å²	14	67 Å²	67	14%	0.144	33%	0.333	C	S	.	.	S	Bend	trans	117.6	151.4	-171	0	0	0	0	0	111.3	P865 L962	G863-P865 VanDerWaalsContact O-CD 3.26Å; G863-P865 WeakPolarHBondContact O-CD 3.4Å; G863-L962 CarbonylContact C-O 3.56Å; G863-L962 WeakPolarHBondContact CA-O 3.39Å; G863-L962 PolarHBondContact N-O 2.94Å
864	V	67.8	Low	75.1	Confident	70 Å²	70	71.2 Å²	71.2	42%	0.424	35%	0.353	S	S	.	.			trans	-81.8	112.2	-178.6	179.5	0	0	0	0	109.9	K866 P964	V864-K866 PolarHBondContact O-N 2.94Å; V864-P964 HydrophobicContact CG1-CB 3.86Å; V864-P964 HydrophobicContact CG1-CG 4.07Å; V864-P964 HydrophobicContact CG2-CB 4.13Å; V864-P964 HydrophobicContact CG2-CG 4.41Å
865	P	70	Confident	74.3	Confident	74 Å²	74	73 Å²	73	48%	0.481	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-68.2	126.2	175.1	28.1	-33.7	0	0	0	109.9	P859 G863	P859-P865 HydrophobicContact CG-CB 3.99Å; G863-P865 VanDerWaalsContact O-CD 3.26Å; G863-P865 WeakPolarHBondContact O-CD 3.4Å
866	K	74.5	Confident	73.8	Confident	69 Å²	69	76.5 Å²	76.5	30%	0.3	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-78.9	152.8	172.4	-65.7	-173.1	-176.3	159.9	0	110.5	N856 V864 F870	N856-K866 HydrophobicContact CB-CD 4.18Å; N856-K866 PolarHBondContact O-N 3.46Å; N856-K866 VanDerWaalsContact OD1-CE 3.31Å; N856-K866 WeakPolarHBondContact OD1-CE 3.36Å; N856-K866 PolarHBondContact OD1-NZ 2.88Å; V864-K866 PolarHBondContact O-N 2.94Å; K866-F870 HydrophobicContact CB-CB 3.89Å; K866-F870 HydrophobicContact CB-CD1 3.66Å; K866-F870 HydrophobicContact CB-CE1 4.4Å; K866-F870 HydrophobicContact CB-CG 3.78Å; K866-F870 HydrophobicContact CD-CB 4.22Å; K866-F870 HydrophobicContact CD-CD1 4.07Å; K866-F870 HydrophobicContact CD-CD2 3.62Å; K866-F870 HydrophobicContact CD-CE1 4.41Å; K866-F870 HydrophobicContact CD-CE2 3.98Å; K866-F870 HydrophobicContact CD-CG 3.69Å; K866-F870 HydrophobicContact CD-CZ 4.37Å; K866-F870 HydrophobicContact CG-CG 4.38Å
867	K	75.4	Confident	73.6	Confident	120 Å²	120	83 Å²	83	52%	0.522	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-58.3	145.5	173	-58.9	-176.4	-178.7	178.7	0	109.5	Y869 F870	K867-Y869 HydrophobicContact CB-CD1 4.46Å; K867-Y869 HydrophobicContact CB-CE1 4.26Å; K867-Y869 HydrophobicContact CB-CE2 4.35Å; K867-Y869 HydrophobicContact CD-CE1 4.36Å; K867-Y869 HydrophobicContact CD-CE2 3.93Å; K867-Y869 WeakPolarHBondContact CD-OH 3.39Å; K867-Y869 PolarHBondContact O-N 3.03Å; K867-Y869 VanDerWaalsContact O-N 3.08Å; K867-F870 VanDerWaalsContact O-CB 3.3Å; K867-F870 WeakPolarHBondContact O-CB 3.25Å; K867-F870 WeakPolarHBondContact O-CD1 3.31Å; K867-F870 PolarHBondContact O-N 2.92Å
868	F	80.5	Confident	73	Confident	140 Å²	140	90.2 Å²	90.2	61%	0.614	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.9	-177.2	71.5	-93.3	0	0	0	113.4	Y853	Y853-F868 WeakPolarHBondContact CE2-O 3.37Å; Y853-F868 PolarHBondContact OH-O 2.75Å
869	Y	84.6	Confident	72.2	Confident	98 Å²	98	86 Å²	86	38%	0.384	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	14.3	176.2	56.8	-97.3	0	0	0	114.6	K867 P871 F872 Q873	K867-Y869 HydrophobicContact CB-CD1 4.46Å; K867-Y869 HydrophobicContact CB-CE1 4.26Å; K867-Y869 HydrophobicContact CB-CE2 4.35Å; K867-Y869 HydrophobicContact CD-CE1 4.36Å; K867-Y869 HydrophobicContact CD-CE2 3.93Å; K867-Y869 WeakPolarHBondContact CD-OH 3.39Å; K867-Y869 PolarHBondContact O-N 3.03Å; K867-Y869 VanDerWaalsContact O-N 3.08Å; Y869-P871 VanDerWaalsContact C-N 3.3Å; Y869-P871 VanDerWaalsContact O-N 3.16Å; Y869-F872 PolarHBondContact O-N 3.31Å; Y869-Q873 HydrophobicContact CD2-CG 4.05Å; Y869-Q873 HydrophobicContact CE2-CG 4.23Å
870	F	83	Confident	71.5	Confident	4 Å²	4	91 Å²	91	2%	0.018	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-53.1	-33.2	-178.7	87.5	-92.5	0	0	0	115.5	W852 Y853 N856 V857 K866 K867 F872 Q873 Y876	W852-F870 AromaticContact CH2-CE2 3.8Å; W852-F870 HydrophobicContact CH2-CE2 3.8Å; W852-F870 AromaticContact CH2-CZ 3.78Å; W852-F870 HydrophobicContact CH2-CZ 3.78Å; W852-F870 AromaticContact CZ2-CE2 3.6Å; W852-F870 HydrophobicContact CZ2-CE2 3.6Å; W852-F870 AromaticContact CZ2-CZ 3.72Å; W852-F870 HydrophobicContact CZ2-CZ 3.72Å; W852-F870 HydrophobicContact CZ3-CZ 4.25Å; Y853-F870 HydrophobicContact CD2-CE1 4.11Å; Y853-F870 HydrophobicContact CE2-CE1 4.47Å; N856-F870 HydrophobicContact CB-CD1 4.4Å; N856-F870 HydrophobicContact CB-CE1 3.54Å; N856-F870 HydrophobicContact CB-CE2 4.49Å; N856-F870 HydrophobicContact CB-CZ 3.59Å; V857-F870 HydrophobicContact CG2-CD1 4.48Å; V857-F870 HydrophobicContact CG2-CE1 4.34Å; K866-F870 HydrophobicContact CB-CB 3.89Å; K866-F870 HydrophobicContact CB-CD1 3.66Å; K866-F870 HydrophobicContact CB-CE1 4.4Å; K866-F870 HydrophobicContact CB-CG 3.78Å; K866-F870 HydrophobicContact CD-CB 4.22Å; K866-F870 HydrophobicContact CD-CD1 4.07Å; K866-F870 HydrophobicContact CD-CD2 3.62Å; K866-F870 HydrophobicContact CD-CE1 4.41Å; K866-F870 HydrophobicContact CD-CE2 3.98Å; K866-F870 HydrophobicContact CD-CG 3.69Å; K866-F870 HydrophobicContact CD-CZ 4.37Å; K866-F870 HydrophobicContact CG-CG 4.38Å; K867-F870 VanDerWaalsContact O-CB 3.3Å; K867-F870 WeakPolarHBondContact O-CB 3.25Å; K867-F870 WeakPolarHBondContact O-CD1 3.31Å; K867-F870 PolarHBondContact O-N 2.92Å; F870-F872 PolarHBondContact O-N 3.49Å; F870-F872 VanDerWaalsContact O-N 3.16Å; F870-Q873 PolarHBondContact O-N 3.33Å; F870-Q873 VanDerWaalsContact O-N 3.15Å; F870-Y876 AromaticContact CD2-CD1 3.9Å; F870-Y876 HydrophobicContact CD2-CD1 3.9Å; F870-Y876 HydrophobicContact CD2-CD2 4.24Å; F870-Y876 HydrophobicContact CD2-CE1 4.09Å; F870-Y876 HydrophobicContact CD2-CE2 4.45Å; F870-Y876 AromaticContact CD2-CG 3.98Å; F870-Y876 HydrophobicContact CD2-CG 3.98Å; F870-Y876 HydrophobicContact CE2-CD1 4.03Å; F870-Y876 AromaticContact CE2-CE1 3.75Å; F870-Y876 HydrophobicContact CE2-CE1 3.75Å; F870-Y876 HydrophobicContact CE2-CE2 4.37Å; F870-Y876 HydrophobicContact CE2-CG 4.45Å; F870-Y876 AromaticContact CE2-CZ 3.93Å
871	P	80.8	Confident	70.8	Confident	25 Å²	25	100.6 Å²	100.6	16%	0.162	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-65.2	-19.2	179.2	-21.4	35.2	0	0	0	113.2	W852 Y853 Y869 W877	W852-P871 HydrophobicContact CH2-CB 4.15Å; W852-P871 HydrophobicContact CH2-CG 4.08Å; W852-P871 HydrophobicContact CZ3-CG 4.23Å; Y853-P871 HydrophobicContact CD2-CG 4.26Å; Y853-P871 HydrophobicContact CE2-CG 4.44Å; Y869-P871 VanDerWaalsContact C-N 3.3Å; Y869-P871 VanDerWaalsContact O-N 3.16Å; P871-W877 PolarHBondContact O-NE1 2.89Å
872	F	82.9	Confident	70.1	Confident	181 Å²	181	98 Å²	98	79%	0.794	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-96.6	-2.5	179.9	-54.4	-71.9	0	0	0	113.1	Y869 F870	Y869-F872 PolarHBondContact O-N 3.31Å; F870-F872 PolarHBondContact O-N 3.49Å; F870-F872 VanDerWaalsContact O-N 3.16Å
873	Q	74.9	Confident	69.4	Low	62 Å²	62	96.2 Å²	96.2	29%	0.29	46%	0.456	S	S	.	.			trans	-81.1	123.4	175.4	-66.7	-169.7	-97.2	0	0	110.7	Y869 F870 S875 Y876	Y869-Q873 HydrophobicContact CD2-CG 4.05Å; Y869-Q873 HydrophobicContact CE2-CG 4.23Å; F870-Q873 PolarHBondContact O-N 3.33Å; F870-Q873 VanDerWaalsContact O-N 3.15Å; Q873-S875 PolarHBondContact O-N 3.49Å; Q873-Y876 PolarHBondContact O-N 3.45Å
874	K	73.6	Confident	68.8	Low	173 Å²	173	100.8 Å²	100.8	75%	0.752	48%	0.483	S	S	*	.	H	α-helix	trans	-52.6	-38.7	175.2	-110.5	-176.7	176.2	-178.6	0	112.8	Y876 W877 F878	K874-Y876 PolarHBondContact O-N 3.2Å; K874-W877 PolarHBondContact O-N 3.39Å; K874-F878 HydrophobicContact CG-CD2 4.37Å; K874-F878 PolarHBondContact O-N 3.09Å; K874-F878 VanDerWaalsContact O-N 3.16Å
875	S	70	Confident	67.8	Low	45 Å²	45	107.4 Å²	107.4	32%	0.315	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-24.2	-179.8	54.2	0	0	0	0	114.1	Q873 G879 E880	Q873-S875 PolarHBondContact O-N 3.49Å; S875-G879 WeakPolarHBondContact O-CA 3.37Å; S875-G879 PolarHBondContact O-N 3.17Å; S875-E880 WeakPolarHBondContact CB-OE2 3.46Å
876	Y	72.1	Confident	66.9	Low	87 Å²	87	108.1 Å²	108.1	34%	0.341	50%	0.5	S	S	.	.	H	α-helix	trans	-74	-37.5	177.4	177.5	-112.5	0	0	0	113.3	W852 F870 Q873 K874	W852-Y876 HydrophobicContact CH2-CE1 4.41Å; W852-Y876 AromaticContact CZ2-CE1 3.8Å; W852-Y876 HydrophobicContact CZ2-CE1 3.8Å; F870-Y876 AromaticContact CD2-CD1 3.9Å; F870-Y876 HydrophobicContact CD2-CD1 3.9Å; F870-Y876 HydrophobicContact CD2-CD2 4.24Å; F870-Y876 HydrophobicContact CD2-CE1 4.09Å; F870-Y876 HydrophobicContact CD2-CE2 4.45Å; F870-Y876 AromaticContact CD2-CG 3.98Å; F870-Y876 HydrophobicContact CD2-CG 3.98Å; F870-Y876 HydrophobicContact CE2-CD1 4.03Å; F870-Y876 AromaticContact CE2-CE1 3.75Å; F870-Y876 HydrophobicContact CE2-CE1 3.75Å; F870-Y876 HydrophobicContact CE2-CE2 4.37Å; F870-Y876 HydrophobicContact CE2-CG 4.45Å; F870-Y876 AromaticContact CE2-CZ 3.93Å; Q873-Y876 PolarHBondContact O-N 3.45Å; K874-Y876 PolarHBondContact O-N 3.2Å
877	W	76.2	Confident	65.8	Low	163 Å²	163	107.4 Å²	107.4	62%	0.617	50%	0.496	S	S	*	.	H	α-helix	trans	-89	-38.5	-175.3	-68.2	100.4	0	0	0	113.5	W852 P871 K874	W852-W877 HydrophobicContact CH2-CZ2 4.46Å; P871-W877 PolarHBondContact O-NE1 2.89Å; K874-W877 PolarHBondContact O-N 3.39Å
878	F	71.1	Confident	64.9	Low	174 Å²	174	106.9 Å²	106.9	76%	0.763	50%	0.496	S	S	*	.	H	α-helix	trans	-100.7	-19.2	-173.8	-65.1	-77.7	0	0	0	113.6	K874	K874-F878 HydrophobicContact CG-CD2 4.37Å; K874-F878 PolarHBondContact O-N 3.09Å; K874-F878 VanDerWaalsContact O-N 3.16Å
879	G	57.4	Low	63.6	Low	46 Å²	46	106.2 Å²	106.2	47%	0.474	49%	0.494	S	S	.	.			trans	69.5	135.3	-166.7	0	0	0	0	0	111.5	S875	S875-G879 WeakPolarHBondContact O-CA 3.37Å; S875-G879 PolarHBondContact O-N 3.17Å
880	E	54.5	Low	62	Low	128 Å²	128	104.9 Å²	104.9	60%	0.598	49%	0.493	S	S	*	.			trans	-77.3	138.9	164.2	-93.2	167.1	129.1	0	0	109.4	S875 T882	S875-E880 WeakPolarHBondContact CB-OE2 3.46Å; E880-T882 PolarHBondContact O-N 3.14Å
881	R	48.9	Very low	60.5	Low	246 Å²	246	108.2 Å²	108.2	93%	0.928	51%	0.508	S	S	*	.			trans	-83.2	93.6	171.5	-78.2	-175.8	174.6	178.3	-1.7	107.3	S883	R881-S883 PolarHBondContact O-N 3.18Å; R881-S883 VanDerWaalsContact O-N 3.15Å
882	T	48.3	Very low	59	Low	60 Å²	60	114.9 Å²	114.9	37%	0.368	53%	0.53	S	S	.	.			trans	-49.7	119.4	169.6	-3.7	0	0	0	0	109.2	E880 D976 E979	E880-T882 PolarHBondContact O-N 3.14Å; T882-D976 HydrophobicContact CG2-CB 4.47Å; T882-E979 WeakPolarHBondContact CB-OE2 3.36Å; T882-E979 VanDerWaalsContact CG2-OE2 3.25Å; T882-E979 WeakPolarHBondContact CG2-OE2 3.31Å; T882-E979 PolarHBondContact OG1-OE2 3.37Å
883	S	46.4	Very low	57.4	Low	41 Å²	41	111 Å²	111	29%	0.287	52%	0.52	S	S	.	.			trans	-78.7	140.2	-176	99.5	0	0	0	0	110	R881 R885 D886	R881-S883 PolarHBondContact O-N 3.18Å; R881-S883 VanDerWaalsContact O-N 3.15Å; S883-R885 PolarHBondContact O-N 3.28Å; S883-R885 VanDerWaalsContact O-N 3.08Å; S883-R885 PolarHBondContact OG-N 2.93Å; S883-D886 VanDerWaalsContact CB-OD2 3.25Å; S883-D886 WeakPolarHBondContact CB-OD2 3.4Å; S883-D886 PolarHBondContact O-N 2.84Å; S883-D886 VanDerWaalsContact OG-CG 3.3Å; S883-D886 PolarHBondContact OG-N 3.49Å; S883-D886 PolarHBondContact OG-OD2 3.04Å
884	P	51.2	Low	56.1	Low	110 Å²	110	109.2 Å²	109.2	71%	0.714	52%	0.515	S	S	*	.	H	α-helix	trans	-59.1	-23	175.7	-25.8	34.8	0	0	0	113.5	E888	P884-E888 PolarHBondContact O-N 3.5Å
885	R	47.1	Very low	54.8	Low	210 Å²	210	108.8 Å²	108.8	79%	0.792	51%	0.513	S	S	*	.	H	α-helix	trans	-70	-36	179.3	-71.2	-177.2	172.3	-179.4	-2.5	112.3	S883 E888 H889	S883-R885 PolarHBondContact O-N 3.28Å; S883-R885 VanDerWaalsContact O-N 3.08Å; S883-R885 PolarHBondContact OG-N 2.93Å; R885-E888 PolarHBondContact O-N 3.33Å; R885-H889 WeakPolarHBondContact O-CB 3.36Å; R885-H889 PolarHBondContact O-N 2.92Å
886	D	51.3	Low	53.4	Low	89 Å²	89	116 Å²	116	48%	0.476	54%	0.539	S	S	.	.	H	α-helix	trans	-69.3	-37.2	-179.7	-56.9	-54.9	0	0	0	111.1	S883 H889 L890	S883-D886 VanDerWaalsContact CB-OD2 3.25Å; S883-D886 WeakPolarHBondContact CB-OD2 3.4Å; S883-D886 PolarHBondContact O-N 2.84Å; S883-D886 VanDerWaalsContact OG-CG 3.3Å; S883-D886 PolarHBondContact OG-N 3.49Å; S883-D886 PolarHBondContact OG-OD2 3.04Å; D886-H889 PolarHBondContact O-N 3.23Å; D886-L890 WeakPolarHBondContact O-CB 3.37Å; D886-L890 WeakPolarHBondContact O-CG 3.43Å; D886-L890 PolarHBondContact O-N 3.02Å
887	Y	52.1	Low	52.1	Low	54 Å²	54	114.5 Å²	114.5	21%	0.212	54%	0.541	C	S	.	.	H	α-helix	trans	-62.3	-46.9	173.9	-179.7	-108.6	0	0	0	112.2	H889 K891 F971	Y887-H889 VanDerWaalsContact C-N 3.34Å; Y887-H889 PolarHBondContact O-N 3.49Å; Y887-K891 HydrophobicContact CE1-CD 4.21Å; Y887-K891 VanDerWaalsContact O-CB 3.27Å; Y887-K891 WeakPolarHBondContact O-CB 3.48Å; Y887-K891 PolarHBondContact O-N 3.35Å; Y887-K891 PolarHBondContact OH-NZ 2.93Å; Y887-F971 HydrophobicContact CD2-CB 4.16Å; Y887-F971 AromaticContact CD2-CD1 3.63Å; Y887-F971 HydrophobicContact CD2-CD1 3.63Å; Y887-F971 AromaticContact CD2-CD2 3.83Å; Y887-F971 HydrophobicContact CD2-CD2 3.83Å; Y887-F971 AromaticContact CD2-CE1 3.92Å; Y887-F971 HydrophobicContact CD2-CE1 3.92Å; Y887-F971 HydrophobicContact CD2-CE2 4.09Å; Y887-F971 AromaticContact CD2-CG 3.59Å; Y887-F971 HydrophobicContact CD2-CG 3.59Å; Y887-F971 HydrophobicContact CD2-CZ 4.14Å; Y887-F971 HydrophobicContact CE2-CB 3.61Å; Y887-F971 HydrophobicContact CE2-CD1 4Å; Y887-F971 AromaticContact CE2-CD2 3.76Å; Y887-F971 HydrophobicContact CE2-CD2 3.76Å; Y887-F971 HydrophobicContact CE2-CE2 4.43Å; Y887-F971 AromaticContact CE2-CG 3.5Å; Y887-F971 HydrophobicContact CE2-CG 3.5Å
888	E	56.1	Low	50.6	Low	109 Å²	109	114.5 Å²	114.5	51%	0.509	55%	0.548	S	S	.	.	H	α-helix	trans	-62.6	-40.1	173.7	-77.7	-154.5	148.4	0	0	112.6	P884 R885 K891 R892	P884-E888 PolarHBondContact O-N 3.5Å; R885-E888 PolarHBondContact O-N 3.33Å; E888-K891 PolarHBondContact O-N 3.43Å; E888-R892 WeakPolarHBondContact O-CG 3.5Å; E888-R892 PolarHBondContact O-N 2.87Å; E888-R892 IonicContact OE2-CZ 2.65Å; E888-R892 IonicContact OE2-NH2 2.58Å; E888-R892 PolarHBondContact OE2-NH2 2.86Å
889	H	54.1	Low	49.8	Very low	126 Å²	126	110.6 Å²	110.6	58%	0.583	53%	0.532	S	S	*	.	H	α-helix	trans	-69.7	-39.7	-175.9	-150.3	-50.1	0	0	0	112	R885 D886 Y887 R892 V893	R885-H889 WeakPolarHBondContact O-CB 3.36Å; R885-H889 PolarHBondContact O-N 2.92Å; D886-H889 PolarHBondContact O-N 3.23Å; Y887-H889 VanDerWaalsContact C-N 3.34Å; Y887-H889 PolarHBondContact O-N 3.49Å; H889-R892 PolarHBondContact O-N 3.49Å; H889-V893 WeakPolarHBondContact O-CG2 3.29Å; H889-V893 PolarHBondContact O-N 3.42Å
890	L	49.6	Very low	49.8	Very low	69 Å²	69	111.9 Å²	111.9	36%	0.361	53%	0.525	S	S	.	.	H	α-helix	trans	-65.6	-41	172.3	-75.8	164.3	0	0	0	111.7	D886 R892 V893 S894 T969 F971	D886-L890 WeakPolarHBondContact O-CB 3.37Å; D886-L890 WeakPolarHBondContact O-CG 3.43Å; D886-L890 PolarHBondContact O-N 3.02Å; L890-R892 VanDerWaalsContact C-N 3.28Å; L890-R892 PolarHBondContact O-N 2.97Å; L890-V893 PolarHBondContact O-N 2.87Å; L890-S894 PolarHBondContact O-N 3.25Å; L890-S894 VanDerWaalsContact O-N 3.09Å; L890-T969 HydrophobicContact CD1-CG2 4.45Å; L890-F971 HydrophobicContact CD1-CE2 4.19Å; L890-F971 HydrophobicContact CD1-CZ 3.82Å
891	K	51.4	Low	50.4	Low	74 Å²	74	108.4 Å²	108.4	32%	0.322	51%	0.509	S	S	.	.	H	α-helix	trans	-68.7	-22.6	178.6	-160.2	170.5	-168.9	172.5	0	113.8	Y887 E888 S894	Y887-K891 HydrophobicContact CE1-CD 4.21Å; Y887-K891 VanDerWaalsContact O-CB 3.27Å; Y887-K891 WeakPolarHBondContact O-CB 3.48Å; Y887-K891 PolarHBondContact O-N 3.35Å; Y887-K891 PolarHBondContact OH-NZ 2.93Å; E888-K891 PolarHBondContact O-N 3.43Å; K891-S894 PolarHBondContact O-OG 3Å
892	R	50.5	Low	50.8	Low	165 Å²	165	104.7 Å²	104.7	62%	0.623	50%	0.503	S	S	*	.	H	α-helix	trans	-76.8	-29.3	168.1	-72.9	-179.4	-167.7	136.3	18	112.9	E888 H889 L890	E888-R892 WeakPolarHBondContact O-CG 3.5Å; E888-R892 PolarHBondContact O-N 2.87Å; E888-R892 IonicContact OE2-CZ 2.65Å; E888-R892 IonicContact OE2-NH2 2.58Å; E888-R892 PolarHBondContact OE2-NH2 2.86Å; H889-R892 PolarHBondContact O-N 3.49Å; L890-R892 VanDerWaalsContact C-N 3.28Å; L890-R892 PolarHBondContact O-N 2.97Å
893	V	49.4	Very low	51.6	Low	99 Å²	99	104 Å²	104	60%	0.6	50%	0.498	S	S	*	.	H	α-helix	trans	-76.3	-35.5	178.2	174	0	0	0	0	111.7	H889 L890 K895	H889-V893 WeakPolarHBondContact O-CG2 3.29Å; H889-V893 PolarHBondContact O-N 3.42Å; L890-V893 PolarHBondContact O-N 2.87Å; V893-K895 VanDerWaalsContact C-N 3.27Å; V893-K895 PolarHBondContact O-N 3.18Å
894	S	47.1	Very low	52.7	Low	26 Å²	26	110.3 Å²	110.3	18%	0.182	53%	0.529	C	S	.	.	G	3₁₀ helix	trans	-70.5	-15.7	179.3	69.3	0	0	0	0	114.7	L890 K891 K896	L890-S894 PolarHBondContact O-N 3.25Å; L890-S894 VanDerWaalsContact O-N 3.09Å; K891-S894 PolarHBondContact O-OG 3Å; S894-K896 PolarHBondContact O-N 3.16Å
895	K	46	Very low	53.7	Low	163 Å²	163	108.6 Å²	108.6	71%	0.709	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-67.9	17.7	-178.3	-103.4	-160.1	175.6	-152.1	0	115.8	V893 E902	V893-K895 VanDerWaalsContact C-N 3.27Å; V893-K895 PolarHBondContact O-N 3.18Å; K895-E902 IonicContact NZ-OE1 3.06Å
896	K	41.1	Very low	55.2	Low	196 Å²	196	102.5 Å²	102.5	85%	0.852	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-106.7	3.3	-177.8	-91.9	-172.5	172.9	-175.8	0	115.5	S894	S894-K896 PolarHBondContact O-N 3.16Å
897	S	43.5	Very low	56.7	Low	56 Å²	56	99.6 Å²	99.6	39%	0.392	49%	0.486	S	S	.	.			trans	-78.7	117.9	168.2	45.6	0	0	0	0	111.1	H900	S897-H900 PolarHBondContact OG-CD2 3.48Å; S897-H900 PolarHBondContact OG-NE2 3.41Å
898	E	46.6	Very low	58.2	Low	163 Å²	163	97 Å²	97	76%	0.762	48%	0.476	S	S	*	.	S	Bend	trans	-63.7	146.2	170.2	-62.3	175.8	150.9	0	0	110
899	H	53.2	Low	59.7	Low	92 Å²	92	91.9 Å²	91.9	43%	0.426	45%	0.452	S	S	.	.			trans	79.9	61.3	176.3	-34.2	-49.7	0	0	0	117.7	Y1133	H899-Y1133 PolarHBondContact CE1-OH 2.87Å; H899-Y1133 AromaticContact ND1-CZ 3.99Å; H899-Y1133 PolarHBondContact ND1-OH 3.48Å; H899-Y1133 VanDerWaalsContact ND1-OH 3.11Å
900	H	58.1	Low	61.3	Low	73 Å²	73	86 Å²	86	34%	0.338	43%	0.425	S	S	.	.			trans	-124.2	138.8	163	-68	-95.6	0	0	0	111.9	S897 Y1124	S897-H900 PolarHBondContact OG-CD2 3.48Å; S897-H900 PolarHBondContact OG-NE2 3.41Å; H900-Y1124 AromaticContact CE1-CD1 3.95Å; H900-Y1124 AromaticContact ND1-CD1 3.25Å; H900-Y1124 WeakPolarHBondContact ND1-CD1 3.41Å; H900-Y1124 AromaticContact ND1-CE1 3.8Å; H900-Y1124 AromaticContact ND1-CG 3.9Å
901	E	66.6	Low	63.2	Low	55 Å²	55	82.8 Å²	82.8	26%	0.257	41%	0.408	S	S	.	.			trans	-84.6	122.6	171.1	163.3	-163.6	-128	0	0	109	R1112 S1126 F1129	E901-R1112 VanDerWaalsContact CB-NH2 3.29Å; E901-R1112 PolarHBondContact O-NH2 3.17Å; E901-R1112 IonicContact OE2-CZ 3.7Å; E901-R1112 IonicContact OE2-NE 2.74Å; E901-R1112 IonicContact OE2-NH2 3.3Å; E901-R1112 PolarHBondContact OE2-NH2 2.85Å; E901-S1126 PolarHBondContact OE1-OG 3.47Å; E901-S1126 PolarHBondContact OE2-N 3.47Å; E901-F1129 HydrophobicContact CB-CD1 4.43Å; E901-F1129 HydrophobicContact CB-CD2 4.23Å; E901-F1129 HydrophobicContact CB-CE2 4.33Å; E901-F1129 HydrophobicContact CB-CG 4.29Å; E901-F1129 HydrophobicContact CB-CZ 4.47Å
902	E	58.1	Low	64.7	Low	169 Å²	169	80 Å²	80	79%	0.79	40%	0.397	S	S	*	.			trans	-75.2	140.6	-177.6	-67.3	-163.8	137.1	0	0	112.2	K895	K895-E902 IonicContact NZ-OE1 3.06Å
903	V	63.6	Low	66.3	Low	44 Å²	44	72.9 Å²	72.9	27%	0.267	38%	0.375	S	S	.	.			trans	-142.1	130.4	-174.6	-173.1	0	0	0	0	111.3	L905 Y937	V903-L905 HydrophobicContact CG1-CB 4.02Å; V903-L905 HydrophobicContact CG1-CD1 3.86Å; V903-L905 HydrophobicContact CG1-CG 4.05Å; V903-L905 PolarHBondContact O-N 3.3Å; V903-Y937 HydrophobicContact CB-CE1 4.29Å
904	N	69.8	Low	68	Low	175 Å²	175	68.2 Å²	68.2	94%	0.936	35%	0.347	S	S	*	.			trans	-81.3	55.4	175.9	-71.6	-23.2	0	0	0	112.5
905	L	73.4	Confident	70	Confident	73 Å²	73	67.6 Å²	67.6	38%	0.382	34%	0.342	S	S	.	.	S	Bend	trans	-126.4	148.9	174.7	-80.8	167.6	0	0	0	110.6	V903 Y937 Q940	V903-L905 HydrophobicContact CG1-CB 4.02Å; V903-L905 HydrophobicContact CG1-CD1 3.86Å; V903-L905 HydrophobicContact CG1-CG 4.05Å; V903-L905 PolarHBondContact O-N 3.3Å; L905-Y937 HydrophobicContact CB-CD1 3.74Å; L905-Y937 HydrophobicContact CB-CG 4.41Å; L905-Y937 WeakPolarHBondContact O-CD1 3.23Å; L905-Y937 WeakPolarHBondContact O-CE1 3.36Å; L905-Q940 HydrophobicContact CD1-CG 4.15Å
906	P	78.6	Confident	71.8	Confident	82 Å²	82	60.9 Å²	60.9	53%	0.532	31%	0.313	S	S	.	.			trans	-67.1	139.1	175.8	27.5	-32.4	0	0	0	111	D938	P906-D938 HydrophobicContact CG-CB 3.95Å; P906-D938 PolarHBondContact O-N 3.36Å
907	V	81.1	Confident	73.7	Confident	29 Å²	29	55 Å²	55	18%	0.176	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	115.5	178.3	179.9	0	0	0	0	109.4	I909 D935 F936 Y937	V907-I909 VanDerWaalsContact CG1-O 3.22Å; V907-I909 WeakPolarHBondContact CG1-O 3.34Å; V907-D935 HydrophobicContact CG1-CB 4.01Å; V907-D935 HydrophobicContact CG2-CB 4.43Å; V907-F936 CarbonylContact C-O 3.58Å; V907-Y937 HydrophobicContact CG2-CD1 4.18Å; V907-Y937 HydrophobicContact CG2-CE1 3.76Å
908	G	84.1	Confident	74.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-39.9	176.1	0	0	0	0	0	113	F936 Y973	G908-F936 PolarHBondContact N-O 3.28Å; G908-Y973 PolarHBondContact O-N 3.05Å
909	I	88.8	Confident	75.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.9	175.7	-46.9	-176.5	0	0	0	110.1	V907 D935 F936 I959 V970 F971 I972 I1065 I1097	V907-I909 VanDerWaalsContact CG1-O 3.22Å; V907-I909 WeakPolarHBondContact CG1-O 3.34Å; I909-D935 CarbonylContact O-C 3.52Å; I909-D935 WeakPolarHBondContact O-CA 3.18Å; I909-F936 HydrophobicContact CB-CB 4.13Å; I909-F936 HydrophobicContact CB-CD2 3.86Å; I909-F936 HydrophobicContact CB-CG 4.4Å; I909-F936 HydrophobicContact CG2-CD2 4.15Å; I909-F936 PolarHBondContact N-O 3.44Å; I909-F936 PolarHBondContact O-N 2.96Å; I909-I959 HydrophobicContact CD1-CG2 3.87Å; I909-I959 HydrophobicContact CG2-CG2 4.34Å; I909-V970 HydrophobicContact CG2-CG1 3.67Å; I909-F971 CarbonylContact C-O 3.57Å; I909-F971 WeakPolarHBondContact CA-O 3.36Å; I909-I972 HydrophobicContact CB-CG1 4.43Å; I909-I972 HydrophobicContact CD1-CD1 4.48Å; I909-I972 HydrophobicContact CD1-CG1 4.4Å; I909-I972 HydrophobicContact CG1-CG1 4.08Å; I909-I972 HydrophobicContact CG2-CG1 3.92Å; I909-I1065 HydrophobicContact CD1-CD1 3.99Å; I909-I1065 HydrophobicContact CD1-CG1 4.25Å; I909-I1065 HydrophobicContact CD1-CG2 3.57Å; I909-I1065 HydrophobicContact CG1-CD1 3.79Å; I909-I1065 HydrophobicContact CG1-CG1 4.27Å; I909-I1065 HydrophobicContact CG1-CG2 4.47Å; I909-I1097 HydrophobicContact CD1-CD1 3.61Å
910	S	87.8	Confident	75.4	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.014	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	118.8	176.2	-171.4	0	0	0	0	109.6	D935 V970 F971	S910-D935 WeakPolarHBondContact CA-OD1 3.49Å; S910-D935 WeakPolarHBondContact CB-OD1 3.48Å; S910-D935 PolarHBondContact OG-OD1 3.15Å; S910-V970 CarbonylContact O-C 3.59Å; S910-V970 WeakPolarHBondContact O-CA 3.34Å; S910-V970 WeakPolarHBondContact O-CG1 3.42Å; S910-F971 PolarHBondContact N-O 2.84Å; S910-F971 PolarHBondContact O-N 3.07Å
911	V	87.9	Confident	74.8	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	124	178.9	-179.8	0	0	0	0	107.6	V914 L932 N933 V934 F936 I959 V970	V911-V914 HydrophobicContact CG1-CB 3.86Å; V911-V914 HydrophobicContact CG1-CG2 3.57Å; V911-L932 HydrophobicContact CG1-CD2 4.37Å; V911-N933 VanDerWaalsContact O-CA 3.3Å; V911-N933 WeakPolarHBondContact O-CA 3.5Å; V911-V934 HydrophobicContact CB-CB 4.46Å; V911-V934 WeakPolarHBondContact CB-O 3.28Å; V911-V934 PolarHBondContact N-O 3Å; V911-V934 PolarHBondContact O-N 3.44Å; V911-V934 VanDerWaalsContact O-N 3.07Å; V911-F936 HydrophobicContact CG2-CE2 3.95Å; V911-I959 HydrophobicContact CG2-CD1 4.2Å; V911-I959 HydrophobicContact CG2-CG1 4.46Å; V911-V970 HydrophobicContact CB-CG2 4.41Å; V911-V970 HydrophobicContact CG1-CG2 4.15Å; V911-V970 HydrophobicContact CG2-CG1 4.04Å; V911-V970 HydrophobicContact CG2-CG2 4.17Å
912	V	84.6	Confident	73.8	Confident	15 Å²	15	63.8 Å²	63.8	9%	0.091	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	115.5	-173.2	-175.4	0	0	0	0	111.1	V914 N933 G968 T969 F971	V912-V914 VanDerWaalsContact C-N 3.29Å; V912-V914 PolarHBondContact O-N 2.9Å; V912-N933 WeakPolarHBondContact CA-OD1 3.37Å; V912-G968 WeakPolarHBondContact O-CA 3.31Å; V912-T969 PolarHBondContact N-O 3.08Å; V912-T969 PolarHBondContact O-N 3.29Å; V912-T969 VanDerWaalsContact O-O 3.08Å; V912-F971 HydrophobicContact CG2-CD2 4.24Å; V912-F971 HydrophobicContact CG2-CE2 4.28Å
913	G	83.1	Confident	73.1	Confident	15 Å²	15	63.7 Å²	63.7	16%	0.155	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	55.6	33.7	175.1	0	0	0	0	0	115.9	T915 D931 L932 N933 G968	G913-T915 PolarHBondContact O-N 2.56Å; G913-D931 WeakPolarHBondContact CA-OD1 3.42Å; G913-L932 PolarHBondContact N-O 3.25Å; G913-N933 PolarHBondContact N-OD1 3.36Å; G913-G968 VanDerWaalsContact O-CA 3.25Å; G913-G968 WeakPolarHBondContact O-CA 3.47Å
914	V	86	Confident	72.3	Confident	1 Å²	1	74 Å²	74	1%	0.006	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	113.9	-170.5	173.6	0	0	0	0	111.9	V911 V912 L929 L932 I958 P965 E967 T969 V970	V911-V914 HydrophobicContact CG1-CB 3.86Å; V911-V914 HydrophobicContact CG1-CG2 3.57Å; V912-V914 VanDerWaalsContact C-N 3.29Å; V912-V914 PolarHBondContact O-N 2.9Å; V914-L929 HydrophobicContact CG1-CD1 4.17Å; V914-L932 HydrophobicContact CB-CB 4.49Å; V914-L932 PolarHBondContact N-O 3.01Å; V914-L932 WeakPolarHBondContact O-CB 2.93Å; V914-L932 PolarHBondContact O-N 3.01Å; V914-I958 HydrophobicContact CG1-CD1 3.85Å; V914-I958 HydrophobicContact CG1-CG2 4.42Å; V914-P965 HydrophobicContact CG1-CB 4.19Å; V914-E967 WeakPolarHBondContact CA-O 3.31Å; V914-T969 WeakPolarHBondContact CG2-O 3.49Å; V914-V970 HydrophobicContact CG2-CG2 3.85Å
915	T	87.5	Confident	71.5	Confident	14 Å²	14	68.1 Å²	68.1	9%	0.086	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139	176.2	-59.3	0	0	0	0	109.9	G913 L929 D931 T966 E967	G913-T915 PolarHBondContact O-N 2.56Å; T915-L929 CarbonylContact C-O 3.53Å; T915-L929 WeakPolarHBondContact CA-O 3.49Å; T915-L929 WeakPolarHBondContact CG2-O 3.31Å; T915-D931 PolarHBondContact OG1-N 3.33Å; T915-T966 WeakPolarHBondContact O-CA 3.45Å; T915-T966 WeakPolarHBondContact O-CB 3.41Å; T915-T966 PolarHBondContact O-N 2.69Å; T915-E967 PolarHBondContact N-O 2.79Å; T915-E967 PolarHBondContact O-N 2.79Å
916	K	84.8	Confident	71	Confident	22 Å²	22	72.1 Å²	72.1	10%	0.096	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	124.4	177.7	-172.4	71	-161.1	168.3	0	112.6	Y918 S928 L929 T954 I958 I963 P964	K916-Y918 HydrophobicContact CG-CD2 4.47Å; K916-Y918 HydrophobicContact CG-CE2 3.98Å; K916-S928 PolarHBondContact O-N 3.39Å; K916-S928 PolarHBondContact O-OG 3.43Å; K916-L929 HydrophobicContact CB-CB 4.05Å; K916-L929 PolarHBondContact N-O 2.78Å; K916-L929 PolarHBondContact O-N 3.42Å; K916-T954 HydrophobicContact CB-CG2 4.04Å; K916-T954 HydrophobicContact CG-CG2 3.75Å; K916-I958 HydrophobicContact CB-CD1 4.22Å; K916-I958 HydrophobicContact CD-CD1 4.38Å; K916-I958 HydrophobicContact CG-CD1 4.42Å; K916-I963 HydrophobicContact CD-CG2 4.29Å; K916-P964 VanDerWaalsContact CD-O 3.31Å; K916-P964 WeakPolarHBondContact CD-O 3.49Å; K916-P964 WeakPolarHBondContact CE-O 3.2Å; K916-P964 PolarHBondContact NZ-O 3.35Å
917	I	80.3	Confident	70.6	Confident	71 Å²	71	70.1 Å²	70.1	36%	0.364	36%	0.356	S	S	.	.			trans	-120.1	135.8	177	-46.8	176.6	0	0	0	109.3	P927 T966	I917-P927 HydrophobicContact CG1-CB 4.33Å; I917-T966 PolarHBondContact N-OG1 3.44Å
918	Y	68.8	Low	70.3	Confident	106 Å²	106	69.8 Å²	69.8	42%	0.416	36%	0.355	S	S	.	.			trans	-114.1	101.7	176.3	-66.8	-79.7	0	0	0	110.6	K916 S928 T954 I963	K916-Y918 HydrophobicContact CG-CD2 4.47Å; K916-Y918 HydrophobicContact CG-CE2 3.98Å; Y918-S928 VanDerWaalsContact CD2-OG 3.23Å; Y918-S928 WeakPolarHBondContact CD2-OG 3.27Å; Y918-S928 WeakPolarHBondContact CE2-OG 3.37Å; Y918-T954 HydrophobicContact CE2-CG2 4.01Å; Y918-T954 VanDerWaalsContact OH-CG2 3.29Å; Y918-T954 WeakPolarHBondContact OH-CG2 3.44Å; Y918-T954 PolarHBondContact OH-OG1 2.73Å; Y918-I963 HydrophobicContact CE1-CD1 4.47Å; Y918-I963 HydrophobicContact CE1-CG2 4.39Å; Y918-I963 WeakPolarHBondContact OH-CD1 3.43Å
919	G	60.5	Low	70.4	Confident	55 Å²	55	69.8 Å²	69.8	57%	0.567	36%	0.355	S	S	*	.	S	Bend	trans	155.8	177.7	177.8	0	0	0	0	0	112.9
920	N	49.5	Very low	70.1	Confident	148 Å²	148	72.2 Å²	72.2	79%	0.791	37%	0.368	S	S	*	.			trans	-79	119.1	167.8	-90.3	-12.6	0	0	0	108.9	K922 K923	N920-K922 PolarHBondContact O-N 3.04Å; N920-K923 PolarHBondContact O-N 3.43Å
921	A	46.5	Very low	69.9	Low	101 Å²	101	77.1 Å²	77.1	84%	0.835	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-8	-174.7	0	0	0	0	0	116.7	K923	A921-K923 VanDerWaalsContact C-N 3.31Å; A921-K923 PolarHBondContact O-N 2.99Å
922	K	46	Very low	69.9	Low	214 Å²	214	77 Å²	77	93%	0.93	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-11.4	175.2	-71.7	-169.6	173.7	-173.9	0	114.7	N920	N920-K922 PolarHBondContact O-N 3.04Å
923	K	42.7	Very low	69.9	Low	167 Å²	167	77.9 Å²	77.9	73%	0.726	40%	0.397	S	S	*	.	S	Bend	trans	-111.1	140.1	163.7	-78.3	-174.7	172.8	-177	0	108.5	N920 A921 D925	N920-K923 PolarHBondContact O-N 3.43Å; A921-K923 VanDerWaalsContact C-N 3.31Å; A921-K923 PolarHBondContact O-N 2.99Å; K923-D925 PolarHBondContact O-N 2.88Å
924	R	46.1	Very low	70.1	Confident	262 Å²	262	77.3 Å²	77.3	99%	0.989	39%	0.391	S	S	*	.			trans	-68.2	70.3	172.9	-72.6	-178.7	174.1	169.6	-3	110
925	D	53.4	Low	70.1	Confident	51 Å²	51	79.1 Å²	79.1	27%	0.273	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-73.7	142.3	169.5	-84.7	-58.8	0	0	0	109.4	K923 K2114	K923-D925 PolarHBondContact O-N 2.88Å; D925-K2114 IonicContact OD1-NZ 3.73Å; D925-K2114 PolarHBondContact OD1-NZ 3.1Å
926	K	62.9	Low	70.2	Confident	156 Å²	156	78.4 Å²	78.4	68%	0.678	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-67.8	132	-176.7	-137.6	173.1	-173.5	174.9	0	109.6
927	P	70.5	Confident	70.4	Confident	40 Å²	40	78.6 Å²	78.6	26%	0.26	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-60.3	141.9	174	24.5	-32.3	0	0	0	110.5	I917 L929 D930	I917-P927 HydrophobicContact CG1-CB 4.33Å; P927-L929 WeakPolarHBondContact CB-O 3.33Å; P927-D930 HydrophobicContact CB-CB 4.07Å; P927-D930 HydrophobicContact CG-CB 3.97Å
928	S	75.2	Confident	70.7	Confident	22 Å²	22	76.3 Å²	76.3	15%	0.154	39%	0.385	C	S	.	.	S	Bend	trans	-93.4	-23.2	178.2	59.4	0	0	0	0	112.9	K916 Y918 G951 G1119	K916-S928 PolarHBondContact O-N 3.39Å; K916-S928 PolarHBondContact O-OG 3.43Å; Y918-S928 VanDerWaalsContact CD2-OG 3.23Å; Y918-S928 WeakPolarHBondContact CD2-OG 3.27Å; Y918-S928 WeakPolarHBondContact CE2-OG 3.37Å; S928-G951 WeakPolarHBondContact O-CA 3.36Å; S928-G1119 WeakPolarHBondContact O-CA 3.45Å
929	L	85	Confident	71.4	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.4	158	-69.3	176.8	0	0	0	106.7	V914 T915 K916 P927 L932 T954 M955 I958 G1119	V914-L929 HydrophobicContact CG1-CD1 4.17Å; T915-L929 CarbonylContact C-O 3.53Å; T915-L929 WeakPolarHBondContact CA-O 3.49Å; T915-L929 WeakPolarHBondContact CG2-O 3.31Å; K916-L929 HydrophobicContact CB-CB 4.05Å; K916-L929 PolarHBondContact N-O 2.78Å; K916-L929 PolarHBondContact O-N 3.42Å; P927-L929 WeakPolarHBondContact CB-O 3.33Å; L929-L932 HydrophobicContact CD2-CD2 4.12Å; L929-T954 HydrophobicContact CD1-CG2 3.93Å; L929-T954 HydrophobicContact CG-CG2 4.18Å; L929-M955 HydrophobicContact CD1-CB 3.97Å; L929-M955 HydrophobicContact CD2-CB 4.47Å; L929-I958 HydrophobicContact CD1-CD1 3.85Å; L929-G1119 WeakPolarHBondContact CA-O 3.33Å
930	D	83.3	Confident	72.7	Confident	52 Å²	52	71.4 Å²	71.4	28%	0.278	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	103.8	-169.8	-168.9	48.3	0	0	0	108.1	P927 L932 G1119 Q1120	P927-D930 HydrophobicContact CB-CB 4.07Å; P927-D930 HydrophobicContact CG-CB 3.97Å; D930-L932 VanDerWaalsContact C-N 3.33Å; D930-L932 PolarHBondContact O-N 3.11Å; D930-G1119 PolarHBondContact N-O 3.46Å; D930-Q1120 HydrophobicContact CB-CG 3.92Å; D930-Q1120 PolarHBondContact OD2-NE2 3.34Å
931	D	84.1	Confident	74.6	Confident	105 Å²	105	64.4 Å²	64.4	56%	0.561	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	46.2	48.2	-177.8	-165.9	27.4	0	0	0	114.5	G913 T915 N933	G913-D931 WeakPolarHBondContact CA-OD1 3.42Å; T915-D931 PolarHBondContact OG1-N 3.33Å; D931-N933 PolarHBondContact O-N 3.41Å; D931-N933 PolarHBondContact O-ND2 2.7Å; D931-N933 PolarHBondContact OD1-ND2 2.93Å
932	L	86.4	Confident	76.7	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124	-175.7	-167.5	77.4	0	0	0	111.5	V911 G913 V914 L929 D930 V934 M955 I1116 L1121	V911-L932 HydrophobicContact CG1-CD2 4.37Å; G913-L932 PolarHBondContact N-O 3.25Å; V914-L932 HydrophobicContact CB-CB 4.49Å; V914-L932 PolarHBondContact N-O 3.01Å; V914-L932 WeakPolarHBondContact O-CB 2.93Å; V914-L932 PolarHBondContact O-N 3.01Å; L929-L932 HydrophobicContact CD2-CD2 4.12Å; D930-L932 VanDerWaalsContact C-N 3.33Å; D930-L932 PolarHBondContact O-N 3.11Å; L932-V934 HydrophobicContact CG-CG2 4.41Å; L932-M955 HydrophobicContact CD2-CB 4.36Å; L932-M955 HydrophobicContact CD2-CG 3.74Å; L932-M955 HydrophobicContact CD2-SD 3.56Å; L932-M955 VanDerWaalsContact CD2-SD 3.56Å; L932-I1116 HydrophobicContact CD1-CD1 4.33Å; L932-I1116 HydrophobicContact CD2-CD1 4.28Å; L932-L1121 HydrophobicContact CD1-CB 3.94Å
933	N	85.7	Confident	78.8	Confident	32 Å²	32	49.4 Å²	49.4	17%	0.171	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	115.6	175.9	-69.1	-81.1	0	0	0	110.1	V911 V912 G913 D931 L1121	V911-N933 VanDerWaalsContact O-CA 3.3Å; V911-N933 WeakPolarHBondContact O-CA 3.5Å; V912-N933 WeakPolarHBondContact CA-OD1 3.37Å; G913-N933 PolarHBondContact N-OD1 3.36Å; D931-N933 PolarHBondContact O-N 3.41Å; D931-N933 PolarHBondContact O-ND2 2.7Å; D931-N933 PolarHBondContact OD1-ND2 2.93Å; N933-L1121 WeakPolarHBondContact O-CD2 3.44Å
934	V	86.7	Confident	81	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.024	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	134.6	-178	170.7	0	0	0	0	111.3	V911 L932 F936 L1121 Y1124	V911-V934 HydrophobicContact CB-CB 4.46Å; V911-V934 WeakPolarHBondContact CB-O 3.28Å; V911-V934 PolarHBondContact N-O 3Å; V911-V934 PolarHBondContact O-N 3.44Å; V911-V934 VanDerWaalsContact O-N 3.07Å; L932-V934 HydrophobicContact CG-CG2 4.41Å; V934-F936 HydrophobicContact CB-CE2 4.26Å; V934-F936 HydrophobicContact CB-CZ 4.42Å; V934-F936 HydrophobicContact CG1-CD1 4.41Å; V934-F936 HydrophobicContact CG1-CD2 4.04Å; V934-F936 HydrophobicContact CG1-CE1 3.91Å; V934-F936 HydrophobicContact CG1-CE2 3.52Å; V934-F936 HydrophobicContact CG1-CG 4.48Å; V934-F936 HydrophobicContact CG1-CZ 3.45Å; V934-F936 VanDerWaalsContact CG1-CZ 3.45Å; V934-L1121 HydrophobicContact CG2-CD1 3.78Å; V934-L1121 HydrophobicContact CG2-CD2 3.81Å; V934-L1121 HydrophobicContact CG2-CG 4.27Å; V934-Y1124 HydrophobicContact CG1-CE2 4.13Å
935	D	87.1	Confident	82.7	Confident	38 Å²	38	29.1 Å²	29.1	20%	0.203	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	147.4	168.4	-73.7	-25.1	0	0	0	112.3	V907 I909 S910 Y937 Y1124	V907-D935 HydrophobicContact CG1-CB 4.01Å; V907-D935 HydrophobicContact CG2-CB 4.43Å; I909-D935 CarbonylContact O-C 3.52Å; I909-D935 WeakPolarHBondContact O-CA 3.18Å; S910-D935 WeakPolarHBondContact CA-OD1 3.49Å; S910-D935 WeakPolarHBondContact CB-OD1 3.48Å; S910-D935 PolarHBondContact OG-OD1 3.15Å; D935-Y937 HydrophobicContact CB-CE2 4.13Å; D935-Y1124 PolarHBondContact O-OH 2.98Å
936	F	89.5	Confident	83.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.4	177	-58.2	-85.9	0	0	0	109.7	V907 G908 I909 V911 V934 T942 V944 M955 I959 T1095 I1097	V907-F936 CarbonylContact C-O 3.58Å; G908-F936 PolarHBondContact N-O 3.28Å; I909-F936 HydrophobicContact CB-CB 4.13Å; I909-F936 HydrophobicContact CB-CD2 3.86Å; I909-F936 HydrophobicContact CB-CG 4.4Å; I909-F936 HydrophobicContact CG2-CD2 4.15Å; I909-F936 PolarHBondContact N-O 3.44Å; I909-F936 PolarHBondContact O-N 2.96Å; V911-F936 HydrophobicContact CG2-CE2 3.95Å; V934-F936 HydrophobicContact CB-CE2 4.26Å; V934-F936 HydrophobicContact CB-CZ 4.42Å; V934-F936 HydrophobicContact CG1-CD1 4.41Å; V934-F936 HydrophobicContact CG1-CD2 4.04Å; V934-F936 HydrophobicContact CG1-CE1 3.91Å; V934-F936 HydrophobicContact CG1-CE2 3.52Å; V934-F936 HydrophobicContact CG1-CG 4.48Å; V934-F936 HydrophobicContact CG1-CZ 3.45Å; V934-F936 VanDerWaalsContact CG1-CZ 3.45Å; F936-T942 HydrophobicContact CD1-CG2 3.67Å; F936-T942 HydrophobicContact CE1-CG2 3.7Å; F936-V944 HydrophobicContact CE1-CG2 4.25Å; F936-M955 HydrophobicContact CZ-CE 3.84Å; F936-M955 HydrophobicContact CZ-SD 4.31Å; F936-I959 HydrophobicContact CE2-CD1 4.25Å; F936-T1095 HydrophobicContact CB-CG2 3.8Å; F936-I1097 HydrophobicContact CB-CD1 4.29Å; F936-I1097 HydrophobicContact CD1-CD1 3.61Å; F936-I1097 HydrophobicContact CD1-CG1 3.66Å; F936-I1097 HydrophobicContact CD1-CG2 4.3Å; F936-I1097 HydrophobicContact CD2-CD1 3.75Å; F936-I1097 HydrophobicContact CE1-CB 4.44Å; F936-I1097 HydrophobicContact CE1-CD1 3.73Å; F936-I1097 HydrophobicContact CE1-CG1 3.91Å; F936-I1097 HydrophobicContact CE1-CG2 3.71Å; F936-I1097 HydrophobicContact CE2-CD1 3.83Å; F936-I1097 HydrophobicContact CG-CD1 3.61Å; F936-I1097 HydrophobicContact CG-CG1 4.05Å; F936-I1097 HydrophobicContact CZ-CD1 3.82Å; F936-I1097 HydrophobicContact CZ-CG1 4.49Å; F936-I1097 HydrophobicContact CZ-CG2 4.17Å
937	Y	88.2	Confident	84	Confident	25 Å²	25	21.1 Å²	21.1	10%	0.098	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	155.3	-167.8	-67.3	-92.5	0	0	0	113	V903 L905 V907 D935 T1095 Y1124	V903-Y937 HydrophobicContact CB-CE1 4.29Å; L905-Y937 HydrophobicContact CB-CD1 3.74Å; L905-Y937 HydrophobicContact CB-CG 4.41Å; L905-Y937 WeakPolarHBondContact O-CD1 3.23Å; L905-Y937 WeakPolarHBondContact O-CE1 3.36Å; V907-Y937 HydrophobicContact CG2-CD1 4.18Å; V907-Y937 HydrophobicContact CG2-CE1 3.76Å; D935-Y937 HydrophobicContact CB-CE2 4.13Å; Y937-T1095 WeakPolarHBondContact O-CB 3.5Å; Y937-T1095 WeakPolarHBondContact O-CG2 3.41Å; Y937-T1095 PolarHBondContact O-OG1 3.17Å; Y937-Y1124 VanDerWaalsContact CE2-OH 3.27Å; Y937-Y1124 WeakPolarHBondContact CE2-OH 3.28Å
938	D	86.6	Confident	83.9	Confident	24 Å²	24	20.9 Å²	20.9	13%	0.128	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	148.9	173.5	-152.5	-7.9	0	0	0	111.2	P906 Q940 Y973 K1064 R1094 T1095	P906-D938 HydrophobicContact CG-CB 3.95Å; P906-D938 PolarHBondContact O-N 3.36Å; D938-Q940 PolarHBondContact O-N 2.84Å; D938-Y973 PolarHBondContact OD2-OH 2.9Å; D938-K1064 IonicContact OD2-NZ 3.06Å; D938-R1094 PolarHBondContact OD1-N 3.32Å; D938-T1095 WeakPolarHBondContact CA-OG1 3.47Å
939	G	84.3	Confident	83.4	Confident	25 Å²	25	23.1 Å²	23.1	26%	0.258	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	11.9	-176.7	0	0	0	0	0	116.4	K1091 R1094	G939-K1091 WeakPolarHBondContact O-CE 3.29Å; G939-R1094 WeakPolarHBondContact CA-O 3.45Å; G939-R1094 PolarHBondContact N-O 3.34Å
940	Q	86.2	Confident	82.9	Confident	32 Å²	32	23.3 Å²	23.3	15%	0.15	15%	0.149	C	C	.	.			trans	-124.3	145.7	-177.7	-70.4	-169	-13.7	0	0	113.1	L905 D938 R1094 I1096 D1111	L905-Q940 HydrophobicContact CD1-CG 4.15Å; D938-Q940 PolarHBondContact O-N 2.84Å; Q940-R1094 PolarHBondContact N-O 3Å; Q940-I1096 PolarHBondContact O-N 2.87Å; Q940-D1111 WeakPolarHBondContact CA-OD2 3.44Å; Q940-D1111 HydrophobicContact CB-CB 4.14Å; Q940-D1111 HydrophobicContact CG-CB 4.17Å
941	I	90	Very high	82.7	Confident	2 Å²	2	21.1 Å²	21.1	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.1	166.1	-54.1	178	0	0	0	108.6	L1088 K1091 I1096 L1098 L1109 D1111 R1112	I941-L1088 HydrophobicContact CD1-CD2 4.37Å; I941-K1091 HydrophobicContact CD1-CB 4.35Å; I941-K1091 HydrophobicContact CD1-CD 4.29Å; I941-K1091 HydrophobicContact CD1-CG 4.49Å; I941-K1091 HydrophobicContact CG1-CB 4.43Å; I941-K1091 HydrophobicContact CG1-CD 4.19Å; I941-K1091 HydrophobicContact CG1-CG 4.18Å; I941-I1096 CarbonylContact C-O 3.58Å; I941-I1096 WeakPolarHBondContact CA-O 3.23Å; I941-I1096 HydrophobicContact CB-CB 4.44Å; I941-I1096 HydrophobicContact CG1-CB 4.06Å; I941-I1096 HydrophobicContact CG1-CD1 4.22Å; I941-I1096 HydrophobicContact CG1-CG2 4.49Å; I941-I1096 HydrophobicContact CG2-CB 4.43Å; I941-I1096 HydrophobicContact CG2-CG2 4.29Å; I941-L1098 HydrophobicContact CG2-CB 4.39Å; I941-L1109 VanDerWaalsContact CB-O 3.25Å; I941-L1109 WeakPolarHBondContact CB-O 3.43Å; I941-L1109 WeakPolarHBondContact CD1-O 3.17Å; I941-L1109 HydrophobicContact CG2-CB 4.48Å; I941-L1109 WeakPolarHBondContact CG2-O 3.32Å; I941-D1111 PolarHBondContact N-OD2 2.98Å; I941-D1111 PolarHBondContact O-N 3.01Å; I941-R1112 PolarHBondContact O-N 3.14Å
942	T	91.1	Very high	82.7	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	115.5	171.7	-51.9	0	0	0	0	110.2	F936 I1096 L1098 R1112 A1114 Y1124	F936-T942 HydrophobicContact CD1-CG2 3.67Å; F936-T942 HydrophobicContact CE1-CG2 3.7Å; T942-I1096 PolarHBondContact N-O 2.88Å; T942-L1098 PolarHBondContact O-N 3.09Å; T942-R1112 CarbonylContact C-O 3.38Å; T942-R1112 WeakPolarHBondContact CA-O 3.29Å; T942-R1112 HydrophobicContact CG2-CB 4.4Å; T942-A1114 HydrophobicContact CG2-CB 4.4Å; T942-Y1124 HydrophobicContact CG2-CE2 4.45Å
943	A	89.9	Confident	82.4	Confident	0 Å²	0	19 Å²	19	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.8	177.3	0	0	0	0	0	111.1	L1098 A1106 R1112 I1113 A1114	A943-L1098 CarbonylContact C-O 3.58Å; A943-L1098 WeakPolarHBondContact CA-O 3.33Å; A943-L1098 HydrophobicContact CB-CD2 4.13Å; A943-A1106 HydrophobicContact CB-CB 3.65Å; A943-R1112 PolarHBondContact N-O 2.83Å; A943-I1113 HydrophobicContact CB-CG1 4.43Å; A943-I1113 CarbonylContact O-C 3.56Å; A943-I1113 WeakPolarHBondContact O-CA 3.38Å; A943-A1114 PolarHBondContact O-N 2.81Å
944	V	89.4	Confident	82.3	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	103.6	-179.3	-175	0	0	0	0	108.6	F936 K952 M955 I1097 L1098 T1100 A1114 I1116	F936-V944 HydrophobicContact CE1-CG2 4.25Å; V944-K952 HydrophobicContact CG1-CG 4.41Å; V944-M955 HydrophobicContact CG1-CE 4.17Å; V944-M955 HydrophobicContact CG2-CE 3.92Å; V944-I1097 HydrophobicContact CG2-CG2 3.72Å; V944-L1098 PolarHBondContact N-O 2.89Å; V944-T1100 PolarHBondContact O-N 2.82Å; V944-A1114 CarbonylContact C-O 3.57Å; V944-A1114 WeakPolarHBondContact CA-O 3.47Å; V944-I1116 HydrophobicContact CG1-CD1 3.63Å; V944-I1116 HydrophobicContact CG1-CG1 4.22Å
945	L	81.3	Confident	82.4	Confident	2 Å²	2	18.5 Å²	18.5	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	156.4	-178.9	-92.8	164.7	0	0	0	111.7	T1100 F1103 A1106 I1113 A1114 I1115 I1116	L945-T1100 HydrophobicContact CD2-CG2 4.4Å; L945-F1103 HydrophobicContact CD1-CD1 3.47Å; L945-F1103 VanDerWaalsContact CD1-CD1 3.47Å; L945-F1103 HydrophobicContact CD1-CE1 3.54Å; L945-F1103 HydrophobicContact CD1-CG 4.1Å; L945-F1103 HydrophobicContact CD1-CZ 4.22Å; L945-F1103 HydrophobicContact CD2-CD1 4.22Å; L945-F1103 HydrophobicContact CD2-CD2 4.02Å; L945-F1103 HydrophobicContact CD2-CE1 4.24Å; L945-F1103 HydrophobicContact CD2-CE2 4.03Å; L945-F1103 HydrophobicContact CD2-CG 4.11Å; L945-F1103 HydrophobicContact CD2-CZ 4.14Å; L945-F1103 HydrophobicContact CG-CD1 4.48Å; L945-F1103 HydrophobicContact CG-CE1 4.4Å; L945-A1106 HydrophobicContact CD1-CB 3.36Å; L945-A1106 HydrophobicContact CD2-CB 4.42Å; L945-A1106 HydrophobicContact CG-CB 3.83Å; L945-I1113 HydrophobicContact CD1-CG2 3.7Å; L945-A1114 PolarHBondContact N-O 3.4Å; L945-I1115 HydrophobicContact CB-CG1 4.03Å; L945-I1116 PolarHBondContact O-N 3.19Å
946	G	76.3	Confident	82.5	Confident	10 Å²	10	16.8 Å²	16.8	10%	0.103	12%	0.118	C	C	.	.			trans	152.3	163.8	174.7	0	0	0	0	0	112.9	K952 I1116	G946-K952 PolarHBondContact O-NZ 2.73Å; G946-I1116 WeakPolarHBondContact CA-O 3.21Å
947	P	68.2	Low	82.2	Confident	29 Å²	29	17.4 Å²	17.4	19%	0.188	12%	0.122	C	C	.	.			trans	-67.1	169.6	179.3	24.3	-30.9	0	0	0	113.2	G949 A950 K952 D2150	P947-G949 PolarHBondContact O-N 3.41Å; P947-A950 HydrophobicContact CG-CB 4.11Å; P947-A950 WeakPolarHBondContact O-CB 3.49Å; P947-A950 PolarHBondContact O-N 3.3Å; P947-A950 VanDerWaalsContact O-N 3.15Å; P947-K952 PolarHBondContact O-NZ 3.35Å; P947-D2150 HydrophobicContact CB-CB 4.23Å
948	N	66.6	Low	82.1	Confident	34 Å²	34	16.4 Å²	16.4	18%	0.182	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	130.1	179.8	-69.3	-16.8	0	0	0	110.4	K952 G2148 D2150	N948-K952 PolarHBondContact OD1-NZ 3.25Å; N948-K952 VanDerWaalsContact OD1-NZ 3.12Å; N948-G2148 PolarHBondContact ND2-O 3.47Å; N948-D2150 HydrophobicContact CB-CB 4.3Å; N948-D2150 WeakPolarHBondContact CB-OD1 3.35Å; N948-D2150 PolarHBondContact N-OD1 3.04Å; N948-D2150 VanDerWaalsContact N-OD1 3.13Å; N948-D2150 PolarHBondContact ND2-N 2.96Å
949	G	65.3	Low	82.1	Confident	70 Å²	70	15.3 Å²	15.3	72%	0.722	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.9	2.2	-166.7	0	0	0	0	0	114.7	P947 G951	P947-G949 PolarHBondContact O-N 3.41Å; G949-G951 PolarHBondContact O-N 3.4Å
950	A	75	Confident	82.1	Confident	4 Å²	4	14.1 Å²	14.1	3%	0.033	10%	0.1	C	C	.	.	S	Bend	trans	-69	-15.8	175.1	0	0	0	0	0	115	P947 I1116 G1119	P947-A950 HydrophobicContact CG-CB 4.11Å; P947-A950 WeakPolarHBondContact O-CB 3.49Å; P947-A950 PolarHBondContact O-N 3.3Å; P947-A950 VanDerWaalsContact O-N 3.15Å; A950-I1116 HydrophobicContact CB-CG2 4.48Å; A950-I1116 WeakPolarHBondContact CB-O 3.39Å; A950-I1116 VanDerWaalsContact O-CG2 3.3Å; A950-I1116 WeakPolarHBondContact O-CG2 3.14Å; A950-G1119 WeakPolarHBondContact O-CA 3.18Å; A950-G1119 PolarHBondContact O-N 3.5Å
951	G	78.3	Confident	81.7	Confident	6 Å²	6	12.8 Å²	12.8	6%	0.062	10%	0.095	C	C	.	.	S	Bend	trans	118.3	-12.3	179.7	0	0	0	0	0	115.5	S928 G949 T953 T954 M955	S928-G951 WeakPolarHBondContact O-CA 3.36Å; G949-G951 PolarHBondContact O-N 3.4Å; G951-T953 PolarHBondContact O-N 3.48Å; G951-T954 CarbonylContact O-C 3.5Å; G951-T954 WeakPolarHBondContact O-CA 3.26Å; G951-T954 VanDerWaalsContact O-CB 3.3Å; G951-T954 WeakPolarHBondContact O-CB 3.38Å; G951-T954 PolarHBondContact O-N 3.21Å; G951-M955 PolarHBondContact O-N 3.43Å
952	K	83.9	Confident	81	Confident	7 Å²	7	13.6 Å²	13.6	3%	0.03	10%	0.099	C	C	.	.	H	α-helix	trans	-40.2	-65.5	-174.4	-48.9	-167.6	-60	-87.9	0	114.5	V944 G946 P947 N948 T954 M955 M956	V944-K952 HydrophobicContact CG1-CG 4.41Å; G946-K952 PolarHBondContact O-NZ 2.73Å; P947-K952 PolarHBondContact O-NZ 3.35Å; N948-K952 PolarHBondContact OD1-NZ 3.25Å; N948-K952 VanDerWaalsContact OD1-NZ 3.12Å; K952-T954 VanDerWaalsContact C-N 3.26Å; K952-T954 PolarHBondContact O-N 2.99Å; K952-M955 WeakPolarHBondContact O-CB 3.38Å; K952-M955 PolarHBondContact O-N 3.38Å; K952-M956 PolarHBondContact O-N 3.26Å; K952-M956 VanDerWaalsContact O-N 3.07Å
953	T	81.1	Confident	80.3	Confident	54 Å²	54	15 Å²	15	33%	0.331	11%	0.107	S	C	.	.	H	α-helix	trans	-66.4	-24.9	-179.9	-50.7	0	0	0	0	113.1	G951 S957 D1069	G951-T953 PolarHBondContact O-N 3.48Å; T953-S957 VanDerWaalsContact O-CB 3.22Å; T953-S957 WeakPolarHBondContact O-CB 3.38Å; T953-S957 PolarHBondContact O-N 3.41Å; T953-S957 PolarHBondContact O-OG 3.28Å; T953-D1069 WeakPolarHBondContact CG2-OD2 3.47Å; T953-D1069 PolarHBondContact OG1-OD1 2.62Å; T953-D1069 VanDerWaalsContact OG1-OD1 3.04Å
954	T	84.3	Confident	79.6	Confident	23 Å²	23	17 Å²	17	14%	0.141	12%	0.119	C	C	.	.	H	α-helix	trans	-71	-42.6	173.1	-69.4	0	0	0	0	110.9	K916 Y918 L929 G951 K952 S957 I958	K916-T954 HydrophobicContact CB-CG2 4.04Å; K916-T954 HydrophobicContact CG-CG2 3.75Å; Y918-T954 HydrophobicContact CE2-CG2 4.01Å; Y918-T954 VanDerWaalsContact OH-CG2 3.29Å; Y918-T954 WeakPolarHBondContact OH-CG2 3.44Å; Y918-T954 PolarHBondContact OH-OG1 2.73Å; L929-T954 HydrophobicContact CD1-CG2 3.93Å; L929-T954 HydrophobicContact CG-CG2 4.18Å; G951-T954 CarbonylContact O-C 3.5Å; G951-T954 WeakPolarHBondContact O-CA 3.26Å; G951-T954 VanDerWaalsContact O-CB 3.3Å; G951-T954 WeakPolarHBondContact O-CB 3.38Å; G951-T954 PolarHBondContact O-N 3.21Å; K952-T954 VanDerWaalsContact C-N 3.26Å; K952-T954 PolarHBondContact O-N 2.99Å; T954-S957 PolarHBondContact O-N 3.35Å; T954-I958 HydrophobicContact CG2-CD1 4.04Å; T954-I958 WeakPolarHBondContact O-CG1 3.27Å; T954-I958 PolarHBondContact O-N 3.01Å
955	M	87.8	Confident	79.3	Confident	3 Å²	3	19.2 Å²	19.2	2%	0.015	13%	0.134	C	C	.	.	H	α-helix	trans	-58.9	-50.8	173.4	-175.7	-163.9	77.6	0	0	110.3	L929 L932 F936 V944 G951 K952 S957 I958 I959 I1116	L929-M955 HydrophobicContact CD1-CB 3.97Å; L929-M955 HydrophobicContact CD2-CB 4.47Å; L932-M955 HydrophobicContact CD2-CB 4.36Å; L932-M955 HydrophobicContact CD2-CG 3.74Å; L932-M955 HydrophobicContact CD2-SD 3.56Å; L932-M955 VanDerWaalsContact CD2-SD 3.56Å; F936-M955 HydrophobicContact CZ-CE 3.84Å; F936-M955 HydrophobicContact CZ-SD 4.31Å; V944-M955 HydrophobicContact CG1-CE 4.17Å; V944-M955 HydrophobicContact CG2-CE 3.92Å; G951-M955 PolarHBondContact O-N 3.43Å; K952-M955 WeakPolarHBondContact O-CB 3.38Å; K952-M955 PolarHBondContact O-N 3.38Å; M955-S957 VanDerWaalsContact C-N 3.32Å; M955-S957 PolarHBondContact O-N 3.24Å; M955-I958 WeakPolarHBondContact O-CB 3.18Å; M955-I958 PolarHBondContact O-N 3.25Å; M955-I958 VanDerWaalsContact O-N 3.09Å; M955-I959 HydrophobicContact CE-CD1 4.09Å; M955-I959 HydrophobicContact CG-CD1 4Å; M955-I959 WeakPolarHBondContact O-CG1 3.38Å; M955-I959 PolarHBondContact O-N 2.97Å; M955-I1116 HydrophobicContact SD-CD1 3.93Å
956	M	88.6	Confident	79.3	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-59.8	-40.3	176.1	-69.3	-172.3	155.3	0	0	112.7	K952 I958 I959 C960 I1067 D1069 I1097	K952-M956 PolarHBondContact O-N 3.26Å; K952-M956 VanDerWaalsContact O-N 3.07Å; M956-I958 VanDerWaalsContact C-N 3.27Å; M956-I958 PolarHBondContact O-N 3.44Å; M956-I959 PolarHBondContact O-N 3.42Å; M956-C960 WeakPolarHBondContact O-CB 3.27Å; M956-C960 PolarHBondContact O-N 3.48Å; M956-C960 PolarHBondContact O-SG 2.93Å; M956-C960 VanDerWaalsContact O-SG 3.34Å; M956-I1067 HydrophobicContact CB-CG2 4.05Å; M956-I1067 HydrophobicContact CE-CG2 3.8Å; M956-I1067 HydrophobicContact CG-CG2 3.84Å; M956-I1067 HydrophobicContact SD-CG2 3.73Å; M956-D1069 HydrophobicContact SD-CB 3.91Å; M956-I1097 HydrophobicContact CE-CB 4.27Å; M956-I1097 HydrophobicContact CE-CG2 3.61Å
957	S	83.9	Confident	79.4	Confident	13 Å²	13	28 Å²	28	9%	0.091	18%	0.177	C	C	.	.	H	α-helix	trans	-65.3	-29	176.4	-63.3	0	0	0	0	113.2	T953 T954 M955 G961 L962 I963	T953-S957 VanDerWaalsContact O-CB 3.22Å; T953-S957 WeakPolarHBondContact O-CB 3.38Å; T953-S957 PolarHBondContact O-N 3.41Å; T953-S957 PolarHBondContact O-OG 3.28Å; T954-S957 PolarHBondContact O-N 3.35Å; M955-S957 VanDerWaalsContact C-N 3.32Å; M955-S957 PolarHBondContact O-N 3.24Å; S957-G961 PolarHBondContact O-N 3.13Å; S957-L962 WeakPolarHBondContact O-CB 3.43Å; S957-L962 PolarHBondContact O-N 2.91Å; S957-I963 PolarHBondContact O-N 3.28Å; S957-I963 VanDerWaalsContact O-N 3.17Å
958	I	86.1	Confident	80	Confident	5 Å²	5	28.6 Å²	28.6	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-73.4	-47.2	172.6	-69.2	162.8	0	0	0	110.2	V914 K916 L929 T954 M955 M956 C960 G961 I963 P965 V970	V914-I958 HydrophobicContact CG1-CD1 3.85Å; V914-I958 HydrophobicContact CG1-CG2 4.42Å; K916-I958 HydrophobicContact CB-CD1 4.22Å; K916-I958 HydrophobicContact CD-CD1 4.38Å; K916-I958 HydrophobicContact CG-CD1 4.42Å; L929-I958 HydrophobicContact CD1-CD1 3.85Å; T954-I958 HydrophobicContact CG2-CD1 4.04Å; T954-I958 WeakPolarHBondContact O-CG1 3.27Å; T954-I958 PolarHBondContact O-N 3.01Å; M955-I958 WeakPolarHBondContact O-CB 3.18Å; M955-I958 PolarHBondContact O-N 3.25Å; M955-I958 VanDerWaalsContact O-N 3.09Å; M956-I958 VanDerWaalsContact C-N 3.27Å; M956-I958 PolarHBondContact O-N 3.44Å; I958-C960 VanDerWaalsContact C-N 3.32Å; I958-C960 PolarHBondContact O-N 3.17Å; I958-G961 PolarHBondContact O-N 2.95Å; I958-I963 WeakPolarHBondContact CA-O 3.37Å; I958-I963 WeakPolarHBondContact CG1-O 3.44Å; I958-P965 HydrophobicContact CG2-CB 4.36Å; I958-V970 HydrophobicContact CG2-CG2 4.21Å
959	I	86.6	Confident	80.8	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-37.4	178.2	-58.1	166.6	0	0	0	111.5	I909 V911 F936 M955 M956 G961 V970 I972 I977 I1067 I1097	I909-I959 HydrophobicContact CD1-CG2 3.87Å; I909-I959 HydrophobicContact CG2-CG2 4.34Å; V911-I959 HydrophobicContact CG2-CD1 4.2Å; V911-I959 HydrophobicContact CG2-CG1 4.46Å; F936-I959 HydrophobicContact CE2-CD1 4.25Å; M955-I959 HydrophobicContact CE-CD1 4.09Å; M955-I959 HydrophobicContact CG-CD1 4Å; M955-I959 WeakPolarHBondContact O-CG1 3.38Å; M955-I959 PolarHBondContact O-N 2.97Å; M956-I959 PolarHBondContact O-N 3.42Å; I959-G961 VanDerWaalsContact C-N 3.28Å; I959-G961 PolarHBondContact O-N 3.46Å; I959-V970 HydrophobicContact CG1-CG1 4.36Å; I959-I972 HydrophobicContact CG2-CD1 4.08Å; I959-I977 HydrophobicContact CG2-CD1 4.4Å; I959-I977 WeakPolarHBondContact O-CD1 3.2Å; I959-I1067 HydrophobicContact CB-CD1 4.06Å; I959-I1067 HydrophobicContact CG2-CD1 3.48Å; I959-I1067 VanDerWaalsContact CG2-CD1 3.48Å; I959-I1097 HydrophobicContact CD1-CD1 4.36Å
960	C	84.1	Confident	81.8	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10	173.9	-65.6	0	0	0	0	114	M685 M956 I958 L962 F990	M685-C960 HydrophobicContact SD-CB 3.96Å; M956-C960 WeakPolarHBondContact O-CB 3.27Å; M956-C960 PolarHBondContact O-N 3.48Å; M956-C960 PolarHBondContact O-SG 2.93Å; M956-C960 VanDerWaalsContact O-SG 3.34Å; I958-C960 VanDerWaalsContact C-N 3.32Å; I958-C960 PolarHBondContact O-N 3.17Å; C960-L962 HydrophobicContact CB-CD1 4.44Å; C960-L962 HydrophobicContact CB-CG 4.47Å; C960-F990 WeakPolarHBondContact SG-CD2 3.15Å
961	G	77	Confident	82.3	Confident	4 Å²	4	25.3 Å²	25.3	4%	0.041	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	30.9	-176.3	0	0	0	0	0	114.9	S957 I958 I959 M981 R985	S957-G961 PolarHBondContact O-N 3.13Å; I958-G961 PolarHBondContact O-N 2.95Å; I959-G961 VanDerWaalsContact C-N 3.28Å; I959-G961 PolarHBondContact O-N 3.46Å; G961-M981 VanDerWaalsContact CA-SD 3.56Å; G961-R985 PolarHBondContact O-NH2 2.72Å
962	L	75.4	Confident	82.7	Confident	18 Å²	18	25.2 Å²	25.2	9%	0.094	15%	0.152	C	C	.	.	S	Bend	trans	-81.5	-31.8	169.7	-76.1	166.7	0	0	0	112	M685 G863 S957 C960 F990	M685-L962 HydrophobicContact CE-CD1 4.13Å; M685-L962 HydrophobicContact CE-CD2 3.87Å; M685-L962 HydrophobicContact CE-CG 4.25Å; M685-L962 HydrophobicContact CG-CD2 4.42Å; M685-L962 HydrophobicContact SD-CD1 3.61Å; M685-L962 HydrophobicContact SD-CD2 3.64Å; M685-L962 HydrophobicContact SD-CG 3.47Å; M685-L962 WeakPolarHBondContact SD-CG 3.46Å; G863-L962 CarbonylContact C-O 3.56Å; G863-L962 WeakPolarHBondContact CA-O 3.39Å; G863-L962 PolarHBondContact N-O 2.94Å; S957-L962 WeakPolarHBondContact O-CB 3.43Å; S957-L962 PolarHBondContact O-N 2.91Å; C960-L962 HydrophobicContact CB-CD1 4.44Å; C960-L962 HydrophobicContact CB-CG 4.47Å; L962-F990 HydrophobicContact CD1-CE1 4.1Å; L962-F990 HydrophobicContact CD1-CZ 4.39Å
963	I	76.3	Confident	82.7	Confident	30 Å²	30	28.6 Å²	28.6	15%	0.154	17%	0.165	C	C	.	.	S	Bend	trans	-136.3	130.9	-175.5	-58.5	179.3	0	0	0	107.4	K916 Y918 S957 I958	K916-I963 HydrophobicContact CD-CG2 4.29Å; Y918-I963 HydrophobicContact CE1-CD1 4.47Å; Y918-I963 HydrophobicContact CE1-CG2 4.39Å; Y918-I963 WeakPolarHBondContact OH-CD1 3.43Å; S957-I963 PolarHBondContact O-N 3.28Å; S957-I963 VanDerWaalsContact O-N 3.17Å; I958-I963 WeakPolarHBondContact CA-O 3.37Å; I958-I963 WeakPolarHBondContact CG1-O 3.44Å
964	P	76.1	Confident	82.4	Confident	41 Å²	41	28.1 Å²	28.1	27%	0.266	17%	0.171	S	C	.	.			trans	-73.9	148.5	176.5	29.4	-31.8	0	0	0	110.7	V864 K916	V864-P964 HydrophobicContact CG1-CB 3.86Å; V864-P964 HydrophobicContact CG1-CG 4.07Å; V864-P964 HydrophobicContact CG2-CB 4.13Å; V864-P964 HydrophobicContact CG2-CG 4.41Å; K916-P964 VanDerWaalsContact CD-O 3.31Å; K916-P964 WeakPolarHBondContact CD-O 3.49Å; K916-P964 WeakPolarHBondContact CE-O 3.2Å; K916-P964 PolarHBondContact NZ-O 3.35Å
965	P	82.3	Confident	82.1	Confident	49 Å²	49	31.7 Å²	31.7	32%	0.318	18%	0.184	S	C	.	.			trans	-60.6	159.3	165.5	29.1	-33.6	0	0	0	110.4	V914 I958	V914-P965 HydrophobicContact CG1-CB 4.19Å; I958-P965 HydrophobicContact CG2-CB 4.36Å
966	T	81.2	Confident	81.6	Confident	68 Å²	68	32.5 Å²	32.5	42%	0.417	19%	0.189	S	C	.	.	S	Bend	trans	-85.3	-44.4	168.7	-63.1	0	0	0	0	109.5	T915 I917	T915-T966 WeakPolarHBondContact O-CA 3.45Å; T915-T966 WeakPolarHBondContact O-CB 3.41Å; T915-T966 PolarHBondContact O-N 2.69Å; I917-T966 PolarHBondContact N-OG1 3.44Å
967	E	79.7	Confident	81.1	Confident	129 Å²	129	33.3 Å²	33.3	60%	0.603	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	161.6	171.1	-62.7	169.6	167.6	0	0	108.4	V914 T915	V914-E967 WeakPolarHBondContact CA-O 3.31Å; T915-E967 PolarHBondContact N-O 2.79Å; T915-E967 PolarHBondContact O-N 2.79Å
968	G	81.5	Confident	80.5	Confident	40 Å²	40	37.1 Å²	37.1	41%	0.412	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	84.2	174.1	-175.3	0	0	0	0	0	114.8	V912 G913	V912-G968 WeakPolarHBondContact O-CA 3.31Å; G913-G968 VanDerWaalsContact O-CA 3.25Å; G913-G968 WeakPolarHBondContact O-CA 3.47Å
969	T	83.2	Confident	79.6	Confident	25 Å²	25	40.8 Å²	40.8	15%	0.153	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	166.1	-177.5	176.2	0	0	0	0	111.3	L890 V912 V914 F971 D976	L890-T969 HydrophobicContact CD1-CG2 4.45Å; V912-T969 PolarHBondContact N-O 3.08Å; V912-T969 PolarHBondContact O-N 3.29Å; V912-T969 VanDerWaalsContact O-O 3.08Å; V914-T969 WeakPolarHBondContact CG2-O 3.49Å; T969-F971 HydrophobicContact CG2-CE2 3.67Å; T969-F971 HydrophobicContact CG2-CZ 3.73Å; T969-D976 PolarHBondContact OG1-OD1 3.16Å; T969-D976 PolarHBondContact OG1-OD2 3.38Å
970	V	86.3	Confident	79	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.03	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	137.9	175.7	-177.4	0	0	0	0	108.4	I909 S910 V911 V914 I958 I959 I977	I909-V970 HydrophobicContact CG2-CG1 3.67Å; S910-V970 CarbonylContact O-C 3.59Å; S910-V970 WeakPolarHBondContact O-CA 3.34Å; S910-V970 WeakPolarHBondContact O-CG1 3.42Å; V911-V970 HydrophobicContact CB-CG2 4.41Å; V911-V970 HydrophobicContact CG1-CG2 4.15Å; V911-V970 HydrophobicContact CG2-CG1 4.04Å; V911-V970 HydrophobicContact CG2-CG2 4.17Å; V914-V970 HydrophobicContact CG2-CG2 3.85Å; I958-V970 HydrophobicContact CG2-CG2 4.21Å; I959-V970 HydrophobicContact CG1-CG1 4.36Å; V970-I977 HydrophobicContact CB-CD1 3.57Å; V970-I977 HydrophobicContact CB-CG1 4.01Å; V970-I977 HydrophobicContact CG1-CD1 3.54Å; V970-I977 HydrophobicContact CG1-CG1 4.21Å; V970-I977 HydrophobicContact CG2-CD1 4.41Å; V970-I977 WeakPolarHBondContact O-CG1 3.16Å; V970-I977 PolarHBondContact O-N 3.23Å; V970-I977 VanDerWaalsContact O-N 3.1Å
971	F	85	Confident	78.6	Confident	10 Å²	10	45.1 Å²	45.1	4%	0.044	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.6	176.9	-59.5	-80.6	0	0	0	110.7	Y887 L890 I909 S910 V912 T969 K975 D976	Y887-F971 HydrophobicContact CD2-CB 4.16Å; Y887-F971 AromaticContact CD2-CD1 3.63Å; Y887-F971 HydrophobicContact CD2-CD1 3.63Å; Y887-F971 AromaticContact CD2-CD2 3.83Å; Y887-F971 HydrophobicContact CD2-CD2 3.83Å; Y887-F971 AromaticContact CD2-CE1 3.92Å; Y887-F971 HydrophobicContact CD2-CE1 3.92Å; Y887-F971 HydrophobicContact CD2-CE2 4.09Å; Y887-F971 AromaticContact CD2-CG 3.59Å; Y887-F971 HydrophobicContact CD2-CG 3.59Å; Y887-F971 HydrophobicContact CD2-CZ 4.14Å; Y887-F971 HydrophobicContact CE2-CB 3.61Å; Y887-F971 HydrophobicContact CE2-CD1 4Å; Y887-F971 AromaticContact CE2-CD2 3.76Å; Y887-F971 HydrophobicContact CE2-CD2 3.76Å; Y887-F971 HydrophobicContact CE2-CE2 4.43Å; Y887-F971 AromaticContact CE2-CG 3.5Å; Y887-F971 HydrophobicContact CE2-CG 3.5Å; L890-F971 HydrophobicContact CD1-CE2 4.19Å; L890-F971 HydrophobicContact CD1-CZ 3.82Å; I909-F971 CarbonylContact C-O 3.57Å; I909-F971 WeakPolarHBondContact CA-O 3.36Å; S910-F971 PolarHBondContact N-O 2.84Å; S910-F971 PolarHBondContact O-N 3.07Å; V912-F971 HydrophobicContact CG2-CD2 4.24Å; V912-F971 HydrophobicContact CG2-CE2 4.28Å; T969-F971 HydrophobicContact CG2-CE2 3.67Å; T969-F971 HydrophobicContact CG2-CZ 3.73Å; F971-K975 CarbonylContact C-O 3.5Å; F971-K975 WeakPolarHBondContact CA-O 3.5Å; F971-D976 HydrophobicContact CD1-CB 4.11Å; F971-D976 HydrophobicContact CE1-CB 3.93Å
972	I	86.2	Confident	78.4	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.015	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	113.6	178.2	-70.1	178.3	0	0	0	108.4	I909 I959 G974 K975 I977 V984 I1065	I909-I972 HydrophobicContact CB-CG1 4.43Å; I909-I972 HydrophobicContact CD1-CD1 4.48Å; I909-I972 HydrophobicContact CD1-CG1 4.4Å; I909-I972 HydrophobicContact CG1-CG1 4.08Å; I909-I972 HydrophobicContact CG2-CG1 3.92Å; I959-I972 HydrophobicContact CG2-CD1 4.08Å; I972-G974 PolarHBondContact O-N 3.35Å; I972-K975 PolarHBondContact N-O 2.89Å; I972-K975 WeakPolarHBondContact O-CB 3.47Å; I972-K975 PolarHBondContact O-N 2.93Å; I972-I977 HydrophobicContact CD1-CD1 3.53Å; I972-I977 HydrophobicContact CD1-CG1 3.85Å; I972-I977 HydrophobicContact CG1-CD1 4.1Å; I972-I977 HydrophobicContact CG1-CG1 4.17Å; I972-V984 HydrophobicContact CB-CG1 4.37Å; I972-V984 HydrophobicContact CB-CG2 4.11Å; I972-V984 HydrophobicContact CD1-CG1 3.5Å; I972-V984 VanDerWaalsContact CD1-CG1 3.5Å; I972-V984 HydrophobicContact CG1-CG1 4.5Å; I972-V984 HydrophobicContact CG2-CG1 4.2Å; I972-V984 HydrophobicContact CG2-CG2 4.25Å; I972-I1065 HydrophobicContact CG2-CD1 3.31Å
973	Y	84	Confident	78.4	Confident	79 Å²	79	49.4 Å²	49.4	31%	0.31	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.3	45.3	-169.9	-67.7	-77.5	0	0	0	112.7	G908 D938 K975 K1064 I1065	G908-Y973 PolarHBondContact O-N 3.05Å; D938-Y973 PolarHBondContact OD2-OH 2.9Å; Y973-K975 PolarHBondContact O-N 3.34Å; Y973-K1064 HydrophobicContact CE2-CB 4.3Å; Y973-K1064 HydrophobicContact CE2-CD 4.43Å; Y973-I1065 HydrophobicContact CD2-CD1 3.85Å; Y973-I1065 HydrophobicContact CE2-CD1 3.56Å; Y973-I1065 HydrophobicContact CE2-CG1 3.83Å
974	G	74.9	Confident	78.6	Confident	43 Å²	43	48.1 Å²	48.1	44%	0.443	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	3.3	-179.1	0	0	0	0	0	116.4	I972	I972-G974 PolarHBondContact O-N 3.35Å
975	K	77.4	Confident	78.9	Confident	99 Å²	99	48.3 Å²	48.3	43%	0.43	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.9	178.2	-58.3	178.4	-176.3	177.1	0	111.2	F971 I972 Y973 N980 V984	F971-K975 CarbonylContact C-O 3.5Å; F971-K975 WeakPolarHBondContact CA-O 3.5Å; I972-K975 PolarHBondContact N-O 2.89Å; I972-K975 WeakPolarHBondContact O-CB 3.47Å; I972-K975 PolarHBondContact O-N 2.93Å; Y973-K975 PolarHBondContact O-N 3.34Å; K975-N980 HydrophobicContact CB-CB 4.24Å; K975-V984 HydrophobicContact CB-CG2 4.45Å
976	D	77.4	Confident	78.7	Confident	20 Å²	20	51.7 Å²	51.7	11%	0.107	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	135	175	-165.5	-51.3	0	0	0	111.1	T882 T969 F971 A978 N980	T882-D976 HydrophobicContact CG2-CB 4.47Å; T969-D976 PolarHBondContact OG1-OD1 3.16Å; T969-D976 PolarHBondContact OG1-OD2 3.38Å; F971-D976 HydrophobicContact CD1-CB 4.11Å; F971-D976 HydrophobicContact CE1-CB 3.93Å; D976-A978 WeakPolarHBondContact OD1-CB 3.44Å; D976-A978 PolarHBondContact OD1-N 2.81Å; D976-N980 PolarHBondContact O-N 2.89Å
977	I	79	Confident	78.8	Confident	17 Å²	17	50.4 Å²	50.4	9%	0.087	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-37.6	177.3	-66	-167.5	0	0	0	112.4	I959 V970 I972 E979 M981	I959-I977 HydrophobicContact CG2-CD1 4.4Å; I959-I977 WeakPolarHBondContact O-CD1 3.2Å; V970-I977 HydrophobicContact CB-CD1 3.57Å; V970-I977 HydrophobicContact CB-CG1 4.01Å; V970-I977 HydrophobicContact CG1-CD1 3.54Å; V970-I977 HydrophobicContact CG1-CG1 4.21Å; V970-I977 HydrophobicContact CG2-CD1 4.41Å; V970-I977 WeakPolarHBondContact O-CG1 3.16Å; V970-I977 PolarHBondContact O-N 3.23Å; V970-I977 VanDerWaalsContact O-N 3.1Å; I972-I977 HydrophobicContact CD1-CD1 3.53Å; I972-I977 HydrophobicContact CD1-CG1 3.85Å; I972-I977 HydrophobicContact CG1-CD1 4.1Å; I972-I977 HydrophobicContact CG1-CG1 4.17Å; I977-E979 VanDerWaalsContact C-N 3.33Å; I977-E979 PolarHBondContact O-N 2.83Å; I977-M981 HydrophobicContact CG2-CE 3.76Å; I977-M981 HydrophobicContact CG2-SD 3.52Å; I977-M981 VanDerWaalsContact CG2-SD 3.52Å; I977-M981 WeakPolarHBondContact O-CB 3.42Å; I977-M981 PolarHBondContact O-N 2.99Å
978	A	69.9	Low	79.1	Confident	93 Å²	93	44.3 Å²	44.3	77%	0.769	27%	0.268	S	S	*	.	H	α-helix	trans	-66.2	-34.5	-176.3	0	0	0	0	0	112.7	D976	D976-A978 WeakPolarHBondContact OD1-CB 3.44Å; D976-A978 PolarHBondContact OD1-N 2.81Å
979	E	67.5	Low	79.4	Confident	82 Å²	82	42.4 Å²	42.4	38%	0.383	25%	0.249	S	C	.	.	H	α-helix	trans	-94.3	-47.5	-178.9	-61.8	-176.3	163	0	0	112.5	T882 I977	T882-E979 WeakPolarHBondContact CB-OE2 3.36Å; T882-E979 VanDerWaalsContact CG2-OE2 3.25Å; T882-E979 WeakPolarHBondContact CG2-OE2 3.31Å; T882-E979 PolarHBondContact OG1-OE2 3.37Å; I977-E979 VanDerWaalsContact C-N 3.33Å; I977-E979 PolarHBondContact O-N 2.83Å
980	N	73.6	Confident	79.7	Confident	65 Å²	65	41.6 Å²	41.6	35%	0.348	24%	0.243	S	C	.	.	H	α-helix	trans	-111.7	22.7	-163.3	-87.8	-63.3	0	0	0	114.9	K975 D976 A982 A983 V984	K975-N980 HydrophobicContact CB-CB 4.24Å; D976-N980 PolarHBondContact O-N 2.89Å; N980-A982 PolarHBondContact O-N 2.77Å; N980-A983 PolarHBondContact O-N 3.28Å; N980-V984 PolarHBondContact O-N 3.23Å
981	M	77.1	Confident	79.8	Confident	28 Å²	28	41.4 Å²	41.4	14%	0.138	24%	0.242	C	C	.	.	H	α-helix	trans	-45.4	-37.5	179.3	-166.9	93.1	-109.2	0	0	114.7	G961 I977 V984 R985	G961-M981 VanDerWaalsContact CA-SD 3.56Å; I977-M981 HydrophobicContact CG2-CE 3.76Å; I977-M981 HydrophobicContact CG2-SD 3.52Å; I977-M981 VanDerWaalsContact CG2-SD 3.52Å; I977-M981 WeakPolarHBondContact O-CB 3.42Å; I977-M981 PolarHBondContact O-N 2.99Å; M981-V984 HydrophobicContact CE-CG1 4.1Å; M981-V984 PolarHBondContact O-N 3.13Å; M981-R985 HydrophobicContact CE-CG 4.18Å; M981-R985 HydrophobicContact CG-CG 4.3Å; M981-R985 VanDerWaalsContact CG-NE 3.3Å; M981-R985 WeakPolarHBondContact O-CB 3.39Å; M981-R985 WeakPolarHBondContact O-CD 3.48Å; M981-R985 VanDerWaalsContact O-CG 3.24Å; M981-R985 WeakPolarHBondContact O-CG 3.24Å; M981-R985 PolarHBondContact O-N 3.38Å
982	A	72.5	Confident	79.7	Confident	76 Å²	76	41.6 Å²	41.6	63%	0.628	24%	0.244	S	C	*	.	H	α-helix	trans	-67.1	-37.5	-176.9	0	0	0	0	0	113	N980	N980-A982 PolarHBondContact O-N 2.77Å
983	A	75.4	Confident	79.2	Confident	35 Å²	35	45.4 Å²	45.4	29%	0.289	26%	0.262	S	S	.	.	H	α-helix	trans	-76	-36.7	175.7	0	0	0	0	0	111.4	N980 R985	N980-A983 PolarHBondContact O-N 3.28Å; A983-R985 VanDerWaalsContact C-N 3.34Å; A983-R985 PolarHBondContact O-N 3Å
984	V	80.4	Confident	78.5	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.018	27%	0.272	C	S	.	.	H	α-helix	trans	-59	-43.5	174.5	165.3	0	0	0	0	111.8	I972 K975 N980 M981 Q986 S987 L988	I972-V984 HydrophobicContact CB-CG1 4.37Å; I972-V984 HydrophobicContact CB-CG2 4.11Å; I972-V984 HydrophobicContact CD1-CG1 3.5Å; I972-V984 VanDerWaalsContact CD1-CG1 3.5Å; I972-V984 HydrophobicContact CG1-CG1 4.5Å; I972-V984 HydrophobicContact CG2-CG1 4.2Å; I972-V984 HydrophobicContact CG2-CG2 4.25Å; K975-V984 HydrophobicContact CB-CG2 4.45Å; N980-V984 PolarHBondContact O-N 3.23Å; M981-V984 HydrophobicContact CE-CG1 4.1Å; M981-V984 PolarHBondContact O-N 3.13Å; V984-Q986 VanDerWaalsContact C-N 3.28Å; V984-Q986 PolarHBondContact O-N 2.96Å; V984-S987 PolarHBondContact O-N 3.16Å; V984-S987 PolarHBondContact O-OG 3.44Å; V984-S987 VanDerWaalsContact O-OG 3.12Å; V984-L988 PolarHBondContact O-N 2.96Å
985	R	83	Confident	78.7	Confident	45 Å²	45	47.9 Å²	47.9	17%	0.17	27%	0.266	C	S	.	.	H	α-helix	trans	-67.2	-22.2	-174.7	-78.1	167.2	169.4	-174	7.1	114.9	K684 M685 G961 M981 A983 L988	K684-R985 WeakPolarHBondContact O-CD 3.4Å; M685-R985 WeakPolarHBondContact O-CB 3.41Å; M685-R985 WeakPolarHBondContact O-CG 3.48Å; G961-R985 PolarHBondContact O-NH2 2.72Å; M981-R985 HydrophobicContact CE-CG 4.18Å; M981-R985 HydrophobicContact CG-CG 4.3Å; M981-R985 VanDerWaalsContact CG-NE 3.3Å; M981-R985 WeakPolarHBondContact O-CB 3.39Å; M981-R985 WeakPolarHBondContact O-CD 3.48Å; M981-R985 VanDerWaalsContact O-CG 3.24Å; M981-R985 WeakPolarHBondContact O-CG 3.24Å; M981-R985 PolarHBondContact O-N 3.38Å; A983-R985 VanDerWaalsContact C-N 3.34Å; A983-R985 PolarHBondContact O-N 3Å; R985-L988 PolarHBondContact O-N 3.18Å
986	Q	78.1	Confident	78.9	Confident	121 Å²	121	44 Å²	44	57%	0.565	25%	0.25	S	S	*	.	H	α-helix	trans	-68.2	-35.3	175.4	-68.6	-174.9	-48.5	0	0	112.1	V984	V984-Q986 VanDerWaalsContact C-N 3.28Å; V984-Q986 PolarHBondContact O-N 2.96Å
987	S	81.7	Confident	79.4	Confident	41 Å²	41	43.8 Å²	43.8	29%	0.287	25%	0.249	S	C	.	.	H	α-helix	trans	-93.5	-0.3	178.4	50.5	0	0	0	0	114.3	V984 K1064 I1065	V984-S987 PolarHBondContact O-N 3.16Å; V984-S987 PolarHBondContact O-OG 3.44Å; V984-S987 VanDerWaalsContact O-OG 3.12Å; S987-K1064 PolarHBondContact O-N 3.47Å; S987-I1065 PolarHBondContact O-N 3.49Å
988	L	87	Confident	79.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	138.8	-178.4	-164.2	78.6	0	0	0	112	V984 R985 K1014 I1065 I1067	V984-L988 PolarHBondContact O-N 2.96Å; R985-L988 PolarHBondContact O-N 3.18Å; L988-K1014 VanDerWaalsContact O-CE 3.27Å; L988-K1014 WeakPolarHBondContact O-CE 3.34Å; L988-K1014 PolarHBondContact O-NZ 3.21Å; L988-I1065 CarbonylContact C-O 3.48Å; L988-I1065 HydrophobicContact CD1-CB 4.2Å; L988-I1065 HydrophobicContact CD1-CG2 3.64Å; L988-I1067 HydrophobicContact CD1-CD1 4.07Å
989	G	88.5	Confident	80.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.6	164.1	0	0	0	0	0	109.8	A1058 I1065 V1066 I1067	G989-A1058 VanDerWaalsContact CA-O 3.23Å; G989-A1058 WeakPolarHBondContact CA-O 3.31Å; G989-I1065 PolarHBondContact N-O 2.97Å; G989-V1066 WeakPolarHBondContact O-CA 3.18Å; G989-I1067 PolarHBondContact O-N 2.77Å
990	F	89.2	Confident	81	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.035	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	129.6	179.5	179.7	-125.8	0	0	0	112.1	F682 M685 M686 C960 L962 P992 I1067 D1069	F682-F990 HydrophobicContact CE2-CD1 4.47Å; F682-F990 WeakPolarHBondContact CE2-O 3.46Å; M685-F990 HydrophobicContact CE-CD1 3.6Å; M685-F990 HydrophobicContact CE-CE1 3.78Å; M685-F990 HydrophobicContact SD-CD1 3.62Å; M685-F990 HydrophobicContact SD-CE1 3.89Å; M685-F990 HydrophobicContact SD-CG 4.49Å; M686-F990 HydrophobicContact CE-CB 4.47Å; M686-F990 VanDerWaalsContact CE-O 3.26Å; M686-F990 WeakPolarHBondContact CE-O 3.33Å; C960-F990 WeakPolarHBondContact SG-CD2 3.15Å; L962-F990 HydrophobicContact CD1-CE1 4.1Å; L962-F990 HydrophobicContact CD1-CZ 4.39Å; F990-P992 HydrophobicContact CD1-CB 4.43Å; F990-P992 HydrophobicContact CD1-CG 4.47Å; F990-P992 HydrophobicContact CE1-CB 3.63Å; F990-P992 HydrophobicContact CE1-CG 4.09Å; F990-P992 HydrophobicContact CZ-CB 3.8Å; F990-I1067 CarbonylContact C-O 3.55Å; F990-I1067 WeakPolarHBondContact CA-O 3.42Å; F990-I1067 HydrophobicContact CD2-CB 3.99Å; F990-I1067 HydrophobicContact CD2-CG2 3.9Å; F990-I1067 WeakPolarHBondContact CD2-O 3.24Å; F990-I1067 HydrophobicContact CE2-CG2 4.11Å; F990-D1069 HydrophobicContact CE2-CB 4.32Å
991	C	88.3	Confident	81.7	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	102.5	169	-173	0	0	0	0	109.5	R1051 A1058 I1067 L1068 D1069	C991-R1051 PolarHBondContact SG-NH1 3.43Å; C991-A1058 HydrophobicContact CB-CB 4.26Å; C991-I1067 PolarHBondContact N-O 3.32Å; C991-L1068 HydrophobicContact CB-CD2 3.49Å; C991-L1068 VanDerWaalsContact CB-CD2 3.49Å; C991-D1069 PolarHBondContact O-N 3.07Å
992	P	82	Confident	82.3	Confident	14 Å²	14	45.7 Å²	45.7	9%	0.091	25%	0.248	C	C	.	.			trans	-69.4	164.8	178.4	23.8	-30.7	0	0	0	112.9	F682 F990 H994 I996 R1051	F682-P992 HydrophobicContact CD2-CG 4.35Å; F682-P992 HydrophobicContact CE2-CG 4.17Å; F990-P992 HydrophobicContact CD1-CB 4.43Å; F990-P992 HydrophobicContact CD1-CG 4.47Å; F990-P992 HydrophobicContact CE1-CB 3.63Å; F990-P992 HydrophobicContact CE1-CG 4.09Å; F990-P992 HydrophobicContact CZ-CB 3.8Å; P992-H994 WeakPolarHBondContact CG-O 3.35Å; P992-H994 PolarHBondContact O-N 2.65Å; P992-I996 HydrophobicContact CB-CD1 4.45Å; P992-I996 HydrophobicContact CG-CD1 3.73Å; P992-I996 HydrophobicContact CG-CG1 3.96Å; P992-R1051 PolarHBondContact O-NH1 3Å; P992-R1051 PolarHBondContact O-NH2 2.69Å
993	Q	75.5	Confident	83.2	Confident	84 Å²	84	42 Å²	42	39%	0.393	22%	0.218	S	C	.	.	S	Bend	trans	-56.3	-31.3	177.1	-162.2	-173.1	38.1	0	0	114.4	D1069 E1070	Q993-D1069 WeakPolarHBondContact CA-O 3.46Å; Q993-E1070 HydrophobicContact CG-CB 4.44Å; Q993-E1070 PolarHBondContact NE2-OE2 3.12Å
994	H	70.6	Confident	84	Confident	114 Å²	114	42.4 Å²	42.4	53%	0.528	21%	0.213	S	C	.	.	S	Bend	trans	-108.3	139.4	177.4	-49.1	-34.6	0	0	0	110.3	P992 I996	P992-H994 WeakPolarHBondContact CG-O 3.35Å; P992-H994 PolarHBondContact O-N 2.65Å; H994-I996 PolarHBondContact O-N 3.29Å; H994-I996 VanDerWaalsContact O-N 3.13Å
995	N	78.4	Confident	84.6	Confident	59 Å²	59	46.2 Å²	46.2	32%	0.316	23%	0.231	S	C	.	.			trans	-69.9	109.1	-178.9	-61.8	-31.7	0	0	0	111.1	L997 K1050 R1051	N995-L997 HydrophobicContact CB-CD1 4.33Å; N995-K1050 HydrophobicContact CB-CB 4.36Å; N995-R1051 PolarHBondContact ND2-N 3Å; N995-R1051 WeakPolarHBondContact OD1-CD 3.26Å; N995-R1051 PolarHBondContact OD1-NH1 3.23Å; N995-R1051 VanDerWaalsContact OD1-NH1 3.13Å
996	I	82.6	Confident	85.1	Confident	19 Å²	19	44.1 Å²	44.1	10%	0.097	22%	0.223	C	C	.	.			trans	-94.4	97.6	176.7	-56.3	179.6	0	0	0	108.3	R678 L679 F682 P992 H994	R678-I996 HydrophobicContact CB-CD1 4.11Å; L679-I996 HydrophobicContact CD2-CG2 3.66Å; L679-I996 HydrophobicContact CG-CG2 4.09Å; F682-I996 HydrophobicContact CB-CD1 4.21Å; F682-I996 HydrophobicContact CB-CG2 4.01Å; F682-I996 HydrophobicContact CD1-CG2 4.31Å; F682-I996 HydrophobicContact CD2-CD1 4.13Å; F682-I996 HydrophobicContact CG-CB 4.35Å; F682-I996 HydrophobicContact CG-CD1 4.35Å; F682-I996 HydrophobicContact CG-CG2 4.11Å; P992-I996 HydrophobicContact CB-CD1 4.45Å; P992-I996 HydrophobicContact CG-CD1 3.73Å; P992-I996 HydrophobicContact CG-CG1 3.96Å; H994-I996 PolarHBondContact O-N 3.29Å; H994-I996 VanDerWaalsContact O-N 3.13Å
997	L	86.3	Confident	85.7	Confident	15 Å²	15	38.4 Å²	38.4	8%	0.079	20%	0.196	C	C	.	.			trans	-133	156.4	-175.7	-62.8	172.3	0	0	0	110.6	N995 A1042 K1050 L1053 I1057	N995-L997 HydrophobicContact CB-CD1 4.33Å; L997-A1042 HydrophobicContact CB-CB 4.43Å; L997-K1050 HydrophobicContact CD1-CB 3.77Å; L997-K1050 HydrophobicContact CD1-CD 4.39Å; L997-K1050 HydrophobicContact CD1-CG 4.04Å; L997-L1053 HydrophobicContact CD1-CD2 4.21Å; L997-L1053 HydrophobicContact CD2-CD2 4.02Å; L997-L1053 HydrophobicContact CD2-CG 3.97Å; L997-I1057 HydrophobicContact CD2-CD1 3.59Å
998	F	85.7	Confident	86.1	Confident	33 Å²	33	38.9 Å²	38.9	15%	0.145	19%	0.194	C	C	.	.			trans	-89.2	108.7	171.9	-64	-87.3	0	0	0	109.3	L679 M683 N1000 L1001 H1006 F1009 Y1010	L679-F998 HydrophobicContact CB-CE1 4.32Å; L679-F998 HydrophobicContact CB-CZ 4.41Å; L679-F998 HydrophobicContact CD1-CD1 3.74Å; L679-F998 HydrophobicContact CD1-CE1 3.73Å; L679-F998 HydrophobicContact CD1-CG 4.49Å; L679-F998 HydrophobicContact CD1-CZ 4.49Å; L679-F998 HydrophobicContact CD2-CD1 3.99Å; L679-F998 HydrophobicContact CD2-CD2 4.05Å; L679-F998 HydrophobicContact CD2-CE1 3.88Å; L679-F998 HydrophobicContact CD2-CE2 3.95Å; L679-F998 HydrophobicContact CD2-CG 4.08Å; L679-F998 HydrophobicContact CD2-CZ 3.86Å; L679-F998 HydrophobicContact CG-CD1 4.45Å; L679-F998 HydrophobicContact CG-CE1 4.2Å; L679-F998 HydrophobicContact CG-CZ 4.48Å; M683-F998 HydrophobicContact SD-CZ 4.23Å; F998-N1000 PolarHBondContact O-N 3.27Å; F998-L1001 HydrophobicContact CB-CB 4.14Å; F998-L1001 HydrophobicContact CB-CD1 3.86Å; F998-L1001 HydrophobicContact CB-CG 3.99Å; F998-L1001 HydrophobicContact CD2-CD1 3.83Å; F998-L1001 HydrophobicContact CG-CD1 3.93Å; F998-L1001 PolarHBondContact O-N 2.97Å; F998-L1001 VanDerWaalsContact O-N 3.11Å; F998-H1006 PolarHBondContact N-NE2 3.42Å; F998-H1006 PolarHBondContact O-CE1 3.36Å; F998-H1006 PolarHBondContact O-NE2 3.09Å; F998-F1009 HydrophobicContact CE2-CD1 4.13Å; F998-F1009 AromaticContact CE2-CE1 3.78Å; F998-F1009 HydrophobicContact CE2-CE1 3.78Å; F998-F1009 HydrophobicContact CZ-CE1 4.02Å; F998-F1009 HydrophobicContact CZ-CZ 4.47Å; F998-Y1010 HydrophobicContact CE2-CE2 4.37Å; F998-Y1010 WeakPolarHBondContact CE2-OH 3.3Å
999	D	80.9	Confident	86.2	Confident	77 Å²	77	42.4 Å²	42.4	41%	0.412	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.4	-176.5	-75.5	-45.9	0	0	0	114.3	A1043 K1050	D999-A1043 HydrophobicContact CB-CB 4.06Å; D999-A1043 WeakPolarHBondContact O-CB 3.4Å; D999-A1043 PolarHBondContact O-N 2.61Å; D999-K1050 IonicContact OD1-NZ 3.56Å
1000	N	84.6	Confident	86.3	Confident	144 Å²	144	42.4 Å²	42.4	77%	0.77	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-7.2	-176.2	-61.7	-9	0	0	0	115.1	F998 L1041	F998-N1000 PolarHBondContact O-N 3.27Å; N1000-L1041 VanDerWaalsContact O-CD2 3.31Å; N1000-L1041 WeakPolarHBondContact O-CD2 3.32Å
1001	L	87.1	Confident	86.2	Confident	49 Å²	49	42 Å²	42	26%	0.257	21%	0.208	S	C	.	.	S	Bend	trans	-99.1	146.1	178.2	-69.8	177.9	0	0	0	110.7	F998 E1005 H1006 A1042	F998-L1001 HydrophobicContact CB-CB 4.14Å; F998-L1001 HydrophobicContact CB-CD1 3.86Å; F998-L1001 HydrophobicContact CB-CG 3.99Å; F998-L1001 HydrophobicContact CD2-CD1 3.83Å; F998-L1001 HydrophobicContact CG-CD1 3.93Å; F998-L1001 PolarHBondContact O-N 2.97Å; F998-L1001 VanDerWaalsContact O-N 3.11Å; L1001-E1005 HydrophobicContact CB-CB 4.31Å; L1001-E1005 HydrophobicContact CD2-CB 4.12Å; L1001-H1006 VanDerWaalsContact CB-CE1 3.49Å; L1001-H1006 WeakPolarHBondContact CB-CE1 3.27Å; L1001-H1006 WeakPolarHBondContact CB-ND1 3.43Å; L1001-H1006 PolarHBondContact O-CE1 3.02Å; L1001-H1006 PolarHBondContact O-ND1 3.31Å; L1001-A1042 PolarHBondContact O-N 3.03Å
1002	T	91.5	Very high	86.2	Confident	21 Å²	21	45.3 Å²	45.3	13%	0.129	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-72.7	166.8	172	63.5	0	0	0	0	112	K1004 E1005 H1006 N1039 E1040 L1041	T1002-K1004 VanDerWaalsContact C-N 3.33Å; T1002-K1004 PolarHBondContact O-N 2.76Å; T1002-E1005 VanDerWaalsContact CB-OE2 3.31Å; T1002-E1005 WeakPolarHBondContact CB-OE2 3.3Å; T1002-E1005 WeakPolarHBondContact CG2-OE2 3.35Å; T1002-E1005 PolarHBondContact N-OE2 3.33Å; T1002-E1005 PolarHBondContact O-N 3.42Å; T1002-E1005 WeakPolarHBondContact OG1-CB 3.42Å; T1002-E1005 VanDerWaalsContact OG1-CG 3.22Å; T1002-E1005 WeakPolarHBondContact OG1-CG 3.45Å; T1002-E1005 PolarHBondContact OG1-N 3.37Å; T1002-E1005 PolarHBondContact OG1-OE2 3.2Å; T1002-H1006 PolarHBondContact O-N 3.12Å; T1002-H1006 VanDerWaalsContact O-N 3.09Å; T1002-H1006 PolarHBondContact O-ND1 3.25Å; T1002-N1039 VanDerWaalsContact CG2-O 3.31Å; T1002-N1039 WeakPolarHBondContact CG2-O 3.36Å; T1002-E1040 VanDerWaalsContact CA-O 3.29Å; T1002-E1040 WeakPolarHBondContact CA-O 3.5Å; T1002-L1041 HydrophobicContact CG2-CD2 4.23Å
1003	V	91.5	Very high	86.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.7	-42.5	176.6	-166.6	0	0	0	0	111.4	L1007 L1029 L1034 K1037 K1038 E1040 L1045 L1053	V1003-L1007 WeakPolarHBondContact O-CG 3.49Å; V1003-L1007 PolarHBondContact O-N 3.5Å; V1003-L1029 HydrophobicContact CB-CD2 4.44Å; V1003-L1029 HydrophobicContact CG1-CD2 3.54Å; V1003-L1034 HydrophobicContact CG1-CD1 4.41Å; V1003-K1037 WeakPolarHBondContact CG2-O 3.25Å; V1003-K1038 PolarHBondContact N-O 3.11Å; V1003-E1040 WeakPolarHBondContact CG2-O 3.17Å; V1003-E1040 PolarHBondContact N-O 3.42Å; V1003-L1045 HydrophobicContact CG2-CD1 4.05Å; V1003-L1045 HydrophobicContact CG2-CD2 4.4Å; V1003-L1053 HydrophobicContact CG1-CD1 3.72Å; V1003-L1053 HydrophobicContact CG1-CD2 4.2Å; V1003-L1053 HydrophobicContact CG1-CG 4.45Å; V1003-L1053 HydrophobicContact CG2-CD2 4.49Å
1004	K	91.3	Very high	86.8	Confident	43 Å²	43	43.3 Å²	43.3	19%	0.187	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-48.1	176.1	-162.2	-166.1	-176.7	-170.1	0	111.8	T1002 H1006 L1007 Q1008 E1022 I1025 K1038	T1002-K1004 VanDerWaalsContact C-N 3.33Å; T1002-K1004 PolarHBondContact O-N 2.76Å; K1004-H1006 PolarHBondContact O-N 3.03Å; K1004-L1007 PolarHBondContact O-N 3.01Å; K1004-Q1008 VanDerWaalsContact CE-NE2 3.32Å; K1004-Q1008 HydrophobicContact CG-CG 4.38Å; K1004-Q1008 WeakPolarHBondContact O-CG 3.38Å; K1004-Q1008 PolarHBondContact O-N 3.45Å; K1004-E1022 WeakPolarHBondContact CE-OE1 3.36Å; K1004-E1022 IonicContact NZ-OE1 2.8Å; K1004-E1022 PolarHBondContact NZ-OE1 2.66Å; K1004-E1022 IonicContact NZ-OE2 3.03Å; K1004-I1025 HydrophobicContact CG-CG2 4.4Å; K1004-K1038 HydrophobicContact CB-CG 3.88Å; K1004-K1038 HydrophobicContact CD-CG 4.49Å; K1004-K1038 HydrophobicContact CG-CG 4.22Å; K1004-K1038 PolarHBondContact N-O 3.5Å
1005	E	92.5	Very high	87.3	Confident	83 Å²	83	41 Å²	41	39%	0.388	23%	0.227	S	C	.	.	H	α-helix	trans	-65	-37.4	-175.8	-71.2	161.9	146.7	0	0	112.3	L1001 T1002 L1007 Q1008 F1009	L1001-E1005 HydrophobicContact CB-CB 4.31Å; L1001-E1005 HydrophobicContact CD2-CB 4.12Å; T1002-E1005 VanDerWaalsContact CB-OE2 3.31Å; T1002-E1005 WeakPolarHBondContact CB-OE2 3.3Å; T1002-E1005 WeakPolarHBondContact CG2-OE2 3.35Å; T1002-E1005 PolarHBondContact N-OE2 3.33Å; T1002-E1005 PolarHBondContact O-N 3.42Å; T1002-E1005 WeakPolarHBondContact OG1-CB 3.42Å; T1002-E1005 VanDerWaalsContact OG1-CG 3.22Å; T1002-E1005 WeakPolarHBondContact OG1-CG 3.45Å; T1002-E1005 PolarHBondContact OG1-N 3.37Å; T1002-E1005 PolarHBondContact OG1-OE2 3.2Å; E1005-L1007 VanDerWaalsContact C-N 3.34Å; E1005-L1007 PolarHBondContact O-N 3.17Å; E1005-Q1008 PolarHBondContact O-N 2.9Å; E1005-F1009 WeakPolarHBondContact O-CB 3.44Å; E1005-F1009 PolarHBondContact O-N 2.91Å
1006	H	92.8	Very high	87.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55	-50.5	172.1	-83.7	85	0	0	0	111.7	F998 L1001 T1002 K1004 F1009 Y1010 A1042 L1053 I1057	F998-H1006 PolarHBondContact N-NE2 3.42Å; F998-H1006 PolarHBondContact O-CE1 3.36Å; F998-H1006 PolarHBondContact O-NE2 3.09Å; L1001-H1006 VanDerWaalsContact CB-CE1 3.49Å; L1001-H1006 WeakPolarHBondContact CB-CE1 3.27Å; L1001-H1006 WeakPolarHBondContact CB-ND1 3.43Å; L1001-H1006 PolarHBondContact O-CE1 3.02Å; L1001-H1006 PolarHBondContact O-ND1 3.31Å; T1002-H1006 PolarHBondContact O-N 3.12Å; T1002-H1006 VanDerWaalsContact O-N 3.09Å; T1002-H1006 PolarHBondContact O-ND1 3.25Å; K1004-H1006 PolarHBondContact O-N 3.03Å; H1006-F1009 PolarHBondContact O-N 2.92Å; H1006-Y1010 VanDerWaalsContact O-CD2 3.24Å; H1006-Y1010 WeakPolarHBondContact O-CD2 3.25Å; H1006-Y1010 PolarHBondContact O-N 3.21Å; H1006-A1042 VanDerWaalsContact CE1-CB 3.48Å; H1006-A1042 WeakPolarHBondContact CE1-CB 3.37Å; H1006-L1053 HydrophobicContact CB-CD1 4.31Å; H1006-I1057 HydrophobicContact CB-CD1 4.25Å
1007	L	91.1	Very high	87.4	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-68.6	-40.3	-178.1	-61	173.8	0	0	0	110.8	V1003 K1004 E1005 F1009 G1011 I1025 L1029 L1053 A1056 I1057 I1060	V1003-L1007 WeakPolarHBondContact O-CG 3.49Å; V1003-L1007 PolarHBondContact O-N 3.5Å; K1004-L1007 PolarHBondContact O-N 3.01Å; E1005-L1007 VanDerWaalsContact C-N 3.34Å; E1005-L1007 PolarHBondContact O-N 3.17Å; L1007-F1009 VanDerWaalsContact C-N 3.3Å; L1007-F1009 PolarHBondContact O-N 2.86Å; L1007-G1011 PolarHBondContact O-N 2.89Å; L1007-I1025 HydrophobicContact CB-CD1 3.98Å; L1007-I1025 HydrophobicContact CB-CG1 3.83Å; L1007-I1025 HydrophobicContact CB-CG2 4.04Å; L1007-I1025 HydrophobicContact CD1-CG2 4.05Å; L1007-L1029 HydrophobicContact CD1-CD1 4.41Å; L1007-L1029 HydrophobicContact CD1-CD2 3.75Å; L1007-L1029 HydrophobicContact CD1-CG 3.78Å; L1007-L1053 HydrophobicContact CD2-CD1 4.15Å; L1007-L1053 HydrophobicContact CG-CD1 4.24Å; L1007-A1056 HydrophobicContact CD2-CB 3.82Å; L1007-I1057 HydrophobicContact CD2-CG1 3.96Å; L1007-I1060 HydrophobicContact CB-CD1 3.74Å; L1007-I1060 HydrophobicContact CD2-CD1 4.02Å; L1007-I1060 HydrophobicContact CG-CD1 4.47Å; L1007-I1060 WeakPolarHBondContact O-CD1 3.21Å
1008	Q	90.4	Very high	86.9	Confident	51 Å²	51	46.4 Å²	46.4	24%	0.238	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-36.9	173.7	-74.7	-176.2	-33.1	0	0	112.6	K1004 E1005 S1012 K1021 E1022 I1025	K1004-Q1008 VanDerWaalsContact CE-NE2 3.32Å; K1004-Q1008 HydrophobicContact CG-CG 4.38Å; K1004-Q1008 WeakPolarHBondContact O-CG 3.38Å; K1004-Q1008 PolarHBondContact O-N 3.45Å; E1005-Q1008 PolarHBondContact O-N 2.9Å; Q1008-S1012 PolarHBondContact O-N 2.87Å; Q1008-S1012 VanDerWaalsContact O-N 3.16Å; Q1008-S1012 PolarHBondContact O-OG 2.75Å; Q1008-K1021 PolarHBondContact O-NZ 2.88Å; Q1008-E1022 PolarHBondContact NE2-OE1 2.84Å; Q1008-I1025 HydrophobicContact CB-CD1 4.1Å; Q1008-I1025 HydrophobicContact CG-CD1 3.46Å; Q1008-I1025 VanDerWaalsContact CG-CD1 3.46Å
1009	F	90.2	Very high	86.5	Confident	75 Å²	75	52.8 Å²	52.8	33%	0.329	29%	0.293	S	S	.	.	H	α-helix	trans	-69.8	-54	179.2	179.3	-106.9	0	0	0	112	M683 F998 E1005 H1006 L1007 G1011 S1012 I1013	M683-F1009 HydrophobicContact CG-CE1 4.3Å; M683-F1009 HydrophobicContact SD-CE1 3.76Å; M683-F1009 HydrophobicContact SD-CZ 3.65Å; F998-F1009 HydrophobicContact CE2-CD1 4.13Å; F998-F1009 AromaticContact CE2-CE1 3.78Å; F998-F1009 HydrophobicContact CE2-CE1 3.78Å; F998-F1009 HydrophobicContact CZ-CE1 4.02Å; F998-F1009 HydrophobicContact CZ-CZ 4.47Å; E1005-F1009 WeakPolarHBondContact O-CB 3.44Å; E1005-F1009 PolarHBondContact O-N 2.91Å; H1006-F1009 PolarHBondContact O-N 2.92Å; L1007-F1009 VanDerWaalsContact C-N 3.3Å; L1007-F1009 PolarHBondContact O-N 2.86Å; F1009-G1011 PolarHBondContact O-N 3.27Å; F1009-S1012 WeakPolarHBondContact O-CB 3.19Å; F1009-S1012 PolarHBondContact O-N 3.47Å; F1009-S1012 VanDerWaalsContact O-N 3.16Å; F1009-I1013 HydrophobicContact CD1-CD1 3.97Å; F1009-I1013 HydrophobicContact CE1-CD1 3.49Å; F1009-I1013 VanDerWaalsContact CE1-CD1 3.49Å; F1009-I1013 HydrophobicContact CE2-CD1 4.33Å; F1009-I1013 HydrophobicContact CZ-CD1 3.7Å; F1009-I1013 PolarHBondContact O-N 3.31Å
1010	Y	89.4	Confident	86.5	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	30%	0.299	C	S	.	.	H	α-helix	trans	-68.3	-32.9	179.7	-72.3	-69.3	0	0	0	112.8	F682 M683 M686 F998 H1006 S1012 I1013 K1014 I1057	F682-Y1010 AromaticContact CD1-CE1 3.89Å; F682-Y1010 HydrophobicContact CD1-CE1 3.89Å; F682-Y1010 AromaticContact CD1-CZ 3.79Å; F682-Y1010 WeakPolarHBondContact CD1-OH 3.37Å; F682-Y1010 AromaticContact CE1-CE1 3.81Å; F682-Y1010 HydrophobicContact CE1-CE1 3.81Å; F682-Y1010 HydrophobicContact CE1-CE2 4.29Å; F682-Y1010 AromaticContact CE1-CZ 3.64Å; M683-Y1010 HydrophobicContact CG-CE1 4.25Å; M686-Y1010 HydrophobicContact CB-CD1 4.27Å; M686-Y1010 HydrophobicContact CG-CD1 4.11Å; M686-Y1010 HydrophobicContact CG-CE1 4.32Å; F998-Y1010 HydrophobicContact CE2-CE2 4.37Å; F998-Y1010 WeakPolarHBondContact CE2-OH 3.3Å; H1006-Y1010 VanDerWaalsContact O-CD2 3.24Å; H1006-Y1010 WeakPolarHBondContact O-CD2 3.25Å; H1006-Y1010 PolarHBondContact O-N 3.21Å; Y1010-S1012 VanDerWaalsContact C-N 3.34Å; Y1010-S1012 PolarHBondContact O-N 3.1Å; Y1010-I1013 HydrophobicContact CD1-CD1 4.2Å; Y1010-I1013 HydrophobicContact CE1-CD1 4.44Å; Y1010-I1013 PolarHBondContact O-N 3.05Å; Y1010-K1014 PolarHBondContact O-N 3.17Å; Y1010-K1014 VanDerWaalsContact O-N 3.1Å; Y1010-I1057 HydrophobicContact CD1-CG2 4.21Å; Y1010-I1057 HydrophobicContact CD2-CB 4.38Å; Y1010-I1057 HydrophobicContact CD2-CD1 4.01Å; Y1010-I1057 HydrophobicContact CD2-CG1 3.95Å; Y1010-I1057 HydrophobicContact CD2-CG2 3.5Å; Y1010-I1057 VanDerWaalsContact CD2-CG2 3.5Å; Y1010-I1057 HydrophobicContact CE2-CD1 4.01Å; Y1010-I1057 HydrophobicContact CE2-CG1 4.44Å; Y1010-I1057 HydrophobicContact CE2-CG2 3.93Å; Y1010-I1057 HydrophobicContact CG-CG2 3.68Å
1011	G	87.9	Confident	86.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.5	-39.4	170	0	0	0	0	0	112.8	L1007 F1009 K1014 G1015 V1016	L1007-G1011 PolarHBondContact O-N 2.89Å; F1009-G1011 PolarHBondContact O-N 3.27Å; G1011-K1014 PolarHBondContact O-N 3.31Å; G1011-G1015 PolarHBondContact O-N 3.45Å; G1011-V1016 WeakPolarHBondContact O-CB 3.38Å; G1011-V1016 WeakPolarHBondContact O-CG2 3.27Å; G1011-V1016 PolarHBondContact O-N 3.19Å
1012	S	87.9	Confident	86.3	Confident	69 Å²	69	50 Å²	50	48%	0.483	27%	0.273	S	S	.	.	H	α-helix	trans	-65.7	-39.5	172.4	-74.6	0	0	0	0	112.7	Q1008 F1009 Y1010 K1014 G1015 K1021	Q1008-S1012 PolarHBondContact O-N 2.87Å; Q1008-S1012 VanDerWaalsContact O-N 3.16Å; Q1008-S1012 PolarHBondContact O-OG 2.75Å; F1009-S1012 WeakPolarHBondContact O-CB 3.19Å; F1009-S1012 PolarHBondContact O-N 3.47Å; F1009-S1012 VanDerWaalsContact O-N 3.16Å; Y1010-S1012 VanDerWaalsContact C-N 3.34Å; Y1010-S1012 PolarHBondContact O-N 3.1Å; S1012-K1014 VanDerWaalsContact C-N 3.29Å; S1012-K1014 PolarHBondContact O-N 3.02Å; S1012-G1015 PolarHBondContact O-N 2.96Å; S1012-G1015 VanDerWaalsContact O-N 3.08Å; S1012-K1021 PolarHBondContact OG-NZ 2.69Å
1013	I	86.1	Confident	86.1	Confident	33 Å²	33	58.9 Å²	58.9	17%	0.169	31%	0.305	C	S	.	.	H	α-helix	trans	-62.8	-37.1	178.5	-69.7	174.9	0	0	0	111.6	M683 M686 L688 F1009 Y1010 G1015	M683-I1013 HydrophobicContact CG-CD1 4.3Å; M683-I1013 HydrophobicContact SD-CD1 4.4Å; M686-I1013 HydrophobicContact CB-CG2 4.43Å; L688-I1013 HydrophobicContact CB-CG2 4.11Å; F1009-I1013 HydrophobicContact CD1-CD1 3.97Å; F1009-I1013 HydrophobicContact CE1-CD1 3.49Å; F1009-I1013 VanDerWaalsContact CE1-CD1 3.49Å; F1009-I1013 HydrophobicContact CE2-CD1 4.33Å; F1009-I1013 HydrophobicContact CZ-CD1 3.7Å; F1009-I1013 PolarHBondContact O-N 3.31Å; Y1010-I1013 HydrophobicContact CD1-CD1 4.2Å; Y1010-I1013 HydrophobicContact CE1-CD1 4.44Å; Y1010-I1013 PolarHBondContact O-N 3.05Å; I1013-G1015 PolarHBondContact O-N 2.93Å
1014	K	84.3	Confident	85.9	Confident	23 Å²	23	60.8 Å²	60.8	10%	0.1	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-5.2	175.4	-74.2	-171.1	171	-169.2	0	114.6	L988 Y1010 G1011 S1012 V1016 I1060	L988-K1014 VanDerWaalsContact O-CE 3.27Å; L988-K1014 WeakPolarHBondContact O-CE 3.34Å; L988-K1014 PolarHBondContact O-NZ 3.21Å; Y1010-K1014 PolarHBondContact O-N 3.17Å; Y1010-K1014 VanDerWaalsContact O-N 3.1Å; G1011-K1014 PolarHBondContact O-N 3.31Å; S1012-K1014 VanDerWaalsContact C-N 3.29Å; S1012-K1014 PolarHBondContact O-N 3.02Å; K1014-V1016 HydrophobicContact CB-CG2 4.44Å; K1014-I1060 HydrophobicContact CD-CG2 4.49Å; K1014-I1060 WeakPolarHBondContact CD-O 3.39Å; K1014-I1060 PolarHBondContact NZ-O 3.48Å
1015	G	79.9	Confident	85.8	Confident	65 Å²	65	58.8 Å²	58.8	67%	0.67	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	26.5	178.6	0	0	0	0	0	114.4	G1011 S1012 I1013 D1017	G1011-G1015 PolarHBondContact O-N 3.45Å; S1012-G1015 PolarHBondContact O-N 2.96Å; S1012-G1015 VanDerWaalsContact O-N 3.08Å; I1013-G1015 PolarHBondContact O-N 2.93Å; G1015-D1017 PolarHBondContact O-N 3.16Å
1016	V	81.5	Confident	85.6	Confident	25 Å²	25	57.3 Å²	57.3	15%	0.152	30%	0.3	C	S	.	.			trans	-68.8	129.6	174.7	-173.6	0	0	0	0	109.8	G1011 K1014 K1021	G1011-V1016 WeakPolarHBondContact O-CB 3.38Å; G1011-V1016 WeakPolarHBondContact O-CG2 3.27Å; G1011-V1016 PolarHBondContact O-N 3.19Å; K1014-V1016 HydrophobicContact CB-CG2 4.44Å; V1016-K1021 HydrophobicContact CB-CB 4.4Å; V1016-K1021 HydrophobicContact CB-CG 4.38Å; V1016-K1021 HydrophobicContact CG1-CB 3.9Å; V1016-K1021 HydrophobicContact CG1-CG 4.26Å
1017	D	81.7	Confident	85.4	Confident	87 Å²	87	59.8 Å²	59.8	47%	0.465	32%	0.32	S	S	.	.			trans	-56.6	128.1	177.1	-169.2	-56.8	0	0	0	110.6	G1015 Q1019 I1020 K1021	G1015-D1017 PolarHBondContact O-N 3.16Å; D1017-Q1019 PolarHBondContact O-N 3.39Å; D1017-Q1019 PolarHBondContact OD1-N 2.95Å; D1017-I1020 HydrophobicContact CB-CD1 4.35Å; D1017-I1020 HydrophobicContact CB-CG1 4.47Å; D1017-I1020 PolarHBondContact O-N 3.44Å; D1017-K1021 WeakPolarHBondContact O-CB 3.37Å; D1017-K1021 PolarHBondContact O-N 3.36Å
1018	P	77.6	Confident	85.2	Confident	94 Å²	94	60.5 Å²	60.5	61%	0.61	32%	0.324	S	S	*	.	H	α-helix	trans	-53.5	-29.7	-175.8	19.3	-32.5	0	0	0	114.8
1019	Q	77.4	Confident	85.2	Confident	167 Å²	167	58.1 Å²	58.1	78%	0.78	31%	0.312	S	S	*	.	H	α-helix	trans	-71.1	-38	178.1	-62	-169.6	5.7	0	0	112.9	D1017	D1017-Q1019 PolarHBondContact O-N 3.39Å; D1017-Q1019 PolarHBondContact OD1-N 2.95Å
1020	I	80.1	Confident	85	Confident	106 Å²	106	63 Å²	63	54%	0.544	33%	0.33	S	S	.	.	H	α-helix	trans	-78.3	-35.3	177.8	-59.1	175.1	0	0	0	109.7	D1017 E1022 R1023 E1024	D1017-I1020 HydrophobicContact CB-CD1 4.35Å; D1017-I1020 HydrophobicContact CB-CG1 4.47Å; D1017-I1020 PolarHBondContact O-N 3.44Å; I1020-E1022 PolarHBondContact O-N 3.01Å; I1020-R1023 PolarHBondContact O-N 2.99Å; I1020-R1023 VanDerWaalsContact O-N 3.09Å; I1020-E1024 PolarHBondContact O-N 3.05Å
1021	K	81.7	Confident	84.7	Confident	23 Å²	23	65 Å²	65	10%	0.1	34%	0.341	C	S	.	.	H	α-helix	trans	-54.6	-44.5	-174.7	-164.9	177.8	71.1	171.6	0	113.4	Q1008 S1012 V1016 D1017 R1023 E1024 I1025	Q1008-K1021 PolarHBondContact O-NZ 2.88Å; S1012-K1021 PolarHBondContact OG-NZ 2.69Å; V1016-K1021 HydrophobicContact CB-CB 4.4Å; V1016-K1021 HydrophobicContact CB-CG 4.38Å; V1016-K1021 HydrophobicContact CG1-CB 3.9Å; V1016-K1021 HydrophobicContact CG1-CG 4.26Å; D1017-K1021 WeakPolarHBondContact O-CB 3.37Å; D1017-K1021 PolarHBondContact O-N 3.36Å; K1021-R1023 PolarHBondContact O-N 3.09Å; K1021-E1024 PolarHBondContact O-N 3.2Å; K1021-I1025 HydrophobicContact CD-CD1 4.39Å; K1021-I1025 HydrophobicContact CG-CD1 3.78Å; K1021-I1025 HydrophobicContact CG-CG1 4.41Å; K1021-I1025 WeakPolarHBondContact O-CB 3.39Å; K1021-I1025 WeakPolarHBondContact O-CD1 3.21Å; K1021-I1025 WeakPolarHBondContact O-CG1 3.19Å; K1021-I1025 PolarHBondContact O-N 2.71Å
1022	E	85.4	Confident	84.5	Confident	82 Å²	82	65.2 Å²	65.2	38%	0.383	34%	0.342	S	S	.	.	H	α-helix	trans	-65.4	-37.4	179.4	-69.6	-123.5	121.7	0	0	112.8	K1004 Q1008 I1020 I1025 D1026	K1004-E1022 WeakPolarHBondContact CE-OE1 3.36Å; K1004-E1022 IonicContact NZ-OE1 2.8Å; K1004-E1022 PolarHBondContact NZ-OE1 2.66Å; K1004-E1022 IonicContact NZ-OE2 3.03Å; Q1008-E1022 PolarHBondContact NE2-OE1 2.84Å; I1020-E1022 PolarHBondContact O-N 3.01Å; E1022-I1025 PolarHBondContact O-N 3.28Å; E1022-D1026 PolarHBondContact O-N 2.86Å
1023	R	87	Confident	84.2	Confident	209 Å²	209	68.9 Å²	68.9	79%	0.789	35%	0.349	S	S	*	.	H	α-helix	trans	-67.9	-43.4	177.5	-63.3	-176.3	-176.6	174.9	2.3	111.8	I1020 K1021 I1025 A1027	I1020-R1023 PolarHBondContact O-N 2.99Å; I1020-R1023 VanDerWaalsContact O-N 3.09Å; K1021-R1023 PolarHBondContact O-N 3.09Å; R1023-I1025 VanDerWaalsContact C-N 3.32Å; R1023-I1025 PolarHBondContact O-N 3.25Å; R1023-A1027 WeakPolarHBondContact O-CB 3.39Å; R1023-A1027 PolarHBondContact O-N 3.34Å
1024	E	87.8	Confident	84.1	Confident	40 Å²	40	67.5 Å²	67.5	19%	0.187	34%	0.343	C	S	.	.	H	α-helix	trans	-62.7	-39.7	175.8	-168.9	-175.7	178	0	0	111.3	I1020 K1021 L1028 G1061 G1062	I1020-E1024 PolarHBondContact O-N 3.05Å; K1021-E1024 PolarHBondContact O-N 3.2Å; E1024-L1028 HydrophobicContact CG-CD1 4.22Å; E1024-L1028 WeakPolarHBondContact O-CB 3.34Å; E1024-L1028 WeakPolarHBondContact O-CG 3.29Å; E1024-L1028 PolarHBondContact O-N 3.3Å; E1024-G1061 PolarHBondContact OE1-N 2.83Å; E1024-G1062 PolarHBondContact OE1-N 3.34Å
1025	I	88.9	Confident	84.1	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-47.4	178.5	-72.4	174.5	0	0	0	112	K1004 L1007 Q1008 K1021 E1022 R1023 A1027 L1028 L1029 I1060	K1004-I1025 HydrophobicContact CG-CG2 4.4Å; L1007-I1025 HydrophobicContact CB-CD1 3.98Å; L1007-I1025 HydrophobicContact CB-CG1 3.83Å; L1007-I1025 HydrophobicContact CB-CG2 4.04Å; L1007-I1025 HydrophobicContact CD1-CG2 4.05Å; Q1008-I1025 HydrophobicContact CB-CD1 4.1Å; Q1008-I1025 HydrophobicContact CG-CD1 3.46Å; Q1008-I1025 VanDerWaalsContact CG-CD1 3.46Å; K1021-I1025 HydrophobicContact CD-CD1 4.39Å; K1021-I1025 HydrophobicContact CG-CD1 3.78Å; K1021-I1025 HydrophobicContact CG-CG1 4.41Å; K1021-I1025 WeakPolarHBondContact O-CB 3.39Å; K1021-I1025 WeakPolarHBondContact O-CD1 3.21Å; K1021-I1025 WeakPolarHBondContact O-CG1 3.19Å; K1021-I1025 PolarHBondContact O-N 2.71Å; E1022-I1025 PolarHBondContact O-N 3.28Å; R1023-I1025 VanDerWaalsContact C-N 3.32Å; R1023-I1025 PolarHBondContact O-N 3.25Å; I1025-A1027 VanDerWaalsContact C-N 3.32Å; I1025-A1027 PolarHBondContact O-N 3.46Å; I1025-L1028 PolarHBondContact O-N 2.97Å; I1025-L1029 HydrophobicContact CG2-CD1 3.85Å; I1025-L1029 HydrophobicContact CG2-CG 4.39Å; I1025-L1029 WeakPolarHBondContact O-CB 3.11Å; I1025-L1029 VanDerWaalsContact O-CG 3.32Å; I1025-L1029 WeakPolarHBondContact O-CG 3.26Å; I1025-L1029 PolarHBondContact O-N 3.34Å; I1025-I1060 HydrophobicContact CG1-CD1 3.95Å
1026	D	89	Confident	84.3	Confident	53 Å²	53	74.2 Å²	74.2	28%	0.283	36%	0.363	S	S	.	.	H	α-helix	trans	-70.2	-31	-179.1	-77.9	-10	0	0	0	111.8	E1022 Y1030 M1035 K1038	E1022-D1026 PolarHBondContact O-N 2.86Å; D1026-Y1030 WeakPolarHBondContact O-CB 3.35Å; D1026-Y1030 PolarHBondContact O-N 2.87Å; D1026-M1035 HydrophobicContact CB-CE 4.26Å; D1026-K1038 WeakPolarHBondContact OD1-CE 3.06Å; D1026-K1038 IonicContact OD1-NZ 3.67Å; D1026-K1038 PolarHBondContact OD1-NZ 3.19Å; D1026-K1038 IonicContact OD2-NZ 2.74Å; D1026-K1038 PolarHBondContact OD2-NZ 2.8Å
1027	A	87.8	Confident	84.5	Confident	52 Å²	52	76.3 Å²	76.3	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-63	-47.9	168.2	0	0	0	0	0	112.3	R1023 I1025 L1029 Y1030 D1031	R1023-A1027 WeakPolarHBondContact O-CB 3.39Å; R1023-A1027 PolarHBondContact O-N 3.34Å; I1025-A1027 VanDerWaalsContact C-N 3.32Å; I1025-A1027 PolarHBondContact O-N 3.46Å; A1027-L1029 VanDerWaalsContact C-N 3.35Å; A1027-L1029 PolarHBondContact O-N 2.97Å; A1027-Y1030 PolarHBondContact O-N 3.11Å; A1027-D1031 WeakPolarHBondContact O-CB 3.19Å; A1027-D1031 PolarHBondContact O-N 3.1Å
1028	L	87.5	Confident	84.7	Confident	15 Å²	15	74 Å²	74	8%	0.079	36%	0.356	C	S	.	.	H	α-helix	trans	-63.9	-36.5	177	-75.3	168.8	0	0	0	112.6	E1024 I1025 T1032 F1059 I1060	E1024-L1028 HydrophobicContact CG-CD1 4.22Å; E1024-L1028 WeakPolarHBondContact O-CB 3.34Å; E1024-L1028 WeakPolarHBondContact O-CG 3.29Å; E1024-L1028 PolarHBondContact O-N 3.3Å; I1025-L1028 PolarHBondContact O-N 2.97Å; L1028-T1032 WeakPolarHBondContact O-CB 3.45Å; L1028-T1032 VanDerWaalsContact O-CG2 3.24Å; L1028-T1032 WeakPolarHBondContact O-CG2 3.35Å; L1028-T1032 PolarHBondContact O-N 3.41Å; L1028-T1032 PolarHBondContact O-OG1 2.87Å; L1028-F1059 HydrophobicContact CD2-CB 4.15Å; L1028-I1060 HydrophobicContact CD1-CB 3.99Å; L1028-I1060 HydrophobicContact CD1-CD1 4.16Å; L1028-I1060 HydrophobicContact CD1-CG1 3.91Å
1029	L	89.3	Confident	85.2	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-69.1	-35.9	176.1	-75.1	171.3	0	0	0	112.8	V1003 L1007 I1025 A1027 T1032 K1033 L1034 M1035 K1038	V1003-L1029 HydrophobicContact CB-CD2 4.44Å; V1003-L1029 HydrophobicContact CG1-CD2 3.54Å; L1007-L1029 HydrophobicContact CD1-CD1 4.41Å; L1007-L1029 HydrophobicContact CD1-CD2 3.75Å; L1007-L1029 HydrophobicContact CD1-CG 3.78Å; I1025-L1029 HydrophobicContact CG2-CD1 3.85Å; I1025-L1029 HydrophobicContact CG2-CG 4.39Å; I1025-L1029 WeakPolarHBondContact O-CB 3.11Å; I1025-L1029 VanDerWaalsContact O-CG 3.32Å; I1025-L1029 WeakPolarHBondContact O-CG 3.26Å; I1025-L1029 PolarHBondContact O-N 3.34Å; A1027-L1029 VanDerWaalsContact C-N 3.35Å; A1027-L1029 PolarHBondContact O-N 2.97Å; L1029-T1032 PolarHBondContact O-OG1 3.03Å; L1029-K1033 PolarHBondContact O-N 3.32Å; L1029-L1034 HydrophobicContact CD2-CB 4.21Å; L1029-L1034 PolarHBondContact O-N 2.84Å; L1029-M1035 HydrophobicContact CB-SD 3.61Å; L1029-M1035 HydrophobicContact CD1-SD 3.96Å; L1029-M1035 HydrophobicContact CG-SD 4.42Å; L1029-M1035 PolarHBondContact O-N 3.22Å; L1029-M1035 VanDerWaalsContact O-N 3.14Å; L1029-K1038 HydrophobicContact CD1-CB 4.25Å; L1029-K1038 HydrophobicContact CD1-CD 3.92Å; L1029-K1038 HydrophobicContact CD1-CG 3.79Å
1030	Y	87.8	Confident	85.6	Confident	177 Å²	177	70.7 Å²	70.7	69%	0.694	34%	0.336	S	S	*	.	H	α-helix	trans	-65.8	-51.5	172.7	-174.8	-94	0	0	0	110.7	D1026 A1027 T1032 K1033	D1026-Y1030 WeakPolarHBondContact O-CB 3.35Å; D1026-Y1030 PolarHBondContact O-N 2.87Å; A1027-Y1030 PolarHBondContact O-N 3.11Å; Y1030-T1032 PolarHBondContact O-N 3.35Å; Y1030-K1033 PolarHBondContact O-N 2.84Å
1031	D	82.7	Confident	86	Confident	43 Å²	43	68.8 Å²	68.8	23%	0.23	33%	0.327	C	S	.	.	H	α-helix	trans	-64.4	-38	-177	-77.5	-1.7	0	0	0	112.9	A1027 K1033 L1086 K1089	A1027-D1031 WeakPolarHBondContact O-CB 3.19Å; A1027-D1031 PolarHBondContact O-N 3.1Å; D1031-K1033 PolarHBondContact O-N 3.41Å; D1031-L1086 HydrophobicContact CB-CD1 4.11Å; D1031-K1089 IonicContact OD1-NZ 2.64Å; D1031-K1089 PolarHBondContact OD1-NZ 3.31Å; D1031-K1089 IonicContact OD2-NZ 2.87Å; D1031-K1089 PolarHBondContact OD2-NZ 3Å
1032	T	82.5	Confident	86.1	Confident	5 Å²	5	67.7 Å²	67.7	3%	0.031	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-5.3	174.8	54.3	0	0	0	0	114.2	L1028 L1029 Y1030 L1034 A1056 L1086	L1028-T1032 WeakPolarHBondContact O-CB 3.45Å; L1028-T1032 VanDerWaalsContact O-CG2 3.24Å; L1028-T1032 WeakPolarHBondContact O-CG2 3.35Å; L1028-T1032 PolarHBondContact O-N 3.41Å; L1028-T1032 PolarHBondContact O-OG1 2.87Å; L1029-T1032 PolarHBondContact O-OG1 3.03Å; Y1030-T1032 PolarHBondContact O-N 3.35Å; T1032-L1034 PolarHBondContact O-N 2.89Å; T1032-A1056 HydrophobicContact CG2-CB 3.94Å; T1032-L1086 HydrophobicContact CG2-CD1 3.5Å; T1032-L1086 VanDerWaalsContact CG2-CD1 3.5Å
1033	K	82	Confident	85.7	Confident	146 Å²	146	65.9 Å²	65.9	64%	0.635	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	35	-172.4	-55.3	176.2	-178.8	171.4	0	112.4	L1029 Y1030 D1031	L1029-K1033 PolarHBondContact O-N 3.32Å; Y1030-K1033 PolarHBondContact O-N 2.84Å; D1031-K1033 PolarHBondContact O-N 3.41Å
1034	L	85.3	Confident	85.3	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.026	31%	0.312	C	S	.	.			trans	-107.2	2.4	178.6	-71.7	176.9	0	0	0	113.6	V1003 L1029 T1032 N1036 K1037 K1038 M1049 K1052 L1053	V1003-L1034 HydrophobicContact CG1-CD1 4.41Å; L1029-L1034 HydrophobicContact CD2-CB 4.21Å; L1029-L1034 PolarHBondContact O-N 2.84Å; T1032-L1034 PolarHBondContact O-N 2.89Å; L1034-N1036 VanDerWaalsContact C-N 3.3Å; L1034-N1036 PolarHBondContact O-N 3.27Å; L1034-K1037 CarbonylContact O-C 3.57Å; L1034-K1037 WeakPolarHBondContact O-CA 3.13Å; L1034-K1037 PolarHBondContact O-N 2.98Å; L1034-K1038 PolarHBondContact O-N 3.45Å; L1034-M1049 HydrophobicContact CD2-CB 4.08Å; L1034-M1049 HydrophobicContact CD2-CG 4.02Å; L1034-K1052 HydrophobicContact CD1-CB 4.01Å; L1034-L1053 HydrophobicContact CD1-CB 4.17Å
1035	M	83.9	Confident	84.8	Confident	69 Å²	69	59.9 Å²	59.9	34%	0.34	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-56.6	-39.5	-174.9	-163	57	170.4	0	0	113.7	D1026 L1029 K1037 K1038	D1026-M1035 HydrophobicContact CB-CE 4.26Å; L1029-M1035 HydrophobicContact CB-SD 3.61Å; L1029-M1035 HydrophobicContact CD1-SD 3.96Å; L1029-M1035 HydrophobicContact CG-SD 4.42Å; L1029-M1035 PolarHBondContact O-N 3.22Å; L1029-M1035 VanDerWaalsContact O-N 3.14Å; M1035-K1037 PolarHBondContact O-N 2.86Å; M1035-K1038 HydrophobicContact CE-CD 3.98Å; M1035-K1038 VanDerWaalsContact O-CB 3.27Å; M1035-K1038 WeakPolarHBondContact O-CB 3.26Å; M1035-K1038 PolarHBondContact O-N 2.96Å; M1035-K1038 VanDerWaalsContact O-N 3.13Å; M1035-K1038 HydrophobicContact SD-CD 3.93Å
1036	N	84.4	Confident	84.1	Confident	160 Å²	160	62.7 Å²	62.7	86%	0.856	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-67	-6.9	175.7	-58.5	6.8	0	0	0	113.6	L1034	L1034-N1036 VanDerWaalsContact C-N 3.3Å; L1034-N1036 PolarHBondContact O-N 3.27Å
1037	K	84.1	Confident	83.3	Confident	69 Å²	69	62.6 Å²	62.6	30%	0.3	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-119.8	11	178.9	-67.6	-68.7	177.1	-179.8	0	112.9	V1003 L1034 M1035 N1039 E1040 L1045	V1003-K1037 WeakPolarHBondContact CG2-O 3.25Å; L1034-K1037 CarbonylContact O-C 3.57Å; L1034-K1037 WeakPolarHBondContact O-CA 3.13Å; L1034-K1037 PolarHBondContact O-N 2.98Å; M1035-K1037 PolarHBondContact O-N 2.86Å; K1037-N1039 PolarHBondContact O-N 3.2Å; K1037-N1039 VanDerWaalsContact O-N 3.1Å; K1037-E1040 HydrophobicContact CB-CB 4.41Å; K1037-E1040 HydrophobicContact CD-CB 4.07Å; K1037-E1040 VanDerWaalsContact CD-CD 3.48Å; K1037-E1040 HydrophobicContact CD-CG 4.34Å; K1037-E1040 WeakPolarHBondContact CD-OE2 3.31Å; K1037-E1040 WeakPolarHBondContact CE-OE2 3.21Å; K1037-E1040 IonicContact NZ-OE1 2.88Å; K1037-E1040 PolarHBondContact NZ-OE1 3.38Å; K1037-E1040 IonicContact NZ-OE2 2.75Å; K1037-E1040 PolarHBondContact NZ-OE2 2.67Å; K1037-E1040 WeakPolarHBondContact O-CB 3.38Å; K1037-E1040 PolarHBondContact O-N 2.88Å; K1037-L1045 HydrophobicContact CB-CD2 4.34Å
1038	K	86.3	Confident	82.7	Confident	38 Å²	38	60.3 Å²	60.3	17%	0.165	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.4	-43.5	-179.9	178.8	170.3	177.2	164.9	0	114.1	V1003 K1004 D1026 L1029 L1034 M1035	V1003-K1038 PolarHBondContact N-O 3.11Å; K1004-K1038 HydrophobicContact CB-CG 3.88Å; K1004-K1038 HydrophobicContact CD-CG 4.49Å; K1004-K1038 HydrophobicContact CG-CG 4.22Å; K1004-K1038 PolarHBondContact N-O 3.5Å; D1026-K1038 WeakPolarHBondContact OD1-CE 3.06Å; D1026-K1038 IonicContact OD1-NZ 3.67Å; D1026-K1038 PolarHBondContact OD1-NZ 3.19Å; D1026-K1038 IonicContact OD2-NZ 2.74Å; D1026-K1038 PolarHBondContact OD2-NZ 2.8Å; L1029-K1038 HydrophobicContact CD1-CB 4.25Å; L1029-K1038 HydrophobicContact CD1-CD 3.92Å; L1029-K1038 HydrophobicContact CD1-CG 3.79Å; L1034-K1038 PolarHBondContact O-N 3.45Å; M1035-K1038 HydrophobicContact CE-CD 3.98Å; M1035-K1038 VanDerWaalsContact O-CB 3.27Å; M1035-K1038 WeakPolarHBondContact O-CB 3.26Å; M1035-K1038 PolarHBondContact O-N 2.96Å; M1035-K1038 VanDerWaalsContact O-N 3.13Å; M1035-K1038 HydrophobicContact SD-CD 3.93Å
1039	N	88.9	Confident	82.5	Confident	127 Å²	127	63 Å²	63	68%	0.679	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	8.4	-176.6	-60.3	-15	0	0	0	113.8	T1002 K1037	T1002-N1039 VanDerWaalsContact CG2-O 3.31Å; T1002-N1039 WeakPolarHBondContact CG2-O 3.36Å; K1037-N1039 PolarHBondContact O-N 3.2Å; K1037-N1039 VanDerWaalsContact O-N 3.1Å
1040	E	86.3	Confident	82.3	Confident	65 Å²	65	65 Å²	65	30%	0.304	34%	0.34	S	S	.	.	S	Bend	trans	-92.1	143.8	-177.7	-152.8	152.2	129.1	0	0	111.5	T1002 V1003 K1037 N1044	T1002-E1040 VanDerWaalsContact CA-O 3.29Å; T1002-E1040 WeakPolarHBondContact CA-O 3.5Å; V1003-E1040 WeakPolarHBondContact CG2-O 3.17Å; V1003-E1040 PolarHBondContact N-O 3.42Å; K1037-E1040 HydrophobicContact CB-CB 4.41Å; K1037-E1040 HydrophobicContact CD-CB 4.07Å; K1037-E1040 VanDerWaalsContact CD-CD 3.48Å; K1037-E1040 HydrophobicContact CD-CG 4.34Å; K1037-E1040 WeakPolarHBondContact CD-OE2 3.31Å; K1037-E1040 WeakPolarHBondContact CE-OE2 3.21Å; K1037-E1040 IonicContact NZ-OE1 2.88Å; K1037-E1040 PolarHBondContact NZ-OE1 3.38Å; K1037-E1040 IonicContact NZ-OE2 2.75Å; K1037-E1040 PolarHBondContact NZ-OE2 2.67Å; K1037-E1040 WeakPolarHBondContact O-CB 3.38Å; K1037-E1040 PolarHBondContact O-N 2.88Å; E1040-N1044 HydrophobicContact CG-CB 4.44Å
1041	L	86.6	Confident	82.2	Confident	66 Å²	66	56.9 Å²	56.9	35%	0.346	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-67.5	138	-179	-66.7	171.5	0	0	0	111.5	N1000 T1002 A1043 N1044	N1000-L1041 VanDerWaalsContact O-CD2 3.31Å; N1000-L1041 WeakPolarHBondContact O-CD2 3.32Å; T1002-L1041 HydrophobicContact CG2-CD2 4.23Å; L1041-A1043 PolarHBondContact O-N 3.22Å; L1041-A1043 VanDerWaalsContact O-N 3.1Å; L1041-N1044 PolarHBondContact O-N 3.26Å
1042	A	84.6	Confident	82.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-59.3	-25.6	179.1	0	0	0	0	0	113.4	L997 L1001 H1006 N1044 K1050 L1053	L997-A1042 HydrophobicContact CB-CB 4.43Å; L1001-A1042 PolarHBondContact O-N 3.03Å; H1006-A1042 VanDerWaalsContact CE1-CB 3.48Å; H1006-A1042 WeakPolarHBondContact CE1-CB 3.37Å; A1042-N1044 VanDerWaalsContact C-N 3.29Å; A1042-N1044 PolarHBondContact O-N 2.91Å; A1042-K1050 WeakPolarHBondContact O-CE 3.34Å; A1042-K1050 PolarHBondContact O-NZ 3.12Å; A1042-L1053 HydrophobicContact CB-CD2 4.41Å
1043	A	76.6	Confident	82.7	Confident	43 Å²	43	56 Å²	56	36%	0.355	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-53.5	-43.6	171	0	0	0	0	0	112.9	D999 L1041 K1050	D999-A1043 HydrophobicContact CB-CB 4.06Å; D999-A1043 WeakPolarHBondContact O-CB 3.4Å; D999-A1043 PolarHBondContact O-N 2.61Å; L1041-A1043 PolarHBondContact O-N 3.22Å; L1041-A1043 VanDerWaalsContact O-N 3.1Å; A1043-K1050 PolarHBondContact O-NZ 3.4Å
1044	N	78.4	Confident	83.1	Confident	113 Å²	113	49 Å²	49	60%	0.604	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-85.3	-9.4	-169.8	-66.6	-14.1	0	0	0	114.3	E1040 L1041 A1042	E1040-N1044 HydrophobicContact CG-CB 4.44Å; L1041-N1044 PolarHBondContact O-N 3.26Å; A1042-N1044 VanDerWaalsContact C-N 3.29Å; A1042-N1044 PolarHBondContact O-N 2.91Å
1045	L	78.4	Confident	83.3	Confident	11 Å²	11	48.8 Å²	48.8	6%	0.058	27%	0.27	C	S	.	.	S	Bend	trans	-69.4	147.1	178.5	-64.2	179.4	0	0	0	112.1	V1003 K1037 M1049 K1050 L1053	V1003-L1045 HydrophobicContact CG2-CD1 4.05Å; V1003-L1045 HydrophobicContact CG2-CD2 4.4Å; K1037-L1045 HydrophobicContact CB-CD2 4.34Å; L1045-M1049 HydrophobicContact CB-CB 3.95Å; L1045-M1049 HydrophobicContact CD2-CB 4.24Å; L1045-M1049 HydrophobicContact CD2-SD 4.34Å; L1045-M1049 HydrophobicContact CG-CB 4.49Å; L1045-K1050 HydrophobicContact CB-CG 3.64Å; L1045-K1050 HydrophobicContact CD1-CG 4.44Å; L1045-K1050 WeakPolarHBondContact O-CE 3.24Å; L1045-L1053 HydrophobicContact CD1-CD2 4Å
1046	S	73.9	Confident	83.6	Confident	59 Å²	59	45.6 Å²	45.6	41%	0.413	26%	0.255	S	S	.	.			trans	-66.9	161.4	170.5	77.7	0	0	0	0	111.7	G1048 M1049 K1050	S1046-G1048 VanDerWaalsContact C-N 3.31Å; S1046-G1048 PolarHBondContact O-N 3.26Å; S1046-M1049 PolarHBondContact O-N 2.85Å; S1046-M1049 WeakPolarHBondContact OG-CG 3.3Å; S1046-M1049 PolarHBondContact OG-N 3.19Å; S1046-K1050 WeakPolarHBondContact O-CG 3.3Å; S1046-K1050 PolarHBondContact O-N 3.07Å
1047	G	72.2	Confident	83.9	Confident	51 Å²	51	38 Å²	38	53%	0.526	21%	0.214	S	C	.	.	H	α-helix	trans	-53.9	-44	-179.9	0	0	0	0	0	113.7	K1050 R1051	G1047-K1050 PolarHBondContact O-N 3.04Å; G1047-R1051 PolarHBondContact O-N 2.99Å
1048	G	74.4	Confident	84.1	Confident	4 Å²	4	34.7 Å²	34.7	4%	0.041	20%	0.2	C	C	.	.	H	α-helix	trans	-66.7	-36.4	174.6	0	0	0	0	0	113.6	S1046 R1051 K1052	S1046-G1048 VanDerWaalsContact C-N 3.31Å; S1046-G1048 PolarHBondContact O-N 3.26Å; G1048-R1051 WeakPolarHBondContact O-CB 3.46Å; G1048-R1051 PolarHBondContact O-N 2.74Å; G1048-K1052 WeakPolarHBondContact O-CG 3.32Å; G1048-K1052 PolarHBondContact O-N 2.91Å
1049	M	83	Confident	84.3	Confident	72 Å²	72	33 Å²	33	36%	0.355	19%	0.192	S	C	.	.	H	α-helix	trans	-68.5	-41.6	174.4	-70.8	172.3	177	0	0	112.1	L1034 L1045 S1046 R1051 K1052 L1053	L1034-M1049 HydrophobicContact CD2-CB 4.08Å; L1034-M1049 HydrophobicContact CD2-CG 4.02Å; L1045-M1049 HydrophobicContact CB-CB 3.95Å; L1045-M1049 HydrophobicContact CD2-CB 4.24Å; L1045-M1049 HydrophobicContact CD2-SD 4.34Å; L1045-M1049 HydrophobicContact CG-CB 4.49Å; S1046-M1049 PolarHBondContact O-N 2.85Å; S1046-M1049 WeakPolarHBondContact OG-CG 3.3Å; S1046-M1049 PolarHBondContact OG-N 3.19Å; M1049-R1051 PolarHBondContact O-N 2.74Å; M1049-K1052 PolarHBondContact O-N 2.75Å; M1049-L1053 PolarHBondContact O-N 3.14Å
1050	K	85	Confident	84.3	Confident	43 Å²	43	26.9 Å²	26.9	19%	0.187	16%	0.16	C	C	.	.	H	α-helix	trans	-59.4	-37.1	171.3	-66.4	-169.1	-163.4	-141.8	0	111.1	N995 L997 D999 A1042 A1043 L1045 S1046 G1047 L1053 S1054	N995-K1050 HydrophobicContact CB-CB 4.36Å; L997-K1050 HydrophobicContact CD1-CB 3.77Å; L997-K1050 HydrophobicContact CD1-CD 4.39Å; L997-K1050 HydrophobicContact CD1-CG 4.04Å; D999-K1050 IonicContact OD1-NZ 3.56Å; A1042-K1050 WeakPolarHBondContact O-CE 3.34Å; A1042-K1050 PolarHBondContact O-NZ 3.12Å; A1043-K1050 PolarHBondContact O-NZ 3.4Å; L1045-K1050 HydrophobicContact CB-CG 3.64Å; L1045-K1050 HydrophobicContact CD1-CG 4.44Å; L1045-K1050 WeakPolarHBondContact O-CE 3.24Å; S1046-K1050 WeakPolarHBondContact O-CG 3.3Å; S1046-K1050 PolarHBondContact O-N 3.07Å; G1047-K1050 PolarHBondContact O-N 3.04Å; K1050-L1053 PolarHBondContact O-N 2.95Å; K1050-S1054 WeakPolarHBondContact O-CB 3.33Å; K1050-S1054 PolarHBondContact O-N 3.33Å
1051	R	85.8	Confident	84.1	Confident	6 Å²	6	24.9 Å²	24.9	2%	0.023	16%	0.157	C	C	.	.	H	α-helix	trans	-64.5	-47.9	175.7	-164.5	56.4	164.9	170.9	-0.1	112.1	C991 P992 N995 G1047 G1048 M1049 L1053 S1054 I1055 D1069 E1070 P1071 V1075 I1083	C991-R1051 PolarHBondContact SG-NH1 3.43Å; P992-R1051 PolarHBondContact O-NH1 3Å; P992-R1051 PolarHBondContact O-NH2 2.69Å; N995-R1051 PolarHBondContact ND2-N 3Å; N995-R1051 WeakPolarHBondContact OD1-CD 3.26Å; N995-R1051 PolarHBondContact OD1-NH1 3.23Å; N995-R1051 VanDerWaalsContact OD1-NH1 3.13Å; G1047-R1051 PolarHBondContact O-N 2.99Å; G1048-R1051 WeakPolarHBondContact O-CB 3.46Å; G1048-R1051 PolarHBondContact O-N 2.74Å; M1049-R1051 PolarHBondContact O-N 2.74Å; R1051-L1053 VanDerWaalsContact C-N 3.35Å; R1051-L1053 PolarHBondContact O-N 3.19Å; R1051-S1054 WeakPolarHBondContact O-CB 3.27Å; R1051-S1054 PolarHBondContact O-N 3.2Å; R1051-S1054 VanDerWaalsContact O-N 3.13Å; R1051-I1055 HydrophobicContact CG-CD1 4.29Å; R1051-I1055 WeakPolarHBondContact O-CG1 3.23Å; R1051-I1055 PolarHBondContact O-N 2.92Å; R1051-D1069 PolarHBondContact NH2-O 2.79Å; R1051-E1070 PolarHBondContact NH2-O 3.4Å; R1051-P1071 WeakPolarHBondContact CG-O 3.28Å; R1051-P1071 PolarHBondContact NE-O 3.1Å; R1051-V1075 HydrophobicContact CB-CG2 4.38Å; R1051-V1075 HydrophobicContact CG-CG2 4.08Å; R1051-I1083 HydrophobicContact CG-CD1 4.02Å
1052	K	86.6	Confident	83.8	Confident	28 Å²	28	24 Å²	24	12%	0.122	16%	0.163	C	C	.	.	H	α-helix	trans	-58.9	-42	175.6	-70.8	177.8	178.7	-173	0	112.5	L1034 G1048 M1049 I1055 A1056 I1083	L1034-K1052 HydrophobicContact CD1-CB 4.01Å; G1048-K1052 WeakPolarHBondContact O-CG 3.32Å; G1048-K1052 PolarHBondContact O-N 2.91Å; M1049-K1052 PolarHBondContact O-N 2.75Å; K1052-I1055 PolarHBondContact O-N 3.36Å; K1052-A1056 PolarHBondContact O-N 3.36Å; K1052-I1083 HydrophobicContact CG-CG1 4.14Å
1053	L	90.2	Very high	83.9	Confident	0 Å²	0	24 Å²	24	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-42.6	173.2	177.5	54.4	0	0	0	112.1	L997 V1003 H1006 L1007 L1034 A1042 L1045 M1049 K1050 R1051 I1055 A1056 I1057	L997-L1053 HydrophobicContact CD1-CD2 4.21Å; L997-L1053 HydrophobicContact CD2-CD2 4.02Å; L997-L1053 HydrophobicContact CD2-CG 3.97Å; V1003-L1053 HydrophobicContact CG1-CD1 3.72Å; V1003-L1053 HydrophobicContact CG1-CD2 4.2Å; V1003-L1053 HydrophobicContact CG1-CG 4.45Å; V1003-L1053 HydrophobicContact CG2-CD2 4.49Å; H1006-L1053 HydrophobicContact CB-CD1 4.31Å; L1007-L1053 HydrophobicContact CD2-CD1 4.15Å; L1007-L1053 HydrophobicContact CG-CD1 4.24Å; L1034-L1053 HydrophobicContact CD1-CB 4.17Å; A1042-L1053 HydrophobicContact CB-CD2 4.41Å; L1045-L1053 HydrophobicContact CD1-CD2 4Å; M1049-L1053 PolarHBondContact O-N 3.14Å; K1050-L1053 PolarHBondContact O-N 2.95Å; R1051-L1053 VanDerWaalsContact C-N 3.35Å; R1051-L1053 PolarHBondContact O-N 3.19Å; L1053-I1055 VanDerWaalsContact C-N 3.27Å; L1053-I1055 PolarHBondContact O-N 3.46Å; L1053-A1056 WeakPolarHBondContact O-CB 3.43Å; L1053-A1056 PolarHBondContact O-N 3.37Å; L1053-I1057 HydrophobicContact CD1-CD1 4.1Å; L1053-I1057 HydrophobicContact CD1-CG1 4.27Å; L1053-I1057 HydrophobicContact CG-CD1 4.08Å; L1053-I1057 WeakPolarHBondContact O-CG1 3.39Å; L1053-I1057 PolarHBondContact O-N 2.72Å
1054	S	89.8	Confident	84.4	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-34.4	176.3	-162.9	0	0	0	0	112.6	K1050 R1051 A1058	K1050-S1054 WeakPolarHBondContact O-CB 3.33Å; K1050-S1054 PolarHBondContact O-N 3.33Å; R1051-S1054 WeakPolarHBondContact O-CB 3.27Å; R1051-S1054 PolarHBondContact O-N 3.2Å; R1051-S1054 VanDerWaalsContact O-N 3.13Å; S1054-A1058 PolarHBondContact O-N 2.92Å
1055	I	89.6	Confident	85	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-72.3	-41.8	174.6	-65.2	167.2	0	0	0	110.6	R1051 K1052 L1053 I1057 A1058 F1059 P1071 I1083 L1086 L1087	R1051-I1055 HydrophobicContact CG-CD1 4.29Å; R1051-I1055 WeakPolarHBondContact O-CG1 3.23Å; R1051-I1055 PolarHBondContact O-N 2.92Å; K1052-I1055 PolarHBondContact O-N 3.36Å; L1053-I1055 VanDerWaalsContact C-N 3.27Å; L1053-I1055 PolarHBondContact O-N 3.46Å; I1055-I1057 VanDerWaalsContact C-N 3.28Å; I1055-I1057 PolarHBondContact O-N 3.04Å; I1055-A1058 WeakPolarHBondContact O-CB 3.23Å; I1055-A1058 PolarHBondContact O-N 2.99Å; I1055-F1059 HydrophobicContact CG2-CD2 3.83Å; I1055-F1059 HydrophobicContact CG2-CE2 3.59Å; I1055-F1059 WeakPolarHBondContact O-CD2 3.17Å; I1055-F1059 PolarHBondContact O-N 3.36Å; I1055-P1071 HydrophobicContact CD1-CB 4.17Å; I1055-I1083 HydrophobicContact CD1-CB 4.47Å; I1055-I1083 HydrophobicContact CD1-CD1 4Å; I1055-I1083 HydrophobicContact CD1-CG1 3.99Å; I1055-I1083 HydrophobicContact CD1-CG2 3.66Å; I1055-L1086 HydrophobicContact CG2-CD2 3.52Å; I1055-L1087 HydrophobicContact CG2-CD2 4.3Å
1056	A	90	Very high	85.6	Confident	1 Å²	1	20.6 Å²	20.6	1%	0.008	14%	0.135	C	C	.	.	H	α-helix	trans	-55.9	-42.6	174.6	0	0	0	0	0	112.6	L1007 T1032 K1052 L1053 A1058 F1059 I1060	L1007-A1056 HydrophobicContact CD2-CB 3.82Å; T1032-A1056 HydrophobicContact CG2-CB 3.94Å; K1052-A1056 PolarHBondContact O-N 3.36Å; L1053-A1056 WeakPolarHBondContact O-CB 3.43Å; L1053-A1056 PolarHBondContact O-N 3.37Å; A1056-A1058 VanDerWaalsContact C-N 3.26Å; A1056-A1058 PolarHBondContact O-N 2.94Å; A1056-F1059 PolarHBondContact O-N 2.89Å; A1056-I1060 PolarHBondContact O-N 3.38Å
1057	I	90.7	Very high	86.5	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.4	-28.7	176.1	-67.5	163.2	0	0	0	111.9	F682 M686 L997 H1006 L1007 Y1010 L1053 I1055 I1060	F682-I1057 HydrophobicContact CE1-CG2 3.96Å; F682-I1057 HydrophobicContact CZ-CG2 4.01Å; M686-I1057 HydrophobicContact CE-CG2 4.14Å; L997-I1057 HydrophobicContact CD2-CD1 3.59Å; H1006-I1057 HydrophobicContact CB-CD1 4.25Å; L1007-I1057 HydrophobicContact CD2-CG1 3.96Å; Y1010-I1057 HydrophobicContact CD1-CG2 4.21Å; Y1010-I1057 HydrophobicContact CD2-CB 4.38Å; Y1010-I1057 HydrophobicContact CD2-CD1 4.01Å; Y1010-I1057 HydrophobicContact CD2-CG1 3.95Å; Y1010-I1057 HydrophobicContact CD2-CG2 3.5Å; Y1010-I1057 VanDerWaalsContact CD2-CG2 3.5Å; Y1010-I1057 HydrophobicContact CE2-CD1 4.01Å; Y1010-I1057 HydrophobicContact CE2-CG1 4.44Å; Y1010-I1057 HydrophobicContact CE2-CG2 3.93Å; Y1010-I1057 HydrophobicContact CG-CG2 3.68Å; L1053-I1057 HydrophobicContact CD1-CD1 4.1Å; L1053-I1057 HydrophobicContact CD1-CG1 4.27Å; L1053-I1057 HydrophobicContact CG-CD1 4.08Å; L1053-I1057 WeakPolarHBondContact O-CG1 3.39Å; L1053-I1057 PolarHBondContact O-N 2.72Å; I1055-I1057 VanDerWaalsContact C-N 3.28Å; I1055-I1057 PolarHBondContact O-N 3.04Å; I1057-I1060 WeakPolarHBondContact O-CG2 3.33Å
1058	A	89.9	Confident	87.5	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-72.5	-38.2	175.4	0	0	0	0	0	112.3	G989 C991 S1054 I1055 A1056 A1063 V1066 L1068	G989-A1058 VanDerWaalsContact CA-O 3.23Å; G989-A1058 WeakPolarHBondContact CA-O 3.31Å; C991-A1058 HydrophobicContact CB-CB 4.26Å; S1054-A1058 PolarHBondContact O-N 2.92Å; I1055-A1058 WeakPolarHBondContact O-CB 3.23Å; I1055-A1058 PolarHBondContact O-N 2.99Å; A1056-A1058 VanDerWaalsContact C-N 3.26Å; A1056-A1058 PolarHBondContact O-N 2.94Å; A1058-A1063 WeakPolarHBondContact O-CB 3.23Å; A1058-V1066 HydrophobicContact CB-CG1 4.08Å; A1058-L1068 HydrophobicContact CB-CD2 4.46Å
1059	F	89.3	Confident	88.1	Confident	2 Å²	2	15.5 Å²	15.5	1%	0.009	9%	0.089	C	C	.	.	H	α-helix	trans	-79	-23.8	-177.7	-77.7	-72.7	0	0	0	115.1	L1028 I1055 A1056 V1066 L1086 L1087 C1090 R1094 I1096	L1028-F1059 HydrophobicContact CD2-CB 4.15Å; I1055-F1059 HydrophobicContact CG2-CD2 3.83Å; I1055-F1059 HydrophobicContact CG2-CE2 3.59Å; I1055-F1059 WeakPolarHBondContact O-CD2 3.17Å; I1055-F1059 PolarHBondContact O-N 3.36Å; A1056-F1059 PolarHBondContact O-N 2.89Å; F1059-V1066 HydrophobicContact CD1-CG1 4.46Å; F1059-V1066 HydrophobicContact CD1-CG2 3.88Å; F1059-V1066 HydrophobicContact CE1-CB 4.26Å; F1059-V1066 HydrophobicContact CE1-CG1 4.1Å; F1059-V1066 HydrophobicContact CE1-CG2 3.86Å; F1059-V1066 HydrophobicContact CE2-CG1 4.46Å; F1059-V1066 HydrophobicContact CZ-CG1 4.1Å; F1059-L1086 HydrophobicContact CD2-CD2 4.33Å; F1059-L1086 HydrophobicContact CE2-CD2 4.07Å; F1059-L1087 HydrophobicContact CE2-CD2 3.68Å; F1059-L1087 HydrophobicContact CZ-CD2 3.69Å; F1059-C1090 HydrophobicContact CD1-CB 3.82Å; F1059-C1090 HydrophobicContact CE1-CB 3.46Å; F1059-C1090 VanDerWaalsContact CE1-CB 3.46Å; F1059-C1090 HydrophobicContact CE2-CB 4.27Å; F1059-C1090 HydrophobicContact CG-CB 4.38Å; F1059-C1090 HydrophobicContact CZ-CB 3.72Å; F1059-R1094 PolarHBondContact O-NH1 3.16Å; F1059-I1096 HydrophobicContact CE1-CD1 3.93Å; F1059-I1096 HydrophobicContact CZ-CD1 4.07Å
1060	I	88.7	Confident	88.1	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	149.3	-173.9	-155.6	158	0	0	0	113.3	L1007 K1014 I1025 L1028 A1056 I1057	L1007-I1060 HydrophobicContact CB-CD1 3.74Å; L1007-I1060 HydrophobicContact CD2-CD1 4.02Å; L1007-I1060 HydrophobicContact CG-CD1 4.47Å; L1007-I1060 WeakPolarHBondContact O-CD1 3.21Å; K1014-I1060 HydrophobicContact CD-CG2 4.49Å; K1014-I1060 WeakPolarHBondContact CD-O 3.39Å; K1014-I1060 PolarHBondContact NZ-O 3.48Å; I1025-I1060 HydrophobicContact CG1-CD1 3.95Å; L1028-I1060 HydrophobicContact CD1-CB 3.99Å; L1028-I1060 HydrophobicContact CD1-CD1 4.16Å; L1028-I1060 HydrophobicContact CD1-CG1 3.91Å; A1056-I1060 PolarHBondContact O-N 3.38Å; I1057-I1060 WeakPolarHBondContact O-CG2 3.33Å
1061	G	81.5	Confident	88	Confident	23 Å²	23	10.3 Å²	10.3	24%	0.237	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	69	36.4	-178.2	0	0	0	0	0	113	E1024 A1063	E1024-G1061 PolarHBondContact OE1-N 2.83Å; G1061-A1063 VanDerWaalsContact C-N 3.29Å; G1061-A1063 PolarHBondContact O-N 2.75Å
1062	G	81	Confident	87.7	Confident	46 Å²	46	10 Å²	10	47%	0.474	6%	0.064	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	35.8	174.3	0	0	0	0	0	114.9	E1024 K1064	E1024-G1062 PolarHBondContact OE1-N 3.34Å; G1062-K1064 PolarHBondContact O-N 3.19Å
1063	A	86.6	Confident	86.9	Confident	1 Å²	1	10 Å²	10	1%	0.008	7%	0.069	C	C	.	.			trans	-54.6	111.7	-177.8	0	0	0	0	0	112.5	A1058 G1061 I1065 V1066 R1094	A1058-A1063 WeakPolarHBondContact O-CB 3.23Å; G1061-A1063 VanDerWaalsContact C-N 3.29Å; G1061-A1063 PolarHBondContact O-N 2.75Å; A1063-I1065 VanDerWaalsContact C-N 3.34Å; A1063-V1066 HydrophobicContact CB-CG2 4.02Å; A1063-R1094 VanDerWaalsContact O-CD 3.25Å; A1063-R1094 WeakPolarHBondContact O-CD 3.26Å; A1063-R1094 WeakPolarHBondContact O-CG 3.32Å; A1063-R1094 PolarHBondContact O-NH1 3.17Å
1064	K	87.2	Confident	85.5	Confident	95 Å²	95	13.6 Å²	13.6	41%	0.413	11%	0.106	S	C	.	.	S	Bend	trans	-70.1	-27.1	177.4	-88.5	-158.4	162.5	-128.7	0	113.7	D938 Y973 S987 G1062 R1094 T1095	D938-K1064 IonicContact OD2-NZ 3.06Å; Y973-K1064 HydrophobicContact CE2-CB 4.3Å; Y973-K1064 HydrophobicContact CE2-CD 4.43Å; S987-K1064 PolarHBondContact O-N 3.47Å; G1062-K1064 PolarHBondContact O-N 3.19Å; K1064-R1094 WeakPolarHBondContact O-CA 3.44Å; K1064-T1095 PolarHBondContact O-N 2.63Å
1065	I	90.2	Very high	84.6	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	126.4	175.2	-70.2	160.8	0	0	0	108	I909 I972 Y973 S987 L988 G989 A1063 I1067 T1095	I909-I1065 HydrophobicContact CD1-CD1 3.99Å; I909-I1065 HydrophobicContact CD1-CG1 4.25Å; I909-I1065 HydrophobicContact CD1-CG2 3.57Å; I909-I1065 HydrophobicContact CG1-CD1 3.79Å; I909-I1065 HydrophobicContact CG1-CG1 4.27Å; I909-I1065 HydrophobicContact CG1-CG2 4.47Å; I972-I1065 HydrophobicContact CG2-CD1 3.31Å; Y973-I1065 HydrophobicContact CD2-CD1 3.85Å; Y973-I1065 HydrophobicContact CE2-CD1 3.56Å; Y973-I1065 HydrophobicContact CE2-CG1 3.83Å; S987-I1065 PolarHBondContact O-N 3.49Å; L988-I1065 CarbonylContact C-O 3.48Å; L988-I1065 HydrophobicContact CD1-CB 4.2Å; L988-I1065 HydrophobicContact CD1-CG2 3.64Å; G989-I1065 PolarHBondContact N-O 2.97Å; A1063-I1065 VanDerWaalsContact C-N 3.34Å; I1065-I1067 HydrophobicContact CG2-CD1 4.35Å; I1065-I1067 HydrophobicContact CG2-CG1 4.08Å; I1065-T1095 WeakPolarHBondContact CA-O 3.36Å
1066	V	92.6	Very high	83.6	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.2	177.8	-175.3	0	0	0	0	109.7	G989 A1058 F1059 A1063 L1068 T1095 I1096 I1097	G989-V1066 WeakPolarHBondContact O-CA 3.18Å; A1058-V1066 HydrophobicContact CB-CG1 4.08Å; F1059-V1066 HydrophobicContact CD1-CG1 4.46Å; F1059-V1066 HydrophobicContact CD1-CG2 3.88Å; F1059-V1066 HydrophobicContact CE1-CB 4.26Å; F1059-V1066 HydrophobicContact CE1-CG1 4.1Å; F1059-V1066 HydrophobicContact CE1-CG2 3.86Å; F1059-V1066 HydrophobicContact CE2-CG1 4.46Å; F1059-V1066 HydrophobicContact CZ-CG1 4.1Å; A1063-V1066 HydrophobicContact CB-CG2 4.02Å; V1066-L1068 HydrophobicContact CG1-CD2 3.81Å; V1066-L1068 HydrophobicContact CG1-CG 4.08Å; V1066-T1095 PolarHBondContact N-O 3.24Å; V1066-I1096 HydrophobicContact CB-CG1 4.34Å; V1066-I1096 CarbonylContact O-C 3.56Å; V1066-I1096 WeakPolarHBondContact O-CA 3.43Å; V1066-I1097 PolarHBondContact O-N 2.92Å
1067	I	92.8	Very high	82.6	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123	-179.3	-60	179	0	0	0	108.7	M956 I959 L988 G989 F990 C991 I1065 I1097	M956-I1067 HydrophobicContact CB-CG2 4.05Å; M956-I1067 HydrophobicContact CE-CG2 3.8Å; M956-I1067 HydrophobicContact CG-CG2 3.84Å; M956-I1067 HydrophobicContact SD-CG2 3.73Å; I959-I1067 HydrophobicContact CB-CD1 4.06Å; I959-I1067 HydrophobicContact CG2-CD1 3.48Å; I959-I1067 VanDerWaalsContact CG2-CD1 3.48Å; L988-I1067 HydrophobicContact CD1-CD1 4.07Å; G989-I1067 PolarHBondContact O-N 2.77Å; F990-I1067 CarbonylContact C-O 3.55Å; F990-I1067 WeakPolarHBondContact CA-O 3.42Å; F990-I1067 HydrophobicContact CD2-CB 3.99Å; F990-I1067 HydrophobicContact CD2-CG2 3.9Å; F990-I1067 WeakPolarHBondContact CD2-O 3.24Å; F990-I1067 HydrophobicContact CE2-CG2 4.11Å; C991-I1067 PolarHBondContact N-O 3.32Å; I1065-I1067 HydrophobicContact CG2-CD1 4.35Å; I1065-I1067 HydrophobicContact CG2-CG1 4.08Å; I1067-I1097 CarbonylContact C-O 3.53Å; I1067-I1097 WeakPolarHBondContact CA-O 3.44Å; I1067-I1097 HydrophobicContact CG1-CB 4.34Å; I1067-I1097 HydrophobicContact CG1-CD1 4.41Å
1068	L	91.7	Very high	81.7	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	105.4	-174.3	-56.4	173.5	0	0	0	109.2	C991 A1058 V1066 E1070 P1071 L1087 I1096 I1097 S1099	C991-L1068 HydrophobicContact CB-CD2 3.49Å; C991-L1068 VanDerWaalsContact CB-CD2 3.49Å; A1058-L1068 HydrophobicContact CB-CD2 4.46Å; V1066-L1068 HydrophobicContact CG1-CD2 3.81Å; V1066-L1068 HydrophobicContact CG1-CG 4.08Å; L1068-E1070 PolarHBondContact O-N 3.41Å; L1068-P1071 HydrophobicContact CB-CB 4.32Å; L1068-P1071 HydrophobicContact CB-CG 4.09Å; L1068-L1087 HydrophobicContact CD1-CD1 3.85Å; L1068-L1087 HydrophobicContact CD1-CD2 3.35Å; L1068-L1087 HydrophobicContact CD1-CG 4.25Å; L1068-I1096 HydrophobicContact CD1-CG2 4.03Å; L1068-I1097 PolarHBondContact N-O 3.07Å; L1068-S1099 PolarHBondContact O-N 3.1Å
1069	D	87.7	Confident	80.8	Confident	6 Å²	6	21.3 Å²	21.3	3%	0.032	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	104.2	179.1	-167.8	41.1	0	0	0	109.8	T953 M956 F990 C991 Q993 R1051 S1099	T953-D1069 WeakPolarHBondContact CG2-OD2 3.47Å; T953-D1069 PolarHBondContact OG1-OD1 2.62Å; T953-D1069 VanDerWaalsContact OG1-OD1 3.04Å; M956-D1069 HydrophobicContact SD-CB 3.91Å; F990-D1069 HydrophobicContact CE2-CB 4.32Å; C991-D1069 PolarHBondContact O-N 3.07Å; Q993-D1069 WeakPolarHBondContact CA-O 3.46Å; R1051-D1069 PolarHBondContact NH2-O 2.79Å; D1069-S1099 VanDerWaalsContact CA-OG 3.28Å; D1069-S1099 WeakPolarHBondContact CA-OG 3.25Å; D1069-S1099 PolarHBondContact OD1-OG 2.98Å
1070	E	83	Confident	80.2	Confident	6 Å²	6	23 Å²	23	3%	0.028	15%	0.151	C	C	.	.	S	Bend	trans	45.7	63.9	-175.8	-55.4	-166.5	149.3	0	0	114	Q993 R1051 L1068 T1072 A1073 S1099 H1101	Q993-E1070 HydrophobicContact CG-CB 4.44Å; Q993-E1070 PolarHBondContact NE2-OE2 3.12Å; R1051-E1070 PolarHBondContact NH2-O 3.4Å; L1068-E1070 PolarHBondContact O-N 3.41Å; E1070-T1072 PolarHBondContact O-N 2.91Å; E1070-A1073 HydrophobicContact CB-CB 3.87Å; E1070-A1073 PolarHBondContact O-N 3.27Å; E1070-S1099 VanDerWaalsContact CA-O 3.28Å; E1070-S1099 WeakPolarHBondContact CA-O 3.06Å; E1070-S1099 PolarHBondContact N-O 3.26Å; E1070-S1099 PolarHBondContact N-OG 3.45Å; E1070-H1101 VanDerWaalsContact CD-ND1 3.33Å; E1070-H1101 IonicContact OE1-CE1 3.25Å; E1070-H1101 IonicContact OE1-CG 3.7Å; E1070-H1101 IonicContact OE1-ND1 2.96Å; E1070-H1101 PolarHBondContact OE1-ND1 3.32Å; E1070-H1101 IonicContact OE2-CE1 2.74Å; E1070-H1101 IonicContact OE2-ND1 2.65Å
1071	P	82.5	Confident	79.5	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.9	-171.8	22.8	-32.3	0	0	0	114.7	R1051 I1055 L1068 I1083 L1087 L1098	R1051-P1071 WeakPolarHBondContact CG-O 3.28Å; R1051-P1071 PolarHBondContact NE-O 3.1Å; I1055-P1071 HydrophobicContact CD1-CB 4.17Å; L1068-P1071 HydrophobicContact CB-CB 4.32Å; L1068-P1071 HydrophobicContact CB-CG 4.09Å; P1071-I1083 HydrophobicContact CB-CG2 4.46Å; P1071-L1087 HydrophobicContact CG-CD1 4.48Å; P1071-L1098 HydrophobicContact CG-CD1 3.25Å
1072	T	79.8	Confident	79.3	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.006	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.2	4.2	-172.8	59.7	0	0	0	0	114.4	E1070 G1074 V1075 R1080 I1083 E1105	E1070-T1072 PolarHBondContact O-N 2.91Å; T1072-G1074 PolarHBondContact O-N 3.1Å; T1072-V1075 WeakPolarHBondContact O-CB 3.4Å; T1072-V1075 PolarHBondContact O-N 3.48Å; T1072-V1075 VanDerWaalsContact O-N 3.17Å; T1072-R1080 HydrophobicContact CG2-CB 4.44Å; T1072-R1080 HydrophobicContact CG2-CG 3.83Å; T1072-I1083 HydrophobicContact CG2-CB 4.16Å; T1072-I1083 HydrophobicContact CG2-CD1 4.24Å; T1072-I1083 HydrophobicContact CG2-CG2 3.87Å; T1072-E1105 WeakPolarHBondContact CB-OE1 3.49Å; T1072-E1105 WeakPolarHBondContact CG2-OE1 3.2Å; T1072-E1105 PolarHBondContact OG1-OE1 3.44Å; T1072-E1105 PolarHBondContact OG1-OE2 2.82Å
1073	A	69.3	Low	79.4	Confident	28 Å²	28	22.3 Å²	22.3	23%	0.231	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	131	175.1	0	0	0	0	0	111.7	E1070 V1075	E1070-A1073 HydrophobicContact CB-CB 3.87Å; E1070-A1073 PolarHBondContact O-N 3.27Å; A1073-V1075 PolarHBondContact O-N 2.99Å
1074	G	62.1	Low	79.2	Confident	75 Å²	75	23.2 Å²	23.2	77%	0.773	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.2	8.4	-176.8	0	0	0	0	0	114.9	T1072	T1072-G1074 PolarHBondContact O-N 3.1Å
1075	V	71.2	Confident	78.8	Confident	11 Å²	11	21.4 Å²	21.4	7%	0.067	13%	0.128	C	C	.	.			trans	-98.2	136.8	177	-174.7	0	0	0	0	109.6	R1051 T1072 A1073 R1080 I1083	R1051-V1075 HydrophobicContact CB-CG2 4.38Å; R1051-V1075 HydrophobicContact CG-CG2 4.08Å; T1072-V1075 WeakPolarHBondContact O-CB 3.4Å; T1072-V1075 PolarHBondContact O-N 3.48Å; T1072-V1075 VanDerWaalsContact O-N 3.17Å; A1073-V1075 PolarHBondContact O-N 2.99Å; V1075-R1080 PolarHBondContact O-NH2 3.4Å; V1075-I1083 HydrophobicContact CG1-CD1 4.32Å
1076	D	69	Low	78.5	Confident	26 Å²	26	22 Å²	22	14%	0.139	13%	0.131	C	C	.	.			trans	-60.9	152	176.4	50.7	-85	0	0	0	112.4	Y1078 S1079 R1080 N2026	D1076-Y1078 VanDerWaalsContact C-N 3.26Å; D1076-Y1078 PolarHBondContact O-N 3.21Å; D1076-Y1078 VanDerWaalsContact O-N 3.15Å; D1076-S1079 PolarHBondContact O-N 3.21Å; D1076-S1079 VanDerWaalsContact O-N 3.11Å; D1076-S1079 PolarHBondContact OD1-OG 3.35Å; D1076-S1079 WeakPolarHBondContact OD2-CB 3.43Å; D1076-S1079 PolarHBondContact OD2-N 3.15Å; D1076-S1079 PolarHBondContact OD2-OG 2.7Å; D1076-R1080 WeakPolarHBondContact O-CB 3.48Å; D1076-R1080 PolarHBondContact O-N 2.96Å; D1076-N2026 PolarHBondContact OD1-ND2 3.06Å
1077	P	68.4	Low	78.2	Confident	24 Å²	24	22.1 Å²	22.1	16%	0.156	13%	0.132	C	C	.	.	H	α-helix	trans	-53.5	-37.8	-175.9	-29.5	35.7	0	0	0	114.5	R1080 R1081 F2284 V2285	P1077-R1080 WeakPolarHBondContact O-CB 3.18Å; P1077-R1080 PolarHBondContact O-N 3.06Å; P1077-R1081 PolarHBondContact O-N 3.21Å; P1077-R1081 VanDerWaalsContact O-N 3.08Å; P1077-F2284 HydrophobicContact CG-CD1 4.32Å; P1077-F2284 HydrophobicContact CG-CE1 4.49Å; P1077-V2285 HydrophobicContact CB-CG2 3.9Å
1078	Y	70.6	Confident	77.7	Confident	87 Å²	87	23 Å²	23	34%	0.341	14%	0.137	S	C	.	.	H	α-helix	trans	-65.2	-50.7	177	175.1	-98.1	0	0	0	112.1	D1076 R1080 R1081 A1082 Q2289	D1076-Y1078 VanDerWaalsContact C-N 3.26Å; D1076-Y1078 PolarHBondContact O-N 3.21Å; D1076-Y1078 VanDerWaalsContact O-N 3.15Å; Y1078-R1080 VanDerWaalsContact C-N 3.26Å; Y1078-R1080 PolarHBondContact O-N 3.26Å; Y1078-R1081 PolarHBondContact O-N 2.77Å; Y1078-A1082 PolarHBondContact O-N 3.12Å; Y1078-Q2289 HydrophobicContact CD2-CG 4.03Å; Y1078-Q2289 HydrophobicContact CE2-CG 3.83Å
1079	S	72	Confident	77.2	Confident	16 Å²	16	28.6 Å²	28.6	11%	0.112	16%	0.161	C	C	.	.	H	α-helix	trans	-67.7	-27	177.8	-62.4	0	0	0	0	112.6	D1076 I1083	D1076-S1079 PolarHBondContact O-N 3.21Å; D1076-S1079 VanDerWaalsContact O-N 3.11Å; D1076-S1079 PolarHBondContact OD1-OG 3.35Å; D1076-S1079 WeakPolarHBondContact OD2-CB 3.43Å; D1076-S1079 PolarHBondContact OD2-N 3.15Å; D1076-S1079 PolarHBondContact OD2-OG 2.7Å; S1079-I1083 WeakPolarHBondContact O-CG1 3.47Å; S1079-I1083 PolarHBondContact O-N 3.28Å
1080	R	76.7	Confident	76.9	Confident	37 Å²	37	29.1 Å²	29.1	14%	0.14	17%	0.165	C	C	.	.	H	α-helix	trans	-64.1	-53.3	172	177.5	177.6	-46.3	163.9	12.6	111.7	T1072 V1075 D1076 P1077 Y1078 A1082 I1083 W1084	T1072-R1080 HydrophobicContact CG2-CB 4.44Å; T1072-R1080 HydrophobicContact CG2-CG 3.83Å; V1075-R1080 PolarHBondContact O-NH2 3.4Å; D1076-R1080 WeakPolarHBondContact O-CB 3.48Å; D1076-R1080 PolarHBondContact O-N 2.96Å; P1077-R1080 WeakPolarHBondContact O-CB 3.18Å; P1077-R1080 PolarHBondContact O-N 3.06Å; Y1078-R1080 VanDerWaalsContact C-N 3.26Å; Y1078-R1080 PolarHBondContact O-N 3.26Å; R1080-A1082 VanDerWaalsContact C-N 3.27Å; R1080-A1082 PolarHBondContact O-N 3.04Å; R1080-I1083 WeakPolarHBondContact O-CA 3.41Å; R1080-I1083 WeakPolarHBondContact O-CB 3.48Å; R1080-I1083 PolarHBondContact O-N 2.79Å; R1080-W1084 HydrophobicContact CG-CD2 4.33Å; R1080-W1084 HydrophobicContact CG-CH2 4.44Å; R1080-W1084 HydrophobicContact CG-CZ2 3.67Å; R1080-W1084 PolarHBondContact O-N 3.32Å; R1080-W1084 VanDerWaalsContact O-N 3.09Å
1081	R	74.1	Confident	76.9	Confident	35 Å²	35	31 Å²	31	13%	0.132	17%	0.173	C	C	.	.	H	α-helix	trans	-56.9	-41.8	176.8	-68.6	-175.5	-170.4	179.2	2.5	111.8	P1077 Y1078 I1083 W1084 D1085 E2237 D2282	P1077-R1081 PolarHBondContact O-N 3.21Å; P1077-R1081 VanDerWaalsContact O-N 3.08Å; Y1078-R1081 PolarHBondContact O-N 2.77Å; R1081-I1083 PolarHBondContact O-N 3.33Å; R1081-W1084 HydrophobicContact CG-CE3 4.26Å; R1081-W1084 HydrophobicContact CG-CZ3 4.41Å; R1081-W1084 WeakPolarHBondContact O-CB 3.23Å; R1081-W1084 PolarHBondContact O-N 3.15Å; R1081-D1085 PolarHBondContact O-N 2.94Å; R1081-D1085 VanDerWaalsContact O-N 3.07Å; R1081-E2237 VanDerWaalsContact CD-OE1 3.25Å; R1081-E2237 WeakPolarHBondContact CD-OE1 3.38Å; R1081-E2237 IonicContact CZ-OE1 2.93Å; R1081-E2237 IonicContact CZ-OE2 3.43Å; R1081-E2237 IonicContact NE-OE1 2.66Å; R1081-E2237 IonicContact NH1-OE1 2.79Å; R1081-E2237 PolarHBondContact NH1-OE1 3.47Å; R1081-E2237 IonicContact NH1-OE2 3.09Å; R1081-E2237 PolarHBondContact NH1-OE2 3.05Å; R1081-E2237 VanDerWaalsContact NH1-OE2 3.09Å; R1081-D2282 IonicContact CZ-OD1 2.66Å; R1081-D2282 IonicContact NH1-OD1 2.76Å; R1081-D2282 PolarHBondContact NH1-OD1 3.39Å; R1081-D2282 IonicContact NH2-OD1 3.31Å; R1081-D2282 PolarHBondContact NH2-OD1 2.83Å
1082	A	76.5	Confident	76.8	Confident	16 Å²	16	38.7 Å²	38.7	13%	0.132	21%	0.209	C	C	.	.	H	α-helix	trans	-66.8	-17.4	175.9	0	0	0	0	0	115	Y1078 R1080	Y1078-A1082 PolarHBondContact O-N 3.12Å; R1080-A1082 VanDerWaalsContact C-N 3.27Å; R1080-A1082 PolarHBondContact O-N 3.04Å
1083	I	83.5	Confident	77	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.015	24%	0.242	C	C	.	.	H	α-helix	trans	-81.9	-40.4	169.1	-73	165.6	0	0	0	109.8	R1051 K1052 I1055 P1071 T1072 V1075 S1079 R1080 R1081 D1085 L1086 L1087	R1051-I1083 HydrophobicContact CG-CD1 4.02Å; K1052-I1083 HydrophobicContact CG-CG1 4.14Å; I1055-I1083 HydrophobicContact CD1-CB 4.47Å; I1055-I1083 HydrophobicContact CD1-CD1 4Å; I1055-I1083 HydrophobicContact CD1-CG1 3.99Å; I1055-I1083 HydrophobicContact CD1-CG2 3.66Å; P1071-I1083 HydrophobicContact CB-CG2 4.46Å; T1072-I1083 HydrophobicContact CG2-CB 4.16Å; T1072-I1083 HydrophobicContact CG2-CD1 4.24Å; T1072-I1083 HydrophobicContact CG2-CG2 3.87Å; V1075-I1083 HydrophobicContact CG1-CD1 4.32Å; S1079-I1083 WeakPolarHBondContact O-CG1 3.47Å; S1079-I1083 PolarHBondContact O-N 3.28Å; R1080-I1083 WeakPolarHBondContact O-CA 3.41Å; R1080-I1083 WeakPolarHBondContact O-CB 3.48Å; R1080-I1083 PolarHBondContact O-N 2.79Å; R1081-I1083 PolarHBondContact O-N 3.33Å; I1083-D1085 PolarHBondContact O-N 2.79Å; I1083-L1086 WeakPolarHBondContact O-CB 3.19Å; I1083-L1086 PolarHBondContact O-N 3.18Å; I1083-L1086 VanDerWaalsContact O-N 3.16Å; I1083-L1087 HydrophobicContact CG2-CD1 4.08Å; I1083-L1087 HydrophobicContact CG2-CG 4.27Å; I1083-L1087 WeakPolarHBondContact O-CG 3.4Å; I1083-L1087 PolarHBondContact O-N 3.01Å
1084	W	83.4	Confident	77.9	Confident	20 Å²	20	45.6 Å²	45.6	8%	0.076	24%	0.239	C	C	.	.	H	α-helix	trans	-59.2	-46.3	178.1	-62.3	-9.6	0	0	0	112.4	R1080 R1081 L1086 L1087 L1088 E1105 I1108 L1109	R1080-W1084 HydrophobicContact CG-CD2 4.33Å; R1080-W1084 HydrophobicContact CG-CH2 4.44Å; R1080-W1084 HydrophobicContact CG-CZ2 3.67Å; R1080-W1084 PolarHBondContact O-N 3.32Å; R1080-W1084 VanDerWaalsContact O-N 3.09Å; R1081-W1084 HydrophobicContact CG-CE3 4.26Å; R1081-W1084 HydrophobicContact CG-CZ3 4.41Å; R1081-W1084 WeakPolarHBondContact O-CB 3.23Å; R1081-W1084 PolarHBondContact O-N 3.15Å; W1084-L1086 PolarHBondContact O-N 2.78Å; W1084-L1087 PolarHBondContact O-N 2.61Å; W1084-L1088 WeakPolarHBondContact O-CG 3.36Å; W1084-L1088 PolarHBondContact O-N 3.35Å; W1084-E1105 HydrophobicContact CZ2-CB 3.77Å; W1084-E1105 HydrophobicContact CZ2-CG 4.06Å; W1084-E1105 PolarHBondContact NE1-OE1 3.16Å; W1084-I1108 HydrophobicContact CE3-CD1 4.11Å; W1084-I1108 HydrophobicContact CE3-CG2 4.32Å; W1084-I1108 HydrophobicContact CH2-CD1 3.98Å; W1084-I1108 HydrophobicContact CZ3-CD1 3.49Å; W1084-I1108 VanDerWaalsContact CZ3-CD1 3.49Å; W1084-L1109 HydrophobicContact CB-CD2 3.92Å; W1084-L1109 HydrophobicContact CG-CD1 4.28Å; W1084-L1109 HydrophobicContact CG-CD2 4.24Å; W1084-L1109 HydrophobicContact CG-CG 4.4Å
1085	D	78.4	Confident	79.3	Confident	58 Å²	58	42 Å²	42	31%	0.31	20%	0.202	S	C	.	.	H	α-helix	trans	-53.5	-42.8	174.3	-67.2	-30.6	0	0	0	112.3	R1081 I1083 K1089 H2239	R1081-D1085 PolarHBondContact O-N 2.94Å; R1081-D1085 VanDerWaalsContact O-N 3.07Å; I1083-D1085 PolarHBondContact O-N 2.79Å; D1085-K1089 WeakPolarHBondContact O-CB 3.49Å; D1085-K1089 PolarHBondContact O-N 2.62Å; D1085-H2239 IonicContact OD1-CE1 3.01Å; D1085-H2239 PolarHBondContact OD1-CE1 2.98Å; D1085-H2239 VanDerWaalsContact OD1-CE1 3.31Å; D1085-H2239 IonicContact OD1-ND1 3.85Å; D1085-H2239 PolarHBondContact OD1-ND1 3.33Å
1086	L	82.9	Confident	80.3	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-68.4	-41.4	-179.5	-175	121.4	0	0	0	111.8	D1031 T1032 I1055 F1059 I1083 W1084 K1089 C1090	D1031-L1086 HydrophobicContact CB-CD1 4.11Å; T1032-L1086 HydrophobicContact CG2-CD1 3.5Å; T1032-L1086 VanDerWaalsContact CG2-CD1 3.5Å; I1055-L1086 HydrophobicContact CG2-CD2 3.52Å; F1059-L1086 HydrophobicContact CD2-CD2 4.33Å; F1059-L1086 HydrophobicContact CE2-CD2 4.07Å; I1083-L1086 WeakPolarHBondContact O-CB 3.19Å; I1083-L1086 PolarHBondContact O-N 3.18Å; I1083-L1086 VanDerWaalsContact O-N 3.16Å; W1084-L1086 PolarHBondContact O-N 2.78Å; L1086-K1089 PolarHBondContact O-N 3.26Å; L1086-C1090 WeakPolarHBondContact O-CB 3.47Å; L1086-C1090 PolarHBondContact O-N 3.03Å; L1086-C1090 PolarHBondContact O-SG 3.33Å
1087	L	87.2	Confident	81.4	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-43	179.2	-65.3	-177.7	0	0	0	112.1	I1055 F1059 L1068 P1071 I1083 W1084 C1090 K1091 L1109	I1055-L1087 HydrophobicContact CG2-CD2 4.3Å; F1059-L1087 HydrophobicContact CE2-CD2 3.68Å; F1059-L1087 HydrophobicContact CZ-CD2 3.69Å; L1068-L1087 HydrophobicContact CD1-CD1 3.85Å; L1068-L1087 HydrophobicContact CD1-CD2 3.35Å; L1068-L1087 HydrophobicContact CD1-CG 4.25Å; P1071-L1087 HydrophobicContact CG-CD1 4.48Å; I1083-L1087 HydrophobicContact CG2-CD1 4.08Å; I1083-L1087 HydrophobicContact CG2-CG 4.27Å; I1083-L1087 WeakPolarHBondContact O-CG 3.4Å; I1083-L1087 PolarHBondContact O-N 3.01Å; W1084-L1087 PolarHBondContact O-N 2.61Å; L1087-C1090 PolarHBondContact O-N 2.83Å; L1087-K1091 PolarHBondContact O-N 2.81Å; L1087-L1109 HydrophobicContact CB-CD2 4.32Å; L1087-L1109 HydrophobicContact CD1-CD1 3.78Å
1088	L	81.8	Confident	82.5	Confident	20 Å²	20	39.2 Å²	39.2	11%	0.105	19%	0.185	C	C	.	.	H	α-helix	trans	-63.8	-40.6	175	-68.4	170.9	0	0	0	111.5	I941 W1084 K1091 L1109 L2240	I941-L1088 HydrophobicContact CD1-CD2 4.37Å; W1084-L1088 WeakPolarHBondContact O-CG 3.36Å; W1084-L1088 PolarHBondContact O-N 3.35Å; L1088-K1091 WeakPolarHBondContact O-CB 3.5Å; L1088-L1109 HydrophobicContact CD1-CD2 4.24Å; L1088-L1109 HydrophobicContact CD2-CD2 4.05Å; L1088-L1109 HydrophobicContact CG-CD2 3.77Å; L1088-L2240 HydrophobicContact CB-CD1 3.86Å
1089	K	80.5	Confident	83.4	Confident	116 Å²	116	35.1 Å²	35.1	50%	0.504	17%	0.169	S	C	.	.	H	α-helix	trans	-66.4	-36.5	176.5	-166.9	-177	-178.2	-166.1	0	113	D1031 D1085 L1086 K1091	D1031-K1089 IonicContact OD1-NZ 2.64Å; D1031-K1089 PolarHBondContact OD1-NZ 3.31Å; D1031-K1089 IonicContact OD2-NZ 2.87Å; D1031-K1089 PolarHBondContact OD2-NZ 3Å; D1085-K1089 WeakPolarHBondContact O-CB 3.49Å; D1085-K1089 PolarHBondContact O-N 2.62Å; L1086-K1089 PolarHBondContact O-N 3.26Å; K1089-K1091 VanDerWaalsContact C-N 3.35Å; K1089-K1091 PolarHBondContact O-N 3.31Å
1090	C	81.8	Confident	83.9	Confident	17 Å²	17	34.4 Å²	34.4	12%	0.115	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	7.4	-176.9	-61.9	0	0	0	0	114.7	F1059 L1086 L1087 R1094	F1059-C1090 HydrophobicContact CD1-CB 3.82Å; F1059-C1090 HydrophobicContact CE1-CB 3.46Å; F1059-C1090 VanDerWaalsContact CE1-CB 3.46Å; F1059-C1090 HydrophobicContact CE2-CB 4.27Å; F1059-C1090 HydrophobicContact CG-CB 4.38Å; F1059-C1090 HydrophobicContact CZ-CB 3.72Å; L1086-C1090 WeakPolarHBondContact O-CB 3.47Å; L1086-C1090 PolarHBondContact O-N 3.03Å; L1086-C1090 PolarHBondContact O-SG 3.33Å; L1087-C1090 PolarHBondContact O-N 2.83Å; C1090-R1094 WeakPolarHBondContact O-CD 3.47Å
1091	K	84	Confident	83.6	Confident	45 Å²	45	33 Å²	33	20%	0.196	16%	0.159	C	C	.	.			trans	-69	-34.4	-174.8	169.2	179.7	161.7	177	0	115.4	G939 I941 L1087 L1088 K1089 D1093 R1094 D1111	G939-K1091 WeakPolarHBondContact O-CE 3.29Å; I941-K1091 HydrophobicContact CD1-CB 4.35Å; I941-K1091 HydrophobicContact CD1-CD 4.29Å; I941-K1091 HydrophobicContact CD1-CG 4.49Å; I941-K1091 HydrophobicContact CG1-CB 4.43Å; I941-K1091 HydrophobicContact CG1-CD 4.19Å; I941-K1091 HydrophobicContact CG1-CG 4.18Å; L1087-K1091 PolarHBondContact O-N 2.81Å; L1088-K1091 WeakPolarHBondContact O-CB 3.5Å; K1089-K1091 VanDerWaalsContact C-N 3.35Å; K1089-K1091 PolarHBondContact O-N 3.31Å; K1091-D1093 PolarHBondContact O-N 3.3Å; K1091-R1094 PolarHBondContact O-N 3.43Å; K1091-D1111 WeakPolarHBondContact CE-OD2 3.31Å; K1091-D1111 IonicContact NZ-OD1 3.91Å; K1091-D1111 PolarHBondContact NZ-OD1 3.16Å; K1091-D1111 IonicContact NZ-OD2 2.59Å; K1091-D1111 PolarHBondContact NZ-OD2 3.05Å
1092	Q	80	Confident	83.5	Confident	162 Å²	162	32.6 Å²	32.6	76%	0.757	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	135.2	-170.6	-69.8	180	-12.4	0	0	111.9	R1094	Q1092-R1094 PolarHBondContact O-N 2.76Å
1093	D	83.3	Confident	83.4	Confident	130 Å²	130	32.8 Å²	32.8	70%	0.695	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	32.1	-178.1	-60	-15.7	0	0	0	115.8	K1091	K1091-D1093 PolarHBondContact O-N 3.3Å
1094	R	88.3	Confident	82.8	Confident	45 Å²	45	36 Å²	36	17%	0.17	17%	0.173	C	C	.	.			trans	-136	140.7	176.9	-58.8	-179	-165	-128.9	12.6	112.7	D938 G939 Q940 F1059 A1063 K1064 C1090 K1091 Q1092 I1096	D938-R1094 PolarHBondContact OD1-N 3.32Å; G939-R1094 WeakPolarHBondContact CA-O 3.45Å; G939-R1094 PolarHBondContact N-O 3.34Å; Q940-R1094 PolarHBondContact N-O 3Å; F1059-R1094 PolarHBondContact O-NH1 3.16Å; A1063-R1094 VanDerWaalsContact O-CD 3.25Å; A1063-R1094 WeakPolarHBondContact O-CD 3.26Å; A1063-R1094 WeakPolarHBondContact O-CG 3.32Å; A1063-R1094 PolarHBondContact O-NH1 3.17Å; K1064-R1094 WeakPolarHBondContact O-CA 3.44Å; C1090-R1094 WeakPolarHBondContact O-CD 3.47Å; K1091-R1094 PolarHBondContact O-N 3.43Å; Q1092-R1094 PolarHBondContact O-N 2.76Å; R1094-I1096 HydrophobicContact CB-CG1 4.2Å
1095	T	91.5	Very high	82.5	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	111.8	162.9	-59.9	0	0	0	0	108.9	F936 Y937 D938 K1064 I1065 V1066 I1097	F936-T1095 HydrophobicContact CB-CG2 3.8Å; Y937-T1095 WeakPolarHBondContact O-CB 3.5Å; Y937-T1095 WeakPolarHBondContact O-CG2 3.41Å; Y937-T1095 PolarHBondContact O-OG1 3.17Å; D938-T1095 WeakPolarHBondContact CA-OG1 3.47Å; K1064-T1095 PolarHBondContact O-N 2.63Å; I1065-T1095 WeakPolarHBondContact CA-O 3.36Å; V1066-T1095 PolarHBondContact N-O 3.24Å; T1095-I1097 HydrophobicContact CG2-CG1 4.5Å
1096	I	92.3	Very high	82.6	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.5	177.8	-54.8	-175.1	0	0	0	109.5	Q940 I941 T942 F1059 V1066 L1068 R1094	Q940-I1096 PolarHBondContact O-N 2.87Å; I941-I1096 CarbonylContact C-O 3.58Å; I941-I1096 WeakPolarHBondContact CA-O 3.23Å; I941-I1096 HydrophobicContact CB-CB 4.44Å; I941-I1096 HydrophobicContact CG1-CB 4.06Å; I941-I1096 HydrophobicContact CG1-CD1 4.22Å; I941-I1096 HydrophobicContact CG1-CG2 4.49Å; I941-I1096 HydrophobicContact CG2-CB 4.43Å; I941-I1096 HydrophobicContact CG2-CG2 4.29Å; T942-I1096 PolarHBondContact N-O 2.88Å; F1059-I1096 HydrophobicContact CE1-CD1 3.93Å; F1059-I1096 HydrophobicContact CZ-CD1 4.07Å; V1066-I1096 HydrophobicContact CB-CG1 4.34Å; V1066-I1096 CarbonylContact O-C 3.56Å; V1066-I1096 WeakPolarHBondContact O-CA 3.43Å; L1068-I1096 HydrophobicContact CD1-CG2 4.03Å; R1094-I1096 HydrophobicContact CB-CG1 4.2Å
1097	I	92.9	Very high	82.2	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	117.1	173.4	-49.7	-179.7	0	0	0	108.7	I909 F936 V944 M956 I959 V1066 I1067 L1068 T1095	I909-I1097 HydrophobicContact CD1-CD1 3.61Å; F936-I1097 HydrophobicContact CB-CD1 4.29Å; F936-I1097 HydrophobicContact CD1-CD1 3.61Å; F936-I1097 HydrophobicContact CD1-CG1 3.66Å; F936-I1097 HydrophobicContact CD1-CG2 4.3Å; F936-I1097 HydrophobicContact CD2-CD1 3.75Å; F936-I1097 HydrophobicContact CE1-CB 4.44Å; F936-I1097 HydrophobicContact CE1-CD1 3.73Å; F936-I1097 HydrophobicContact CE1-CG1 3.91Å; F936-I1097 HydrophobicContact CE1-CG2 3.71Å; F936-I1097 HydrophobicContact CE2-CD1 3.83Å; F936-I1097 HydrophobicContact CG-CD1 3.61Å; F936-I1097 HydrophobicContact CG-CG1 4.05Å; F936-I1097 HydrophobicContact CZ-CD1 3.82Å; F936-I1097 HydrophobicContact CZ-CG1 4.49Å; F936-I1097 HydrophobicContact CZ-CG2 4.17Å; V944-I1097 HydrophobicContact CG2-CG2 3.72Å; M956-I1097 HydrophobicContact CE-CB 4.27Å; M956-I1097 HydrophobicContact CE-CG2 3.61Å; I959-I1097 HydrophobicContact CD1-CD1 4.36Å; V1066-I1097 PolarHBondContact O-N 2.92Å; I1067-I1097 CarbonylContact C-O 3.53Å; I1067-I1097 WeakPolarHBondContact CA-O 3.44Å; I1067-I1097 HydrophobicContact CG1-CB 4.34Å; I1067-I1097 HydrophobicContact CG1-CD1 4.41Å; L1068-I1097 PolarHBondContact N-O 3.07Å; T1095-I1097 HydrophobicContact CG2-CG1 4.5Å
1098	L	91.5	Very high	81.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.4	-179.8	165.3	66.9	0	0	0	108.7	I941 T942 A943 V944 P1071 T1100 E1105 L1109	I941-L1098 HydrophobicContact CG2-CB 4.39Å; T942-L1098 PolarHBondContact O-N 3.09Å; A943-L1098 CarbonylContact C-O 3.58Å; A943-L1098 WeakPolarHBondContact CA-O 3.33Å; A943-L1098 HydrophobicContact CB-CD2 4.13Å; V944-L1098 PolarHBondContact N-O 2.89Å; P1071-L1098 HydrophobicContact CG-CD1 3.25Å; L1098-T1100 HydrophobicContact CD2-CG2 4.32Å; L1098-T1100 HydrophobicContact CG-CG2 4.34Å; L1098-E1105 HydrophobicContact CD2-CG 4.26Å; L1098-L1109 HydrophobicContact CD2-CB 3.98Å; L1098-L1109 HydrophobicContact CD2-CD1 3.73Å
1099	S	88.7	Confident	81.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133	160.6	76.6	0	0	0	0	108.2	L1068 D1069 E1070	L1068-S1099 PolarHBondContact O-N 3.1Å; D1069-S1099 VanDerWaalsContact CA-OG 3.28Å; D1069-S1099 WeakPolarHBondContact CA-OG 3.25Å; D1069-S1099 PolarHBondContact OD1-OG 2.98Å; E1070-S1099 VanDerWaalsContact CA-O 3.28Å; E1070-S1099 WeakPolarHBondContact CA-O 3.06Å; E1070-S1099 PolarHBondContact N-O 3.26Å; E1070-S1099 PolarHBondContact N-OG 3.45Å
1100	T	82.1	Confident	81.6	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.006	15%	0.145	C	C	.	.			trans	-147.6	159.3	172.1	-174.1	0	0	0	0	111.1	V944 L945 L1098 F1102 E1105 A1106	V944-T1100 PolarHBondContact O-N 2.82Å; L945-T1100 HydrophobicContact CD2-CG2 4.4Å; L1098-T1100 HydrophobicContact CD2-CG2 4.32Å; L1098-T1100 HydrophobicContact CG-CG2 4.34Å; T1100-F1102 WeakPolarHBondContact CG2-O 3.06Å; T1100-F1102 PolarHBondContact OG1-N 3Å; T1100-E1105 WeakPolarHBondContact CB-OE2 3.4Å; T1100-E1105 HydrophobicContact CG2-CB 4.37Å; T1100-E1105 HydrophobicContact CG2-CG 4.39Å; T1100-E1105 PolarHBondContact OG1-OE2 3.27Å; T1100-A1106 HydrophobicContact CG2-CB 3.88Å
1101	H	71.9	Confident	81.6	Confident	8 Å²	8	30.9 Å²	30.9	4%	0.037	15%	0.152	C	C	.	.	S	Bend	trans	-112.8	2.6	169.7	54.6	-102	0	0	0	112	E1070 P2151	E1070-H1101 VanDerWaalsContact CD-ND1 3.33Å; E1070-H1101 IonicContact OE1-CE1 3.25Å; E1070-H1101 IonicContact OE1-CG 3.7Å; E1070-H1101 IonicContact OE1-ND1 2.96Å; E1070-H1101 PolarHBondContact OE1-ND1 3.32Å; E1070-H1101 IonicContact OE2-CE1 2.74Å; E1070-H1101 IonicContact OE2-ND1 2.65Å; H1101-P2151 WeakPolarHBondContact O-CD 3.47Å; H1101-P2151 WeakPolarHBondContact O-CG 3.42Å
1102	F	71.9	Confident	81.7	Confident	26 Å²	26	28.9 Å²	28.9	11%	0.114	14%	0.143	C	C	.	.			trans	-97.7	115.8	174.2	-66	-61.5	0	0	0	108.9	T1100 D1104 E1105 A1106	T1100-F1102 WeakPolarHBondContact CG2-O 3.06Å; T1100-F1102 PolarHBondContact OG1-N 3Å; F1102-D1104 WeakPolarHBondContact CB-OD1 3.34Å; F1102-E1105 HydrophobicContact CB-CB 3.67Å; F1102-E1105 PolarHBondContact O-N 2.94Å; F1102-A1106 PolarHBondContact O-N 2.83Å; F1102-A1106 VanDerWaalsContact O-N 3.13Å
1103	F	73.8	Confident	82	Confident	21 Å²	21	21.2 Å²	21.2	9%	0.092	11%	0.107	C	C	.	.	H	α-helix	trans	-69.6	-37	178.5	-86.4	-91.5	0	0	0	111.5	L945 E1105 A1106 E1107 L1221 E1222 N1225 P2151	L945-F1103 HydrophobicContact CD1-CD1 3.47Å; L945-F1103 VanDerWaalsContact CD1-CD1 3.47Å; L945-F1103 HydrophobicContact CD1-CE1 3.54Å; L945-F1103 HydrophobicContact CD1-CG 4.1Å; L945-F1103 HydrophobicContact CD1-CZ 4.22Å; L945-F1103 HydrophobicContact CD2-CD1 4.22Å; L945-F1103 HydrophobicContact CD2-CD2 4.02Å; L945-F1103 HydrophobicContact CD2-CE1 4.24Å; L945-F1103 HydrophobicContact CD2-CE2 4.03Å; L945-F1103 HydrophobicContact CD2-CG 4.11Å; L945-F1103 HydrophobicContact CD2-CZ 4.14Å; L945-F1103 HydrophobicContact CG-CD1 4.48Å; L945-F1103 HydrophobicContact CG-CE1 4.4Å; F1103-E1105 VanDerWaalsContact C-N 3.32Å; F1103-E1105 PolarHBondContact O-N 3.15Å; F1103-A1106 CarbonylContact O-C 3.38Å; F1103-A1106 PolarHBondContact O-N 3.34Å; F1103-E1107 VanDerWaalsContact O-CB 3.29Å; F1103-E1107 WeakPolarHBondContact O-CB 3.33Å; F1103-E1107 PolarHBondContact O-N 2.8Å; F1103-L1221 HydrophobicContact CD1-CB 4.15Å; F1103-L1221 HydrophobicContact CD1-CD2 3.83Å; F1103-L1221 HydrophobicContact CE1-CD2 3.92Å; F1103-L1221 WeakPolarHBondContact CE1-O 3.37Å; F1103-E1222 HydrophobicContact CB-CB 3.79Å; F1103-E1222 HydrophobicContact CB-CG 4.48Å; F1103-E1222 HydrophobicContact CD1-CB 4.25Å; F1103-E1222 HydrophobicContact CD2-CB 3.71Å; F1103-E1222 HydrophobicContact CD2-CG 3.58Å; F1103-E1222 HydrophobicContact CE2-CB 4.34Å; F1103-E1222 HydrophobicContact CE2-CG 3.98Å; F1103-E1222 HydrophobicContact CG-CB 3.66Å; F1103-E1222 HydrophobicContact CG-CG 4.1Å; F1103-N1225 HydrophobicContact CE1-CB 4.22Å; F1103-N1225 WeakPolarHBondContact CE1-ND2 3.31Å; F1103-N1225 HydrophobicContact CZ-CB 4.22Å; F1103-N1225 WeakPolarHBondContact CZ-ND2 3.38Å; F1103-P2151 HydrophobicContact CD2-CG 4.48Å
1104	D	70.9	Confident	82.2	Confident	69 Å²	69	15 Å²	15	37%	0.369	7%	0.074	S	C	.	.	H	α-helix	trans	-53.9	-44.9	169.6	52	-57.5	0	0	0	112.1	F1102 E1107 I1108	F1102-D1104 WeakPolarHBondContact CB-OD1 3.34Å; D1104-E1107 PolarHBondContact O-N 2.92Å; D1104-I1108 WeakPolarHBondContact O-CB 3.17Å; D1104-I1108 WeakPolarHBondContact O-CD1 3.21Å; D1104-I1108 VanDerWaalsContact O-CG1 3.23Å; D1104-I1108 WeakPolarHBondContact O-CG1 3.05Å; D1104-I1108 PolarHBondContact O-N 3.08Å
1105	E	77	Confident	82	Confident	1 Å²	1	13.1 Å²	13.1	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-65.3	-43.3	174.5	-177.5	167.5	-125.4	0	0	112.2	T1072 W1084 L1098 T1100 F1102 F1103 L1109	T1072-E1105 WeakPolarHBondContact CB-OE1 3.49Å; T1072-E1105 WeakPolarHBondContact CG2-OE1 3.2Å; T1072-E1105 PolarHBondContact OG1-OE1 3.44Å; T1072-E1105 PolarHBondContact OG1-OE2 2.82Å; W1084-E1105 HydrophobicContact CZ2-CB 3.77Å; W1084-E1105 HydrophobicContact CZ2-CG 4.06Å; W1084-E1105 PolarHBondContact NE1-OE1 3.16Å; L1098-E1105 HydrophobicContact CD2-CG 4.26Å; T1100-E1105 WeakPolarHBondContact CB-OE2 3.4Å; T1100-E1105 HydrophobicContact CG2-CB 4.37Å; T1100-E1105 HydrophobicContact CG2-CG 4.39Å; T1100-E1105 PolarHBondContact OG1-OE2 3.27Å; F1102-E1105 HydrophobicContact CB-CB 3.67Å; F1102-E1105 PolarHBondContact O-N 2.94Å; F1103-E1105 VanDerWaalsContact C-N 3.32Å; F1103-E1105 PolarHBondContact O-N 3.15Å; E1105-L1109 HydrophobicContact CG-CD1 3.73Å; E1105-L1109 HydrophobicContact CG-CG 4.38Å; E1105-L1109 VanDerWaalsContact O-CB 3.27Å; E1105-L1109 WeakPolarHBondContact O-CB 3.29Å; E1105-L1109 WeakPolarHBondContact O-CG 3.44Å; E1105-L1109 PolarHBondContact O-N 3.28Å
1106	A	79.5	Confident	81.6	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-67.7	-32.7	178.6	0	0	0	0	0	113.2	A943 L945 T1100 F1102 F1103 G1110 I1113	A943-A1106 HydrophobicContact CB-CB 3.65Å; L945-A1106 HydrophobicContact CD1-CB 3.36Å; L945-A1106 HydrophobicContact CD2-CB 4.42Å; L945-A1106 HydrophobicContact CG-CB 3.83Å; T1100-A1106 HydrophobicContact CG2-CB 3.88Å; F1102-A1106 PolarHBondContact O-N 2.83Å; F1102-A1106 VanDerWaalsContact O-N 3.13Å; F1103-A1106 CarbonylContact O-C 3.38Å; F1103-A1106 PolarHBondContact O-N 3.34Å; A1106-G1110 WeakPolarHBondContact O-CA 3.12Å; A1106-G1110 PolarHBondContact O-N 3.47Å; A1106-I1113 HydrophobicContact CB-CD1 4.37Å; A1106-I1113 HydrophobicContact CB-CG1 4.49Å
1107	E	76.3	Confident	80.7	Confident	34 Å²	34	13.3 Å²	13.3	16%	0.159	7%	0.069	C	C	.	.	H	α-helix	trans	-79.6	-28.8	179.6	-170.4	174.9	152.5	0	0	112.5	F1103 D1104 K1131 L1221 K2210	F1103-E1107 VanDerWaalsContact O-CB 3.29Å; F1103-E1107 WeakPolarHBondContact O-CB 3.33Å; F1103-E1107 PolarHBondContact O-N 2.8Å; D1104-E1107 PolarHBondContact O-N 2.92Å; E1107-K1131 VanDerWaalsContact OE1-CE 3.3Å; E1107-K1131 WeakPolarHBondContact OE1-CE 3.2Å; E1107-K1131 IonicContact OE1-NZ 2.62Å; E1107-K1131 PolarHBondContact OE1-NZ 2.64Å; E1107-K1131 IonicContact OE2-NZ 2.76Å; E1107-L1221 PolarHBondContact OE2-N 3.31Å; E1107-K2210 PolarHBondContact O-NZ 3.36Å
1108	I	75.3	Confident	79.8	Confident	48 Å²	48	19.3 Å²	19.3	25%	0.246	10%	0.095	C	C	.	.	H	α-helix	trans	-81	-45.3	174.2	-68.6	167.9	0	0	0	111.3	W1084 D1104	W1084-I1108 HydrophobicContact CE3-CD1 4.11Å; W1084-I1108 HydrophobicContact CE3-CG2 4.32Å; W1084-I1108 HydrophobicContact CH2-CD1 3.98Å; W1084-I1108 HydrophobicContact CZ3-CD1 3.49Å; W1084-I1108 VanDerWaalsContact CZ3-CD1 3.49Å; D1104-I1108 WeakPolarHBondContact O-CB 3.17Å; D1104-I1108 WeakPolarHBondContact O-CD1 3.21Å; D1104-I1108 VanDerWaalsContact O-CG1 3.23Å; D1104-I1108 WeakPolarHBondContact O-CG1 3.05Å; D1104-I1108 PolarHBondContact O-N 3.08Å
1109	L	79.9	Confident	79	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-92.7	-31.8	-174.4	-63.7	-179	0	0	0	114.5	I941 W1084 L1087 L1088 L1098 E1105 D1111	I941-L1109 VanDerWaalsContact CB-O 3.25Å; I941-L1109 WeakPolarHBondContact CB-O 3.43Å; I941-L1109 WeakPolarHBondContact CD1-O 3.17Å; I941-L1109 HydrophobicContact CG2-CB 4.48Å; I941-L1109 WeakPolarHBondContact CG2-O 3.32Å; W1084-L1109 HydrophobicContact CB-CD2 3.92Å; W1084-L1109 HydrophobicContact CG-CD1 4.28Å; W1084-L1109 HydrophobicContact CG-CD2 4.24Å; W1084-L1109 HydrophobicContact CG-CG 4.4Å; L1087-L1109 HydrophobicContact CB-CD2 4.32Å; L1087-L1109 HydrophobicContact CD1-CD1 3.78Å; L1088-L1109 HydrophobicContact CD1-CD2 4.24Å; L1088-L1109 HydrophobicContact CD2-CD2 4.05Å; L1088-L1109 HydrophobicContact CG-CD2 3.77Å; L1098-L1109 HydrophobicContact CD2-CB 3.98Å; L1098-L1109 HydrophobicContact CD2-CD1 3.73Å; E1105-L1109 HydrophobicContact CG-CD1 3.73Å; E1105-L1109 HydrophobicContact CG-CG 4.38Å; E1105-L1109 VanDerWaalsContact O-CB 3.27Å; E1105-L1109 WeakPolarHBondContact O-CB 3.29Å; E1105-L1109 WeakPolarHBondContact O-CG 3.44Å; E1105-L1109 PolarHBondContact O-N 3.28Å; L1109-D1111 PolarHBondContact O-N 3.5Å
1110	G	80.2	Confident	78.6	Confident	6 Å²	6	22.7 Å²	22.7	6%	0.062	11%	0.111	C	C	.	.			trans	-81.9	113.1	-170.7	0	0	0	0	0	112.9	A1106	A1106-G1110 WeakPolarHBondContact O-CA 3.12Å; A1106-G1110 PolarHBondContact O-N 3.47Å
1111	D	83.2	Confident	78.6	Confident	48 Å²	48	24.3 Å²	24.3	26%	0.257	12%	0.119	S	C	.	.	S	Bend	trans	-63.5	-35.7	162.6	-63.5	-63.8	0	0	0	110.6	Q940 I941 K1091 L1109	Q940-D1111 WeakPolarHBondContact CA-OD2 3.44Å; Q940-D1111 HydrophobicContact CB-CB 4.14Å; Q940-D1111 HydrophobicContact CG-CB 4.17Å; I941-D1111 PolarHBondContact N-OD2 2.98Å; I941-D1111 PolarHBondContact O-N 3.01Å; K1091-D1111 WeakPolarHBondContact CE-OD2 3.31Å; K1091-D1111 IonicContact NZ-OD1 3.91Å; K1091-D1111 PolarHBondContact NZ-OD1 3.16Å; K1091-D1111 IonicContact NZ-OD2 2.59Å; K1091-D1111 PolarHBondContact NZ-OD2 3.05Å; L1109-D1111 PolarHBondContact O-N 3.5Å
1112	R	85.8	Confident	79	Confident	4 Å²	4	28 Å²	28	2%	0.015	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	148.6	169.7	-50.7	-163	94.6	173.9	8.1	110.8	E901 I941 T942 A943 Y1124 G1125	E901-R1112 VanDerWaalsContact CB-NH2 3.29Å; E901-R1112 PolarHBondContact O-NH2 3.17Å; E901-R1112 IonicContact OE2-CZ 3.7Å; E901-R1112 IonicContact OE2-NE 2.74Å; E901-R1112 IonicContact OE2-NH2 3.3Å; E901-R1112 PolarHBondContact OE2-NH2 2.85Å; I941-R1112 PolarHBondContact O-N 3.14Å; T942-R1112 CarbonylContact C-O 3.38Å; T942-R1112 WeakPolarHBondContact CA-O 3.29Å; T942-R1112 HydrophobicContact CG2-CB 4.4Å; A943-R1112 PolarHBondContact N-O 2.83Å; R1112-Y1124 PolarHBondContact NH1-OH 3.02Å; R1112-G1125 CarbonylContact C-O 3.51Å; R1112-G1125 WeakPolarHBondContact CA-O 3.44Å
1113	I	86.6	Confident	79.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.6	-180	-64.1	175.8	0	0	0	108.4	A943 L945 A1106 I1115 Y1124 G1125 A1127 L1130 L1221	A943-I1113 HydrophobicContact CB-CG1 4.43Å; A943-I1113 CarbonylContact O-C 3.56Å; A943-I1113 WeakPolarHBondContact O-CA 3.38Å; L945-I1113 HydrophobicContact CD1-CG2 3.7Å; A1106-I1113 HydrophobicContact CB-CD1 4.37Å; A1106-I1113 HydrophobicContact CB-CG1 4.49Å; I1113-I1115 HydrophobicContact CG2-CD1 4.18Å; I1113-I1115 HydrophobicContact CG2-CG1 4.03Å; I1113-Y1124 WeakPolarHBondContact O-CA 3.48Å; I1113-G1125 PolarHBondContact N-O 3.41Å; I1113-G1125 PolarHBondContact O-N 3.02Å; I1113-A1127 HydrophobicContact CD1-CB 3.96Å; I1113-L1130 HydrophobicContact CB-CD1 3.74Å; I1113-L1130 HydrophobicContact CG2-CD1 3.93Å; I1113-L1221 HydrophobicContact CD1-CD1 3.93Å; I1113-L1221 HydrophobicContact CD1-CD2 3.93Å; I1113-L1221 HydrophobicContact CG2-CD2 4.23Å
1114	A	87	Confident	79.8	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.008	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113.1	177.9	0	0	0	0	0	109.2	T942 A943 V944 L945 L1121 Y1124	T942-A1114 HydrophobicContact CG2-CB 4.4Å; A943-A1114 PolarHBondContact O-N 2.81Å; V944-A1114 CarbonylContact C-O 3.57Å; V944-A1114 WeakPolarHBondContact CA-O 3.47Å; L945-A1114 PolarHBondContact N-O 3.4Å; A1114-L1121 HydrophobicContact CB-CD1 4.18Å; A1114-Y1124 HydrophobicContact CB-CD2 3.81Å; A1114-Y1124 HydrophobicContact CB-CE2 4.37Å
1115	I	84.3	Confident	80.3	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.021	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.2	-177.6	-68.8	152.2	0	0	0	109.4	L945 I1113 K1122 C1123 L1130 L1221 N1225 F1229	L945-I1115 HydrophobicContact CB-CG1 4.03Å; I1113-I1115 HydrophobicContact CG2-CD1 4.18Å; I1113-I1115 HydrophobicContact CG2-CG1 4.03Å; I1115-K1122 PolarHBondContact O-N 2.94Å; I1115-C1123 WeakPolarHBondContact CD1-SG 3.34Å; I1115-C1123 PolarHBondContact N-O 3.4Å; I1115-L1130 HydrophobicContact CD1-CD1 4.35Å; I1115-L1221 HydrophobicContact CD1-CD2 4.39Å; I1115-N1225 WeakPolarHBondContact CD1-ND2 3.4Å; I1115-F1229 HydrophobicContact CG2-CE2 4.46Å
1116	I	82.2	Confident	80.4	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132	-180	-57.6	-179.2	0	0	0	109.8	L932 V944 L945 G946 A950 M955 Q1120 L1121	L932-I1116 HydrophobicContact CD1-CD1 4.33Å; L932-I1116 HydrophobicContact CD2-CD1 4.28Å; V944-I1116 HydrophobicContact CG1-CD1 3.63Å; V944-I1116 HydrophobicContact CG1-CG1 4.22Å; L945-I1116 PolarHBondContact O-N 3.19Å; G946-I1116 WeakPolarHBondContact CA-O 3.21Å; A950-I1116 HydrophobicContact CB-CG2 4.48Å; A950-I1116 WeakPolarHBondContact CB-O 3.39Å; A950-I1116 VanDerWaalsContact O-CG2 3.3Å; A950-I1116 WeakPolarHBondContact O-CG2 3.14Å; M955-I1116 HydrophobicContact SD-CD1 3.93Å; I1116-Q1120 CarbonylContact C-O 3.57Å; I1116-Q1120 WeakPolarHBondContact CA-O 3.47Å; I1116-L1121 HydrophobicContact CG1-CD1 4.24Å
1117	A	74.8	Confident	80.1	Confident	5 Å²	5	24.2 Å²	24.2	4%	0.041	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	129.8	179.7	0	0	0	0	0	111.2	G1119 Q1120 K1122 F1229	A1117-G1119 PolarHBondContact O-N 3.42Å; A1117-G1119 VanDerWaalsContact O-N 3.17Å; A1117-Q1120 PolarHBondContact N-O 3.26Å; A1117-Q1120 PolarHBondContact O-N 2.99Å; A1117-K1122 HydrophobicContact CB-CG 3.67Å; A1117-F1229 HydrophobicContact CB-CE1 4.17Å; A1117-F1229 HydrophobicContact CB-CE2 4.35Å; A1117-F1229 HydrophobicContact CB-CZ 3.49Å; A1117-F1229 VanDerWaalsContact CB-CZ 3.49Å
1118	K	72.6	Confident	79.9	Confident	127 Å²	127	26.1 Å²	26.1	55%	0.552	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	34.6	178.6	-58.1	172.1	-178	165.6	0	113.6
1119	G	75.3	Confident	80	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	-8.3	-179.5	0	0	0	0	0	115.9	S928 L929 D930 A950 A1117	S928-G1119 WeakPolarHBondContact O-CA 3.45Å; L929-G1119 WeakPolarHBondContact CA-O 3.33Å; D930-G1119 PolarHBondContact N-O 3.46Å; A950-G1119 WeakPolarHBondContact O-CA 3.18Å; A950-G1119 PolarHBondContact O-N 3.5Å; A1117-G1119 PolarHBondContact O-N 3.42Å; A1117-G1119 VanDerWaalsContact O-N 3.17Å
1120	Q	80.2	Confident	79.7	Confident	72 Å²	72	26.7 Å²	26.7	34%	0.336	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	149.6	-176.6	-62.4	177.1	-11.9	0	0	111.4	D930 I1116 A1117	D930-Q1120 HydrophobicContact CB-CG 3.92Å; D930-Q1120 PolarHBondContact OD2-NE2 3.34Å; I1116-Q1120 CarbonylContact C-O 3.57Å; I1116-Q1120 WeakPolarHBondContact CA-O 3.47Å; A1117-Q1120 PolarHBondContact N-O 3.26Å; A1117-Q1120 PolarHBondContact O-N 2.99Å
1121	L	82.7	Confident	79.2	Confident	35 Å²	35	27.8 Å²	27.8	18%	0.183	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	142.6	165.9	-168.4	71.1	0	0	0	109.4	L932 N933 V934 A1114 I1116	L932-L1121 HydrophobicContact CD1-CB 3.94Å; N933-L1121 WeakPolarHBondContact O-CD2 3.44Å; V934-L1121 HydrophobicContact CG2-CD1 3.78Å; V934-L1121 HydrophobicContact CG2-CD2 3.81Å; V934-L1121 HydrophobicContact CG2-CG 4.27Å; A1114-L1121 HydrophobicContact CB-CD1 4.18Å; I1116-L1121 HydrophobicContact CG1-CD1 4.24Å
1122	K	79.2	Confident	78.5	Confident	86 Å²	86	33.2 Å²	33.2	37%	0.374	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-37.6	176.1	-65.5	-64.4	160.2	-148.6	0	114	I1115 A1117	I1115-K1122 PolarHBondContact O-N 2.94Å; A1117-K1122 HydrophobicContact CB-CG 3.67Å
1123	C	79	Confident	77.7	Confident	9 Å²	9	38.3 Å²	38.3	6%	0.061	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	148.5	176.6	36.1	0	0	0	0	110.2	I1115 L1130 Y1134	I1115-C1123 WeakPolarHBondContact CD1-SG 3.34Å; I1115-C1123 PolarHBondContact N-O 3.4Å; C1123-L1130 HydrophobicContact CB-CD2 3.86Å; C1123-Y1134 HydrophobicContact CB-CE2 4.3Å; C1123-Y1134 WeakPolarHBondContact CB-OH 3.34Å; C1123-Y1134 PolarHBondContact SG-OH 3.22Å
1124	Y	83.1	Confident	76.8	Confident	3 Å²	3	41.6 Å²	41.6	1%	0.012	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	128.1	-170.6	174.7	-87.3	0	0	0	110.5	H900 V934 D935 Y937 T942 R1112 I1113 A1114	H900-Y1124 AromaticContact CE1-CD1 3.95Å; H900-Y1124 AromaticContact ND1-CD1 3.25Å; H900-Y1124 WeakPolarHBondContact ND1-CD1 3.41Å; H900-Y1124 AromaticContact ND1-CE1 3.8Å; H900-Y1124 AromaticContact ND1-CG 3.9Å; V934-Y1124 HydrophobicContact CG1-CE2 4.13Å; D935-Y1124 PolarHBondContact O-OH 2.98Å; Y937-Y1124 VanDerWaalsContact CE2-OH 3.27Å; Y937-Y1124 WeakPolarHBondContact CE2-OH 3.28Å; T942-Y1124 HydrophobicContact CG2-CE2 4.45Å; R1112-Y1124 PolarHBondContact NH1-OH 3.02Å; I1113-Y1124 WeakPolarHBondContact O-CA 3.48Å; A1114-Y1124 HydrophobicContact CB-CD2 3.81Å; A1114-Y1124 HydrophobicContact CB-CE2 4.37Å
1125	G	81.8	Confident	75.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161	-174.2	177.2	0	0	0	0	0	112.4	R1112 I1113	R1112-G1125 CarbonylContact C-O 3.51Å; R1112-G1125 WeakPolarHBondContact CA-O 3.44Å; I1113-G1125 PolarHBondContact N-O 3.41Å; I1113-G1125 PolarHBondContact O-N 3.02Å
1126	S	78.8	Confident	74.2	Confident	21 Å²	21	53.4 Å²	53.4	15%	0.147	24%	0.239	C	C	.	.			trans	-62	154.6	171.9	65.4	0	0	0	0	112.1	E901 I1128 F1129 L1130	E901-S1126 PolarHBondContact OE1-OG 3.47Å; E901-S1126 PolarHBondContact OE2-N 3.47Å; S1126-I1128 PolarHBondContact O-N 3.42Å; S1126-F1129 PolarHBondContact O-N 3.21Å; S1126-F1129 VanDerWaalsContact O-N 3.16Å; S1126-F1129 WeakPolarHBondContact OG-CB 3.07Å; S1126-F1129 PolarHBondContact OG-N 3.01Å; S1126-F1129 VanDerWaalsContact OG-N 3.14Å; S1126-L1130 WeakPolarHBondContact O-CG 3.03Å; S1126-L1130 PolarHBondContact O-N 3.42Å
1127	A	74.1	Confident	73.5	Confident	4 Å²	4	53.7 Å²	53.7	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-56.9	-39.7	176.4	0	0	0	0	0	111.6	I1113 L1130 K1131 L1221	I1113-A1127 HydrophobicContact CD1-CB 3.96Å; A1127-L1130 PolarHBondContact O-N 2.82Å; A1127-K1131 WeakPolarHBondContact O-CB 3.45Å; A1127-K1131 WeakPolarHBondContact O-CG 3.32Å; A1127-K1131 PolarHBondContact O-N 3.4Å; A1127-L1221 HydrophobicContact CB-CD1 4.04Å
1128	I	72.2	Confident	73.3	Confident	74 Å²	74	54.6 Å²	54.6	38%	0.379	24%	0.244	S	C	.	.	H	α-helix	trans	-59.8	-51.3	174.4	-62.3	162.9	0	0	0	111.2	S1126 L1130 K1131 H1132 L2212 E2271	S1126-I1128 PolarHBondContact O-N 3.42Å; I1128-L1130 VanDerWaalsContact C-N 3.33Å; I1128-L1130 PolarHBondContact O-N 2.69Å; I1128-K1131 PolarHBondContact O-N 2.96Å; I1128-H1132 WeakPolarHBondContact O-CB 3.48Å; I1128-H1132 PolarHBondContact O-N 3.32Å; I1128-L2212 HydrophobicContact CD1-CD1 3.65Å; I1128-L2212 HydrophobicContact CD1-CG 4.28Å; I1128-E2271 HydrophobicContact CD1-CB 4.34Å; I1128-E2271 HydrophobicContact CD1-CG 3.77Å; I1128-E2271 HydrophobicContact CG1-CG 3.72Å
1129	F	76.3	Confident	73.4	Confident	57 Å²	57	48.6 Å²	48.6	25%	0.25	22%	0.218	C	C	.	.	H	α-helix	trans	-56.2	-47.6	178.9	171.8	-100	0	0	0	111.2	E901 S1126 H1132 Y1133	E901-F1129 HydrophobicContact CB-CD1 4.43Å; E901-F1129 HydrophobicContact CB-CD2 4.23Å; E901-F1129 HydrophobicContact CB-CE2 4.33Å; E901-F1129 HydrophobicContact CB-CG 4.29Å; E901-F1129 HydrophobicContact CB-CZ 4.47Å; S1126-F1129 PolarHBondContact O-N 3.21Å; S1126-F1129 VanDerWaalsContact O-N 3.16Å; S1126-F1129 WeakPolarHBondContact OG-CB 3.07Å; S1126-F1129 PolarHBondContact OG-N 3.01Å; S1126-F1129 VanDerWaalsContact OG-N 3.14Å; F1129-H1132 PolarHBondContact O-N 2.71Å; F1129-Y1133 HydrophobicContact CZ-CD2 4.42Å; F1129-Y1133 VanDerWaalsContact O-CB 3.22Å; F1129-Y1133 WeakPolarHBondContact O-CB 3.38Å; F1129-Y1133 PolarHBondContact O-N 3.23Å
1130	L	73.6	Confident	73.5	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-63.7	-45.6	178.5	-65.8	173.6	0	0	0	112.3	I1113 I1115 C1123 S1126 A1127 I1128 H1132 Y1133 Y1134 L1221	I1113-L1130 HydrophobicContact CB-CD1 3.74Å; I1113-L1130 HydrophobicContact CG2-CD1 3.93Å; I1115-L1130 HydrophobicContact CD1-CD1 4.35Å; C1123-L1130 HydrophobicContact CB-CD2 3.86Å; S1126-L1130 WeakPolarHBondContact O-CG 3.03Å; S1126-L1130 PolarHBondContact O-N 3.42Å; A1127-L1130 PolarHBondContact O-N 2.82Å; I1128-L1130 VanDerWaalsContact C-N 3.33Å; I1128-L1130 PolarHBondContact O-N 2.69Å; L1130-H1132 VanDerWaalsContact C-N 3.31Å; L1130-H1132 PolarHBondContact O-N 3.09Å; L1130-Y1133 PolarHBondContact O-N 3.14Å; L1130-Y1134 HydrophobicContact CD2-CE2 4.3Å; L1130-Y1134 VanDerWaalsContact O-CD2 3.3Å; L1130-Y1134 WeakPolarHBondContact O-CD2 3.16Å; L1130-Y1134 PolarHBondContact O-N 3.5Å; L1130-L1221 HydrophobicContact CB-CD1 4.22Å; L1130-L1221 HydrophobicContact CD1-CD2 4.39Å
1131	K	70.2	Confident	73.2	Confident	29 Å²	29	46.3 Å²	46.3	13%	0.126	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-40.4	176.8	-74.9	-166.4	-178.2	-167.2	0	112.5	E1107 A1127 I1128 R1135 C1136 S1219 L1221	E1107-K1131 VanDerWaalsContact OE1-CE 3.3Å; E1107-K1131 WeakPolarHBondContact OE1-CE 3.2Å; E1107-K1131 IonicContact OE1-NZ 2.62Å; E1107-K1131 PolarHBondContact OE1-NZ 2.64Å; E1107-K1131 IonicContact OE2-NZ 2.76Å; A1127-K1131 WeakPolarHBondContact O-CB 3.45Å; A1127-K1131 WeakPolarHBondContact O-CG 3.32Å; A1127-K1131 PolarHBondContact O-N 3.4Å; I1128-K1131 PolarHBondContact O-N 2.96Å; K1131-R1135 PolarHBondContact O-N 2.86Å; K1131-C1136 VanDerWaalsContact CA-SG 3.58Å; K1131-C1136 HydrophobicContact CB-CB 4.26Å; K1131-C1136 WeakPolarHBondContact CB-SG 3.38Å; K1131-C1136 VanDerWaalsContact CG-SG 3.54Å; K1131-C1136 WeakPolarHBondContact O-CB 3.47Å; K1131-C1136 PolarHBondContact O-N 3.29Å; K1131-C1136 PolarHBondContact O-SG 3.06Å; K1131-S1219 PolarHBondContact NZ-O 2.74Å; K1131-L1221 HydrophobicContact CG-CD1 4.05Å
1132	H	69.8	Low	72.9	Confident	162 Å²	162	44.7 Å²	44.7	75%	0.75	20%	0.201	S	C	*	.	H	α-helix	trans	-72	-42.8	179.1	-157.2	55.1	0	0	0	111.6	I1128 F1129 L1130 Y1134 R1135	I1128-H1132 WeakPolarHBondContact O-CB 3.48Å; I1128-H1132 PolarHBondContact O-N 3.32Å; F1129-H1132 PolarHBondContact O-N 2.71Å; L1130-H1132 VanDerWaalsContact C-N 3.31Å; L1130-H1132 PolarHBondContact O-N 3.09Å; H1132-Y1134 PolarHBondContact O-N 3.28Å; H1132-R1135 PolarHBondContact O-N 3.38Å
1133	Y	68.1	Low	72.4	Confident	112 Å²	112	40.9 Å²	40.9	44%	0.439	18%	0.184	S	C	.	.	H	α-helix	trans	-60.4	-43.1	178.4	-167.8	-99.2	0	0	0	112.6	H899 F1129 L1130 R1135	H899-Y1133 PolarHBondContact CE1-OH 2.87Å; H899-Y1133 AromaticContact ND1-CZ 3.99Å; H899-Y1133 PolarHBondContact ND1-OH 3.48Å; H899-Y1133 VanDerWaalsContact ND1-OH 3.11Å; F1129-Y1133 HydrophobicContact CZ-CD2 4.42Å; F1129-Y1133 VanDerWaalsContact O-CB 3.22Å; F1129-Y1133 WeakPolarHBondContact O-CB 3.38Å; F1129-Y1133 PolarHBondContact O-N 3.23Å; L1130-Y1133 PolarHBondContact O-N 3.14Å; Y1133-R1135 VanDerWaalsContact C-N 3.32Å; Y1133-R1135 PolarHBondContact O-N 3.1Å
1134	Y	67.6	Low	71.9	Confident	69 Å²	69	41.1 Å²	41.1	27%	0.271	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	10.5	178.5	-67.8	-65.7	0	0	0	114.8	C1123 L1130 H1132 A1228	C1123-Y1134 HydrophobicContact CB-CE2 4.3Å; C1123-Y1134 WeakPolarHBondContact CB-OH 3.34Å; C1123-Y1134 PolarHBondContact SG-OH 3.22Å; L1130-Y1134 HydrophobicContact CD2-CE2 4.3Å; L1130-Y1134 VanDerWaalsContact O-CD2 3.3Å; L1130-Y1134 WeakPolarHBondContact O-CD2 3.16Å; L1130-Y1134 PolarHBondContact O-N 3.5Å; H1132-Y1134 PolarHBondContact O-N 3.28Å; Y1134-A1228 HydrophobicContact CD1-CB 3.86Å; Y1134-A1228 HydrophobicContact CE1-CB 3.61Å
1135	R	55.7	Low	70.8	Confident	225 Å²	225	44.8 Å²	44.8	85%	0.849	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	56.8	177.1	-59.9	-176.3	176.2	-171.2	-1.4	114.2	K1131 H1132 Y1133	K1131-R1135 PolarHBondContact O-N 2.86Å; H1132-R1135 PolarHBondContact O-N 3.38Å; Y1133-R1135 VanDerWaalsContact C-N 3.32Å; Y1133-R1135 PolarHBondContact O-N 3.1Å
1136	C	60.7	Low	69.5	Low	28 Å²	28	47.7 Å²	47.7	19%	0.189	23%	0.228	C	C	.	.			trans	-48.6	140.6	172.9	-85.2	0	0	0	0	114	K1131 G1189 S1219 T1224	K1131-C1136 VanDerWaalsContact CA-SG 3.58Å; K1131-C1136 HydrophobicContact CB-CB 4.26Å; K1131-C1136 WeakPolarHBondContact CB-SG 3.38Å; K1131-C1136 VanDerWaalsContact CG-SG 3.54Å; K1131-C1136 WeakPolarHBondContact O-CB 3.47Å; K1131-C1136 PolarHBondContact O-N 3.29Å; K1131-C1136 PolarHBondContact O-SG 3.06Å; C1136-G1189 WeakPolarHBondContact O-CA 3.49Å; C1136-S1219 WeakPolarHBondContact CB-OG 3.29Å; C1136-T1224 HydrophobicContact CB-CG2 4.45Å; C1136-T1224 WeakPolarHBondContact SG-CG2 3.39Å
1137	G	68.1	Low	68.1	Low	6 Å²	6	56.1 Å²	56.1	6%	0.062	27%	0.265	C	S	.	.			trans	-111.2	-172.2	172.9	0	0	0	0	0	113.5	L1187 S1219	G1137-L1187 CarbonylContact C-O 3.55Å; G1137-L1187 WeakPolarHBondContact CA-O 3.16Å; G1137-S1219 PolarHBondContact N-OG 3.38Å; G1137-S1219 VanDerWaalsContact O-CB 3.26Å; G1137-S1219 WeakPolarHBondContact O-CB 3.18Å; G1137-S1219 PolarHBondContact O-N 3.37Å; G1137-S1219 PolarHBondContact O-OG 2.74Å
1138	Y	71.3	Confident	66.7	Low	24 Å²	24	61.5 Å²	61.5	9%	0.094	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	138.1	166.7	-69.1	-83	0	0	0	109.9	L1187 K1190 L1192 L1195 S1217 E1218 K2265	Y1138-L1187 PolarHBondContact N-O 2.81Å; Y1138-L1187 VanDerWaalsContact O-CB 3.3Å; Y1138-L1187 WeakPolarHBondContact O-CB 3.22Å; Y1138-L1187 PolarHBondContact O-N 3.14Å; Y1138-K1190 WeakPolarHBondContact CE2-O 3.37Å; Y1138-L1192 HydrophobicContact CD1-CD1 4.01Å; Y1138-L1192 HydrophobicContact CD2-CD1 4.43Å; Y1138-L1192 HydrophobicContact CE1-CD1 3.44Å; Y1138-L1192 VanDerWaalsContact CE1-CD1 3.44Å; Y1138-L1192 HydrophobicContact CE2-CD1 3.92Å; Y1138-L1192 HydrophobicContact CG-CD1 4.48Å; Y1138-L1195 HydrophobicContact CD2-CD1 3.7Å; Y1138-L1195 HydrophobicContact CE2-CD1 4.39Å; Y1138-L1195 HydrophobicContact CG-CD1 4.07Å; Y1138-S1217 CarbonylContact C-O 3.31Å; Y1138-S1217 WeakPolarHBondContact CA-O 3.28Å; Y1138-E1218 HydrophobicContact CD1-CB 4.33Å; Y1138-E1218 HydrophobicContact CD1-CG 4.27Å; Y1138-E1218 HydrophobicContact CE1-CB 4.19Å; Y1138-E1218 HydrophobicContact CE1-CG 3.81Å; Y1138-K2265 PolarHBondContact OH-NZ 3.47Å
1139	N	72.9	Confident	65.2	Low	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.8	172.4	-70.8	-20.9	0	0	0	110	Q1184 F1185 L1216 S1217 E1223	N1139-Q1184 HydrophobicContact CB-CG 4.45Å; N1139-Q1184 PolarHBondContact ND2-NE2 3.36Å; N1139-Q1184 VanDerWaalsContact ND2-NE2 3.14Å; N1139-F1185 CarbonylContact C-O 3.53Å; N1139-F1185 VanDerWaalsContact CA-O 3.27Å; N1139-F1185 WeakPolarHBondContact CA-O 3.29Å; N1139-L1216 CarbonylContact O-C 3.55Å; N1139-L1216 WeakPolarHBondContact O-CA 3.09Å; N1139-S1217 WeakPolarHBondContact CB-OG 3.11Å; N1139-S1217 PolarHBondContact N-O 3.11Å; N1139-S1217 PolarHBondContact O-N 3.13Å; N1139-E1223 PolarHBondContact ND2-OE1 2.79Å; N1139-E1223 PolarHBondContact ND2-OE2 2.84Å
1140	L	77.7	Confident	63.7	Low	1 Å²	1	65.2 Å²	65.2	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	108.6	175.7	-178.2	73.3	0	0	0	108.3	F1142 Q1184 F1185 L1187 I1202 Y1214 G1215 L1216	L1140-F1142 HydrophobicContact CD2-CE2 3.5Å; L1140-F1142 HydrophobicContact CD2-CZ 3.89Å; L1140-F1142 HydrophobicContact CG-CD2 4.32Å; L1140-F1142 HydrophobicContact CG-CE2 3.71Å; L1140-F1142 HydrophobicContact CG-CZ 4.28Å; L1140-Q1184 WeakPolarHBondContact O-CA 3.43Å; L1140-F1185 HydrophobicContact CB-CB 4.45Å; L1140-F1185 PolarHBondContact N-O 2.81Å; L1140-F1185 PolarHBondContact O-N 3.44Å; L1140-L1187 HydrophobicContact CB-CD1 3.89Å; L1140-I1202 HydrophobicContact CD1-CD1 4.45Å; L1140-I1202 HydrophobicContact CD2-CD1 3.79Å; L1140-Y1214 HydrophobicContact CD1-CD2 4.48Å; L1140-G1215 WeakPolarHBondContact CA-O 3.46Å; L1140-L1216 HydrophobicContact CB-CD1 4.29Å; L1140-L1216 HydrophobicContact CD1-CD1 3.8Å
1141	T	74.4	Confident	62.4	Low	24 Å²	24	70.9 Å²	70.9	15%	0.147	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	141.6	176.3	42.6	0	0	0	0	111.2	E1182 I1183 Q1184 Y1214 G1215	T1141-E1182 WeakPolarHBondContact CB-OE1 3.45Å; T1141-E1182 WeakPolarHBondContact CG2-OE1 3.27Å; T1141-I1183 CarbonylContact C-O 3.59Å; T1141-I1183 WeakPolarHBondContact CA-O 3.35Å; T1141-Q1184 HydrophobicContact CG2-CB 3.93Å; T1141-Q1184 HydrophobicContact CG2-CG 3.65Å; T1141-Y1214 CarbonylContact O-C 3.59Å; T1141-Y1214 WeakPolarHBondContact O-CA 3.48Å; T1141-Y1214 VanDerWaalsContact O-CB 3.26Å; T1141-Y1214 WeakPolarHBondContact O-CB 3.49Å; T1141-G1215 PolarHBondContact N-O 3.34Å; T1141-G1215 PolarHBondContact O-N 2.76Å
1142	F	76.9	Confident	61.3	Low	1 Å²	1	75.7 Å²	75.7	0%	0.004	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.2	175.8	-74.6	-91.7	0	0	0	110.4	L1140 L1162 V1166 E1182 I1183 F1185 I1202 L1206 C1211	L1140-F1142 HydrophobicContact CD2-CE2 3.5Å; L1140-F1142 HydrophobicContact CD2-CZ 3.89Å; L1140-F1142 HydrophobicContact CG-CD2 4.32Å; L1140-F1142 HydrophobicContact CG-CE2 3.71Å; L1140-F1142 HydrophobicContact CG-CZ 4.28Å; F1142-L1162 HydrophobicContact CB-CD2 4.18Å; F1142-L1162 HydrophobicContact CD1-CD1 4.3Å; F1142-L1162 HydrophobicContact CD1-CD2 4.39Å; F1142-L1162 HydrophobicContact CD2-CD2 4.09Å; F1142-L1162 HydrophobicContact CE1-CD1 4.11Å; F1142-L1162 HydrophobicContact CG-CD2 4.01Å; F1142-L1162 HydrophobicContact CZ-CD1 4.3Å; F1142-V1166 HydrophobicContact CE2-CG2 4.19Å; F1142-V1166 HydrophobicContact CZ-CG2 4.4Å; F1142-E1182 CarbonylContact O-C 3.58Å; F1142-E1182 WeakPolarHBondContact O-CA 3.49Å; F1142-E1182 VanDerWaalsContact O-CG 3.28Å; F1142-E1182 WeakPolarHBondContact O-CG 3.45Å; F1142-I1183 PolarHBondContact N-O 3.02Å; F1142-I1183 PolarHBondContact O-N 3.12Å; F1142-F1185 AromaticContact CD2-CD2 3.81Å; F1142-F1185 HydrophobicContact CD2-CD2 3.81Å; F1142-F1185 AromaticContact CD2-CE2 3.6Å; F1142-F1185 HydrophobicContact CD2-CE2 3.6Å; F1142-F1185 AromaticContact CE2-CD2 3.75Å; F1142-F1185 HydrophobicContact CE2-CD2 3.75Å; F1142-F1185 AromaticContact CE2-CE2 3.63Å; F1142-F1185 HydrophobicContact CE2-CE2 3.63Å; F1142-I1202 HydrophobicContact CE1-CD1 4.42Å; F1142-I1202 HydrophobicContact CE1-CG1 4.34Å; F1142-I1202 HydrophobicContact CE1-CG2 3.64Å; F1142-I1202 HydrophobicContact CZ-CD1 3.73Å; F1142-I1202 HydrophobicContact CZ-CG1 4Å; F1142-I1202 HydrophobicContact CZ-CG2 4.07Å; F1142-L1206 HydrophobicContact CD1-CD1 4.4Å; F1142-L1206 HydrophobicContact CE1-CD1 4.35Å; F1142-C1211 HydrophobicContact CD1-CB 4.49Å
1143	T	67.6	Low	60.4	Low	5 Å²	5	75.9 Å²	75.9	3%	0.031	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.2	-175.5	-39.2	0	0	0	0	110.9	C1211 V1212 A1213 Q2195	T1143-C1211 CarbonylContact O-C 3.45Å; T1143-C1211 VanDerWaalsContact O-CA 3.27Å; T1143-C1211 WeakPolarHBondContact O-CA 3.26Å; T1143-V1212 PolarHBondContact O-N 3.12Å; T1143-A1213 PolarHBondContact N-O 2.9Å; T1143-Q2195 HydrophobicContact CG2-CG 3.98Å; T1143-Q2195 VanDerWaalsContact CG2-NE2 3.26Å
1144	R	69	Low	59.6	Low	14 Å²	14	78.4 Å²	78.4	5%	0.053	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	149.6	179.7	-62.7	-175.2	72.1	169	1.6	112.6	V1146 A1155 S1158 N1159 Q1181	R1144-V1146 HydrophobicContact CB-CG2 4.48Å; R1144-A1155 PolarHBondContact NH1-O 3.22Å; R1144-S1158 PolarHBondContact NH2-OG 3.27Å; R1144-N1159 PolarHBondContact NH1-OD1 3.03Å; R1144-Q1181 PolarHBondContact N-O 3Å
1145	S	59.8	Low	58.9	Low	80 Å²	80	76 Å²	76	56%	0.559	39%	0.393	S	S	*	.			trans	-86.3	124.4	165.5	53.5	0	0	0	0	109.9
1146	V	55.6	Low	59.1	Low	62 Å²	62	69.1 Å²	69.1	38%	0.376	38%	0.376	S	S	.	.			trans	-127.5	110	177.5	-175.4	0	0	0	0	110.5	R1144 V1148 L1180 Q1181	R1144-V1146 HydrophobicContact CB-CG2 4.48Å; V1146-V1148 HydrophobicContact CG1-CG2 4.01Å; V1146-L1180 WeakPolarHBondContact CG2-O 3.45Å; V1146-Q1181 HydrophobicContact CG2-CG 4.12Å
1147	E	48.9	Very low	59.1	Low	198 Å²	198	72.1 Å²	72.1	93%	0.925	39%	0.39	S	S	*	.			trans	-82.7	119.7	160	-69.9	-173.7	156.3	0	0	109	S1149	E1147-S1149 PolarHBondContact O-N 3.08Å
1148	V	44	Very low	59	Low	116 Å²	116	72.8 Å²	72.8	70%	0.703	39%	0.394	S	S	*	.	S	Bend	trans	-89.1	108.7	-168.8	179.6	0	0	0	0	111.2	V1146	V1146-V1148 HydrophobicContact CG1-CG2 4.01Å
1149	S	41.1	Very low	58.8	Low	122 Å²	122	72.2 Å²	72.2	85%	0.853	39%	0.393	S	S	*	.	S	Bend	trans	-177.7	-18.8	134.8	39.4	0	0	0	0	116.3	E1147	E1147-S1149 PolarHBondContact O-N 3.08Å
1150	A	43.8	Very low	58.7	Low	88 Å²	88	80.3 Å²	80.3	73%	0.727	42%	0.424	S	S	*	.	S	Bend	trans	-121.5	-13.3	-161	0	0	0	0	0	119.8
1151	Q	47.6	Very low	58.5	Low	123 Å²	123	85.3 Å²	85.3	58%	0.575	45%	0.45	S	S	*	.			trans	-133.6	74.4	-169	-67.5	-176.8	15.6	0	0	115	R1154	Q1151-R1154 VanDerWaalsContact OE1-CD 3.25Å
1152	K	46.8	Very low	58.5	Low	130 Å²	130	84.4 Å²	84.4	57%	0.565	44%	0.444	S	S	*	.	H	α-helix	trans	-75	-31.1	-179.9	-145.1	175.3	-172.1	179.6	0	114.4
1153	Q	50.4	Low	58.4	Low	165 Å²	165	85.4 Å²	85.4	77%	0.771	45%	0.45	S	S	*	.	H	α-helix	trans	-76.3	-47.8	-177.4	-83	161.5	-52.7	0	0	113.5	A1155 V1156 D1157	Q1153-A1155 PolarHBondContact O-N 2.8Å; Q1153-A1155 VanDerWaalsContact O-N 3.12Å; Q1153-V1156 PolarHBondContact O-N 3.49Å; Q1153-D1157 PolarHBondContact O-N 3.41Å
1154	R	52.4	Low	58.9	Low	165 Å²	165	89.3 Å²	89.3	62%	0.623	47%	0.471	S	S	*	.	H	α-helix	trans	-58.3	-28.3	178.8	-75.9	176.6	174.9	174.8	-3.6	113.7	Q1151 S1158	Q1151-R1154 VanDerWaalsContact OE1-CD 3.25Å; R1154-S1158 WeakPolarHBondContact O-CB 3.24Å; R1154-S1158 PolarHBondContact O-N 3.05Å
1155	A	52.6	Low	59.4	Low	18 Å²	18	89.9 Å²	89.9	15%	0.149	47%	0.474	C	S	.	.	H	α-helix	trans	-64	-40.3	175.3	0	0	0	0	0	112.3	R1144 Q1153 N1159 L1180	R1144-A1155 PolarHBondContact NH1-O 3.22Å; Q1153-A1155 PolarHBondContact O-N 2.8Å; Q1153-A1155 VanDerWaalsContact O-N 3.12Å; A1155-N1159 PolarHBondContact O-N 3.46Å; A1155-N1159 PolarHBondContact O-OD1 3.18Å; A1155-L1180 HydrophobicContact CB-CD2 4.4Å
1156	V	59.3	Low	60.2	Low	81 Å²	81	86.1 Å²	86.1	49%	0.491	45%	0.448	S	S	.	.	H	α-helix	trans	-71.3	-41.7	-177.1	178.9	0	0	0	0	111.9	Q1153 S1158 N1159 R1160	Q1153-V1156 PolarHBondContact O-N 3.49Å; V1156-S1158 VanDerWaalsContact C-N 3.31Å; V1156-S1158 PolarHBondContact O-N 2.6Å; V1156-N1159 WeakPolarHBondContact O-CB 2.98Å; V1156-N1159 PolarHBondContact O-N 3.31Å; V1156-R1160 PolarHBondContact O-N 2.81Å; V1156-R1160 VanDerWaalsContact O-N 3.08Å
1157	D	61.5	Low	61.3	Low	91 Å²	91	86.2 Å²	86.2	49%	0.487	45%	0.446	S	S	.	.	H	α-helix	trans	-65.3	-38.2	176.9	-63.5	-38	0	0	0	111.5	Q1153 R1160 N1161	Q1153-D1157 PolarHBondContact O-N 3.41Å; D1157-R1160 PolarHBondContact O-N 3.02Å; D1157-N1161 PolarHBondContact O-N 3.32Å; D1157-N1161 VanDerWaalsContact O-N 3.13Å
1158	S	64.9	Low	62.6	Low	20 Å²	20	83.4 Å²	83.4	14%	0.14	44%	0.437	C	S	.	.	H	α-helix	trans	-66.4	-37.1	174.9	179.1	0	0	0	0	112.5	R1144 R1154 V1156 N1161 L1162	R1144-S1158 PolarHBondContact NH2-OG 3.27Å; R1154-S1158 WeakPolarHBondContact O-CB 3.24Å; R1154-S1158 PolarHBondContact O-N 3.05Å; V1156-S1158 VanDerWaalsContact C-N 3.31Å; V1156-S1158 PolarHBondContact O-N 2.6Å; S1158-N1161 PolarHBondContact O-N 3.27Å; S1158-L1162 PolarHBondContact O-N 3.3Å; S1158-L1162 VanDerWaalsContact O-N 3.12Å
1159	N	66.6	Low	64.1	Low	13 Å²	13	83.2 Å²	83.2	7%	0.07	42%	0.424	C	S	.	.	H	α-helix	trans	-61.2	-48.5	171.9	-82.6	20	0	0	0	111.5	R1144 A1155 V1156 N1161 L1162 V1163 E1178 I1183	R1144-N1159 PolarHBondContact NH1-OD1 3.03Å; A1155-N1159 PolarHBondContact O-N 3.46Å; A1155-N1159 PolarHBondContact O-OD1 3.18Å; V1156-N1159 WeakPolarHBondContact O-CB 2.98Å; V1156-N1159 PolarHBondContact O-N 3.31Å; N1159-N1161 VanDerWaalsContact C-N 3.27Å; N1159-N1161 PolarHBondContact O-N 2.77Å; N1159-L1162 PolarHBondContact O-N 2.96Å; N1159-V1163 WeakPolarHBondContact O-CB 3.44Å; N1159-V1163 WeakPolarHBondContact O-CG2 3.22Å; N1159-V1163 PolarHBondContact O-N 3.28Å; N1159-E1178 WeakPolarHBondContact CB-OE1 3.48Å; N1159-E1178 WeakPolarHBondContact ND2-CG 2.98Å; N1159-E1178 PolarHBondContact ND2-OE1 3.22Å; N1159-I1183 HydrophobicContact CB-CD1 4.48Å; N1159-I1183 WeakPolarHBondContact OD1-CD1 3.43Å
1160	R	71.4	Confident	65.7	Low	170 Å²	170	78.6 Å²	78.6	64%	0.642	39%	0.391	S	S	*	.	H	α-helix	trans	-56.4	-41.3	177.6	-86.4	-179.2	165.1	176.2	-5.2	112.3	V1156 D1157 N1164	V1156-R1160 PolarHBondContact O-N 2.81Å; V1156-R1160 VanDerWaalsContact O-N 3.08Å; D1157-R1160 PolarHBondContact O-N 3.02Å; R1160-N1164 VanDerWaalsContact O-CB 3.29Å; R1160-N1164 WeakPolarHBondContact O-CB 3.21Å; R1160-N1164 PolarHBondContact O-N 2.88Å; R1160-N1164 PolarHBondContact O-ND2 3.39Å
1161	N	73.5	Confident	66.9	Low	106 Å²	106	79.5 Å²	79.5	57%	0.567	39%	0.389	S	S	*	.	H	α-helix	trans	-66.6	-40.7	178.3	-72.5	-15.6	0	0	0	112.6	D1157 S1158 N1159 F1165	D1157-N1161 PolarHBondContact O-N 3.32Å; D1157-N1161 VanDerWaalsContact O-N 3.13Å; S1158-N1161 PolarHBondContact O-N 3.27Å; N1159-N1161 VanDerWaalsContact C-N 3.27Å; N1159-N1161 PolarHBondContact O-N 2.77Å; N1161-F1165 WeakPolarHBondContact O-CB 3.15Å; N1161-F1165 PolarHBondContact O-N 2.9Å
1162	L	74.6	Confident	68	Low	4 Å²	4	79.9 Å²	79.9	2%	0.021	40%	0.395	C	S	.	.	H	α-helix	trans	-66.5	-46.6	174.9	-172.4	81.8	0	0	0	111.5	F1142 S1158 N1159 N1164 F1165 V1166 I1183 F1185 F1209	F1142-L1162 HydrophobicContact CB-CD2 4.18Å; F1142-L1162 HydrophobicContact CD1-CD1 4.3Å; F1142-L1162 HydrophobicContact CD1-CD2 4.39Å; F1142-L1162 HydrophobicContact CD2-CD2 4.09Å; F1142-L1162 HydrophobicContact CE1-CD1 4.11Å; F1142-L1162 HydrophobicContact CG-CD2 4.01Å; F1142-L1162 HydrophobicContact CZ-CD1 4.3Å; S1158-L1162 PolarHBondContact O-N 3.3Å; S1158-L1162 VanDerWaalsContact O-N 3.12Å; N1159-L1162 PolarHBondContact O-N 2.96Å; L1162-N1164 PolarHBondContact O-N 2.89Å; L1162-F1165 WeakPolarHBondContact O-CB 3.34Å; L1162-F1165 PolarHBondContact O-N 3.12Å; L1162-V1166 WeakPolarHBondContact O-CG2 3.45Å; L1162-V1166 PolarHBondContact O-N 3.45Å; L1162-I1183 HydrophobicContact CD2-CB 4.37Å; L1162-I1183 HydrophobicContact CD2-CD1 3.61Å; L1162-I1183 HydrophobicContact CD2-CG2 4.45Å; L1162-F1185 HydrophobicContact CD2-CE2 4.07Å; L1162-F1185 HydrophobicContact CD2-CZ 4.27Å; L1162-F1185 HydrophobicContact CG-CE2 4.47Å; L1162-F1185 HydrophobicContact CG-CZ 4.42Å; L1162-F1209 HydrophobicContact CB-CD1 4.27Å; L1162-F1209 HydrophobicContact CD1-CB 3.83Å; L1162-F1209 HydrophobicContact CD1-CD1 3.81Å; L1162-F1209 HydrophobicContact CD1-CD2 3.85Å; L1162-F1209 HydrophobicContact CD1-CE1 4.29Å; L1162-F1209 HydrophobicContact CD1-CE2 4.31Å; L1162-F1209 HydrophobicContact CD1-CG 3.57Å
1163	V	75.4	Confident	69.3	Low	22 Å²	22	74.7 Å²	74.7	13%	0.133	37%	0.374	C	S	.	.	H	α-helix	trans	-60.3	-46.1	179.4	170.4	0	0	0	0	110.8	N1159 F1165 V1166 I1167 V1175 F1185	N1159-V1163 WeakPolarHBondContact O-CB 3.44Å; N1159-V1163 WeakPolarHBondContact O-CG2 3.22Å; N1159-V1163 PolarHBondContact O-N 3.28Å; V1163-F1165 VanDerWaalsContact C-N 3.35Å; V1163-F1165 PolarHBondContact O-N 3.34Å; V1163-V1166 PolarHBondContact O-N 3.46Å; V1163-I1167 HydrophobicContact CG1-CD1 3.59Å; V1163-I1167 HydrophobicContact CG1-CG1 4.4Å; V1163-I1167 WeakPolarHBondContact O-CB 3.28Å; V1163-I1167 VanDerWaalsContact O-CG1 3.29Å; V1163-I1167 WeakPolarHBondContact O-CG1 3.3Å; V1163-I1167 PolarHBondContact O-N 2.96Å; V1163-V1175 HydrophobicContact CG1-CG2 4.3Å; V1163-F1185 HydrophobicContact CB-CE1 4.41Å; V1163-F1185 HydrophobicContact CG2-CE1 4.02Å; V1163-F1185 HydrophobicContact CG2-CZ 4Å
1164	N	76.8	Confident	70.2	Confident	88 Å²	88	72.5 Å²	72.5	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-38.4	175.6	-72.1	-12.9	0	0	0	112.3	R1160 L1162 N1168	R1160-N1164 VanDerWaalsContact O-CB 3.29Å; R1160-N1164 WeakPolarHBondContact O-CB 3.21Å; R1160-N1164 PolarHBondContact O-N 2.88Å; R1160-N1164 PolarHBondContact O-ND2 3.39Å; L1162-N1164 PolarHBondContact O-N 2.89Å; N1164-N1168 VanDerWaalsContact O-CB 3.27Å; N1164-N1168 WeakPolarHBondContact O-CB 2.99Å; N1164-N1168 PolarHBondContact O-N 3.3Å; N1164-N1168 PolarHBondContact O-ND2 2.96Å
1165	F	80.9	Confident	71.1	Confident	26 Å²	26	67.4 Å²	67.4	11%	0.114	35%	0.349	C	S	.	.	H	α-helix	trans	-61.5	-45.4	176.3	174	-98.7	0	0	0	112.2	N1161 L1162 V1163 Y1169 E1201 I1202 F1209	N1161-F1165 WeakPolarHBondContact O-CB 3.15Å; N1161-F1165 PolarHBondContact O-N 2.9Å; L1162-F1165 WeakPolarHBondContact O-CB 3.34Å; L1162-F1165 PolarHBondContact O-N 3.12Å; V1163-F1165 VanDerWaalsContact C-N 3.35Å; V1163-F1165 PolarHBondContact O-N 3.34Å; F1165-Y1169 HydrophobicContact CE1-CD2 4.41Å; F1165-Y1169 HydrophobicContact CE2-CD2 4.02Å; F1165-Y1169 AromaticContact CE2-CE2 3.83Å; F1165-Y1169 HydrophobicContact CE2-CE2 3.83Å; F1165-Y1169 AromaticContact CZ-CD2 3.94Å; F1165-Y1169 HydrophobicContact CZ-CD2 3.94Å; F1165-Y1169 AromaticContact CZ-CE2 3.79Å; F1165-Y1169 HydrophobicContact CZ-CE2 3.79Å; F1165-Y1169 PolarHBondContact O-N 3.2Å; F1165-E1201 HydrophobicContact CZ-CG 4.15Å; F1165-I1202 HydrophobicContact CE1-CG1 4.08Å; F1165-F1209 HydrophobicContact CB-CE1 4.4Å; F1165-F1209 HydrophobicContact CB-CZ 4.07Å; F1165-F1209 HydrophobicContact CD1-CE2 4.26Å; F1165-F1209 HydrophobicContact CD1-CZ 4.03Å; F1165-F1209 HydrophobicContact CD2-CZ 4.14Å; F1165-F1209 HydrophobicContact CE1-CE2 4.43Å; F1165-F1209 HydrophobicContact CG-CE2 4.46Å; F1165-F1209 AromaticContact CG-CZ 3.81Å; F1165-F1209 HydrophobicContact CG-CZ 3.81Å
1166	V	76	Confident	71.7	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-71.1	-41.3	-179.8	-180	0	0	0	0	111.7	F1142 L1162 V1163 N1168 Y1169 V1170 V1173 F1185	F1142-V1166 HydrophobicContact CE2-CG2 4.19Å; F1142-V1166 HydrophobicContact CZ-CG2 4.4Å; L1162-V1166 WeakPolarHBondContact O-CG2 3.45Å; L1162-V1166 PolarHBondContact O-N 3.45Å; V1163-V1166 PolarHBondContact O-N 3.46Å; V1166-N1168 VanDerWaalsContact C-N 3.33Å; V1166-N1168 PolarHBondContact O-N 3.42Å; V1166-Y1169 PolarHBondContact O-N 3.42Å; V1166-V1170 PolarHBondContact O-N 3.43Å; V1166-V1173 HydrophobicContact CG1-CG1 4.11Å; V1166-V1173 HydrophobicContact CG1-CG2 4.16Å; V1166-F1185 HydrophobicContact CB-CD1 4.22Å; V1166-F1185 HydrophobicContact CB-CE1 3.97Å; V1166-F1185 HydrophobicContact CB-CE2 4.36Å; V1166-F1185 HydrophobicContact CB-CZ 4.05Å; V1166-F1185 HydrophobicContact CG1-CB 4.36Å; V1166-F1185 HydrophobicContact CG1-CD1 3.89Å; V1166-F1185 HydrophobicContact CG1-CD2 4.25Å; V1166-F1185 HydrophobicContact CG1-CE1 4.17Å; V1166-F1185 HydrophobicContact CG1-CG 3.92Å; V1166-F1185 HydrophobicContact CG1-CZ 4.48Å; V1166-F1185 HydrophobicContact CG2-CD2 4.22Å; V1166-F1185 HydrophobicContact CG2-CE1 4.3Å; V1166-F1185 HydrophobicContact CG2-CE2 3.82Å; V1166-F1185 HydrophobicContact CG2-CZ 3.86Å
1167	I	77.9	Confident	71.6	Confident	65 Å²	65	67.3 Å²	67.3	33%	0.333	34%	0.343	S	S	.	.	H	α-helix	trans	-63	-39.2	176.1	-69	171.7	0	0	0	111.3	V1163 Y1169 V1170 P1171	V1163-I1167 HydrophobicContact CG1-CD1 3.59Å; V1163-I1167 HydrophobicContact CG1-CG1 4.4Å; V1163-I1167 WeakPolarHBondContact O-CB 3.28Å; V1163-I1167 VanDerWaalsContact O-CG1 3.29Å; V1163-I1167 WeakPolarHBondContact O-CG1 3.3Å; V1163-I1167 PolarHBondContact O-N 2.96Å; I1167-Y1169 VanDerWaalsContact C-N 3.3Å; I1167-Y1169 PolarHBondContact O-N 3.17Å; I1167-V1170 CarbonylContact O-C 3.58Å; I1167-V1170 VanDerWaalsContact O-C 3.23Å; I1167-V1170 PolarHBondContact O-N 3.25Å; I1167-P1171 WeakPolarHBondContact O-CA 3.35Å
1168	N	78.2	Confident	71.7	Confident	139 Å²	139	67.9 Å²	67.9	74%	0.743	34%	0.343	S	S	*	.	H	α-helix	trans	-65.5	-31.4	177.2	-75.7	-12	0	0	0	113.1	N1164 V1166	N1164-N1168 VanDerWaalsContact O-CB 3.27Å; N1164-N1168 WeakPolarHBondContact O-CB 2.99Å; N1164-N1168 PolarHBondContact O-N 3.3Å; N1164-N1168 PolarHBondContact O-ND2 2.96Å; V1166-N1168 VanDerWaalsContact C-N 3.33Å; V1166-N1168 PolarHBondContact O-N 3.42Å
1169	Y	75.5	Confident	71.4	Confident	112 Å²	112	68.6 Å²	68.6	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-80	-36.2	175.2	-106.9	-79.7	0	0	0	112.9	F1165 V1166 I1167 L1198 E1201	F1165-Y1169 HydrophobicContact CE1-CD2 4.41Å; F1165-Y1169 HydrophobicContact CE2-CD2 4.02Å; F1165-Y1169 AromaticContact CE2-CE2 3.83Å; F1165-Y1169 HydrophobicContact CE2-CE2 3.83Å; F1165-Y1169 AromaticContact CZ-CD2 3.94Å; F1165-Y1169 HydrophobicContact CZ-CD2 3.94Å; F1165-Y1169 AromaticContact CZ-CE2 3.79Å; F1165-Y1169 HydrophobicContact CZ-CE2 3.79Å; F1165-Y1169 PolarHBondContact O-N 3.2Å; V1166-Y1169 PolarHBondContact O-N 3.42Å; I1167-Y1169 VanDerWaalsContact C-N 3.3Å; I1167-Y1169 PolarHBondContact O-N 3.17Å; Y1169-L1198 HydrophobicContact CD1-CD1 4.12Å; Y1169-L1198 HydrophobicContact CD2-CD1 4.17Å; Y1169-L1198 HydrophobicContact CG-CD1 3.77Å; Y1169-E1201 HydrophobicContact CE2-CG 4.43Å
1170	V	73.9	Confident	70.9	Confident	24 Å²	24	71.7 Å²	71.7	15%	0.145	36%	0.364	C	S	.	.			trans	-135.6	96.9	-178.7	-173.7	0	0	0	0	109.9	V1166 I1167 N1172 V1173 L1187 P1188 L1198	V1166-V1170 PolarHBondContact O-N 3.43Å; I1167-V1170 CarbonylContact O-C 3.58Å; I1167-V1170 VanDerWaalsContact O-C 3.23Å; I1167-V1170 PolarHBondContact O-N 3.25Å; V1170-N1172 PolarHBondContact O-N 3.49Å; V1170-N1172 VanDerWaalsContact O-N 3.09Å; V1170-V1173 HydrophobicContact CB-CG2 3.71Å; V1170-V1173 HydrophobicContact CG1-CG2 3.78Å; V1170-V1173 WeakPolarHBondContact O-CB 3.49Å; V1170-V1173 PolarHBondContact O-N 2.87Å; V1170-V1173 VanDerWaalsContact O-N 3.09Å; V1170-L1187 HydrophobicContact CB-CD2 4.26Å; V1170-L1187 HydrophobicContact CG1-CD2 4.28Å; V1170-L1187 HydrophobicContact CG2-CD2 3.93Å; V1170-P1188 HydrophobicContact CG1-CG 4.32Å; V1170-L1198 HydrophobicContact CG2-CD2 4.08Å
1171	P	68.6	Low	70.3	Confident	108 Å²	108	66.2 Å²	66.2	70%	0.701	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-16.6	-168.5	24.7	-34.8	0	0	0	114.9	I1167	I1167-P1171 WeakPolarHBondContact O-CA 3.35Å
1172	N	70.8	Confident	69.9	Low	131 Å²	131	63.7 Å²	63.7	70%	0.701	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	19.3	177.3	-73.3	-13.1	0	0	0	113.1	V1170 P1188	V1170-N1172 PolarHBondContact O-N 3.49Å; V1170-N1172 VanDerWaalsContact O-N 3.09Å; N1172-P1188 HydrophobicContact CB-CG 4.1Å
1173	V	73.5	Confident	69.9	Low	20 Å²	20	63.6 Å²	63.6	12%	0.121	33%	0.329	C	S	.	.			trans	-67.8	135.6	173.5	149.3	0	0	0	0	111.4	V1166 V1170 F1185 L1187	V1166-V1173 HydrophobicContact CG1-CG1 4.11Å; V1166-V1173 HydrophobicContact CG1-CG2 4.16Å; V1170-V1173 HydrophobicContact CB-CG2 3.71Å; V1170-V1173 HydrophobicContact CG1-CG2 3.78Å; V1170-V1173 WeakPolarHBondContact O-CB 3.49Å; V1170-V1173 PolarHBondContact O-N 2.87Å; V1170-V1173 VanDerWaalsContact O-N 3.09Å; V1173-F1185 HydrophobicContact CG1-CB 3.96Å; V1173-F1185 HydrophobicContact CG1-CD1 3.59Å; V1173-F1185 HydrophobicContact CG1-CG 4.2Å; V1173-L1187 HydrophobicContact CG2-CD2 3.54Å; V1173-L1187 HydrophobicContact CG2-CG 4.22Å
1174	K	70.6	Confident	69.9	Low	120 Å²	120	63 Å²	63	52%	0.522	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117.9	173.7	-158.6	177.1	-173.2	-179.6	0	108.8	V1176 M1186	K1174-V1176 PolarHBondContact O-N 3.39Å; K1174-M1186 HydrophobicContact CB-CB 4.46Å; K1174-M1186 PolarHBondContact N-O 2.97Å; K1174-M1186 PolarHBondContact O-N 3.42Å
1175	V	71.5	Confident	69.9	Low	57 Å²	57	58.8 Å²	58.8	35%	0.345	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	124.8	172.3	-175	0	0	0	0	108.2	V1163 F1185	V1163-V1175 HydrophobicContact CG1-CG2 4.3Å; V1175-F1185 HydrophobicContact CG2-CD1 3.92Å; V1175-F1185 HydrophobicContact CG2-CE1 3.91Å
1176	V	63.6	Low	69.5	Low	59 Å²	59	58.6 Å²	58.6	36%	0.358	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-43	-177.5	-179.1	0	0	0	0	111.3	K1174 Q1184 M1186	K1174-V1176 PolarHBondContact O-N 3.39Å; V1176-Q1184 HydrophobicContact CB-CB 4.46Å; V1176-Q1184 HydrophobicContact CB-CG 4.26Å; V1176-Q1184 PolarHBondContact N-O 3.15Å; V1176-M1186 HydrophobicContact CG2-CB 3.46Å; V1176-M1186 VanDerWaalsContact CG2-CB 3.46Å; V1176-M1186 HydrophobicContact CG2-CE 4.09Å
1177	R	58.8	Low	69.5	Low	39 Å²	39	58.8 Å²	58.8	15%	0.147	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	135.8	-175.6	-109.2	-178.4	-153.8	161.8	4.2	109.2	Q1184 M2170 E2171	R1177-Q1184 HydrophobicContact CB-CB 3.75Å; R1177-Q1184 PolarHBondContact N-O 3.46Å; R1177-Q1184 PolarHBondContact O-N 3.2Å; R1177-M2170 VanDerWaalsContact CZ-C 3.4Å; R1177-M2170 PolarHBondContact NE-O 3.3Å; R1177-M2170 PolarHBondContact NH1-O 3.1Å; R1177-M2170 PolarHBondContact NH2-O 3.48Å; R1177-M2170 PolarHBondContact NH2-SD 3.16Å; R1177-E2171 IonicContact CZ-OE1 3.18Å; R1177-E2171 IonicContact CZ-OE2 3.3Å; R1177-E2171 VanDerWaalsContact CZ-OE2 3.3Å; R1177-E2171 IonicContact NH1-OE1 3.88Å; R1177-E2171 IonicContact NH1-OE2 2.72Å; R1177-E2171 PolarHBondContact NH1-OE2 3.44Å; R1177-E2171 IonicContact NH2-OE1 3.63Å; R1177-E2171 PolarHBondContact NH2-OE1 3.08Å; R1177-E2171 IonicContact NH2-OE2 2.73Å; R1177-E2171 PolarHBondContact NH2-OE2 2.85Å
1178	E	62.9	Low	69.1	Low	103 Å²	103	57.9 Å²	57.9	48%	0.481	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	112.8	170.3	-167	-179.2	172.9	0	0	108.1	N1159 I1183	N1159-E1178 WeakPolarHBondContact CB-OE1 3.48Å; N1159-E1178 WeakPolarHBondContact ND2-CG 2.98Å; N1159-E1178 PolarHBondContact ND2-OE1 3.22Å; E1178-I1183 HydrophobicContact CG-CG1 4.49Å
1179	S	58	Low	68.2	Low	34 Å²	34	53.9 Å²	53.9	24%	0.238	29%	0.294	C	S	.	.			trans	-125.6	164.4	-179.9	176.1	0	0	0	0	109.8	Q1181 E1182	S1179-Q1181 PolarHBondContact O-N 2.89Å; S1179-E1182 WeakPolarHBondContact CA-O 3.37Å; S1179-E1182 VanDerWaalsContact CB-O 3.29Å; S1179-E1182 WeakPolarHBondContact CB-O 3.42Å; S1179-E1182 PolarHBondContact N-O 3.28Å
1180	L	55.9	Low	67.3	Low	79 Å²	79	53.9 Å²	53.9	41%	0.414	30%	0.296	S	S	.	.	S	Bend	trans	-63.5	-25.5	173.5	-81.9	161.7	0	0	0	112.7	V1146 A1155	V1146-L1180 WeakPolarHBondContact CG2-O 3.45Å; A1155-L1180 HydrophobicContact CB-CD2 4.4Å
1181	Q	58.9	Low	66.5	Low	55 Å²	55	57.3 Å²	57.3	26%	0.257	32%	0.317	S	S	.	.	S	Bend	trans	-110.8	-17	-177	-65.3	-176.2	-4.1	0	0	114.1	R1144 V1146 S1179	R1144-Q1181 PolarHBondContact N-O 3Å; V1146-Q1181 HydrophobicContact CG2-CG 4.12Å; S1179-Q1181 PolarHBondContact O-N 2.89Å
1182	E	66.4	Low	66.3	Low	53 Å²	53	53 Å²	53	25%	0.248	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	147.4	-176	-157.3	175.9	166.6	0	0	112.5	T1141 F1142 S1179	T1141-E1182 WeakPolarHBondContact CB-OE1 3.45Å; T1141-E1182 WeakPolarHBondContact CG2-OE1 3.27Å; F1142-E1182 CarbonylContact O-C 3.58Å; F1142-E1182 WeakPolarHBondContact O-CA 3.49Å; F1142-E1182 VanDerWaalsContact O-CG 3.28Å; F1142-E1182 WeakPolarHBondContact O-CG 3.45Å; S1179-E1182 WeakPolarHBondContact CA-O 3.37Å; S1179-E1182 VanDerWaalsContact CB-O 3.29Å; S1179-E1182 WeakPolarHBondContact CB-O 3.42Å; S1179-E1182 PolarHBondContact N-O 3.28Å
1183	I	74.7	Confident	66	Low	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.7	178.7	-55.9	166.5	0	0	0	108.8	T1141 F1142 N1159 L1162 E1178 F1185	T1141-I1183 CarbonylContact C-O 3.59Å; T1141-I1183 WeakPolarHBondContact CA-O 3.35Å; F1142-I1183 PolarHBondContact N-O 3.02Å; F1142-I1183 PolarHBondContact O-N 3.12Å; N1159-I1183 HydrophobicContact CB-CD1 4.48Å; N1159-I1183 WeakPolarHBondContact OD1-CD1 3.43Å; L1162-I1183 HydrophobicContact CD2-CB 4.37Å; L1162-I1183 HydrophobicContact CD2-CD1 3.61Å; L1162-I1183 HydrophobicContact CD2-CG2 4.45Å; E1178-I1183 HydrophobicContact CG-CG1 4.49Å; I1183-F1185 HydrophobicContact CG2-CD2 4.38Å; I1183-F1185 HydrophobicContact CG2-CE1 4.44Å; I1183-F1185 HydrophobicContact CG2-CE2 3.66Å; I1183-F1185 HydrophobicContact CG2-CZ 3.71Å
1184	Q	73.8	Confident	65.7	Low	10 Å²	10	55.8 Å²	55.8	5%	0.047	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.2	-175.5	-172.1	-179.3	-3	0	0	111.4	N1139 L1140 T1141 V1176 R1177 E1223	N1139-Q1184 HydrophobicContact CB-CG 4.45Å; N1139-Q1184 PolarHBondContact ND2-NE2 3.36Å; N1139-Q1184 VanDerWaalsContact ND2-NE2 3.14Å; L1140-Q1184 WeakPolarHBondContact O-CA 3.43Å; T1141-Q1184 HydrophobicContact CG2-CB 3.93Å; T1141-Q1184 HydrophobicContact CG2-CG 3.65Å; V1176-Q1184 HydrophobicContact CB-CB 4.46Å; V1176-Q1184 HydrophobicContact CB-CG 4.26Å; V1176-Q1184 PolarHBondContact N-O 3.15Å; R1177-Q1184 HydrophobicContact CB-CB 3.75Å; R1177-Q1184 PolarHBondContact N-O 3.46Å; R1177-Q1184 PolarHBondContact O-N 3.2Å; Q1184-E1223 PolarHBondContact NE2-OE1 2.03Å
1185	F	77.3	Confident	65.7	Low	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.9	176	-57.9	-85.8	0	0	0	110.4	N1139 L1140 F1142 L1162 V1163 V1166 V1173 V1175 I1183	N1139-F1185 CarbonylContact C-O 3.53Å; N1139-F1185 VanDerWaalsContact CA-O 3.27Å; N1139-F1185 WeakPolarHBondContact CA-O 3.29Å; L1140-F1185 HydrophobicContact CB-CB 4.45Å; L1140-F1185 PolarHBondContact N-O 2.81Å; L1140-F1185 PolarHBondContact O-N 3.44Å; F1142-F1185 AromaticContact CD2-CD2 3.81Å; F1142-F1185 HydrophobicContact CD2-CD2 3.81Å; F1142-F1185 AromaticContact CD2-CE2 3.6Å; F1142-F1185 HydrophobicContact CD2-CE2 3.6Å; F1142-F1185 AromaticContact CE2-CD2 3.75Å; F1142-F1185 HydrophobicContact CE2-CD2 3.75Å; F1142-F1185 AromaticContact CE2-CE2 3.63Å; F1142-F1185 HydrophobicContact CE2-CE2 3.63Å; L1162-F1185 HydrophobicContact CD2-CE2 4.07Å; L1162-F1185 HydrophobicContact CD2-CZ 4.27Å; L1162-F1185 HydrophobicContact CG-CE2 4.47Å; L1162-F1185 HydrophobicContact CG-CZ 4.42Å; V1163-F1185 HydrophobicContact CB-CE1 4.41Å; V1163-F1185 HydrophobicContact CG2-CE1 4.02Å; V1163-F1185 HydrophobicContact CG2-CZ 4Å; V1166-F1185 HydrophobicContact CB-CD1 4.22Å; V1166-F1185 HydrophobicContact CB-CE1 3.97Å; V1166-F1185 HydrophobicContact CB-CE2 4.36Å; V1166-F1185 HydrophobicContact CB-CZ 4.05Å; V1166-F1185 HydrophobicContact CG1-CB 4.36Å; V1166-F1185 HydrophobicContact CG1-CD1 3.89Å; V1166-F1185 HydrophobicContact CG1-CD2 4.25Å; V1166-F1185 HydrophobicContact CG1-CE1 4.17Å; V1166-F1185 HydrophobicContact CG1-CG 3.92Å; V1166-F1185 HydrophobicContact CG1-CZ 4.48Å; V1166-F1185 HydrophobicContact CG2-CD2 4.22Å; V1166-F1185 HydrophobicContact CG2-CE1 4.3Å; V1166-F1185 HydrophobicContact CG2-CE2 3.82Å; V1166-F1185 HydrophobicContact CG2-CZ 3.86Å; V1173-F1185 HydrophobicContact CG1-CB 3.96Å; V1173-F1185 HydrophobicContact CG1-CD1 3.59Å; V1173-F1185 HydrophobicContact CG1-CG 4.2Å; V1175-F1185 HydrophobicContact CG2-CD1 3.92Å; V1175-F1185 HydrophobicContact CG2-CE1 3.91Å; I1183-F1185 HydrophobicContact CG2-CD2 4.38Å; I1183-F1185 HydrophobicContact CG2-CE1 4.44Å; I1183-F1185 HydrophobicContact CG2-CE2 3.66Å; I1183-F1185 HydrophobicContact CG2-CZ 3.71Å
1186	M	73.1	Confident	65.5	Low	22 Å²	22	53.5 Å²	53.5	11%	0.108	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	115.5	168	179.3	179.3	-69.8	0	0	109.3	K1174 V1176 E1223 I1227	K1174-M1186 HydrophobicContact CB-CB 4.46Å; K1174-M1186 PolarHBondContact N-O 2.97Å; K1174-M1186 PolarHBondContact O-N 3.42Å; V1176-M1186 HydrophobicContact CG2-CB 3.46Å; V1176-M1186 VanDerWaalsContact CG2-CB 3.46Å; V1176-M1186 HydrophobicContact CG2-CE 4.09Å; M1186-E1223 HydrophobicContact CE-CB 4.4Å; M1186-I1227 HydrophobicContact CE-CD1 3.91Å; M1186-I1227 HydrophobicContact SD-CD1 3.67Å
1187	L	76.5	Confident	65.9	Low	3 Å²	3	54.4 Å²	54.4	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.9	175.6	-60.7	149.4	0	0	0	108.4	G1137 Y1138 L1140 V1170 V1173 L1195 L1198 L1216	G1137-L1187 CarbonylContact C-O 3.55Å; G1137-L1187 WeakPolarHBondContact CA-O 3.16Å; Y1138-L1187 PolarHBondContact N-O 2.81Å; Y1138-L1187 VanDerWaalsContact O-CB 3.3Å; Y1138-L1187 WeakPolarHBondContact O-CB 3.22Å; Y1138-L1187 PolarHBondContact O-N 3.14Å; L1140-L1187 HydrophobicContact CB-CD1 3.89Å; V1170-L1187 HydrophobicContact CB-CD2 4.26Å; V1170-L1187 HydrophobicContact CG1-CD2 4.28Å; V1170-L1187 HydrophobicContact CG2-CD2 3.93Å; V1173-L1187 HydrophobicContact CG2-CD2 3.54Å; V1173-L1187 HydrophobicContact CG2-CG 4.22Å; L1187-L1195 HydrophobicContact CD1-CD1 4.25Å; L1187-L1195 HydrophobicContact CD1-CD2 3.76Å; L1187-L1195 HydrophobicContact CD2-CD2 3.95Å; L1187-L1195 HydrophobicContact CG-CD2 4.3Å; L1187-L1198 HydrophobicContact CD2-CD2 3.98Å; L1187-L1216 HydrophobicContact CD1-CD1 4.13Å
1188	P	68.4	Low	66.8	Low	46 Å²	46	52.9 Å²	52.9	30%	0.299	28%	0.28	S	S	.	.			trans	-60.6	150.4	177.2	26.7	-35.3	0	0	0	111.5	V1170 N1172 K1190	V1170-P1188 HydrophobicContact CG1-CG 4.32Å; N1172-P1188 HydrophobicContact CB-CG 4.1Å; P1188-K1190 VanDerWaalsContact C-N 3.3Å; P1188-K1190 PolarHBondContact O-N 3.44Å
1189	G	59.9	Low	67.3	Low	56 Å²	56	48.1 Å²	48.1	58%	0.577	26%	0.258	S	S	*	.	S	Bend	trans	-61.7	77.4	-174	0	0	0	0	0	115.4	C1136	C1136-G1189 WeakPolarHBondContact O-CA 3.49Å
1190	K	55.9	Low	68.2	Low	111 Å²	111	52 Å²	52	48%	0.483	27%	0.271	S	S	.	.			trans	-104	157.3	170.6	-81.5	164.8	154.2	-87.4	0	110	Y1138 P1188 E1194	Y1138-K1190 WeakPolarHBondContact CE2-O 3.37Å; P1188-K1190 VanDerWaalsContact C-N 3.3Å; P1188-K1190 PolarHBondContact O-N 3.44Å; K1190-E1194 WeakPolarHBondContact CB-OE2 3.36Å; K1190-E1194 WeakPolarHBondContact CD-OE2 3.48Å; K1190-E1194 WeakPolarHBondContact CE-OE2 3.32Å; K1190-E1194 WeakPolarHBondContact CG-OE2 3.35Å; K1190-E1194 IonicContact NZ-OE1 3.6Å; K1190-E1194 IonicContact NZ-OE2 2.62Å; K1190-E1194 PolarHBondContact NZ-OE2 3.42Å
1191	V	58.6	Low	69.1	Low	96 Å²	96	49.8 Å²	49.8	58%	0.582	26%	0.258	S	S	*	.			trans	-64.2	142.2	-178.3	-175.5	0	0	0	0	109.9	E1193 E1194	V1191-E1193 HydrophobicContact CG1-CB 4.35Å; V1191-E1193 HydrophobicContact CG1-CG 4.35Å; V1191-E1193 PolarHBondContact O-N 3.31Å; V1191-E1194 PolarHBondContact O-N 3.23Å
1192	L	63.1	Low	70	Confident	19 Å²	19	47.3 Å²	47.3	10%	0.099	25%	0.246	C	C	.	.	H	α-helix	trans	-55.2	-28.2	-175.9	-152.8	82.6	0	0	0	113.1	Y1138 E1194 L1195 L1216 I2258 V2261 I2262	Y1138-L1192 HydrophobicContact CD1-CD1 4.01Å; Y1138-L1192 HydrophobicContact CD2-CD1 4.43Å; Y1138-L1192 HydrophobicContact CE1-CD1 3.44Å; Y1138-L1192 VanDerWaalsContact CE1-CD1 3.44Å; Y1138-L1192 HydrophobicContact CE2-CD1 3.92Å; Y1138-L1192 HydrophobicContact CG-CD1 4.48Å; L1192-E1194 VanDerWaalsContact C-N 3.29Å; L1192-E1194 PolarHBondContact O-N 3.05Å; L1192-L1195 PolarHBondContact O-N 2.81Å; L1192-L1216 HydrophobicContact CD1-CD2 4.03Å; L1192-I2258 HydrophobicContact CD2-CG2 4.06Å; L1192-V2261 HydrophobicContact CD2-CG1 4.22Å; L1192-I2262 HydrophobicContact CD2-CD1 4.27Å; L1192-I2262 HydrophobicContact CD2-CG1 3.8Å
1193	E	63.7	Low	70.3	Confident	98 Å²	98	47.7 Å²	47.7	46%	0.458	25%	0.25	S	S	.	.	H	α-helix	trans	-59	-34	175.1	-64.7	-174.1	160.3	0	0	112.9	V1191 L1195 R2266	V1191-E1193 HydrophobicContact CG1-CB 4.35Å; V1191-E1193 HydrophobicContact CG1-CG 4.35Å; V1191-E1193 PolarHBondContact O-N 3.31Å; E1193-L1195 VanDerWaalsContact C-N 3.34Å; E1193-L1195 PolarHBondContact O-N 3.01Å; E1193-R2266 IonicContact OE1-CZ 3.7Å; E1193-R2266 IonicContact OE1-NH2 2.98Å; E1193-R2266 PolarHBondContact OE1-NH2 3.37Å
1194	E	68	Low	70.3	Confident	110 Å²	110	54.7 Å²	54.7	51%	0.514	28%	0.281	S	S	.	.	H	α-helix	trans	-75.2	-19.5	178.5	-66.2	-172.2	179.1	0	0	113.6	K1190 V1191 L1192 P1197	K1190-E1194 WeakPolarHBondContact CB-OE2 3.36Å; K1190-E1194 WeakPolarHBondContact CD-OE2 3.48Å; K1190-E1194 WeakPolarHBondContact CE-OE2 3.32Å; K1190-E1194 WeakPolarHBondContact CG-OE2 3.35Å; K1190-E1194 IonicContact NZ-OE1 3.6Å; K1190-E1194 IonicContact NZ-OE2 2.62Å; K1190-E1194 PolarHBondContact NZ-OE2 3.42Å; V1191-E1194 PolarHBondContact O-N 3.23Å; L1192-E1194 VanDerWaalsContact C-N 3.29Å; L1192-E1194 PolarHBondContact O-N 3.05Å; E1194-P1197 WeakPolarHBondContact O-CD 3.3Å
1195	L	69.8	Low	70.4	Confident	13 Å²	13	58.6 Å²	58.6	7%	0.068	30%	0.295	C	S	.	.	H	α-helix	trans	-85.7	-15.6	-179.8	-74.2	167.8	0	0	0	113.2	Y1138 L1187 L1192 E1193 P1197 L1198 V1199	Y1138-L1195 HydrophobicContact CD2-CD1 3.7Å; Y1138-L1195 HydrophobicContact CE2-CD1 4.39Å; Y1138-L1195 HydrophobicContact CG-CD1 4.07Å; L1187-L1195 HydrophobicContact CD1-CD1 4.25Å; L1187-L1195 HydrophobicContact CD1-CD2 3.76Å; L1187-L1195 HydrophobicContact CD2-CD2 3.95Å; L1187-L1195 HydrophobicContact CG-CD2 4.3Å; L1192-L1195 PolarHBondContact O-N 2.81Å; E1193-L1195 VanDerWaalsContact C-N 3.34Å; E1193-L1195 PolarHBondContact O-N 3.01Å; L1195-P1197 VanDerWaalsContact C-CD 3.46Å; L1195-L1198 HydrophobicContact CD2-CD2 4.03Å; L1195-L1198 WeakPolarHBondContact O-CB 3.38Å; L1195-L1198 PolarHBondContact O-N 3.02Å; L1195-L1198 VanDerWaalsContact O-N 3.15Å; L1195-V1199 PolarHBondContact O-N 3.32Å; L1195-V1199 VanDerWaalsContact O-N 3.13Å
1196	R	68.3	Low	70.1	Confident	117 Å²	117	59.8 Å²	59.8	44%	0.442	30%	0.301	S	S	.	.	H	α-helix	trans	-55.2	-40.9	-176.3	-157.1	172.5	-177.3	-117.5	1	114	F1200 D2259	R1196-F1200 PolarHBondContact O-N 3.39Å; R1196-F1200 VanDerWaalsContact O-N 3.16Å; R1196-D2259 IonicContact CZ-OD1 3.8Å; R1196-D2259 IonicContact CZ-OD2 2.88Å; R1196-D2259 IonicContact NE-OD1 3.2Å; R1196-D2259 PolarHBondContact NE-OD1 3.27Å; R1196-D2259 IonicContact NH2-OD1 2.77Å; R1196-D2259 PolarHBondContact NH2-OD1 3.29Å; R1196-D2259 IonicContact NH2-OD2 3.39Å; R1196-D2259 PolarHBondContact NH2-OD2 2.96Å
1197	P	73.1	Confident	69.8	Low	78 Å²	78	63.6 Å²	63.6	51%	0.506	33%	0.33	S	S	.	.	H	α-helix	trans	-68.1	-38.2	177	-18.7	32.9	0	0	0	113.4	E1194 L1195 F1200 E1201	E1194-P1197 WeakPolarHBondContact O-CD 3.3Å; L1195-P1197 VanDerWaalsContact C-CD 3.46Å; P1197-F1200 PolarHBondContact O-N 3.08Å; P1197-E1201 PolarHBondContact O-N 3.04Å; P1197-E1201 VanDerWaalsContact O-N 3.11Å
1198	L	76	Confident	69.7	Low	7 Å²	7	70.4 Å²	70.4	4%	0.037	36%	0.362	C	S	.	.	H	α-helix	trans	-61.9	-47.4	178	174.6	62.7	0	0	0	110.5	Y1169 V1170 L1187 L1195 F1200 E1201 I1202	Y1169-L1198 HydrophobicContact CD1-CD1 4.12Å; Y1169-L1198 HydrophobicContact CD2-CD1 4.17Å; Y1169-L1198 HydrophobicContact CG-CD1 3.77Å; V1170-L1198 HydrophobicContact CG2-CD2 4.08Å; L1187-L1198 HydrophobicContact CD2-CD2 3.98Å; L1195-L1198 HydrophobicContact CD2-CD2 4.03Å; L1195-L1198 WeakPolarHBondContact O-CB 3.38Å; L1195-L1198 PolarHBondContact O-N 3.02Å; L1195-L1198 VanDerWaalsContact O-N 3.15Å; L1198-F1200 PolarHBondContact O-N 3.11Å; L1198-E1201 PolarHBondContact O-N 2.8Å; L1198-I1202 HydrophobicContact CD1-CD1 3.9Å; L1198-I1202 HydrophobicContact CD1-CG1 4.39Å; L1198-I1202 HydrophobicContact CG-CD1 3.8Å; L1198-I1202 WeakPolarHBondContact O-CB 3.37Å; L1198-I1202 WeakPolarHBondContact O-CD1 3.28Å; L1198-I1202 VanDerWaalsContact O-CG1 3.24Å; L1198-I1202 WeakPolarHBondContact O-CG1 3.49Å; L1198-I1202 PolarHBondContact O-N 3.41Å
1199	V	73.5	Confident	69.6	Low	2 Å²	2	69.5 Å²	69.5	1%	0.012	35%	0.353	C	S	.	.	H	α-helix	trans	-63.4	-41.3	178.9	179.2	0	0	0	0	111.6	L1195 E1201 I1202 D1203 Y1214 L2255 I2258	L1195-V1199 PolarHBondContact O-N 3.32Å; L1195-V1199 VanDerWaalsContact O-N 3.13Å; V1199-E1201 PolarHBondContact O-N 3.44Å; V1199-I1202 PolarHBondContact O-N 2.94Å; V1199-D1203 PolarHBondContact O-N 2.95Å; V1199-Y1214 HydrophobicContact CG1-CE2 3.82Å; V1199-L2255 HydrophobicContact CB-CD1 4.45Å; V1199-L2255 HydrophobicContact CG1-CD1 3.91Å; V1199-I2258 HydrophobicContact CG1-CD1 4.01Å; V1199-I2258 HydrophobicContact CG2-CD1 4.34Å
1200	F	76.4	Confident	70.1	Confident	117 Å²	117	71.8 Å²	71.8	51%	0.513	35%	0.349	S	S	.	.	H	α-helix	trans	-61.4	-43.2	177.5	-176.9	-97	0	0	0	112.9	R1196 P1197 L1198 K1204 L2255	R1196-F1200 PolarHBondContact O-N 3.39Å; R1196-F1200 VanDerWaalsContact O-N 3.16Å; P1197-F1200 PolarHBondContact O-N 3.08Å; L1198-F1200 PolarHBondContact O-N 3.11Å; F1200-K1204 PolarHBondContact O-N 3.48Å; F1200-L2255 HydrophobicContact CB-CD1 4.41Å; F1200-L2255 HydrophobicContact CD2-CD2 4.1Å
1201	E	76.6	Confident	70.6	Confident	32 Å²	32	67 Å²	67	15%	0.15	33%	0.329	C	S	.	.	H	α-helix	trans	-74.5	-27.6	179.4	-165.8	62.8	-169.1	0	0	112.4	F1165 Y1169 P1197 L1198 V1199 R1205	F1165-E1201 HydrophobicContact CZ-CG 4.15Å; Y1169-E1201 HydrophobicContact CE2-CG 4.43Å; P1197-E1201 PolarHBondContact O-N 3.04Å; P1197-E1201 VanDerWaalsContact O-N 3.11Å; L1198-E1201 PolarHBondContact O-N 2.8Å; V1199-E1201 PolarHBondContact O-N 3.44Å; E1201-R1205 WeakPolarHBondContact O-CG 3.2Å; E1201-R1205 PolarHBondContact O-N 3.41Å; E1201-R1205 IonicContact OE1-CZ 3.54Å; E1201-R1205 IonicContact OE1-NE 3.53Å; E1201-R1205 PolarHBondContact OE1-NE 3.07Å; E1201-R1205 IonicContact OE1-NH2 2.71Å; E1201-R1205 PolarHBondContact OE1-NH2 3.05Å
1202	I	76.4	Confident	71.1	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-64.3	-51.4	169.9	-74.6	162.5	0	0	0	111.3	L1140 F1142 F1165 L1198 V1199 K1204 R1205 L1206 Y1214	L1140-I1202 HydrophobicContact CD1-CD1 4.45Å; L1140-I1202 HydrophobicContact CD2-CD1 3.79Å; F1142-I1202 HydrophobicContact CE1-CD1 4.42Å; F1142-I1202 HydrophobicContact CE1-CG1 4.34Å; F1142-I1202 HydrophobicContact CE1-CG2 3.64Å; F1142-I1202 HydrophobicContact CZ-CD1 3.73Å; F1142-I1202 HydrophobicContact CZ-CG1 4Å; F1142-I1202 HydrophobicContact CZ-CG2 4.07Å; F1165-I1202 HydrophobicContact CE1-CG1 4.08Å; L1198-I1202 HydrophobicContact CD1-CD1 3.9Å; L1198-I1202 HydrophobicContact CD1-CG1 4.39Å; L1198-I1202 HydrophobicContact CG-CD1 3.8Å; L1198-I1202 WeakPolarHBondContact O-CB 3.37Å; L1198-I1202 WeakPolarHBondContact O-CD1 3.28Å; L1198-I1202 VanDerWaalsContact O-CG1 3.24Å; L1198-I1202 WeakPolarHBondContact O-CG1 3.49Å; L1198-I1202 PolarHBondContact O-N 3.41Å; V1199-I1202 PolarHBondContact O-N 2.94Å; I1202-K1204 PolarHBondContact O-N 2.73Å; I1202-K1204 VanDerWaalsContact O-N 3.15Å; I1202-R1205 PolarHBondContact O-N 2.88Å; I1202-L1206 HydrophobicContact CG2-CD1 3.8Å; I1202-L1206 PolarHBondContact O-N 2.77Å; I1202-Y1214 HydrophobicContact CG2-CD1 4.02Å; I1202-Y1214 HydrophobicContact CG2-CD2 4.3Å; I1202-Y1214 HydrophobicContact CG2-CE1 4.19Å; I1202-Y1214 HydrophobicContact CG2-CE2 4.48Å; I1202-Y1214 HydrophobicContact CG2-CG 4.08Å
1203	D	72.4	Confident	71.3	Confident	62 Å²	62	65.3 Å²	65.3	33%	0.332	32%	0.321	S	S	.	.	H	α-helix	trans	-57.2	-34.1	-178	-149.9	51.9	0	0	0	111.1	V1199 Y1214	V1199-D1203 PolarHBondContact O-N 2.95Å; D1203-Y1214 HydrophobicContact CB-CE1 4.48Å; D1203-Y1214 VanDerWaalsContact CG-OH 3.29Å; D1203-Y1214 WeakPolarHBondContact OD1-CE1 3.16Å; D1203-Y1214 PolarHBondContact OD1-OH 2.8Å
1204	K	74.9	Confident	72	Confident	148 Å²	148	60.8 Å²	60.8	64%	0.643	30%	0.299	S	S	*	.	H	α-helix	trans	-75.7	-28.2	178.8	-161.2	176.1	-176.1	-175.9	0	114.5	F1200 I1202	F1200-K1204 PolarHBondContact O-N 3.48Å; I1202-K1204 PolarHBondContact O-N 2.73Å; I1202-K1204 VanDerWaalsContact O-N 3.15Å
1205	R	76	Confident	72.2	Confident	92 Å²	92	55.7 Å²	55.7	35%	0.347	28%	0.276	S	S	.	.	H	α-helix	trans	-108.1	-1	-176.3	-63.8	-172.6	-168.7	-151.1	4.9	114.7	E1201 I1202 S1207 Q1208 F1209	E1201-R1205 WeakPolarHBondContact O-CG 3.2Å; E1201-R1205 PolarHBondContact O-N 3.41Å; E1201-R1205 IonicContact OE1-CZ 3.54Å; E1201-R1205 IonicContact OE1-NE 3.53Å; E1201-R1205 PolarHBondContact OE1-NE 3.07Å; E1201-R1205 IonicContact OE1-NH2 2.71Å; E1201-R1205 PolarHBondContact OE1-NH2 3.05Å; I1202-R1205 PolarHBondContact O-N 2.88Å; R1205-S1207 PolarHBondContact O-N 2.93Å; R1205-Q1208 WeakPolarHBondContact O-CB 3.32Å; R1205-Q1208 PolarHBondContact O-N 3.27Å; R1205-F1209 HydrophobicContact CB-CD2 4.14Å; R1205-F1209 HydrophobicContact CB-CE2 3.68Å; R1205-F1209 WeakPolarHBondContact O-CD2 3.36Å
1206	L	71.3	Confident	72.5	Confident	25 Å²	25	55.6 Å²	55.6	13%	0.131	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-40.2	-170.1	-150.9	77.5	0	0	0	114.6	F1142 I1202 F1209 C1211 Y1214	F1142-L1206 HydrophobicContact CD1-CD1 4.4Å; F1142-L1206 HydrophobicContact CE1-CD1 4.35Å; I1202-L1206 HydrophobicContact CG2-CD1 3.8Å; I1202-L1206 PolarHBondContact O-N 2.77Å; L1206-F1209 PolarHBondContact O-N 3.39Å; L1206-C1211 HydrophobicContact CD1-CB 4.15Å; L1206-C1211 HydrophobicContact CG-CB 4Å; L1206-C1211 PolarHBondContact O-N 3.02Å; L1206-Y1214 HydrophobicContact CD1-CD1 3.49Å; L1206-Y1214 VanDerWaalsContact CD1-CD1 3.49Å; L1206-Y1214 HydrophobicContact CD1-CE1 4.13Å; L1206-Y1214 HydrophobicContact CD1-CG 4.31Å; L1206-Y1214 HydrophobicContact CD2-CD1 4.05Å; L1206-Y1214 HydrophobicContact CD2-CE1 4.43Å; L1206-Y1214 HydrophobicContact CG-CD1 4.44Å
1207	S	67.7	Low	72.6	Confident	102 Å²	102	51 Å²	51	71%	0.713	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-29.7	178.8	54.7	0	0	0	0	114.2	R1205 F1209 Q1210	R1205-S1207 PolarHBondContact O-N 2.93Å; S1207-F1209 VanDerWaalsContact C-N 3.27Å; S1207-F1209 PolarHBondContact O-N 3.41Å; S1207-Q1210 PolarHBondContact O-N 2.04Å
1208	Q	73.3	Confident	72.4	Confident	145 Å²	145	49.2 Å²	49.2	68%	0.678	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-28.7	175.9	-68.5	-175.2	-29.8	0	0	112	R1205	R1205-Q1208 WeakPolarHBondContact O-CB 3.32Å; R1205-Q1208 PolarHBondContact O-N 3.27Å
1209	F	67.4	Low	72.1	Confident	27 Å²	27	48.9 Å²	48.9	12%	0.118	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	9.5	-179.5	-60.6	-65	0	0	0	113.9	L1162 F1165 R1205 L1206 S1207 C1211	L1162-F1209 HydrophobicContact CB-CD1 4.27Å; L1162-F1209 HydrophobicContact CD1-CB 3.83Å; L1162-F1209 HydrophobicContact CD1-CD1 3.81Å; L1162-F1209 HydrophobicContact CD1-CD2 3.85Å; L1162-F1209 HydrophobicContact CD1-CE1 4.29Å; L1162-F1209 HydrophobicContact CD1-CE2 4.31Å; L1162-F1209 HydrophobicContact CD1-CG 3.57Å; F1165-F1209 HydrophobicContact CB-CE1 4.4Å; F1165-F1209 HydrophobicContact CB-CZ 4.07Å; F1165-F1209 HydrophobicContact CD1-CE2 4.26Å; F1165-F1209 HydrophobicContact CD1-CZ 4.03Å; F1165-F1209 HydrophobicContact CD2-CZ 4.14Å; F1165-F1209 HydrophobicContact CE1-CE2 4.43Å; F1165-F1209 HydrophobicContact CG-CE2 4.46Å; F1165-F1209 AromaticContact CG-CZ 3.81Å; F1165-F1209 HydrophobicContact CG-CZ 3.81Å; R1205-F1209 HydrophobicContact CB-CD2 4.14Å; R1205-F1209 HydrophobicContact CB-CE2 3.68Å; R1205-F1209 WeakPolarHBondContact O-CD2 3.36Å; L1206-F1209 PolarHBondContact O-N 3.39Å; S1207-F1209 VanDerWaalsContact C-N 3.27Å; S1207-F1209 PolarHBondContact O-N 3.41Å; F1209-C1211 PolarHBondContact O-N 3.38Å; F1209-C1211 PolarHBondContact O-SG 2.73Å; F1209-C1211 VanDerWaalsContact O-SG 3.35Å
1210	Q	69	Low	71.8	Confident	105 Å²	105	50.5 Å²	50.5	49%	0.491	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	32.4	-174.5	-59.2	-175.5	-28.7	0	0	113.7	S1207	S1207-Q1210 PolarHBondContact O-N 2.04Å
1211	C	68.1	Low	71.2	Confident	10 Å²	10	45.1 Å²	45.1	7%	0.068	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.1	177.9	-65.9	0	0	0	0	110.2	F1142 T1143 L1206 F1209	F1142-C1211 HydrophobicContact CD1-CB 4.49Å; T1143-C1211 CarbonylContact O-C 3.45Å; T1143-C1211 VanDerWaalsContact O-CA 3.27Å; T1143-C1211 WeakPolarHBondContact O-CA 3.26Å; L1206-C1211 HydrophobicContact CD1-CB 4.15Å; L1206-C1211 HydrophobicContact CG-CB 4Å; L1206-C1211 PolarHBondContact O-N 3.02Å; F1209-C1211 PolarHBondContact O-N 3.38Å; F1209-C1211 PolarHBondContact O-SG 2.73Å; F1209-C1211 VanDerWaalsContact O-SG 3.35Å
1212	V	67.1	Low	70.5	Confident	73 Å²	73	45 Å²	45	44%	0.442	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-39.7	-178.5	-178.3	0	0	0	0	111.2	T1143	T1143-V1212 PolarHBondContact O-N 3.12Å
1213	A	69.2	Low	69.8	Low	7 Å²	7	46.1 Å²	46.1	6%	0.058	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	162.2	-175.4	0	0	0	0	0	110.3	T1143	T1143-A1213 PolarHBondContact N-O 2.9Å
1214	Y	77.1	Confident	69.2	Low	3 Å²	3	43.6 Å²	43.6	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	151.5	170.1	65	-82.2	0	0	0	110	L1140 T1141 V1199 I1202 D1203 L1206 Y2205 V2254	L1140-Y1214 HydrophobicContact CD1-CD2 4.48Å; T1141-Y1214 CarbonylContact O-C 3.59Å; T1141-Y1214 WeakPolarHBondContact O-CA 3.48Å; T1141-Y1214 VanDerWaalsContact O-CB 3.26Å; T1141-Y1214 WeakPolarHBondContact O-CB 3.49Å; V1199-Y1214 HydrophobicContact CG1-CE2 3.82Å; I1202-Y1214 HydrophobicContact CG2-CD1 4.02Å; I1202-Y1214 HydrophobicContact CG2-CD2 4.3Å; I1202-Y1214 HydrophobicContact CG2-CE1 4.19Å; I1202-Y1214 HydrophobicContact CG2-CE2 4.48Å; I1202-Y1214 HydrophobicContact CG2-CG 4.08Å; D1203-Y1214 HydrophobicContact CB-CE1 4.48Å; D1203-Y1214 VanDerWaalsContact CG-OH 3.29Å; D1203-Y1214 WeakPolarHBondContact OD1-CE1 3.16Å; D1203-Y1214 PolarHBondContact OD1-OH 2.8Å; L1206-Y1214 HydrophobicContact CD1-CD1 3.49Å; L1206-Y1214 VanDerWaalsContact CD1-CD1 3.49Å; L1206-Y1214 HydrophobicContact CD1-CE1 4.13Å; L1206-Y1214 HydrophobicContact CD1-CG 4.31Å; L1206-Y1214 HydrophobicContact CD2-CD1 4.05Å; L1206-Y1214 HydrophobicContact CD2-CE1 4.43Å; L1206-Y1214 HydrophobicContact CG-CD1 4.44Å; Y1214-Y2205 WeakPolarHBondContact O-CE1 3.2Å; Y1214-V2254 HydrophobicContact CE2-CB 4.39Å; Y1214-V2254 HydrophobicContact CE2-CG1 3.72Å
1215	G	73.2	Confident	68.1	Low	3 Å²	3	37.1 Å²	37.1	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	153.8	179.5	0	0	0	0	0	111.9	L1140 T1141	L1140-G1215 WeakPolarHBondContact CA-O 3.46Å; T1141-G1215 PolarHBondContact N-O 3.34Å; T1141-G1215 PolarHBondContact O-N 2.76Å
1216	L	75.5	Confident	67.1	Low	10 Å²	10	36.6 Å²	36.6	5%	0.052	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	97.6	177.3	-168.2	83.9	0	0	0	109.7	N1139 L1140 L1187 L1192 I2258 L2275	N1139-L1216 CarbonylContact O-C 3.55Å; N1139-L1216 WeakPolarHBondContact O-CA 3.09Å; L1140-L1216 HydrophobicContact CB-CD1 4.29Å; L1140-L1216 HydrophobicContact CD1-CD1 3.8Å; L1187-L1216 HydrophobicContact CD1-CD1 4.13Å; L1192-L1216 HydrophobicContact CD1-CD2 4.03Å; L1216-I2258 HydrophobicContact CD2-CD1 4.41Å; L1216-L2275 CarbonylContact C-O 3.57Å; L1216-L2275 PolarHBondContact N-O 3.47Å; L1216-L2275 VanDerWaalsContact N-O 3.07Å; L1216-L2275 PolarHBondContact O-N 3.31Å
1217	S	70.2	Confident	66.1	Low	22 Å²	22	38 Å²	38	15%	0.154	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	144.2	-179.5	59.5	0	0	0	0	111.8	Y1138 N1139 N2276	Y1138-S1217 CarbonylContact C-O 3.31Å; Y1138-S1217 WeakPolarHBondContact CA-O 3.28Å; N1139-S1217 WeakPolarHBondContact CB-OG 3.11Å; N1139-S1217 PolarHBondContact N-O 3.11Å; N1139-S1217 PolarHBondContact O-N 3.13Å; S1217-N2276 VanDerWaalsContact CB-OD1 3.23Å; S1217-N2276 WeakPolarHBondContact CB-OD1 3.34Å
1218	E	68.9	Low	65.2	Low	40 Å²	40	33.9 Å²	33.9	19%	0.187	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.3	169.3	-151.2	163.5	-138.5	0	0	107.1	Y1138 S1220 K2265 A2272 C2273	Y1138-E1218 HydrophobicContact CD1-CB 4.33Å; Y1138-E1218 HydrophobicContact CD1-CG 4.27Å; Y1138-E1218 HydrophobicContact CE1-CB 4.19Å; Y1138-E1218 HydrophobicContact CE1-CG 3.81Å; E1218-S1220 PolarHBondContact O-N 3.07Å; E1218-K2265 IonicContact OE1-NZ 3.53Å; E1218-K2265 PolarHBondContact OE1-NZ 2.97Å; E1218-A2272 VanDerWaalsContact OE2-CA 3.25Å; E1218-A2272 WeakPolarHBondContact OE2-CA 3.38Å; E1218-A2272 WeakPolarHBondContact OE2-CB 3.47Å; E1218-C2273 PolarHBondContact OE2-N 3.38Å
1219	S	68.9	Low	64	Low	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-58.2	136.7	-170.5	50.6	0	0	0	0	112.7	K1131 C1136 G1137	K1131-S1219 PolarHBondContact NZ-O 2.74Å; C1136-S1219 WeakPolarHBondContact CB-OG 3.29Å; G1137-S1219 PolarHBondContact N-OG 3.38Å; G1137-S1219 VanDerWaalsContact O-CB 3.26Å; G1137-S1219 WeakPolarHBondContact O-CB 3.18Å; G1137-S1219 PolarHBondContact O-N 3.37Å; G1137-S1219 PolarHBondContact O-OG 2.74Å
1220	S	67.6	Low	62.9	Low	36 Å²	36	30.2 Å²	30.2	25%	0.252	17%	0.168	S	C	.	.	P	Polyproline II helix	trans	-75.2	157.8	-175.1	65.4	0	0	0	0	111.8	E1218 E1222 E1223 T1224	E1218-S1220 PolarHBondContact O-N 3.07Å; S1220-E1222 PolarHBondContact O-N 3.43Å; S1220-E1223 PolarHBondContact N-OE2 2.98Å; S1220-E1223 PolarHBondContact O-N 3.47Å; S1220-E1223 VanDerWaalsContact OG-CD 3.31Å; S1220-E1223 VanDerWaalsContact OG-CG 3.31Å; S1220-E1223 WeakPolarHBondContact OG-CG 3.3Å; S1220-E1223 PolarHBondContact OG-N 2.93Å; S1220-E1223 PolarHBondContact OG-OE2 3.25Å; S1220-T1224 PolarHBondContact O-N 2.94Å; S1220-T1224 PolarHBondContact O-OG1 2.7Å; S1220-T1224 VanDerWaalsContact O-OG1 3.05Å
1221	L	64.4	Low	61.6	Low	4 Å²	4	30.4 Å²	30.4	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-66.6	-16.2	174.2	-147.7	129.2	0	0	0	112.5	F1103 E1107 I1113 I1115 A1127 L1130 K1131 N1225	F1103-L1221 HydrophobicContact CD1-CB 4.15Å; F1103-L1221 HydrophobicContact CD1-CD2 3.83Å; F1103-L1221 HydrophobicContact CE1-CD2 3.92Å; F1103-L1221 WeakPolarHBondContact CE1-O 3.37Å; E1107-L1221 PolarHBondContact OE2-N 3.31Å; I1113-L1221 HydrophobicContact CD1-CD1 3.93Å; I1113-L1221 HydrophobicContact CD1-CD2 3.93Å; I1113-L1221 HydrophobicContact CG2-CD2 4.23Å; I1115-L1221 HydrophobicContact CD1-CD2 4.39Å; A1127-L1221 HydrophobicContact CB-CD1 4.04Å; L1130-L1221 HydrophobicContact CB-CD1 4.22Å; L1130-L1221 HydrophobicContact CD1-CD2 4.39Å; K1131-L1221 HydrophobicContact CG-CD1 4.05Å; L1221-N1225 WeakPolarHBondContact O-CB 3.16Å
1222	E	61.9	Low	60.3	Low	30 Å²	30	35.2 Å²	35.2	14%	0.14	20%	0.196	C	C	.	.	H	α-helix	trans	-73.3	-49.7	172.8	-169.8	168.6	152.9	0	0	111.9	F1103 S1220 N1225 Q1226 R2155	F1103-E1222 HydrophobicContact CB-CB 3.79Å; F1103-E1222 HydrophobicContact CB-CG 4.48Å; F1103-E1222 HydrophobicContact CD1-CB 4.25Å; F1103-E1222 HydrophobicContact CD2-CB 3.71Å; F1103-E1222 HydrophobicContact CD2-CG 3.58Å; F1103-E1222 HydrophobicContact CE2-CB 4.34Å; F1103-E1222 HydrophobicContact CE2-CG 3.98Å; F1103-E1222 HydrophobicContact CG-CB 3.66Å; F1103-E1222 HydrophobicContact CG-CG 4.1Å; S1220-E1222 PolarHBondContact O-N 3.43Å; E1222-N1225 PolarHBondContact O-N 3.1Å; E1222-Q1226 WeakPolarHBondContact O-CG 3.16Å; E1222-Q1226 PolarHBondContact O-N 3.3Å; E1222-Q1226 VanDerWaalsContact O-N 3.08Å; E1222-R2155 IonicContact OE1-CZ 3.81Å; E1222-R2155 IonicContact OE1-NE 2.78Å; E1222-R2155 PolarHBondContact OE1-NE 3.01Å; E1222-R2155 IonicContact OE1-NH2 3.18Å; E1222-R2155 PolarHBondContact OE1-NH2 3.09Å
1223	E	62.2	Low	59	Low	25 Å²	25	33 Å²	33	12%	0.117	18%	0.182	C	C	.	.	H	α-helix	trans	-69.6	-37.3	-174.4	-67.4	162.1	127.1	0	0	112.8	N1139 Q1184 M1186 S1220 Q1226 I1227	N1139-E1223 PolarHBondContact ND2-OE1 2.79Å; N1139-E1223 PolarHBondContact ND2-OE2 2.84Å; Q1184-E1223 PolarHBondContact NE2-OE1 2.03Å; M1186-E1223 HydrophobicContact CE-CB 4.4Å; S1220-E1223 PolarHBondContact N-OE2 2.98Å; S1220-E1223 PolarHBondContact O-N 3.47Å; S1220-E1223 VanDerWaalsContact OG-CD 3.31Å; S1220-E1223 VanDerWaalsContact OG-CG 3.31Å; S1220-E1223 WeakPolarHBondContact OG-CG 3.3Å; S1220-E1223 PolarHBondContact OG-N 2.93Å; S1220-E1223 PolarHBondContact OG-OE2 3.25Å; E1223-Q1226 PolarHBondContact O-N 2.83Å; E1223-I1227 PolarHBondContact O-N 2.79Å
1224	T	58.4	Low	57.5	Low	9 Å²	9	36.4 Å²	36.4	6%	0.055	20%	0.199	C	C	.	.	H	α-helix	trans	-65.6	-39.9	173.7	35.6	0	0	0	0	112	C1136 S1220 Q1226 I1227 A1228	C1136-T1224 HydrophobicContact CB-CG2 4.45Å; C1136-T1224 WeakPolarHBondContact SG-CG2 3.39Å; S1220-T1224 PolarHBondContact O-N 2.94Å; S1220-T1224 PolarHBondContact O-OG1 2.7Å; S1220-T1224 VanDerWaalsContact O-OG1 3.05Å; T1224-Q1226 VanDerWaalsContact C-N 3.28Å; T1224-Q1226 PolarHBondContact O-N 3.27Å; T1224-I1227 PolarHBondContact O-N 3.08Å; T1224-I1227 VanDerWaalsContact O-N 3.13Å; T1224-A1228 PolarHBondContact O-N 3.37Å; T1224-A1228 VanDerWaalsContact O-N 3.09Å
1225	N	53.3	Low	55.6	Low	12 Å²	12	42 Å²	42	6%	0.064	23%	0.234	C	C	.	.	H	α-helix	trans	-67.7	-29.8	178.1	-154	0.1	0	0	0	111.7	F1103 I1115 L1221 E1222 A1228 F1229	F1103-N1225 HydrophobicContact CE1-CB 4.22Å; F1103-N1225 WeakPolarHBondContact CE1-ND2 3.31Å; F1103-N1225 HydrophobicContact CZ-CB 4.22Å; F1103-N1225 WeakPolarHBondContact CZ-ND2 3.38Å; I1115-N1225 WeakPolarHBondContact CD1-ND2 3.4Å; L1221-N1225 WeakPolarHBondContact O-CB 3.16Å; E1222-N1225 PolarHBondContact O-N 3.1Å; N1225-A1228 PolarHBondContact O-N 3.25Å; N1225-F1229 WeakPolarHBondContact O-CB 3.42Å; N1225-F1229 PolarHBondContact O-N 3.18Å
1226	Q	54.1	Low	53.7	Low	80 Å²	80	49.7 Å²	49.7	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-63.6	-37.3	170.2	-69.4	-160.9	-63.2	0	0	113.4	E1222 E1223 T1224 A1230 R2155	E1222-Q1226 WeakPolarHBondContact O-CG 3.16Å; E1222-Q1226 PolarHBondContact O-N 3.3Å; E1222-Q1226 VanDerWaalsContact O-N 3.08Å; E1223-Q1226 PolarHBondContact O-N 2.83Å; T1224-Q1226 VanDerWaalsContact C-N 3.28Å; T1224-Q1226 PolarHBondContact O-N 3.27Å; Q1226-A1230 WeakPolarHBondContact O-CB 3.02Å; Q1226-A1230 PolarHBondContact O-N 3.19Å; Q1226-R2155 VanDerWaalsContact CD-CZ 3.44Å; Q1226-R2155 VanDerWaalsContact NE2-CZ 3.3Å; Q1226-R2155 VanDerWaalsContact NE2-NH1 3.13Å; Q1226-R2155 VanDerWaalsContact OE1-CZ 3.28Å
1227	I	51.7	Low	51.8	Low	54 Å²	54	54.1 Å²	54.1	28%	0.277	29%	0.286	S	S	.	.	H	α-helix	trans	-69.7	-44.3	177.4	-62.2	169.6	0	0	0	109.7	M1186 E1223 T1224 A1230 D1231	M1186-I1227 HydrophobicContact CE-CD1 3.91Å; M1186-I1227 HydrophobicContact SD-CD1 3.67Å; E1223-I1227 PolarHBondContact O-N 2.79Å; T1224-I1227 PolarHBondContact O-N 3.08Å; T1224-I1227 VanDerWaalsContact O-N 3.13Å; I1227-A1230 PolarHBondContact O-N 3.36Å; I1227-D1231 PolarHBondContact O-N 3.02Å; I1227-D1231 VanDerWaalsContact O-N 3.09Å
1228	A	48.6	Very low	50	Low	17 Å²	17	60.9 Å²	60.9	14%	0.14	31%	0.312	C	S	.	.	H	α-helix	trans	-63.3	-42.3	175.9	0	0	0	0	0	113.1	Y1134 T1224 N1225 I1232	Y1134-A1228 HydrophobicContact CD1-CB 3.86Å; Y1134-A1228 HydrophobicContact CE1-CB 3.61Å; T1224-A1228 PolarHBondContact O-N 3.37Å; T1224-A1228 VanDerWaalsContact O-N 3.09Å; N1225-A1228 PolarHBondContact O-N 3.25Å; A1228-I1232 WeakPolarHBondContact O-CG1 3.34Å; A1228-I1232 PolarHBondContact O-N 3.01Å
1229	F	47.2	Very low	48.3	Very low	52 Å²	52	70.3 Å²	70.3	23%	0.228	35%	0.346	C	S	.	.	H	α-helix	trans	-66.2	-40.8	172	-103.9	-102	0	0	0	111.7	I1115 A1117 N1225 D1231 I1232 V1233	I1115-F1229 HydrophobicContact CG2-CE2 4.46Å; A1117-F1229 HydrophobicContact CB-CE1 4.17Å; A1117-F1229 HydrophobicContact CB-CE2 4.35Å; A1117-F1229 HydrophobicContact CB-CZ 3.49Å; A1117-F1229 VanDerWaalsContact CB-CZ 3.49Å; N1225-F1229 WeakPolarHBondContact O-CB 3.42Å; N1225-F1229 PolarHBondContact O-N 3.18Å; F1229-D1231 VanDerWaalsContact C-N 3.32Å; F1229-D1231 PolarHBondContact O-N 3.48Å; F1229-I1232 PolarHBondContact O-N 3.43Å; F1229-V1233 HydrophobicContact CD1-CG2 4.03Å; F1229-V1233 WeakPolarHBondContact O-CB 3.5Å; F1229-V1233 WeakPolarHBondContact O-CG2 3.49Å; F1229-V1233 PolarHBondContact O-N 3.06Å
1230	A	45.4	Very low	46.6	Very low	43 Å²	43	74 Å²	74	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-58	-44.2	179.4	0	0	0	0	0	111	Q1226 I1227 V1233 L1234	Q1226-A1230 WeakPolarHBondContact O-CB 3.02Å; Q1226-A1230 PolarHBondContact O-N 3.19Å; I1227-A1230 PolarHBondContact O-N 3.36Å; A1230-V1233 PolarHBondContact O-N 2.82Å; A1230-L1234 WeakPolarHBondContact O-CA 3.42Å; A1230-L1234 WeakPolarHBondContact O-CB 3.2Å; A1230-L1234 WeakPolarHBondContact O-CD1 3.49Å; A1230-L1234 WeakPolarHBondContact O-CG 3.24Å; A1230-L1234 PolarHBondContact O-N 2.74Å
1231	D	41.4	Very low	45	Very low	109 Å²	109	79.7 Å²	79.7	58%	0.583	39%	0.393	S	S	*	.	H	α-helix	trans	-67.2	-38.1	179.1	-74	-25.6	0	0	0	113	I1227 F1229 T1235	I1227-D1231 PolarHBondContact O-N 3.02Å; I1227-D1231 VanDerWaalsContact O-N 3.09Å; F1229-D1231 VanDerWaalsContact C-N 3.32Å; F1229-D1231 PolarHBondContact O-N 3.48Å; D1231-T1235 PolarHBondContact O-OG1 2.89Å
1232	I	40.9	Very low	43.3	Very low	110 Å²	110	89.2 Å²	89.2	56%	0.564	43%	0.434	S	S	*	.	H	α-helix	trans	-74.1	-26.8	176.4	-63.2	170.8	0	0	0	112.2	A1228 F1229 T1235	A1228-I1232 WeakPolarHBondContact O-CG1 3.34Å; A1228-I1232 PolarHBondContact O-N 3.01Å; F1229-I1232 PolarHBondContact O-N 3.43Å; I1232-T1235 PolarHBondContact O-OG1 3.31Å
1233	V	39.4	Very low	41.9	Very low	27 Å²	27	91 Å²	91	16%	0.164	45%	0.45	C	S	.	.	H	α-helix	trans	-94.5	-24.8	-178.3	175.7	0	0	0	0	111.9	F1229 A1230 T1235 F1236 F1237	F1229-V1233 HydrophobicContact CD1-CG2 4.03Å; F1229-V1233 WeakPolarHBondContact O-CB 3.5Å; F1229-V1233 WeakPolarHBondContact O-CG2 3.49Å; F1229-V1233 PolarHBondContact O-N 3.06Å; A1230-V1233 PolarHBondContact O-N 2.82Å; V1233-T1235 PolarHBondContact O-N 2.75Å; V1233-F1236 CarbonylContact O-C 3.56Å; V1233-F1236 WeakPolarHBondContact O-CA 3.38Å; V1233-F1236 PolarHBondContact O-N 2.94Å; V1233-F1237 HydrophobicContact CG1-CB 4.3Å; V1233-F1237 HydrophobicContact CG1-CD2 3.29Å; V1233-F1237 HydrophobicContact CG1-CE2 3.84Å; V1233-F1237 HydrophobicContact CG1-CG 4.04Å; V1233-F1237 PolarHBondContact O-N 3.37Å
1234	L	37.8	Very low	40.3	Very low	78 Å²	78	93.4 Å²	93.4	41%	0.408	46%	0.463	S	S	.	.	H	α-helix	trans	-61.3	-27.8	175.4	-90.7	162.9	0	0	0	112.6	A1230 F1236 K1238	A1230-L1234 WeakPolarHBondContact O-CA 3.42Å; A1230-L1234 WeakPolarHBondContact O-CB 3.2Å; A1230-L1234 WeakPolarHBondContact O-CD1 3.49Å; A1230-L1234 WeakPolarHBondContact O-CG 3.24Å; A1230-L1234 PolarHBondContact O-N 2.74Å; L1234-F1236 PolarHBondContact O-N 2.84Å; L1234-K1238 HydrophobicContact CD2-CG 4.34Å; L1234-K1238 WeakPolarHBondContact O-CB 3.35Å; L1234-K1238 PolarHBondContact O-N 3.38Å
1235	T	35.8	Very low	39.1	Very low	122 Å²	122	101.9 Å²	101.9	75%	0.748	50%	0.502	S	S	*	.	H	α-helix	trans	-67.7	-19.4	171	-1.6	0	0	0	0	113.1	D1231 I1232 V1233	D1231-T1235 PolarHBondContact O-OG1 2.89Å; I1232-T1235 PolarHBondContact O-OG1 3.31Å; V1233-T1235 PolarHBondContact O-N 2.75Å
1236	F	34.9	Very low	38.2	Very low	163 Å²	163	107.8 Å²	107.8	72%	0.715	53%	0.534	S	S	*	.	H	α-helix	trans	-106.8	-41.7	178	-111.7	-90.5	0	0	0	113.3	V1233 L1234	V1233-F1236 CarbonylContact O-C 3.56Å; V1233-F1236 WeakPolarHBondContact O-CA 3.38Å; V1233-F1236 PolarHBondContact O-N 2.94Å; L1234-F1236 PolarHBondContact O-N 2.84Å
1237	F	35.3	Very low	37.4	Very low	103 Å²	103	106.3 Å²	106.3	45%	0.452	54%	0.536	S	S	.	.	H	α-helix	trans	-77.7	-20.5	-173.9	-101.5	-105.7	0	0	0	114.7	V1233 R1239 S1240 F1241	V1233-F1237 HydrophobicContact CG1-CB 4.3Å; V1233-F1237 HydrophobicContact CG1-CD2 3.29Å; V1233-F1237 HydrophobicContact CG1-CE2 3.84Å; V1233-F1237 HydrophobicContact CG1-CG 4.04Å; V1233-F1237 PolarHBondContact O-N 3.37Å; F1237-R1239 PolarHBondContact O-N 3.1Å; F1237-S1240 PolarHBondContact O-N 3.33Å; F1237-F1241 HydrophobicContact CD1-CD2 4.38Å; F1237-F1241 PolarHBondContact O-N 3.06Å
1238	K	31.7	Very low	36.8	Very low	164 Å²	164	109.2 Å²	109.2	71%	0.713	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-9.4	172.9	-89.6	-179.4	172.7	173.7	0	114.2	L1234	L1234-K1238 HydrophobicContact CD2-CG 4.34Å; L1234-K1238 WeakPolarHBondContact O-CB 3.35Å; L1234-K1238 PolarHBondContact O-N 3.38Å
1239	R	33	Very low	36.3	Very low	238 Å²	238	112.7 Å²	112.7	90%	0.898	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-14.9	172.5	-111.2	177.5	176.9	160.6	-0.4	115.6	F1237	F1237-R1239 PolarHBondContact O-N 3.1Å
1240	S	34.5	Very low	35.9	Very low	79 Å²	79	118.1 Å²	118.1	55%	0.552	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	-18.7	-176.5	-69	0	0	0	0	114.7	F1237 K1242	F1237-S1240 PolarHBondContact O-N 3.33Å; S1240-K1242 PolarHBondContact O-N 2.95Å
1241	F	32.2	Very low	35.8	Very low	155 Å²	155	118.1 Å²	118.1	68%	0.68	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	8.6	-178.7	-110.6	-88.7	0	0	0	115.4	F1237	F1237-F1241 HydrophobicContact CD1-CD2 4.38Å; F1237-F1241 PolarHBondContact O-N 3.06Å
1242	K	30.1	Very low	36	Very low	203 Å²	203	120.4 Å²	120.4	88%	0.883	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	18.5	-176.2	-133.5	-179.7	-175.3	-173.9	0	114.9	S1240	S1240-K1242 PolarHBondContact O-N 2.95Å
1243	S	31.3	Very low	36.1	Very low	68 Å²	68	122.2 Å²	122.2	48%	0.476	61%	0.606	S	S	.	*	S	Bend	trans	-134.8	19.4	180	73.7	0	0	0	0	114.7
1244	N	29.9	Very low	36.6	Very low	75 Å²	75	122.4 Å²	122.4	40%	0.401	61%	0.606	S	S	.	*			trans	-105.9	11.4	-170.3	-94.1	11.7	0	0	0	115.4
1245	Q	33.6	Very low	37.1	Very low	187 Å²	187	124.4 Å²	124.4	87%	0.874	61%	0.613	S	S	*	*	S	Bend	trans	-86.7	-22.9	169.6	-82.7	-179.5	-37.3	0	0	113.4
1246	D	34.5	Very low	38.1	Very low	136 Å²	136	122.7 Å²	122.7	73%	0.727	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-3.4	-178.2	-57.2	-42.1	0	0	0	114.6	S1249	D1246-S1249 PolarHBondContact O-OG 3.32Å
1247	A	35.7	Very low	39	Very low	50 Å²	50	117.6 Å²	117.6	41%	0.413	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.4	-17.3	-176.7	0	0	0	0	0	114.3
1248	N	38.7	Very low	40	Very low	114 Å²	114	119.4 Å²	119.4	61%	0.61	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-9.6	-174.7	-78.1	-16.7	0	0	0	114.2
1249	S	39.8	Very low	41.4	Very low	91 Å²	91	117.2 Å²	117.2	64%	0.636	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-24.6	175.2	51.1	0	0	0	0	113.8	D1246	D1246-S1249 PolarHBondContact O-OG 3.32Å
1250	F	38.7	Very low	42.8	Very low	166 Å²	166	111.3 Å²	111.3	73%	0.728	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-1.5	-175.5	-95.4	-81.4	0	0	0	115.4
1251	L	43.3	Very low	44.2	Very low	42 Å²	42	116.9 Å²	116.9	22%	0.22	59%	0.588	C	S	.	*	T	Hydrogen-bonded Turn	trans	-99.2	-0.1	-171.3	-79	164.4	0	0	0	115.1
1252	H	44.4	Very low	45.9	Very low	157 Å²	157	110.7 Å²	110.7	73%	0.727	57%	0.568	S	S	*	*	S	Bend	trans	-89.7	-25.6	179.1	-95.3	-88.7	0	0	0	114.4	D1254	H1252-D1254 PolarHBondContact O-N 2.98Å
1253	E	43.5	Very low	47.9	Very low	149 Å²	149	101.9 Å²	101.9	70%	0.696	53%	0.531	S	S	*	.			trans	-98	55.7	-179.8	-65.3	-172.4	167.6	0	0	113.6	E1255	E1253-E1255 PolarHBondContact O-N 3.2Å
1254	D	49.6	Very low	50.2	Low	30 Å²	30	99.9 Å²	99.9	16%	0.16	52%	0.516	C	S	.	.			trans	-72.3	61.1	162.6	-85.5	-25.8	0	0	0	110.1	H1252 V1256 K2136	H1252-D1254 PolarHBondContact O-N 2.98Å; D1254-V1256 PolarHBondContact O-N 3.33Å; D1254-K2136 HydrophobicContact CB-CD 4.27Å; D1254-K2136 HydrophobicContact CB-CG 4.43Å
1255	E	49.5	Very low	52.6	Low	121 Å²	121	102.1 Å²	102.1	57%	0.565	53%	0.527	S	S	*	.			trans	-71.4	99.2	173.6	-78.1	-161.2	143.9	0	0	110.9	E1253 K2091	E1253-E1255 PolarHBondContact O-N 3.2Å; E1255-K2091 HydrophobicContact CB-CD 4.42Å; E1255-K2091 IonicContact OE2-NZ 2.95Å; E1255-K2091 PolarHBondContact OE2-NZ 3.37Å
1256	V	55.2	Low	54.8	Low	85 Å²	85	93.8 Å²	93.8	52%	0.515	49%	0.489	S	S	.	.	B	Isolated β-bridge	trans	-64.6	134.9	167.7	-176.3	0	0	0	0	109.1	D1254 T1258 C2089	D1254-V1256 PolarHBondContact O-N 3.33Å; V1256-T1258 PolarHBondContact O-N 2.89Å; V1256-T1258 VanDerWaalsContact O-N 3.15Å; V1256-C2089 HydrophobicContact CG1-CB 4.39Å
1257	E	55.5	Low	57.3	Low	57 Å²	57	87.9 Å²	87.9	27%	0.266	46%	0.457	S	S	.	.			trans	-61.3	117.6	170	-87.4	169.1	-173.5	0	0	109.8	D1259 T1263 C2089 K2091	E1257-D1259 VanDerWaalsContact C-N 3.35Å; E1257-T1263 HydrophobicContact CB-CG2 3.96Å; E1257-T1263 WeakPolarHBondContact O-CG2 3.23Å; E1257-C2089 PolarHBondContact N-O 3.2Å; E1257-K2091 HydrophobicContact CG-CG 3.89Å
1258	T	55.4	Low	59.6	Low	140 Å²	140	87.2 Å²	87.2	86%	0.859	45%	0.448	S	S	*	.			trans	-81.2	-17.2	173.9	44.2	0	0	0	0	112.5	V1256 F1260	V1256-T1258 PolarHBondContact O-N 2.89Å; V1256-T1258 VanDerWaalsContact O-N 3.15Å; T1258-F1260 PolarHBondContact O-N 3.39Å
1259	D	61	Low	61.8	Low	119 Å²	119	87 Å²	87	64%	0.636	44%	0.442	S	S	*	.			trans	-68.1	121.9	179.7	-90.1	-29.6	0	0	0	112.8	E1257 Y1261 G1262 T1263	E1257-D1259 VanDerWaalsContact C-N 3.35Å; D1259-Y1261 VanDerWaalsContact C-N 3.27Å; D1259-Y1261 PolarHBondContact O-N 3.44Å; D1259-G1262 PolarHBondContact O-N 3.45Å; D1259-T1263 WeakPolarHBondContact O-CB 3.5Å; D1259-T1263 WeakPolarHBondContact O-CG2 3.28Å; D1259-T1263 PolarHBondContact O-N 3.4Å; D1259-T1263 PolarHBondContact O-OG1 2.91Å
1260	F	63.1	Low	64	Low	114 Å²	114	83 Å²	83	50%	0.5	41%	0.414	S	S	.	.	H	α-helix	trans	-58.8	-36.9	-179.9	-175	-83.6	0	0	0	112.6	T1258 T1263 V1264	T1258-F1260 PolarHBondContact O-N 3.39Å; F1260-T1263 WeakPolarHBondContact CA-OG1 3.48Å; F1260-T1263 PolarHBondContact O-OG1 3.4Å; F1260-V1264 HydrophobicContact CD1-CG2 4.18Å; F1260-V1264 HydrophobicContact CE1-CG2 4.07Å; F1260-V1264 WeakPolarHBondContact O-CB 3.26Å; F1260-V1264 WeakPolarHBondContact O-CG2 3.5Å; F1260-V1264 PolarHBondContact O-N 3.11Å
1261	Y	62.6	Low	66.4	Low	195 Å²	195	75.1 Å²	75.1	77%	0.765	38%	0.38	S	S	*	.	H	α-helix	trans	-77.1	-41.8	179.5	-74.6	-80.4	0	0	0	112.9	D1259 V1264 L1265	D1259-Y1261 VanDerWaalsContact C-N 3.27Å; D1259-Y1261 PolarHBondContact O-N 3.44Å; Y1261-V1264 PolarHBondContact O-N 3.28Å; Y1261-L1265 WeakPolarHBondContact O-CB 3.34Å; Y1261-L1265 PolarHBondContact O-N 3.09Å
1262	G	69.1	Low	68.5	Low	26 Å²	26	75.2 Å²	75.2	27%	0.268	38%	0.38	S	S	.	.	H	α-helix	trans	-61.5	-47.8	177	0	0	0	0	0	112.1	D1259 V1264 L1265 S1266	D1259-G1262 PolarHBondContact O-N 3.45Å; G1262-V1264 PolarHBondContact O-N 3.14Å; G1262-L1265 PolarHBondContact O-N 3.26Å; G1262-S1266 VanDerWaalsContact O-CB 3.26Å; G1262-S1266 WeakPolarHBondContact O-CB 3.13Å; G1262-S1266 PolarHBondContact O-N 3.45Å
1263	T	71.9	Confident	70.6	Confident	18 Å²	18	73.7 Å²	73.7	11%	0.11	37%	0.371	C	S	.	.	H	α-helix	trans	-58.3	-46.5	175.6	52.2	0	0	0	0	113.2	E1257 D1259 F1260 Q1267 C2089	E1257-T1263 HydrophobicContact CB-CG2 3.96Å; E1257-T1263 WeakPolarHBondContact O-CG2 3.23Å; D1259-T1263 WeakPolarHBondContact O-CB 3.5Å; D1259-T1263 WeakPolarHBondContact O-CG2 3.28Å; D1259-T1263 PolarHBondContact O-N 3.4Å; D1259-T1263 PolarHBondContact O-OG1 2.91Å; F1260-T1263 WeakPolarHBondContact CA-OG1 3.48Å; F1260-T1263 PolarHBondContact O-OG1 3.4Å; T1263-Q1267 WeakPolarHBondContact O-CG 3.47Å; T1263-Q1267 PolarHBondContact O-N 3.32Å; T1263-Q1267 VanDerWaalsContact O-N 3.09Å; T1263-C2089 VanDerWaalsContact CB-SG 3.58Å; T1263-C2089 HydrophobicContact CG2-CB 3.69Å
1264	V	78.7	Confident	72.7	Confident	26 Å²	26	66.9 Å²	66.9	16%	0.158	34%	0.339	C	S	.	.	H	α-helix	trans	-59.1	-51.9	176.1	167.4	0	0	0	0	110.8	F1260 Y1261 G1262 S1266 Q1267 V1268 W1707 L1708	F1260-V1264 HydrophobicContact CD1-CG2 4.18Å; F1260-V1264 HydrophobicContact CE1-CG2 4.07Å; F1260-V1264 WeakPolarHBondContact O-CB 3.26Å; F1260-V1264 WeakPolarHBondContact O-CG2 3.5Å; F1260-V1264 PolarHBondContact O-N 3.11Å; Y1261-V1264 PolarHBondContact O-N 3.28Å; G1262-V1264 PolarHBondContact O-N 3.14Å; V1264-S1266 PolarHBondContact O-N 2.86Å; V1264-Q1267 PolarHBondContact O-N 3.45Å; V1264-V1268 WeakPolarHBondContact O-CG2 3.23Å; V1264-V1268 PolarHBondContact O-N 2.59Å; V1264-V1268 VanDerWaalsContact O-N 3.11Å; V1264-W1707 HydrophobicContact CG1-CH2 4.37Å; V1264-L1708 HydrophobicContact CB-CD1 4.47Å; V1264-L1708 HydrophobicContact CG1-CD1 4.29Å; V1264-L1708 HydrophobicContact CG1-CD2 4.12Å; V1264-L1708 HydrophobicContact CG2-CD1 4.06Å
1265	L	80.3	Confident	74.5	Confident	122 Å²	122	65.5 Å²	65.5	64%	0.639	33%	0.332	S	S	*	.	H	α-helix	trans	-65	-39.5	-177.5	-169.2	70.3	0	0	0	112	Y1261 G1262 V1268 K1269	Y1261-L1265 WeakPolarHBondContact O-CB 3.34Å; Y1261-L1265 PolarHBondContact O-N 3.09Å; G1262-L1265 PolarHBondContact O-N 3.26Å; L1265-V1268 PolarHBondContact O-N 3.17Å; L1265-K1269 VanDerWaalsContact O-CB 3.29Å; L1265-K1269 WeakPolarHBondContact O-CB 3.39Å; L1265-K1269 PolarHBondContact O-N 3.46Å
1266	S	81.3	Confident	76.2	Confident	11 Å²	11	65.7 Å²	65.7	8%	0.077	33%	0.331	C	S	.	.	H	α-helix	trans	-56.1	-49.5	173.3	168.5	0	0	0	0	112	G1262 V1264 K1269 A1270 G2086 R2095	G1262-S1266 VanDerWaalsContact O-CB 3.26Å; G1262-S1266 WeakPolarHBondContact O-CB 3.13Å; G1262-S1266 PolarHBondContact O-N 3.45Å; V1264-S1266 PolarHBondContact O-N 2.86Å; S1266-K1269 PolarHBondContact O-N 2.86Å; S1266-A1270 WeakPolarHBondContact O-CB 3.37Å; S1266-A1270 PolarHBondContact O-N 3.29Å; S1266-G2086 PolarHBondContact OG-O 2.79Å; S1266-R2095 PolarHBondContact OG-NH2 3.02Å
1267	Q	85.2	Confident	77.7	Confident	12 Å²	12	63.2 Å²	63.2	6%	0.056	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-43.6	-179.9	-72.7	-170.8	-8.6	0	0	111.7	T1263 V1264 Y1271 G1703 L1708 I2087	T1263-Q1267 WeakPolarHBondContact O-CG 3.47Å; T1263-Q1267 PolarHBondContact O-N 3.32Å; T1263-Q1267 VanDerWaalsContact O-N 3.09Å; V1264-Q1267 PolarHBondContact O-N 3.45Å; Q1267-Y1271 WeakPolarHBondContact O-CB 3.31Å; Q1267-Y1271 PolarHBondContact O-N 2.79Å; Q1267-Y1271 VanDerWaalsContact O-N 3.11Å; Q1267-G1703 PolarHBondContact NE2-O 3.47Å; Q1267-L1708 HydrophobicContact CB-CD2 4.17Å; Q1267-I2087 PolarHBondContact NE2-O 2.77Å
1268	V	85.2	Confident	79	Confident	36 Å²	36	60.6 Å²	60.6	22%	0.218	30%	0.303	C	S	.	.	H	α-helix	trans	-59.6	-52.9	174.4	177.8	0	0	0	0	110.7	V1264 L1265 A1270 Y1271 M1272 L1708 A1712	V1264-V1268 WeakPolarHBondContact O-CG2 3.23Å; V1264-V1268 PolarHBondContact O-N 2.59Å; V1264-V1268 VanDerWaalsContact O-N 3.11Å; L1265-V1268 PolarHBondContact O-N 3.17Å; V1268-A1270 VanDerWaalsContact C-N 3.34Å; V1268-A1270 PolarHBondContact O-N 3.39Å; V1268-Y1271 PolarHBondContact O-N 3.5Å; V1268-M1272 HydrophobicContact CG1-CG 3.82Å; V1268-M1272 WeakPolarHBondContact O-CB 3.2Å; V1268-M1272 WeakPolarHBondContact O-CG 2.98Å; V1268-M1272 PolarHBondContact O-N 3.45Å; V1268-L1708 HydrophobicContact CG2-CD2 3.36Å; V1268-A1712 HydrophobicContact CG1-CB 4.3Å
1269	K	85.4	Confident	80	Confident	109 Å²	109	56.3 Å²	56.3	47%	0.474	27%	0.274	S	S	.	.	H	α-helix	trans	-59.3	-42.9	-176.9	-171.8	-175	-176	-170	0	111.8	L1265 S1266 K1273 E2092	L1265-K1269 VanDerWaalsContact O-CB 3.29Å; L1265-K1269 WeakPolarHBondContact O-CB 3.39Å; L1265-K1269 PolarHBondContact O-N 3.46Å; S1266-K1269 PolarHBondContact O-N 2.86Å; K1269-K1273 WeakPolarHBondContact O-CB 3.14Å; K1269-K1273 PolarHBondContact O-N 2.73Å; K1269-E2092 IonicContact NZ-OE1 2.69Å; K1269-E2092 PolarHBondContact NZ-OE1 3.34Å; K1269-E2092 IonicContact NZ-OE2 3.47Å; K1269-E2092 PolarHBondContact NZ-OE2 3.2Å
1270	A	85.1	Confident	80.9	Confident	8 Å²	8	53.7 Å²	53.7	7%	0.066	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-45.2	177.4	0	0	0	0	0	112	S1266 V1268 K1273 K1274 L2083	S1266-A1270 WeakPolarHBondContact O-CB 3.37Å; S1266-A1270 PolarHBondContact O-N 3.29Å; V1268-A1270 VanDerWaalsContact C-N 3.34Å; V1268-A1270 PolarHBondContact O-N 3.39Å; A1270-K1273 WeakPolarHBondContact O-CB 3.28Å; A1270-K1273 PolarHBondContact O-N 3.48Å; A1270-K1274 PolarHBondContact O-N 3.08Å; A1270-K1274 VanDerWaalsContact O-N 3.1Å; A1270-L2083 HydrophobicContact CB-CD1 4.24Å; A1270-L2083 WeakPolarHBondContact O-CD1 3.44Å
1271	Y	88.2	Confident	81.6	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-75.8	-36.7	-178.2	-170.8	-88.3	0	0	0	113.2	Q1267 V1268 K1273 K1274 R1275 D1690 M1704 Y1709 A1712 N1713	Q1267-Y1271 WeakPolarHBondContact O-CB 3.31Å; Q1267-Y1271 PolarHBondContact O-N 2.79Å; Q1267-Y1271 VanDerWaalsContact O-N 3.11Å; V1268-Y1271 PolarHBondContact O-N 3.5Å; Y1271-K1273 VanDerWaalsContact C-N 3.26Å; Y1271-K1273 PolarHBondContact O-N 3.21Å; Y1271-K1274 HydrophobicContact CD2-CD 4.21Å; Y1271-K1274 HydrophobicContact CE2-CD 3.96Å; Y1271-K1274 VanDerWaalsContact O-CB 3.32Å; Y1271-K1274 WeakPolarHBondContact O-CB 3.41Å; Y1271-K1274 PolarHBondContact O-N 3.1Å; Y1271-K1274 VanDerWaalsContact O-N 3.14Å; Y1271-R1275 HydrophobicContact CD1-CG 4.39Å; Y1271-R1275 HydrophobicContact CE1-CG 3.96Å; Y1271-R1275 PolarHBondContact O-N 3.16Å; Y1271-R1275 VanDerWaalsContact O-N 3.09Å; Y1271-D1690 PolarHBondContact OH-OD2 2.93Å; Y1271-M1704 HydrophobicContact CD2-CE 3.82Å; Y1271-M1704 HydrophobicContact CD2-SD 4.29Å; Y1271-M1704 HydrophobicContact CG-CE 4.15Å; Y1271-Y1709 HydrophobicContact CE1-CE2 4.48Å; Y1271-Y1709 AromaticContact CE2-CD2 3.85Å; Y1271-Y1709 HydrophobicContact CE2-CD2 3.85Å; Y1271-Y1709 AromaticContact CE2-CE2 3.67Å; Y1271-Y1709 HydrophobicContact CE2-CE2 3.67Å; Y1271-Y1709 AromaticContact CZ-CD2 3.87Å; Y1271-Y1709 AromaticContact CZ-CE2 3.53Å; Y1271-Y1709 WeakPolarHBondContact OH-CE2 3.44Å; Y1271-A1712 HydrophobicContact CD1-CB 3.76Å; Y1271-A1712 HydrophobicContact CG-CB 4.5Å; Y1271-N1713 WeakPolarHBondContact CE1-ND2 3.41Å; Y1271-N1713 VanDerWaalsContact CE1-OD1 3.26Å; Y1271-N1713 WeakPolarHBondContact CE1-OD1 3.43Å; Y1271-N1713 PolarHBondContact OH-ND2 3.33Å; Y1271-N1713 PolarHBondContact OH-OD1 3.23Å
1272	M	87.7	Confident	82.1	Confident	44 Å²	44	45.9 Å²	45.9	22%	0.217	23%	0.233	C	C	.	.	H	α-helix	trans	-56.2	-42	168.1	-71.3	-81.6	-79.5	0	0	110.9	V1268 K1274 R1275 F1276 V1715 F1716 L1719	V1268-M1272 HydrophobicContact CG1-CG 3.82Å; V1268-M1272 WeakPolarHBondContact O-CB 3.2Å; V1268-M1272 WeakPolarHBondContact O-CG 2.98Å; V1268-M1272 PolarHBondContact O-N 3.45Å; M1272-K1274 PolarHBondContact O-N 3.47Å; M1272-R1275 PolarHBondContact O-N 3.38Å; M1272-F1276 PolarHBondContact O-N 2.96Å; M1272-V1715 HydrophobicContact CE-CG1 4.13Å; M1272-F1716 HydrophobicContact CE-CD2 4.26Å; M1272-F1716 HydrophobicContact SD-CB 3.68Å; M1272-F1716 HydrophobicContact SD-CD2 3.85Å; M1272-F1716 HydrophobicContact SD-CG 4.27Å; M1272-L1719 HydrophobicContact CE-CD1 4.29Å
1273	K	88.2	Confident	82.1	Confident	125 Å²	125	51.7 Å²	51.7	54%	0.543	25%	0.247	S	C	.	.	H	α-helix	trans	-64.9	-37.1	176.1	-169.8	174	-176.9	176.4	0	112.5	K1269 A1270 Y1271 F1276 L1277	K1269-K1273 WeakPolarHBondContact O-CB 3.14Å; K1269-K1273 PolarHBondContact O-N 2.73Å; A1270-K1273 WeakPolarHBondContact O-CB 3.28Å; A1270-K1273 PolarHBondContact O-N 3.48Å; Y1271-K1273 VanDerWaalsContact C-N 3.26Å; Y1271-K1273 PolarHBondContact O-N 3.21Å; K1273-F1276 PolarHBondContact O-N 3.44Å; K1273-L1277 HydrophobicContact CG-CD1 4.21Å; K1273-L1277 HydrophobicContact CG-CG 4.47Å; K1273-L1277 WeakPolarHBondContact O-CB 3.47Å; K1273-L1277 VanDerWaalsContact O-CG 3.3Å; K1273-L1277 WeakPolarHBondContact O-CG 3.39Å; K1273-L1277 PolarHBondContact O-N 3.3Å
1274	K	88.8	Confident	81.8	Confident	6 Å²	6	59.3 Å²	59.3	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-57.5	-50.9	170.6	-177.3	-157	174	-169.9	0	111.2	A1270 Y1271 M1272 F1276 L1277 N1278 D1690 L2075 L2083	A1270-K1274 PolarHBondContact O-N 3.08Å; A1270-K1274 VanDerWaalsContact O-N 3.1Å; Y1271-K1274 HydrophobicContact CD2-CD 4.21Å; Y1271-K1274 HydrophobicContact CE2-CD 3.96Å; Y1271-K1274 VanDerWaalsContact O-CB 3.32Å; Y1271-K1274 WeakPolarHBondContact O-CB 3.41Å; Y1271-K1274 PolarHBondContact O-N 3.1Å; Y1271-K1274 VanDerWaalsContact O-N 3.14Å; M1272-K1274 PolarHBondContact O-N 3.47Å; K1274-F1276 VanDerWaalsContact C-N 3.33Å; K1274-F1276 PolarHBondContact O-N 3.42Å; K1274-L1277 PolarHBondContact O-N 2.84Å; K1274-N1278 PolarHBondContact O-N 2.99Å; K1274-D1690 IonicContact NZ-OD1 3.55Å; K1274-D1690 PolarHBondContact NZ-OD1 3.41Å; K1274-D1690 IonicContact NZ-OD2 3.69Å; K1274-D1690 PolarHBondContact NZ-OD2 3.25Å; K1274-L2075 HydrophobicContact CG-CD1 4.22Å; K1274-L2083 HydrophobicContact CB-CD1 4.07Å; K1274-L2083 HydrophobicContact CB-CD2 4.16Å; K1274-L2083 HydrophobicContact CD-CD2 3.9Å; K1274-L2083 HydrophobicContact CG-CD2 3.95Å
1275	R	86.4	Confident	81	Confident	1 Å²	1	59.9 Å²	59.9	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-57.3	-45.1	178.7	-69.3	-67.7	-59	-121.2	1.8	111.5	Y1271 M1272 N1278 I1279 F1686 N1713 F1716 D1717	Y1271-R1275 HydrophobicContact CD1-CG 4.39Å; Y1271-R1275 HydrophobicContact CE1-CG 3.96Å; Y1271-R1275 PolarHBondContact O-N 3.16Å; Y1271-R1275 VanDerWaalsContact O-N 3.09Å; M1272-R1275 PolarHBondContact O-N 3.38Å; R1275-N1278 PolarHBondContact O-N 3.02Å; R1275-I1279 PolarHBondContact O-N 3.13Å; R1275-F1686 VanDerWaalsContact NH2-CD2 3.26Å; R1275-N1713 PolarHBondContact NH1-OD1 3.18Å; R1275-F1716 HydrophobicContact CB-CD1 3.94Å; R1275-F1716 HydrophobicContact CB-CD2 3.65Å; R1275-F1716 HydrophobicContact CB-CE1 3.99Å; R1275-F1716 HydrophobicContact CB-CE2 3.68Å; R1275-F1716 HydrophobicContact CB-CG 3.79Å; R1275-F1716 HydrophobicContact CB-CZ 3.86Å; R1275-F1716 HydrophobicContact CG-CD1 4.45Å; R1275-F1716 HydrophobicContact CG-CD2 4.42Å; R1275-F1716 HydrophobicContact CG-CG 4.21Å; R1275-D1717 IonicContact CZ-OD1 3.46Å; R1275-D1717 IonicContact CZ-OD2 3.26Å; R1275-D1717 VanDerWaalsContact CZ-OD2 3.27Å; R1275-D1717 IonicContact NH1-OD2 3.73Å; R1275-D1717 PolarHBondContact NH1-OD2 3.16Å; R1275-D1717 IonicContact NH2-OD1 3.75Å; R1275-D1717 PolarHBondContact NH2-OD1 3.43Å; R1275-D1717 IonicContact NH2-OD2 3.6Å; R1275-D1717 PolarHBondContact NH2-OD2 2.94Å
1276	F	85.7	Confident	80.1	Confident	124 Å²	124	55.1 Å²	55.1	54%	0.544	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-44.2	176.7	-174.5	-98.1	0	0	0	113.4	M1272 K1273 K1274 N1278 I1279 T1280 F1716	M1272-F1276 PolarHBondContact O-N 2.96Å; K1273-F1276 PolarHBondContact O-N 3.44Å; K1274-F1276 VanDerWaalsContact C-N 3.33Å; K1274-F1276 PolarHBondContact O-N 3.42Å; F1276-N1278 PolarHBondContact O-N 3.34Å; F1276-I1279 PolarHBondContact O-N 3.04Å; F1276-T1280 HydrophobicContact CD1-CG2 4.2Å; F1276-T1280 HydrophobicContact CE1-CG2 3.76Å; F1276-T1280 HydrophobicContact CE2-CG2 4.19Å; F1276-T1280 HydrophobicContact CZ-CG2 3.76Å; F1276-T1280 WeakPolarHBondContact O-CG2 3.05Å; F1276-T1280 PolarHBondContact O-N 3.47Å; F1276-T1280 PolarHBondContact O-OG1 3.09Å; F1276-F1716 HydrophobicContact CB-CE2 4.13Å; F1276-F1716 HydrophobicContact CB-CZ 4.48Å
1277	L	86.2	Confident	79.3	Confident	33 Å²	33	57.1 Å²	57.1	17%	0.173	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-40.1	177.2	-73.6	171.2	0	0	0	112.2	K1273 K1274 T1280 R1281 L2075 E2079	K1273-L1277 HydrophobicContact CG-CD1 4.21Å; K1273-L1277 HydrophobicContact CG-CG 4.47Å; K1273-L1277 WeakPolarHBondContact O-CB 3.47Å; K1273-L1277 VanDerWaalsContact O-CG 3.3Å; K1273-L1277 WeakPolarHBondContact O-CG 3.39Å; K1273-L1277 PolarHBondContact O-N 3.3Å; K1274-L1277 PolarHBondContact O-N 2.84Å; L1277-T1280 WeakPolarHBondContact CA-OG1 3.49Å; L1277-T1280 PolarHBondContact O-N 3.43Å; L1277-T1280 PolarHBondContact O-OG1 3.35Å; L1277-T1280 VanDerWaalsContact O-OG1 3.14Å; L1277-R1281 WeakPolarHBondContact O-CB 3.01Å; L1277-R1281 WeakPolarHBondContact O-CG 3.32Å; L1277-R1281 PolarHBondContact O-N 2.87Å; L1277-L2075 HydrophobicContact CB-CD2 3.89Å; L1277-L2075 HydrophobicContact CD1-CD2 4.27Å; L1277-E2079 HydrophobicContact CD1-CB 4.28Å; L1277-E2079 HydrophobicContact CD1-CG 4.08Å
1278	N	82.6	Confident	78.2	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-42.7	177.4	-76.3	-6.9	0	0	0	112.3	K1274 R1275 F1276 D1282 F1686 D2072 R2074	K1274-N1278 PolarHBondContact O-N 2.99Å; R1275-N1278 PolarHBondContact O-N 3.02Å; F1276-N1278 PolarHBondContact O-N 3.34Å; N1278-D1282 PolarHBondContact O-N 3.29Å; N1278-F1686 HydrophobicContact CB-CE1 4Å; N1278-D2072 PolarHBondContact ND2-OD2 3.28Å; N1278-D2072 PolarHBondContact OD1-OD2 3.27Å; N1278-R2074 PolarHBondContact ND2-NH2 2.94Å; N1278-R2074 VanDerWaalsContact ND2-NH2 3.19Å
1279	I	76.9	Confident	77.1	Confident	49 Å²	49	60.5 Å²	60.5	25%	0.251	29%	0.292	S	S	.	.	H	α-helix	trans	-68.5	-42	178.3	-74.9	174.3	0	0	0	112.2	R1275 F1276 R1281 D1282 W1283 A1286 F1686 F1716	R1275-I1279 PolarHBondContact O-N 3.13Å; F1276-I1279 PolarHBondContact O-N 3.04Å; I1279-R1281 VanDerWaalsContact C-N 3.31Å; I1279-R1281 PolarHBondContact O-N 3.46Å; I1279-D1282 CarbonylContact O-C 3.57Å; I1279-D1282 VanDerWaalsContact O-C 3.31Å; I1279-W1283 PolarHBondContact O-N 3.49Å; I1279-A1286 HydrophobicContact CG2-CB 3.84Å; I1279-F1686 HydrophobicContact CG1-CZ 4.11Å; I1279-F1716 HydrophobicContact CD1-CE1 3.44Å; I1279-F1716 VanDerWaalsContact CD1-CE1 3.44Å; I1279-F1716 HydrophobicContact CD1-CZ 3.81Å
1280	T	79.7	Confident	76	Confident	64 Å²	64	57.4 Å²	57.4	39%	0.393	28%	0.282	S	S	.	.	H	α-helix	trans	-70.4	-27.6	178.8	47.2	0	0	0	0	112.8	F1276 L1277	F1276-T1280 HydrophobicContact CD1-CG2 4.2Å; F1276-T1280 HydrophobicContact CE1-CG2 3.76Å; F1276-T1280 HydrophobicContact CE2-CG2 4.19Å; F1276-T1280 HydrophobicContact CZ-CG2 3.76Å; F1276-T1280 WeakPolarHBondContact O-CG2 3.05Å; F1276-T1280 PolarHBondContact O-N 3.47Å; F1276-T1280 PolarHBondContact O-OG1 3.09Å; L1277-T1280 WeakPolarHBondContact CA-OG1 3.49Å; L1277-T1280 PolarHBondContact O-N 3.43Å; L1277-T1280 PolarHBondContact O-OG1 3.35Å; L1277-T1280 VanDerWaalsContact O-OG1 3.14Å
1281	R	78.2	Confident	74.8	Confident	74 Å²	74	63.6 Å²	63.6	28%	0.279	31%	0.308	S	S	.	.	H	α-helix	trans	-82.6	-38.7	176.8	-75.1	-167.6	163.8	176.3	8.1	114.6	L1277 I1279 W1283 R2074 E2079	L1277-R1281 WeakPolarHBondContact O-CB 3.01Å; L1277-R1281 WeakPolarHBondContact O-CG 3.32Å; L1277-R1281 PolarHBondContact O-N 2.87Å; I1279-R1281 VanDerWaalsContact C-N 3.31Å; I1279-R1281 PolarHBondContact O-N 3.46Å; R1281-W1283 PolarHBondContact O-N 2.78Å; R1281-R2074 WeakPolarHBondContact CD-O 3.5Å; R1281-R2074 PolarHBondContact NH1-O 2.97Å; R1281-E2079 IonicContact CZ-OE1 3.73Å; R1281-E2079 VanDerWaalsContact CZ-OE1 3.26Å; R1281-E2079 IonicContact CZ-OE2 2.83Å; R1281-E2079 IonicContact NE-OE1 2.7Å; R1281-E2079 IonicContact NE-OE2 3.49Å; R1281-E2079 IonicContact NH1-OE1 3.14Å; R1281-E2079 IonicContact NH1-OE2 3.54Å; R1281-E2079 PolarHBondContact NH1-OE2 2.8Å; R1281-E2079 IonicContact NH2-OE1 2.68Å; R1281-E2079 PolarHBondContact NH2-OE1 3.25Å; R1281-E2079 IonicContact NH2-OE2 3.9Å; R1281-E2079 PolarHBondContact NH2-OE2 2.69Å; R1281-E2079 VanDerWaalsContact NH2-OE2 3.09Å
1282	D	73.9	Confident	73.4	Confident	71 Å²	71	68.2 Å²	68.2	38%	0.38	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	53.4	166.2	-153.9	-16.8	0	0	0	110.4	N1278 I1279 R1284 A1285 A1286	N1278-D1282 PolarHBondContact O-N 3.29Å; I1279-D1282 CarbonylContact O-C 3.57Å; I1279-D1282 VanDerWaalsContact O-C 3.31Å; D1282-R1284 PolarHBondContact O-N 3.4Å; D1282-R1284 VanDerWaalsContact O-N 3.08Å; D1282-A1285 HydrophobicContact CB-CB 4.04Å; D1282-A1285 PolarHBondContact O-N 2.86Å; D1282-A1285 VanDerWaalsContact OD1-CB 3.29Å; D1282-A1285 WeakPolarHBondContact OD1-CB 3.34Å; D1282-A1285 PolarHBondContact OD1-N 2.77Å; D1282-A1286 PolarHBondContact O-N 3.4Å
1283	W	68.2	Low	72	Confident	149 Å²	149	66.9 Å²	66.9	56%	0.564	32%	0.324	S	S	*	.	H	α-helix	trans	-58	-25.2	178.4	78	-93	0	0	0	111.7	I1279 R1281 V1287	I1279-W1283 PolarHBondContact O-N 3.49Å; R1281-W1283 PolarHBondContact O-N 2.78Å; W1283-V1287 HydrophobicContact CE3-CB 4.24Å; W1283-V1287 HydrophobicContact CE3-CG2 3.76Å; W1283-V1287 HydrophobicContact CZ3-CB 4.46Å; W1283-V1287 HydrophobicContact CZ3-CG2 4.16Å; W1283-V1287 WeakPolarHBondContact O-CB 3.37Å; W1283-V1287 VanDerWaalsContact O-CG2 3.26Å; W1283-V1287 WeakPolarHBondContact O-CG2 3.23Å; W1283-V1287 PolarHBondContact O-N 2.92Å
1284	R	65.4	Low	70.5	Confident	178 Å²	178	62.1 Å²	62.1	67%	0.672	31%	0.306	S	S	*	.	H	α-helix	trans	-68.3	-47.2	173.5	-68.1	-177.1	179.1	173.2	-1.1	111.1	D1282 C1288	D1282-R1284 PolarHBondContact O-N 3.4Å; D1282-R1284 VanDerWaalsContact O-N 3.08Å; R1284-C1288 VanDerWaalsContact O-CB 3.31Å; R1284-C1288 WeakPolarHBondContact O-CB 3.13Å; R1284-C1288 PolarHBondContact O-N 3.14Å; R1284-C1288 PolarHBondContact O-SG 3.28Å
1285	A	63.1	Low	69.1	Low	38 Å²	38	66.6 Å²	66.6	31%	0.314	33%	0.329	S	S	.	.	H	α-helix	trans	-61.8	-43	172.2	0	0	0	0	0	111.6	D1282 C1288 I1289	D1282-A1285 HydrophobicContact CB-CB 4.04Å; D1282-A1285 PolarHBondContact O-N 2.86Å; D1282-A1285 VanDerWaalsContact OD1-CB 3.29Å; D1282-A1285 WeakPolarHBondContact OD1-CB 3.34Å; D1282-A1285 PolarHBondContact OD1-N 2.77Å; A1285-C1288 PolarHBondContact O-N 2.67Å; A1285-I1289 VanDerWaalsContact O-CB 3.24Å; A1285-I1289 WeakPolarHBondContact O-CB 3.44Å; A1285-I1289 WeakPolarHBondContact O-CG1 3.13Å; A1285-I1289 PolarHBondContact O-N 3.01Å
1286	A	61	Low	67.6	Low	22 Å²	22	68.6 Å²	68.6	18%	0.182	34%	0.34	C	S	.	.	H	α-helix	trans	-63.1	-44.8	177.8	0	0	0	0	0	112.8	I1279 D1282 I1289 V1290	I1279-A1286 HydrophobicContact CG2-CB 3.84Å; D1282-A1286 PolarHBondContact O-N 3.4Å; A1286-I1289 WeakPolarHBondContact O-CB 3.39Å; A1286-I1289 PolarHBondContact O-N 3.01Å; A1286-V1290 PolarHBondContact O-N 3.37Å
1287	V	64.4	Low	66.2	Low	53 Å²	53	63.2 Å²	63.2	32%	0.321	32%	0.317	S	S	.	.	H	α-helix	trans	-69.3	-36	175.6	167.4	0	0	0	0	111.3	W1283 V1290 K1291	W1283-V1287 HydrophobicContact CE3-CB 4.24Å; W1283-V1287 HydrophobicContact CE3-CG2 3.76Å; W1283-V1287 HydrophobicContact CZ3-CB 4.46Å; W1283-V1287 HydrophobicContact CZ3-CG2 4.16Å; W1283-V1287 WeakPolarHBondContact O-CB 3.37Å; W1283-V1287 VanDerWaalsContact O-CG2 3.26Å; W1283-V1287 WeakPolarHBondContact O-CG2 3.23Å; W1283-V1287 PolarHBondContact O-N 2.92Å; V1287-V1290 PolarHBondContact O-N 2.75Å; V1287-K1291 HydrophobicContact CG1-CD 3.72Å; V1287-K1291 HydrophobicContact CG1-CG 3.89Å; V1287-K1291 WeakPolarHBondContact O-CA 3.48Å; V1287-K1291 WeakPolarHBondContact O-CB 3.47Å; V1287-K1291 WeakPolarHBondContact O-CG 3.09Å; V1287-K1291 PolarHBondContact O-N 2.86Å
1288	C	62.4	Low	64.8	Low	64 Å²	64	64.2 Å²	64.2	43%	0.432	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-43.1	170.8	-71.4	0	0	0	0	111	R1284 A1285 V1290 I1292	R1284-C1288 VanDerWaalsContact O-CB 3.31Å; R1284-C1288 WeakPolarHBondContact O-CB 3.13Å; R1284-C1288 PolarHBondContact O-N 3.14Å; R1284-C1288 PolarHBondContact O-SG 3.28Å; A1285-C1288 PolarHBondContact O-N 2.67Å; C1288-V1290 PolarHBondContact O-N 2.81Å; C1288-I1292 HydrophobicContact CB-CD1 3.9Å; C1288-I1292 HydrophobicContact CB-CG1 4.49Å; C1288-I1292 WeakPolarHBondContact O-CB 3.42Å; C1288-I1292 WeakPolarHBondContact O-CG1 3.49Å; C1288-I1292 PolarHBondContact O-N 2.9Å
1289	I	61.6	Low	63.5	Low	54 Å²	54	68.7 Å²	68.7	28%	0.277	35%	0.345	S	S	.	.	H	α-helix	trans	-56.1	-47.5	175.1	-87.1	165.7	0	0	0	111.4	A1285 A1286 R1293	A1285-I1289 VanDerWaalsContact O-CB 3.24Å; A1285-I1289 WeakPolarHBondContact O-CB 3.44Å; A1285-I1289 WeakPolarHBondContact O-CG1 3.13Å; A1285-I1289 PolarHBondContact O-N 3.01Å; A1286-I1289 WeakPolarHBondContact O-CB 3.39Å; A1286-I1289 PolarHBondContact O-N 3.01Å; I1289-R1293 VanDerWaalsContact CG2-NH1 3.32Å; I1289-R1293 WeakPolarHBondContact O-CB 3.22Å; I1289-R1293 WeakPolarHBondContact O-CD 3.06Å; I1289-R1293 WeakPolarHBondContact O-CG 3.42Å
1290	V	61.9	Low	62.4	Low	45 Å²	45	70.2 Å²	70.2	27%	0.273	35%	0.354	S	S	.	.	H	α-helix	trans	-76.7	-49.5	179.4	177.5	0	0	0	0	111.5	A1286 V1287 C1288 R1293 T1294 F1723 L1727	A1286-V1290 PolarHBondContact O-N 3.37Å; V1287-V1290 PolarHBondContact O-N 2.75Å; C1288-V1290 PolarHBondContact O-N 2.81Å; V1290-R1293 PolarHBondContact O-N 3.31Å; V1290-T1294 PolarHBondContact O-N 3.5Å; V1290-T1294 PolarHBondContact O-OG1 3.43Å; V1290-T1294 VanDerWaalsContact O-OG1 3.07Å; V1290-F1723 HydrophobicContact CG1-CE1 4.29Å; V1290-L1727 HydrophobicContact CG1-CD2 3.92Å
1291	K	60.4	Low	61.1	Low	137 Å²	137	67.8 Å²	67.8	60%	0.596	34%	0.34	S	S	*	.	H	α-helix	trans	-66.2	-45	-177.1	-77.3	-167.7	174.6	-168.9	0	113.3	V1287 R1293 T1294 L1295	V1287-K1291 HydrophobicContact CG1-CD 3.72Å; V1287-K1291 HydrophobicContact CG1-CG 3.89Å; V1287-K1291 WeakPolarHBondContact O-CA 3.48Å; V1287-K1291 WeakPolarHBondContact O-CB 3.47Å; V1287-K1291 WeakPolarHBondContact O-CG 3.09Å; V1287-K1291 PolarHBondContact O-N 2.86Å; K1291-R1293 PolarHBondContact O-N 3.46Å; K1291-T1294 WeakPolarHBondContact CA-OG1 3.28Å; K1291-T1294 PolarHBondContact O-N 3.3Å; K1291-T1294 PolarHBondContact O-OG1 2.83Å; K1291-T1294 VanDerWaalsContact O-OG1 3.13Å; K1291-L1295 VanDerWaalsContact O-CB 3.29Å; K1291-L1295 WeakPolarHBondContact O-CB 3.47Å; K1291-L1295 PolarHBondContact O-N 3.1Å
1292	I	57.9	Low	59.9	Low	98 Å²	98	66.1 Å²	66.1	50%	0.503	34%	0.336	S	S	.	.	H	α-helix	trans	-63.7	-38	-179	-65.3	170.1	0	0	0	109.3	C1288 L1295 I1296	C1288-I1292 HydrophobicContact CB-CD1 3.9Å; C1288-I1292 HydrophobicContact CB-CG1 4.49Å; C1288-I1292 WeakPolarHBondContact O-CB 3.42Å; C1288-I1292 WeakPolarHBondContact O-CG1 3.49Å; C1288-I1292 PolarHBondContact O-N 2.9Å; I1292-L1295 PolarHBondContact O-N 3.33Å; I1292-I1296 HydrophobicContact CG2-CD1 3.77Å; I1292-I1296 HydrophobicContact CG2-CG1 4.33Å; I1292-I1296 WeakPolarHBondContact O-CB 3.36Å; I1292-I1296 WeakPolarHBondContact O-CG1 3.25Å; I1292-I1296 PolarHBondContact O-N 2.81Å
1293	R	60.2	Low	58.9	Low	16 Å²	16	65.7 Å²	65.7	6%	0.06	34%	0.337	C	S	.	.	H	α-helix	trans	-70.5	-40.3	178.3	-66.6	179.3	-170.4	148.7	10.7	112.9	I1289 V1290 K1291 L1297 S1678 S1682	I1289-R1293 VanDerWaalsContact CG2-NH1 3.32Å; I1289-R1293 WeakPolarHBondContact O-CB 3.22Å; I1289-R1293 WeakPolarHBondContact O-CD 3.06Å; I1289-R1293 WeakPolarHBondContact O-CG 3.42Å; V1290-R1293 PolarHBondContact O-N 3.31Å; K1291-R1293 PolarHBondContact O-N 3.46Å; R1293-L1297 WeakPolarHBondContact O-CB 3.24Å; R1293-L1297 WeakPolarHBondContact O-CG 3.41Å; R1293-L1297 PolarHBondContact O-N 3.38Å; R1293-S1678 WeakPolarHBondContact CD-OG 3.34Å; R1293-S1678 PolarHBondContact NE-OG 3.25Å; R1293-S1678 VanDerWaalsContact NE-OG 3.1Å; R1293-S1678 PolarHBondContact NH2-O 2.9Å; R1293-S1682 PolarHBondContact NH1-OG 3.12Å; R1293-S1682 PolarHBondContact NH2-OG 3.45Å
1294	T	55.9	Low	58	Low	26 Å²	26	60.2 Å²	60.2	16%	0.16	32%	0.319	C	S	.	.	H	α-helix	trans	-68.1	-34.4	169.7	47.1	0	0	0	0	112.5	V1290 K1291 L1297 I1298 L1727 I1731	V1290-T1294 PolarHBondContact O-N 3.5Å; V1290-T1294 PolarHBondContact O-OG1 3.43Å; V1290-T1294 VanDerWaalsContact O-OG1 3.07Å; K1291-T1294 WeakPolarHBondContact CA-OG1 3.28Å; K1291-T1294 PolarHBondContact O-N 3.3Å; K1291-T1294 PolarHBondContact O-OG1 2.83Å; K1291-T1294 VanDerWaalsContact O-OG1 3.13Å; T1294-L1297 PolarHBondContact O-N 2.74Å; T1294-I1298 WeakPolarHBondContact O-CB 2.92Å; T1294-I1298 WeakPolarHBondContact O-CD1 3.5Å; T1294-I1298 WeakPolarHBondContact O-CG1 3.08Å; T1294-I1298 PolarHBondContact O-N 3.03Å; T1294-L1727 HydrophobicContact CG2-CD2 3.4Å; T1294-L1727 VanDerWaalsContact CG2-CD2 3.4Å; T1294-L1727 HydrophobicContact CG2-CG 3.81Å; T1294-I1731 HydrophobicContact CG2-CD1 3.94Å
1295	L	58.9	Low	57.3	Low	99 Å²	99	52.5 Å²	52.5	52%	0.518	29%	0.291	S	S	.	.	H	α-helix	trans	-66.3	-38.9	175.3	-134.4	89.6	0	0	0	111.9	K1291 I1292 N1299	K1291-L1295 VanDerWaalsContact O-CB 3.29Å; K1291-L1295 WeakPolarHBondContact O-CB 3.47Å; K1291-L1295 PolarHBondContact O-N 3.1Å; I1292-L1295 PolarHBondContact O-N 3.33Å; L1295-N1299 WeakPolarHBondContact O-CB 3.12Å; L1295-N1299 VanDerWaalsContact O-CG 3.31Å; L1295-N1299 PolarHBondContact O-N 3.41Å
1296	I	56.3	Low	56.7	Low	44 Å²	44	56.4 Å²	56.4	23%	0.226	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-50.1	173.3	-75.2	168.5	0	0	0	109.4	I1292 I1298 L1300	I1292-I1296 HydrophobicContact CG2-CD1 3.77Å; I1292-I1296 HydrophobicContact CG2-CG1 4.33Å; I1292-I1296 WeakPolarHBondContact O-CB 3.36Å; I1292-I1296 WeakPolarHBondContact O-CG1 3.25Å; I1292-I1296 PolarHBondContact O-N 2.81Å; I1296-I1298 VanDerWaalsContact C-N 3.34Å; I1296-I1298 PolarHBondContact O-N 3.47Å; I1296-L1300 HydrophobicContact CG2-CD1 3.99Å; I1296-L1300 WeakPolarHBondContact O-CB 3.27Å; I1296-L1300 PolarHBondContact O-N 2.82Å; I1296-L1300 VanDerWaalsContact O-N 3.09Å
1297	L	55.1	Low	56.1	Low	11 Å²	11	58.9 Å²	58.9	6%	0.058	32%	0.316	C	S	.	.	H	α-helix	trans	-57.8	-43.9	176	-78.8	165.2	0	0	0	112.5	R1293 T1294 A1301 F1672 A1675 A1728	R1293-L1297 WeakPolarHBondContact O-CB 3.24Å; R1293-L1297 WeakPolarHBondContact O-CG 3.41Å; R1293-L1297 PolarHBondContact O-N 3.38Å; T1294-L1297 PolarHBondContact O-N 2.74Å; L1297-A1301 WeakPolarHBondContact O-CB 3.17Å; L1297-A1301 PolarHBondContact O-N 3.25Å; L1297-F1672 HydrophobicContact CD2-CD1 3.28Å; L1297-F1672 HydrophobicContact CD2-CE1 3.36Å; L1297-F1672 HydrophobicContact CD2-CG 4.02Å; L1297-F1672 HydrophobicContact CD2-CZ 4.12Å; L1297-A1675 HydrophobicContact CD1-CB 4.12Å; L1297-A1675 HydrophobicContact CD2-CB 3.8Å; L1297-A1675 HydrophobicContact CG-CB 3.7Å; L1297-A1728 HydrophobicContact CD1-CB 4.39Å
1298	I	56.8	Low	55.4	Low	54 Å²	54	57.5 Å²	57.5	28%	0.277	31%	0.309	S	S	.	.	H	α-helix	trans	-69.3	-60.2	-180	-74.1	167.6	0	0	0	109.9	T1294 I1296 L1300 I1302 I1731	T1294-I1298 WeakPolarHBondContact O-CB 2.92Å; T1294-I1298 WeakPolarHBondContact O-CD1 3.5Å; T1294-I1298 WeakPolarHBondContact O-CG1 3.08Å; T1294-I1298 PolarHBondContact O-N 3.03Å; I1296-I1298 VanDerWaalsContact C-N 3.34Å; I1296-I1298 PolarHBondContact O-N 3.47Å; I1298-L1300 PolarHBondContact O-N 3.11Å; I1298-I1302 HydrophobicContact CB-CD1 4.24Å; I1298-I1302 HydrophobicContact CG2-CD1 3.47Å; I1298-I1302 VanDerWaalsContact CG2-CD1 3.47Å; I1298-I1302 WeakPolarHBondContact O-CB 3.26Å; I1298-I1302 WeakPolarHBondContact O-CD1 3.33Å; I1298-I1302 WeakPolarHBondContact O-CG1 3.41Å; I1298-I1302 PolarHBondContact O-N 3.06Å; I1298-I1302 VanDerWaalsContact O-N 3.1Å; I1298-I1731 HydrophobicContact CD1-CD1 4.37Å; I1298-I1731 HydrophobicContact CG1-CD1 4.26Å; I1298-I1731 HydrophobicContact CG1-CG2 4.48Å
1299	N	55.9	Low	54.6	Low	97 Å²	97	59.3 Å²	59.3	52%	0.519	31%	0.314	S	S	.	.	H	α-helix	trans	-71	-25.9	-169.4	-66.9	-15.3	0	0	0	114.4	L1295 P1303	L1295-N1299 WeakPolarHBondContact O-CB 3.12Å; L1295-N1299 VanDerWaalsContact O-CG 3.31Å; L1295-N1299 PolarHBondContact O-N 3.41Å; N1299-P1303 WeakPolarHBondContact O-CD 3.47Å; N1299-P1303 WeakPolarHBondContact O-CG 3.21Å
1300	L	52.6	Low	54	Low	81 Å²	81	59.8 Å²	59.8	42%	0.424	32%	0.322	S	S	.	.	H	α-helix	trans	-89.7	-39.1	175.5	-76.7	154.8	0	0	0	112.6	I1296 I1298 I1304 A1671	I1296-L1300 HydrophobicContact CG2-CD1 3.99Å; I1296-L1300 WeakPolarHBondContact O-CB 3.27Å; I1296-L1300 PolarHBondContact O-N 2.82Å; I1296-L1300 VanDerWaalsContact O-N 3.09Å; I1298-L1300 PolarHBondContact O-N 3.11Å; L1300-I1304 WeakPolarHBondContact O-CD1 3.07Å; L1300-I1304 VanDerWaalsContact O-CG1 3.31Å; L1300-I1304 WeakPolarHBondContact O-CG1 3.26Å; L1300-A1671 HydrophobicContact CB-CB 4.18Å
1301	A	52.6	Low	53.3	Low	13 Å²	13	59.8 Å²	59.8	11%	0.107	32%	0.32	C	S	.	.	H	α-helix	trans	-72.3	-36.7	-178.9	0	0	0	0	0	113	L1297 I1304 V1305 L1668	L1297-A1301 WeakPolarHBondContact O-CB 3.17Å; L1297-A1301 PolarHBondContact O-N 3.25Å; A1301-I1304 PolarHBondContact O-N 3.01Å; A1301-V1305 WeakPolarHBondContact O-CB 3.46Å; A1301-V1305 VanDerWaalsContact O-CG2 3.32Å; A1301-V1305 WeakPolarHBondContact O-CG2 3.22Å; A1301-V1305 PolarHBondContact O-N 3.16Å; A1301-L1668 HydrophobicContact CB-CD1 3.53Å
1302	I	53.1	Low	52.7	Low	39 Å²	39	57.9 Å²	57.9	20%	0.2	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-50.9	-173	-70.1	163.8	0	0	0	113.1	I1298 I1304 V1305 L1306 Y1735	I1298-I1302 HydrophobicContact CB-CD1 4.24Å; I1298-I1302 HydrophobicContact CG2-CD1 3.47Å; I1298-I1302 VanDerWaalsContact CG2-CD1 3.47Å; I1298-I1302 WeakPolarHBondContact O-CB 3.26Å; I1298-I1302 WeakPolarHBondContact O-CD1 3.33Å; I1298-I1302 WeakPolarHBondContact O-CG1 3.41Å; I1298-I1302 PolarHBondContact O-N 3.06Å; I1298-I1302 VanDerWaalsContact O-N 3.1Å; I1302-I1304 VanDerWaalsContact C-N 3.31Å; I1302-I1304 PolarHBondContact O-N 3.09Å; I1302-V1305 PolarHBondContact O-N 2.99Å; I1302-L1306 HydrophobicContact CG2-CD1 3.72Å; I1302-L1306 HydrophobicContact CG2-CG 4.44Å; I1302-L1306 WeakPolarHBondContact O-CB 3.4Å; I1302-L1306 VanDerWaalsContact O-CG 3.3Å; I1302-L1306 WeakPolarHBondContact O-CG 3.31Å; I1302-L1306 PolarHBondContact O-N 3.18Å; I1302-Y1735 HydrophobicContact CD1-CE1 4.22Å; I1302-Y1735 HydrophobicContact CD1-CE2 4.18Å; I1302-Y1735 WeakPolarHBondContact CD1-OH 3.45Å; I1302-Y1735 HydrophobicContact CG1-CE1 3.87Å; I1302-Y1735 HydrophobicContact CG1-CE2 3.98Å
1303	P	52.8	Low	52.3	Low	62 Å²	62	55.7 Å²	55.7	40%	0.403	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-42.2	178.4	-21.5	33.8	0	0	0	111.4	N1299 V1305 L1306 I1307	N1299-P1303 WeakPolarHBondContact O-CD 3.47Å; N1299-P1303 WeakPolarHBondContact O-CG 3.21Å; P1303-V1305 PolarHBondContact O-N 3.44Å; P1303-L1306 PolarHBondContact O-N 2.92Å; P1303-I1307 WeakPolarHBondContact O-CB 3.47Å; P1303-I1307 WeakPolarHBondContact O-CD1 3.22Å; P1303-I1307 WeakPolarHBondContact O-CG1 3.48Å; P1303-I1307 PolarHBondContact O-N 2.66Å
1304	I	50.5	Low	52.1	Low	34 Å²	34	61 Å²	61	17%	0.174	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-44	-178.4	-62.2	171.2	0	0	0	111.1	L1300 A1301 I1302 I1307 S1308 A1664 S1667 L1668	L1300-I1304 WeakPolarHBondContact O-CD1 3.07Å; L1300-I1304 VanDerWaalsContact O-CG1 3.31Å; L1300-I1304 WeakPolarHBondContact O-CG1 3.26Å; A1301-I1304 PolarHBondContact O-N 3.01Å; I1302-I1304 VanDerWaalsContact C-N 3.31Å; I1302-I1304 PolarHBondContact O-N 3.09Å; I1304-I1307 PolarHBondContact O-N 3.02Å; I1304-S1308 PolarHBondContact O-N 3.27Å; I1304-S1308 PolarHBondContact O-OG 3.06Å; I1304-A1664 HydrophobicContact CG2-CB 4.37Å; I1304-A1664 VanDerWaalsContact CG2-O 3.31Å; I1304-A1664 WeakPolarHBondContact CG2-O 3.5Å; I1304-S1667 VanDerWaalsContact CG2-OG 3.31Å; I1304-S1667 WeakPolarHBondContact CG2-OG 3.33Å; I1304-L1668 HydrophobicContact CG2-CB 4.28Å
1305	V	49.8	Very low	52.5	Low	16 Å²	16	63.1 Å²	63.1	10%	0.097	36%	0.358	C	S	.	.	H	α-helix	trans	-68	-37.4	176.9	168.6	0	0	0	0	112	A1301 I1302 P1303 S1308 N1309 L1668 E1737	A1301-V1305 WeakPolarHBondContact O-CB 3.46Å; A1301-V1305 VanDerWaalsContact O-CG2 3.32Å; A1301-V1305 WeakPolarHBondContact O-CG2 3.22Å; A1301-V1305 PolarHBondContact O-N 3.16Å; I1302-V1305 PolarHBondContact O-N 2.99Å; P1303-V1305 PolarHBondContact O-N 3.44Å; V1305-S1308 WeakPolarHBondContact CA-OG 3.19Å; V1305-S1308 PolarHBondContact O-OG 3.49Å; V1305-N1309 PolarHBondContact O-N 3.49Å; V1305-N1309 PolarHBondContact O-ND2 3.4Å; V1305-L1668 HydrophobicContact CG2-CD1 4.01Å; V1305-L1668 HydrophobicContact CG2-CD2 4.19Å; V1305-E1737 WeakPolarHBondContact CG1-OE1 3.44Å
1306	L	49.8	Very low	53	Low	120 Å²	120	59.1 Å²	59.1	63%	0.628	34%	0.337	S	S	*	.	H	α-helix	trans	-65.7	-43.7	174	-73.4	167.9	0	0	0	111.4	I1302 P1303 N1309	I1302-L1306 HydrophobicContact CG2-CD1 3.72Å; I1302-L1306 HydrophobicContact CG2-CG 4.44Å; I1302-L1306 WeakPolarHBondContact O-CB 3.4Å; I1302-L1306 VanDerWaalsContact O-CG 3.3Å; I1302-L1306 WeakPolarHBondContact O-CG 3.31Å; I1302-L1306 PolarHBondContact O-N 3.18Å; P1303-L1306 PolarHBondContact O-N 2.92Å; L1306-N1309 PolarHBondContact O-N 2.8Å
1307	I	48.9	Very low	53.8	Low	73 Å²	73	58.8 Å²	58.8	37%	0.374	33%	0.333	S	S	.	.	H	α-helix	trans	-63	-45.3	176.8	-69.3	162.2	0	0	0	110.7	P1303 I1304 N1309 S1310	P1303-I1307 WeakPolarHBondContact O-CB 3.47Å; P1303-I1307 WeakPolarHBondContact O-CD1 3.22Å; P1303-I1307 WeakPolarHBondContact O-CG1 3.48Å; P1303-I1307 PolarHBondContact O-N 2.66Å; I1304-I1307 PolarHBondContact O-N 3.02Å; I1307-N1309 VanDerWaalsContact C-N 3.29Å; I1307-N1309 PolarHBondContact O-N 3.09Å; I1307-S1310 WeakPolarHBondContact O-CB 3.5Å; I1307-S1310 PolarHBondContact O-N 3.06Å; I1307-S1310 VanDerWaalsContact O-N 3.11Å; I1307-S1310 PolarHBondContact O-OG 2.71Å
1308	S	49.3	Very low	54.7	Low	25 Å²	25	58.4 Å²	58.4	18%	0.175	33%	0.331	C	S	.	.	H	α-helix	trans	-62.6	-33.7	-179.3	59.5	0	0	0	0	113.3	I1304 V1305 S1310	I1304-S1308 PolarHBondContact O-N 3.27Å; I1304-S1308 PolarHBondContact O-OG 3.06Å; V1305-S1308 WeakPolarHBondContact CA-OG 3.19Å; V1305-S1308 PolarHBondContact O-OG 3.49Å; S1308-S1310 PolarHBondContact O-N 3.41Å
1309	N	47.3	Very low	55.3	Low	102 Å²	102	56.7 Å²	56.7	55%	0.545	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-73.3	-11.9	178.9	-78.6	-52.7	0	0	0	113.7	V1305 L1306 I1307 L1311	V1305-N1309 PolarHBondContact O-N 3.49Å; V1305-N1309 PolarHBondContact O-ND2 3.4Å; L1306-N1309 PolarHBondContact O-N 2.8Å; I1307-N1309 VanDerWaalsContact C-N 3.29Å; I1307-N1309 PolarHBondContact O-N 3.09Å; N1309-L1311 VanDerWaalsContact C-N 3.3Å; N1309-L1311 PolarHBondContact O-N 2.97Å
1310	S	49	Very low	55.5	Low	64 Å²	64	52.3 Å²	52.3	45%	0.448	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-75.1	-12.6	-179.7	73.9	0	0	0	0	114.8	I1307 S1308 T1312	I1307-S1310 WeakPolarHBondContact O-CB 3.5Å; I1307-S1310 PolarHBondContact O-N 3.06Å; I1307-S1310 VanDerWaalsContact O-N 3.11Å; I1307-S1310 PolarHBondContact O-OG 2.71Å; S1308-S1310 PolarHBondContact O-N 3.41Å; S1310-T1312 VanDerWaalsContact C-N 3.34Å; S1310-T1312 PolarHBondContact O-N 3.32Å
1311	L	46.5	Very low	55.8	Low	45 Å²	45	49 Å²	49	24%	0.236	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-86.7	14.2	-167.4	-76	161.2	0	0	0	115.6	N1309 D1660	N1309-L1311 VanDerWaalsContact C-N 3.3Å; N1309-L1311 PolarHBondContact O-N 2.97Å; L1311-D1660 HydrophobicContact CD1-CB 4.42Å
1312	T	48.5	Very low	55.9	Low	96 Å²	96	53.8 Å²	53.8	59%	0.589	30%	0.299	S	S	*	.	S	Bend	trans	-77.2	132	177.5	49.1	0	0	0	0	111.8	S1310 Q1314	S1310-T1312 VanDerWaalsContact C-N 3.34Å; S1310-T1312 PolarHBondContact O-N 3.32Å; T1312-Q1314 PolarHBondContact O-N 3.36Å; T1312-Q1314 VanDerWaalsContact O-N 3.08Å
1313	A	49.7	Very low	56	Low	52 Å²	52	52.7 Å²	52.7	43%	0.43	29%	0.293	S	S	.	.			trans	-65.4	107.5	178.8	0	0	0	0	0	111.4
1314	Q	55.7	Low	55.9	Low	128 Å²	128	50.2 Å²	50.2	60%	0.598	28%	0.276	S	S	*	.			trans	-90.5	156.6	179.5	-63	-174.4	10.3	0	0	111.4	T574 T1312	T574-Q1314 WeakPolarHBondContact CB-O 3.27Å; T574-Q1314 PolarHBondContact OG1-O 2.93Å; T1312-Q1314 PolarHBondContact O-N 3.36Å; T1312-Q1314 VanDerWaalsContact O-N 3.08Å
1315	S	64.4	Low	55.7	Low	71 Å²	71	55.6 Å²	55.6	50%	0.497	30%	0.298	S	S	.	.			trans	-74.9	130.6	170.2	49.2	0	0	0	0	110.6
1316	L	69.5	Low	55.5	Low	15 Å²	15	59.4 Å²	59.4	8%	0.079	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	109.1	179.7	-174.9	59.2	0	0	0	110.4	T574 I577 V1611 I1643 N1644	T574-L1316 HydrophobicContact CG2-CB 3.85Å; I577-L1316 HydrophobicContact CD1-CD1 3.95Å; I577-L1316 HydrophobicContact CD1-CD2 4.18Å; I577-L1316 HydrophobicContact CG1-CD2 4.06Å; L1316-V1611 HydrophobicContact CD2-CG1 3.71Å; L1316-I1643 WeakPolarHBondContact O-CA 3.26Å; L1316-I1643 WeakPolarHBondContact O-CG2 3.5Å; L1316-N1644 PolarHBondContact N-O 3.17Å; L1316-N1644 PolarHBondContact O-N 3.45Å
1317	R	72.9	Confident	55.2	Low	37 Å²	37	56.2 Å²	56.2	14%	0.14	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	121.6	173.5	-179	177.1	-179.7	149.3	-3	109.6	E561 S1319 Y1386 I1643	E561-R1317 WeakPolarHBondContact OE1-CD 3.31Å; E561-R1317 IonicContact OE1-CZ 3.01Å; E561-R1317 VanDerWaalsContact OE1-CZ 3.24Å; E561-R1317 IonicContact OE1-NE 3.6Å; E561-R1317 IonicContact OE1-NH1 3.66Å; E561-R1317 PolarHBondContact OE1-NH1 3.28Å; E561-R1317 IonicContact OE2-CZ 3.63Å; E561-R1317 IonicContact OE2-NH1 3.41Å; E561-R1317 PolarHBondContact OE2-NH1 2.88Å; E561-R1317 IonicContact OE2-NH2 3.61Å; R1317-S1319 PolarHBondContact O-N 2.92Å; R1317-Y1386 PolarHBondContact NE-OH 2.81Å; R1317-Y1386 PolarHBondContact NH1-OH 3.05Å; R1317-Y1386 PolarHBondContact NH2-OH 3.01Å; R1317-I1643 HydrophobicContact CB-CG1 4.26Å; R1317-I1643 HydrophobicContact CG-CG1 4.33Å
1318	F	72.3	Confident	54.8	Low	2 Å²	2	55.1 Å²	55.1	1%	0.009	30%	0.303	C	S	.	.			trans	-71.1	127.7	177.7	-59.5	-64.7	0	0	0	110.6	Y603 F608 V1611 P1614 T1642 N1644	Y603-F1318 AromaticContact CE1-CZ 3.88Å; Y603-F1318 HydrophobicContact CE1-CZ 3.88Å; F608-F1318 AromaticContact CE1-CE2 3.53Å; F608-F1318 HydrophobicContact CE1-CE2 3.53Å; F608-F1318 AromaticContact CE1-CZ 3.96Å; F608-F1318 HydrophobicContact CE1-CZ 3.96Å; F608-F1318 AromaticContact CZ-CE2 3.58Å; F608-F1318 HydrophobicContact CZ-CE2 3.58Å; F608-F1318 HydrophobicContact CZ-CZ 4.03Å; F1318-V1611 HydrophobicContact CD1-CB 3.96Å; F1318-V1611 HydrophobicContact CD1-CG1 4.42Å; F1318-V1611 HydrophobicContact CE1-CB 3.69Å; F1318-V1611 HydrophobicContact CE1-CG1 3.78Å; F1318-P1614 HydrophobicContact CD1-CB 4.14Å; F1318-P1614 HydrophobicContact CD1-CG 3.98Å; F1318-P1614 HydrophobicContact CD2-CB 4.14Å; F1318-P1614 HydrophobicContact CE1-CB 3.94Å; F1318-P1614 HydrophobicContact CE1-CG 3.53Å; F1318-P1614 HydrophobicContact CE2-CB 3.93Å; F1318-P1614 HydrophobicContact CE2-CG 4.36Å; F1318-P1614 HydrophobicContact CG-CB 4.22Å; F1318-P1614 HydrophobicContact CZ-CB 3.8Å; F1318-P1614 HydrophobicContact CZ-CG 3.72Å; F1318-T1642 WeakPolarHBondContact CD2-O 3.4Å; F1318-T1642 WeakPolarHBondContact CD2-OG1 3.3Å; F1318-T1642 PolarHBondContact N-O 3.38Å; F1318-N1644 HydrophobicContact CE1-CB 4.44Å; F1318-N1644 HydrophobicContact CE2-CB 3.75Å; F1318-N1644 HydrophobicContact CZ-CB 3.5Å; F1318-N1644 VanDerWaalsContact CZ-CB 3.5Å
1319	S	69.7	Low	54.1	Low	19 Å²	19	58.1 Å²	58.1	13%	0.133	32%	0.322	C	S	.	.			trans	-157.8	136.3	159.9	84.1	0	0	0	0	108.3	R1317 S1321 R1322	R1317-S1319 PolarHBondContact O-N 2.92Å; S1319-S1321 PolarHBondContact O-N 3.38Å; S1319-R1322 PolarHBondContact O-N 3.27Å; S1319-R1322 VanDerWaalsContact O-N 3.17Å; S1319-R1322 WeakPolarHBondContact OG-CB 3.24Å; S1319-R1322 PolarHBondContact OG-N 3.28Å
1320	P	60.8	Low	53.6	Low	4 Å²	4	56.8 Å²	56.8	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-52.7	-44.1	177	-25.5	32.9	0	0	0	111.1	R1322 Y1323 Y1324 F1616 A1619	P1320-R1322 PolarHBondContact O-N 3.48Å; P1320-Y1323 WeakPolarHBondContact O-CB 3.42Å; P1320-Y1323 PolarHBondContact O-N 3.17Å; P1320-Y1324 WeakPolarHBondContact O-CD2 3.05Å; P1320-Y1324 PolarHBondContact O-N 3.18Å; P1320-F1616 HydrophobicContact CB-CD1 4.43Å; P1320-F1616 HydrophobicContact CB-CE1 3.93Å; P1320-F1616 HydrophobicContact CB-CZ 4.49Å; P1320-F1616 HydrophobicContact CG-CD1 4.16Å; P1320-F1616 HydrophobicContact CG-CE1 4.17Å; P1320-A1619 HydrophobicContact CG-CB 3.93Å
1321	S	58	Low	52.8	Low	12 Å²	12	56.2 Å²	56.2	8%	0.084	31%	0.306	C	S	.	.	H	α-helix	trans	-69.4	-7.1	-173.4	90.7	0	0	0	0	116.2	S1319 K1325 R1381	S1319-S1321 PolarHBondContact O-N 3.38Å; S1321-K1325 WeakPolarHBondContact O-CB 3.29Å; S1321-R1381 PolarHBondContact O-NH2 2.71Å; S1321-R1381 VanDerWaalsContact O-NH2 3.08Å; S1321-R1381 PolarHBondContact OG-NE 3.02Å
1322	R	55.1	Low	52.3	Low	113 Å²	113	56.2 Å²	56.2	43%	0.426	31%	0.308	S	S	.	.	H	α-helix	trans	-98.3	-40.6	174.9	-174.2	175.5	-178	173	-1.3	111.5	S1319 P1320 Y1324 K1325 E1326	S1319-R1322 PolarHBondContact O-N 3.27Å; S1319-R1322 VanDerWaalsContact O-N 3.17Å; S1319-R1322 WeakPolarHBondContact OG-CB 3.24Å; S1319-R1322 PolarHBondContact OG-N 3.28Å; P1320-R1322 PolarHBondContact O-N 3.48Å; R1322-Y1324 PolarHBondContact O-N 2.62Å; R1322-K1325 PolarHBondContact O-N 2.82Å; R1322-E1326 IonicContact CZ-OE1 2.71Å; R1322-E1326 IonicContact NE-OE1 2.9Å; R1322-E1326 PolarHBondContact NE-OE1 3.22Å; R1322-E1326 IonicContact NH2-OE1 2.62Å; R1322-E1326 PolarHBondContact O-N 3.44Å
1323	Y	54.6	Low	51.6	Low	16 Å²	16	53.4 Å²	53.4	6%	0.063	29%	0.289	C	S	.	.	H	α-helix	trans	-51.4	-40.2	170.9	174.9	-95.1	0	0	0	112	I577 V578 P1320 G1609 V1611	I577-Y1323 HydrophobicContact CG2-CD2 3.66Å; I577-Y1323 HydrophobicContact CG2-CE2 4.11Å; V578-Y1323 HydrophobicContact CG2-CE2 3.62Å; P1320-Y1323 WeakPolarHBondContact O-CB 3.42Å; P1320-Y1323 PolarHBondContact O-N 3.17Å; Y1323-G1609 WeakPolarHBondContact OH-CA 3.45Å; Y1323-V1611 HydrophobicContact CD2-CG2 3.99Å
1324	Y	52.5	Low	51	Low	11 Å²	11	53.9 Å²	53.9	4%	0.043	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-19	175.2	-79.5	-98.2	0	0	0	115.2	P1320 R1322 H1327 C1349 Y1350 C1471 G1472 W1473 F1616	P1320-Y1324 WeakPolarHBondContact O-CD2 3.05Å; P1320-Y1324 PolarHBondContact O-N 3.18Å; R1322-Y1324 PolarHBondContact O-N 2.62Å; Y1324-H1327 VanDerWaalsContact O-O 3.1Å; Y1324-C1349 HydrophobicContact CD1-CB 4.48Å; Y1324-C1349 HydrophobicContact CD2-CB 4.05Å; Y1324-C1349 HydrophobicContact CE2-CB 4.14Å; Y1324-C1349 HydrophobicContact CG-CB 4.22Å; Y1324-Y1350 PolarHBondContact OH-O 3.47Å; Y1324-C1471 VanDerWaalsContact CE1-O 3.29Å; Y1324-C1471 WeakPolarHBondContact CE1-O 3.21Å; Y1324-G1472 VanDerWaalsContact CE1-CA 3.47Å; Y1324-W1473 PolarHBondContact OH-N 2.82Å; Y1324-W1473 PolarHBondContact OH-O 3.11Å; Y1324-F1616 HydrophobicContact CE2-CZ 4.48Å
1325	K	46.6	Very low	50.3	Low	146 Å²	146	51.9 Å²	51.9	64%	0.635	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-27.9	-171.9	-169.8	169.9	-178.3	172.7	0	113.4	S1321 R1322	S1321-K1325 WeakPolarHBondContact O-CB 3.29Å; R1322-K1325 PolarHBondContact O-N 2.82Å
1326	E	43.6	Very low	49.2	Very low	96 Å²	96	49.5 Å²	49.5	45%	0.449	27%	0.266	S	S	.	.	S	Bend	trans	-82.2	-4.8	174.1	-68.2	169.3	-164.6	0	0	111.9	R1322	R1322-E1326 IonicContact CZ-OE1 2.71Å; R1322-E1326 IonicContact NE-OE1 2.9Å; R1322-E1326 PolarHBondContact NE-OE1 3.22Å; R1322-E1326 IonicContact NH2-OE1 2.62Å; R1322-E1326 PolarHBondContact O-N 3.44Å
1327	H	43.8	Very low	47.8	Very low	54 Å²	54	52 Å²	52	25%	0.25	28%	0.281	C	S	.	.	S	Bend	trans	-129.2	83.9	179.1	-60.7	-22.4	0	0	0	109.4	V578 R580 Y1324	V578-H1327 WeakPolarHBondContact CG2-NE2 3.29Å; R580-H1327 PolarHBondContact NH2-ND1 2.86Å; Y1324-H1327 VanDerWaalsContact O-O 3.1Å
1328	G	40.5	Very low	46.2	Very low	50 Å²	50	59 Å²	59	52%	0.515	31%	0.313	S	S	.	.			trans	-58.6	161	-170.7	0	0	0	0	0	115.1	L1330	G1328-L1330 PolarHBondContact O-N 2.89Å
1329	P	35	Very low	44.8	Very low	87 Å²	87	64.1 Å²	64.1	57%	0.565	34%	0.34	S	S	*	.			trans	-74.8	89.5	-173.1	31	-35.4	0	0	0	112	L1331 C1471	P1329-L1331 PolarHBondContact O-N 2.89Å; P1329-L1331 VanDerWaalsContact O-N 3.11Å; P1329-C1471 VanDerWaalsContact C-SG 3.59Å; P1329-C1471 WeakPolarHBondContact CA-SG 3.36Å; P1329-C1471 HydrophobicContact CB-CB 4.27Å
1330	L	36.1	Very low	43.5	Very low	75 Å²	75	66.1 Å²	66.1	39%	0.393	35%	0.348	S	S	.	.			trans	-76.4	94.6	170.6	-93.7	161	0	0	0	111	N781 G1328	N781-L1330 HydrophobicContact CB-CD1 4.36Å; N781-L1330 HydrophobicContact CB-CD2 4.13Å; G1328-L1330 PolarHBondContact O-N 2.89Å
1331	L	33.7	Very low	42.3	Very low	51 Å²	51	73.3 Å²	73.3	27%	0.267	38%	0.382	S	S	.	.			trans	64.1	78.5	161.1	-67.3	164.2	0	0	0	116.7	V826 N828 P1329 K1469	V826-L1331 HydrophobicContact CG1-CD1 3.32Å; N828-L1331 HydrophobicContact CB-CD2 4.05Å; N828-L1331 WeakPolarHBondContact ND2-CD2 3.17Å; P1329-L1331 PolarHBondContact O-N 2.89Å; P1329-L1331 VanDerWaalsContact O-N 3.11Å; L1331-K1469 WeakPolarHBondContact O-CB 3.44Å
1332	V	35	Very low	41.2	Very low	46 Å²	46	82.8 Å²	82.8	28%	0.279	42%	0.422	S	S	.	.			trans	-65.4	142.4	157.8	-176.3	0	0	0	0	110.3	I1336	V1332-I1336 HydrophobicContact CG1-CB 3.67Å; V1332-I1336 HydrophobicContact CG1-CD1 3.98Å; V1332-I1336 HydrophobicContact CG1-CG1 4.4Å; V1332-I1336 HydrophobicContact CG1-CG2 3.64Å
1333	D	33.9	Very low	40.1	Very low	36 Å²	36	81.8 Å²	81.8	19%	0.193	43%	0.432	C	S	.	.			trans	-56.7	135.7	-179.8	-159.4	-62.2	0	0	0	112.5	V1335 I1336 T1337 K1469	D1333-V1335 PolarHBondContact O-N 3.33Å; D1333-V1335 PolarHBondContact OD1-N 2.59Å; D1333-I1336 PolarHBondContact O-N 2.86Å; D1333-T1337 PolarHBondContact O-N 2.95Å; D1333-T1337 PolarHBondContact O-OG1 2.9Å; D1333-K1469 IonicContact OD2-NZ 3.99Å; D1333-K1469 PolarHBondContact OD2-NZ 3.45Å
1334	P	38	Very low	39	Very low	63 Å²	63	86.6 Å²	86.6	41%	0.409	46%	0.463	S	S	.	.	H	α-helix	trans	-55.2	-22.1	-179.9	19.8	-33.6	0	0	0	115.2	K1338	P1334-K1338 PolarHBondContact O-N 2.81Å; P1334-K1338 VanDerWaalsContact O-N 3.16Å
1335	V	40.8	Very low	38.2	Very low	85 Å²	85	97.1 Å²	97.1	52%	0.515	51%	0.509	S	S	.	.	H	α-helix	trans	-64.7	-40.6	173.8	-179.4	0	0	0	0	111.7	D1333	D1333-V1335 PolarHBondContact O-N 3.33Å; D1333-V1335 PolarHBondContact OD1-N 2.59Å
1336	I	41.6	Very low	37.8	Very low	22 Å²	22	92.1 Å²	92.1	11%	0.113	50%	0.495	C	S	.	.	H	α-helix	trans	-75	-38.3	178.5	-63.3	170.5	0	0	0	110	V1332 D1333 K1338 L1339 I1340	V1332-I1336 HydrophobicContact CG1-CB 3.67Å; V1332-I1336 HydrophobicContact CG1-CD1 3.98Å; V1332-I1336 HydrophobicContact CG1-CG1 4.4Å; V1332-I1336 HydrophobicContact CG1-CG2 3.64Å; D1333-I1336 PolarHBondContact O-N 2.86Å; I1336-K1338 VanDerWaalsContact C-N 3.28Å; I1336-K1338 PolarHBondContact O-N 3.27Å; I1336-L1339 PolarHBondContact O-N 3.41Å; I1336-I1340 HydrophobicContact CG2-CD1 3.48Å; I1336-I1340 VanDerWaalsContact CG2-CD1 3.48Å; I1336-I1340 HydrophobicContact CG2-CG1 4.12Å; I1336-I1340 PolarHBondContact O-N 3Å
1337	T	39.7	Very low	37.9	Very low	66 Å²	66	88.5 Å²	88.5	41%	0.405	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-33.6	177.9	-50.6	0	0	0	0	112.7	D1333 L1339 H1341	D1333-T1337 PolarHBondContact O-N 2.95Å; D1333-T1337 PolarHBondContact O-OG1 2.9Å; T1337-L1339 VanDerWaalsContact C-N 3.29Å; T1337-L1339 PolarHBondContact O-N 3.21Å; T1337-H1341 PolarHBondContact O-N 2.99Å
1338	K	40	Very low	38.1	Very low	184 Å²	184	88.6 Å²	88.6	80%	0.8	49%	0.485	S	S	*	.	H	α-helix	trans	-67	-24.5	173	-83.4	-174.4	173	-177.9	0	114.1	P1334 I1336	P1334-K1338 PolarHBondContact O-N 2.81Å; P1334-K1338 VanDerWaalsContact O-N 3.16Å; I1336-K1338 VanDerWaalsContact C-N 3.28Å; I1336-K1338 PolarHBondContact O-N 3.27Å
1339	L	41.1	Very low	38.6	Very low	111 Å²	111	86.2 Å²	86.2	58%	0.581	46%	0.461	S	S	*	.	H	α-helix	trans	-92.5	-26.8	178.1	-81.4	159.1	0	0	0	113.4	I1336 T1337 P1406	I1336-L1339 PolarHBondContact O-N 3.41Å; T1337-L1339 VanDerWaalsContact C-N 3.29Å; T1337-L1339 PolarHBondContact O-N 3.21Å; L1339-P1406 HydrophobicContact CD1-CG 4.39Å
1340	I	42.5	Very low	39.8	Very low	60 Å²	60	85.1 Å²	85.1	31%	0.308	45%	0.446	S	S	.	.	H	α-helix	trans	-100.5	7.5	-174	-59.7	-175.3	0	0	0	112.8	I1336 F1342	I1336-I1340 HydrophobicContact CG2-CD1 3.48Å; I1336-I1340 VanDerWaalsContact CG2-CD1 3.48Å; I1336-I1340 HydrophobicContact CG2-CG1 4.12Å; I1336-I1340 PolarHBondContact O-N 3Å; I1340-F1342 PolarHBondContact O-N 3.46Å
1341	H	36.1	Very low	41.1	Very low	156 Å²	156	81.6 Å²	81.6	72%	0.722	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	2.8	-166.7	-143.2	-31	0	0	0	117	T1337	T1337-H1341 PolarHBondContact O-N 2.99Å
1342	F	35.9	Very low	43	Very low	211 Å²	211	79.3 Å²	79.3	93%	0.925	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-2.5	-174.8	-107.2	-83.5	0	0	0	117.7	I1340	I1340-F1342 PolarHBondContact O-N 3.46Å
1343	S	31.6	Very low	44.9	Very low	91 Å²	91	77.1 Å²	77.1	64%	0.636	40%	0.403	S	S	*	.	S	Bend	trans	-147.2	103.3	172.2	68	0	0	0	0	117.1
1344	T	31.2	Very low	46.7	Very low	118 Å²	118	75.5 Å²	75.5	72%	0.724	39%	0.394	S	S	*	.			trans	41	107.9	140.7	55.4	0	0	0	0	121.7	A1346	T1344-A1346 VanDerWaalsContact C-N 3.26Å; T1344-A1346 PolarHBondContact O-N 2.78Å
1345	K	36	Very low	48.1	Very low	232 Å²	232	76 Å²	76	100%	1.009	39%	0.388	S	S	*	.	S	Bend		39.6	2.1	127.1	-83.7	-171.9	176.4	-178	0	123.3
1346	A	37.8	Very low	49.1	Very low	41 Å²	41	73.5 Å²	73.5	34%	0.339	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-101.9	140.5	177.2	0	0	0	0	0	111.3	T1344 L1348	T1344-A1346 VanDerWaalsContact C-N 3.26Å; T1344-A1346 PolarHBondContact O-N 2.78Å; A1346-L1348 PolarHBondContact O-N 3.25Å
1347	G	45.5	Very low	49.7	Very low	20 Å²	20	76 Å²	76	21%	0.206	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-67.8	119.5	177	0	0	0	0	0	111.1
1348	L	48.7	Very low	50.3	Low	55 Å²	55	77.8 Å²	77.8	29%	0.288	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-79.8	124.4	-177.2	-71.2	160.2	0	0	0	111.1	A1346 Y1350 D1444 V1446	A1346-L1348 PolarHBondContact O-N 3.25Å; L1348-Y1350 HydrophobicContact CB-CE2 4.45Å; L1348-D1444 VanDerWaalsContact CA-O 3.24Å; L1348-D1444 WeakPolarHBondContact CA-O 3.31Å; L1348-V1446 HydrophobicContact CB-CG2 4.23Å; L1348-V1446 HydrophobicContact CD1-CG2 4.48Å; L1348-V1446 HydrophobicContact CD2-CG2 4.06Å; L1348-V1446 HydrophobicContact CG-CG2 4.5Å
1349	C	50.2	Low	50.8	Low	1 Å²	1	70.5 Å²	70.5	1%	0.007	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.6	173	-41.4	0	0	0	0	109.8	Y1324 D1444 D1445 V1446	Y1324-C1349 HydrophobicContact CD1-CB 4.48Å; Y1324-C1349 HydrophobicContact CD2-CB 4.05Å; Y1324-C1349 HydrophobicContact CE2-CB 4.14Å; Y1324-C1349 HydrophobicContact CG-CB 4.22Å; C1349-D1444 PolarHBondContact N-O 3.06Å; C1349-D1444 VanDerWaalsContact N-O 3.09Å; C1349-D1445 WeakPolarHBondContact CB-OD1 3.27Å; C1349-D1445 CarbonylContact O-C 3.57Å; C1349-D1445 WeakPolarHBondContact O-CA 3.28Å; C1349-D1445 PolarHBondContact SG-OD1 2.97Å; C1349-V1446 PolarHBondContact O-N 3.01Å
1350	Y	60.2	Low	51	Low	63 Å²	63	74.5 Å²	74.5	25%	0.247	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	139.7	173.7	-70.6	-95.7	0	0	0	110.7	Y1324 L1348 V1446 P1474	Y1324-Y1350 PolarHBondContact OH-O 3.47Å; L1348-Y1350 HydrophobicContact CB-CE2 4.45Å; Y1350-V1446 CarbonylContact C-O 3.56Å; Y1350-V1446 WeakPolarHBondContact CA-O 3.36Å; Y1350-V1446 HydrophobicContact CD1-CB 3.77Å; Y1350-V1446 HydrophobicContact CD1-CG1 3.94Å; Y1350-V1446 HydrophobicContact CD1-CG2 4.38Å; Y1350-V1446 HydrophobicContact CE1-CB 3.87Å; Y1350-V1446 HydrophobicContact CE1-CG1 3.86Å; Y1350-V1446 HydrophobicContact CE1-CG2 4.06Å; Y1350-V1446 HydrophobicContact CG-CB 4.39Å; Y1350-P1474 WeakPolarHBondContact O-CA 3.3Å
1351	S	64.4	Low	51.2	Low	2 Å²	2	76.3 Å²	76.3	1%	0.014	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	171.8	166.7	74.4	0	0	0	0	110.9	L1378 V1446 M1447 A1448 T1475	S1351-L1378 WeakPolarHBondContact OG-CD1 3.44Å; S1351-V1446 PolarHBondContact N-O 3.02Å; S1351-M1447 WeakPolarHBondContact O-CA 3.44Å; S1351-A1448 PolarHBondContact O-N 3.02Å; S1351-T1475 CarbonylContact C-O 3.6Å
1352	S	72.8	Confident	51.6	Low	3 Å²	3	74.7 Å²	74.7	2%	0.021	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	159.1	-178.8	-57.1	0	0	0	0	111.1	A1448 T1475 V1476 F1477	S1352-A1448 CarbonylContact C-O 3.57Å; S1352-A1448 WeakPolarHBondContact CA-O 3.44Å; S1352-T1475 PolarHBondContact N-O 3.37Å; S1352-V1476 WeakPolarHBondContact O-CA 3.5Å; S1352-F1477 PolarHBondContact O-N 3.03Å
1353	F	74.8	Confident	52.4	Low	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	161	168.2	64	-102.4	0	0	0	111.3	R1355 I1370 W1402 M1447 A1448 D1449 L1450 F1477 F1479	F1353-R1355 HydrophobicContact CD2-CG 4.26Å; F1353-R1355 HydrophobicContact CE2-CG 4.19Å; F1353-I1370 HydrophobicContact CD1-CG2 4.25Å; F1353-I1370 HydrophobicContact CD2-CD1 4Å; F1353-I1370 HydrophobicContact CE1-CG2 3.71Å; F1353-I1370 HydrophobicContact CE2-CD1 4.11Å; F1353-I1370 HydrophobicContact CG-CD1 4.37Å; F1353-I1370 HydrophobicContact CZ-CD1 4.5Å; F1353-I1370 HydrophobicContact CZ-CG2 3.9Å; F1353-W1402 AromaticContact CE1-CH2 3.64Å; F1353-W1402 HydrophobicContact CE1-CH2 3.64Å; F1353-W1402 HydrophobicContact CE1-CZ2 4.12Å; F1353-W1402 AromaticContact CZ-CH2 3.53Å; F1353-W1402 HydrophobicContact CZ-CH2 3.53Å; F1353-W1402 AromaticContact CZ-CZ2 3.82Å; F1353-W1402 HydrophobicContact CZ-CZ2 3.82Å; F1353-M1447 HydrophobicContact CD1-CE 3.7Å; F1353-M1447 HydrophobicContact CD1-CG 3.99Å; F1353-M1447 HydrophobicContact CD1-SD 3.9Å; F1353-M1447 HydrophobicContact CE1-CE 4.41Å; F1353-M1447 HydrophobicContact CE1-CG 4.13Å; F1353-M1447 HydrophobicContact CE1-SD 4.03Å; F1353-A1448 PolarHBondContact N-O 3.08Å; F1353-D1449 HydrophobicContact CE2-CB 3.91Å; F1353-D1449 VanDerWaalsContact CE2-CG 3.44Å; F1353-D1449 HydrophobicContact CZ-CB 3.88Å; F1353-L1450 PolarHBondContact O-N 2.78Å; F1353-F1477 WeakPolarHBondContact CA-O 3.39Å; F1353-F1477 HydrophobicContact CB-CB 4.38Å; F1353-F1477 WeakPolarHBondContact CB-O 3.18Å; F1353-F1479 HydrophobicContact CB-CE2 4.35Å
1354	T	71.4	Confident	53.8	Low	1 Å²	1	69.3 Å²	69.3	1%	0.006	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142.1	170.8	39.1	0	0	0	0	110.3	L1450 I1455 V1476 F1477 D1478	T1354-L1450 HydrophobicContact CG2-CB 3.87Å; T1354-I1455 HydrophobicContact CG2-CD1 3.64Å; T1354-I1455 HydrophobicContact CG2-CG1 3.81Å; T1354-V1476 HydrophobicContact CG2-CG1 4.4Å; T1354-F1477 PolarHBondContact N-O 2.94Å; T1354-F1477 VanDerWaalsContact N-O 3.08Å; T1354-D1478 VanDerWaalsContact OG1-CA 3.26Å; T1354-D1478 WeakPolarHBondContact OG1-CA 3.4Å; T1354-D1478 VanDerWaalsContact OG1-CB 3.32Å; T1354-D1478 WeakPolarHBondContact OG1-CB 3.27Å; T1354-D1478 PolarHBondContact OG1-OD1 3.16Å
1355	R	67.7	Low	55.5	Low	74 Å²	74	65.1 Å²	65.1	28%	0.279	34%	0.34	S	S	.	.			trans	-106.4	148.9	170.4	-56.5	-174	-165.2	131	21.5	109.7	W44 F1353 M1366 I1370 D1449 S1451	W44-R1355 WeakPolarHBondContact CH2-O 3.35Å; F1353-R1355 HydrophobicContact CD2-CG 4.26Å; F1353-R1355 HydrophobicContact CE2-CG 4.19Å; R1355-M1366 HydrophobicContact CB-CE 4.05Å; R1355-M1366 HydrophobicContact CG-CE 3.97Å; R1355-I1370 HydrophobicContact CG-CD1 4.47Å; R1355-D1449 IonicContact CZ-OD2 2.72Å; R1355-D1449 VanDerWaalsContact CZ-OD2 3.25Å; R1355-D1449 IonicContact NH1-OD2 2.78Å; R1355-D1449 IonicContact NH2-OD2 2.84Å; R1355-D1449 PolarHBondContact NH2-OD2 2.91Å; R1355-S1451 WeakPolarHBondContact CB-OG 3.27Å; R1355-S1451 PolarHBondContact N-OG 3.14Å
1356	P	60.9	Low	57	Low	32 Å²	32	54.5 Å²	54.5	21%	0.208	29%	0.294	C	S	.	.			trans	-62.9	142.9	178.2	24.7	-32.9	0	0	0	111.1	N1358 D1359 M1366	P1356-N1358 PolarHBondContact O-N 2.98Å; P1356-D1359 HydrophobicContact CG-CB 4.02Å; P1356-D1359 PolarHBondContact O-N 3.11Å; P1356-M1366 VanDerWaalsContact CD-CE 3.49Å
1357	P	54.3	Low	58.7	Low	75 Å²	75	57.9 Å²	57.9	49%	0.487	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-7.4	-158.3	19.6	-32.6	0	0	0	117.5
1358	N	53.6	Low	60.1	Low	104 Å²	104	59 Å²	59	56%	0.556	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-1.4	176.2	-63.2	4.5	0	0	0	113.4	P1356 K1360 R1484	P1356-N1358 PolarHBondContact O-N 2.98Å; N1358-K1360 VanDerWaalsContact C-N 3.3Å; N1358-K1360 PolarHBondContact O-N 2.75Å; N1358-R1484 PolarHBondContact ND2-NH2 3.33Å; N1358-R1484 VanDerWaalsContact ND2-NH2 3.12Å
1359	D	49.6	Very low	61.6	Low	31 Å²	31	56.5 Å²	56.5	17%	0.166	29%	0.289	C	S	.	.			trans	-86.4	67.8	-173.5	-167.3	18	0	0	0	112	P1356 S1361 S1363	P1356-D1359 HydrophobicContact CG-CB 4.02Å; P1356-D1359 PolarHBondContact O-N 3.11Å; D1359-S1361 VanDerWaalsContact C-N 3.31Å; D1359-S1363 PolarHBondContact OD1-N 3.15Å; D1359-S1363 WeakPolarHBondContact OD2-CB 3.31Å; D1359-S1363 PolarHBondContact OD2-OG 3.33Å
1360	K	46.6	Very low	62.8	Low	195 Å²	195	56.9 Å²	56.9	85%	0.848	29%	0.29	S	S	*	.			trans	-87.3	-3.4	166.7	-69.4	-176.3	-179.6	174.5	0	112.5	N1358	N1358-K1360 VanDerWaalsContact C-N 3.3Å; N1358-K1360 PolarHBondContact O-N 2.75Å
1361	S	45.1	Very low	63.5	Low	98 Å²	98	57.2 Å²	57.2	69%	0.685	30%	0.296	S	S	*	.	S	Bend	trans	-125.4	73.8	-176.9	55.5	0	0	0	0	111.1	D1359 S1363	D1359-S1361 VanDerWaalsContact C-N 3.31Å; S1361-S1363 PolarHBondContact O-N 2.81Å; S1361-S1363 VanDerWaalsContact O-N 3.13Å
1362	E	44.9	Very low	64.1	Low	122 Å²	122	57.1 Å²	57.1	57%	0.57	30%	0.296	S	S	*	.			trans	24.9	69.4	164.6	-56.7	-170.7	150.9	0	0	117.2	N1364 R1367	E1362-N1364 PolarHBondContact O-N 3.05Å; E1362-R1367 VanDerWaalsContact CD-CZ 3.5Å; E1362-R1367 IonicContact OE1-CZ 2.77Å; E1362-R1367 IonicContact OE1-NH1 3Å; E1362-R1367 PolarHBondContact OE1-NH1 3.41Å; E1362-R1367 VanDerWaalsContact OE1-NH1 3.11Å; E1362-R1367 IonicContact OE1-NH2 2.71Å; E1362-R1367 PolarHBondContact OE1-NH2 2.86Å; E1362-R1367 IonicContact OE2-CZ 3.96Å; E1362-R1367 IonicContact OE2-NH1 3.41Å; E1362-R1367 PolarHBondContact OE2-NH1 3.05Å; E1362-R1367 IonicContact OE2-NH2 2.67Å
1363	S	52.4	Low	64.3	Low	40 Å²	40	57.3 Å²	57.3	28%	0.28	30%	0.297	S	S	.	.			trans	-58.1	123.7	168.7	70.3	0	0	0	0	111.9	D1359 S1361 F1365 M1366	D1359-S1363 PolarHBondContact OD1-N 3.15Å; D1359-S1363 WeakPolarHBondContact OD2-CB 3.31Å; D1359-S1363 PolarHBondContact OD2-OG 3.33Å; S1361-S1363 PolarHBondContact O-N 2.81Å; S1361-S1363 VanDerWaalsContact O-N 3.13Å; S1363-F1365 PolarHBondContact O-N 2.97Å; S1363-F1365 VanDerWaalsContact O-N 3.1Å; S1363-M1366 PolarHBondContact O-N 3.06Å
1364	N	60.7	Low	64.1	Low	148 Å²	148	57.9 Å²	57.9	79%	0.791	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-23	-174.6	-83.7	-38.5	0	0	0	114	E1362 P1368	E1362-N1364 PolarHBondContact O-N 3.05Å; N1364-P1368 VanDerWaalsContact O-CD 3.31Å; N1364-P1368 WeakPolarHBondContact O-CD 3.22Å
1365	F	67.6	Low	64.2	Low	30 Å²	30	59.2 Å²	59.2	13%	0.132	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-45.2	179.2	171.3	-113.7	0	0	0	112.4	L628 V630 S1363 Y1369 H1599	L628-F1365 HydrophobicContact CD2-CD2 3.94Å; L628-F1365 HydrophobicContact CD2-CE2 3.87Å; V630-F1365 HydrophobicContact CG1-CZ 4.06Å; V630-F1365 HydrophobicContact CG2-CE2 3.57Å; V630-F1365 HydrophobicContact CG2-CZ 3.72Å; S1363-F1365 PolarHBondContact O-N 2.97Å; S1363-F1365 VanDerWaalsContact O-N 3.1Å; F1365-Y1369 HydrophobicContact CD2-CE2 4.02Å; F1365-Y1369 AromaticContact CE2-CE2 3.54Å; F1365-Y1369 HydrophobicContact CE2-CE2 3.54Å; F1365-Y1369 AromaticContact CE2-CZ 3.91Å; F1365-Y1369 AromaticContact CZ-CE2 3.88Å; F1365-Y1369 HydrophobicContact CZ-CE2 3.88Å; F1365-Y1369 WeakPolarHBondContact O-CD2 3.37Å; F1365-Y1369 WeakPolarHBondContact O-CE2 3.39Å; F1365-H1599 HydrophobicContact CD1-CB 4.07Å; F1365-H1599 AromaticContact CD1-CG 3.93Å; F1365-H1599 AromaticContact CD1-ND1 3.92Å; F1365-H1599 HydrophobicContact CD2-CB 4.36Å; F1365-H1599 AromaticContact CD2-CD2 3.94Å; F1365-H1599 HydrophobicContact CE1-CB 3.59Å; F1365-H1599 AromaticContact CE1-CG 3.98Å; F1365-H1599 HydrophobicContact CE2-CB 3.89Å; F1365-H1599 HydrophobicContact CG-CB 4.45Å; F1365-H1599 AromaticContact CG-CG 4Å; F1365-H1599 HydrophobicContact CZ-CB 3.5Å; F1365-H1599 VanDerWaalsContact CZ-CB 3.5Å
1366	M	68.6	Low	64.3	Low	9 Å²	9	57 Å²	57	4%	0.044	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-46.7	-164.7	-81.7	-87.1	-96.3	0	0	114.1	R1355 P1356 S1363 P1368 Y1369 I1370 F1479	R1355-M1366 HydrophobicContact CB-CE 4.05Å; R1355-M1366 HydrophobicContact CG-CE 3.97Å; P1356-M1366 VanDerWaalsContact CD-CE 3.49Å; S1363-M1366 PolarHBondContact O-N 3.06Å; M1366-P1368 VanDerWaalsContact C-CD 3.46Å; M1366-Y1369 PolarHBondContact O-N 2.82Å; M1366-Y1369 VanDerWaalsContact O-N 3.13Å; M1366-I1370 PolarHBondContact O-N 3.35Å; M1366-F1479 HydrophobicContact CE-CB 3.49Å; M1366-F1479 VanDerWaalsContact CE-CB 3.49Å; M1366-F1479 HydrophobicContact CE-CD2 4.22Å; M1366-F1479 HydrophobicContact CE-CG 3.98Å; M1366-F1479 HydrophobicContact SD-CB 3.15Å; M1366-F1479 WeakPolarHBondContact SD-CB 3.32Å; M1366-F1479 HydrophobicContact SD-CD1 3.5Å; M1366-F1479 WeakPolarHBondContact SD-CD1 3.37Å; M1366-F1479 HydrophobicContact SD-CD2 3.91Å; M1366-F1479 HydrophobicContact SD-CE1 4.28Å; M1366-F1479 HydrophobicContact SD-CG 3.29Å; M1366-F1479 WeakPolarHBondContact SD-CG 3.26Å
1367	R	72.6	Confident	64.6	Low	112 Å²	112	55.8 Å²	55.8	42%	0.423	29%	0.294	S	S	.	.	H	α-helix	trans	-53.3	-44.2	-171.6	-176.9	-170.8	-165.3	154.3	26.6	113.6	E1362 Y1369 I1370 D1371	E1362-R1367 VanDerWaalsContact CD-CZ 3.5Å; E1362-R1367 IonicContact OE1-CZ 2.77Å; E1362-R1367 IonicContact OE1-NH1 3Å; E1362-R1367 PolarHBondContact OE1-NH1 3.41Å; E1362-R1367 VanDerWaalsContact OE1-NH1 3.11Å; E1362-R1367 IonicContact OE1-NH2 2.71Å; E1362-R1367 PolarHBondContact OE1-NH2 2.86Å; E1362-R1367 IonicContact OE2-CZ 3.96Å; E1362-R1367 IonicContact OE2-NH1 3.41Å; E1362-R1367 PolarHBondContact OE2-NH1 3.05Å; E1362-R1367 IonicContact OE2-NH2 2.67Å; R1367-Y1369 VanDerWaalsContact C-N 3.28Å; R1367-Y1369 PolarHBondContact O-N 3.45Å; R1367-I1370 PolarHBondContact O-N 3.47Å; R1367-D1371 VanDerWaalsContact CG-OD2 3.31Å; R1367-D1371 WeakPolarHBondContact CG-OD2 3.31Å; R1367-D1371 IonicContact NE-OD2 3.89Å; R1367-D1371 VanDerWaalsContact O-CB 3.31Å; R1367-D1371 WeakPolarHBondContact O-CB 3.47Å; R1367-D1371 PolarHBondContact O-N 2.94Å
1368	P	76	Confident	65.1	Low	44 Å²	44	52.7 Å²	52.7	29%	0.286	27%	0.273	S	S	.	.	H	α-helix	trans	-59.1	-34.8	179.9	-26	37	0	0	0	114.1	N1364 M1366 A1372 A1627	N1364-P1368 VanDerWaalsContact O-CD 3.31Å; N1364-P1368 WeakPolarHBondContact O-CD 3.22Å; M1366-P1368 VanDerWaalsContact C-CD 3.46Å; P1368-A1372 WeakPolarHBondContact O-CB 3.31Å; P1368-A1372 PolarHBondContact O-N 2.96Å; P1368-A1372 VanDerWaalsContact O-N 3.07Å; P1368-A1627 HydrophobicContact CB-CB 3.88Å
1369	Y	78.5	Confident	65.7	Low	3 Å²	3	48 Å²	48	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-72.4	-48.2	178	-63	-94.7	0	0	0	111.6	V630 F1365 M1366 R1367 A1372 M1373 F1479 R1624 A1627 H1628	V630-Y1369 WeakPolarHBondContact CG2-OH 3.41Å; F1365-Y1369 HydrophobicContact CD2-CE2 4.02Å; F1365-Y1369 AromaticContact CE2-CE2 3.54Å; F1365-Y1369 HydrophobicContact CE2-CE2 3.54Å; F1365-Y1369 AromaticContact CE2-CZ 3.91Å; F1365-Y1369 AromaticContact CZ-CE2 3.88Å; F1365-Y1369 HydrophobicContact CZ-CE2 3.88Å; F1365-Y1369 WeakPolarHBondContact O-CD2 3.37Å; F1365-Y1369 WeakPolarHBondContact O-CE2 3.39Å; M1366-Y1369 PolarHBondContact O-N 2.82Å; M1366-Y1369 VanDerWaalsContact O-N 3.13Å; R1367-Y1369 VanDerWaalsContact C-N 3.28Å; R1367-Y1369 PolarHBondContact O-N 3.45Å; Y1369-A1372 PolarHBondContact O-N 3.47Å; Y1369-M1373 WeakPolarHBondContact O-CG 3.32Å; Y1369-M1373 PolarHBondContact O-N 3.28Å; Y1369-F1479 HydrophobicContact CG-CE1 4.5Å; Y1369-R1624 HydrophobicContact CD1-CB 4.34Å; Y1369-R1624 HydrophobicContact CE1-CB 3.79Å; Y1369-R1624 HydrophobicContact CE1-CG 3.86Å; Y1369-A1627 HydrophobicContact CD1-CB 4.22Å; Y1369-A1627 HydrophobicContact CG-CB 4.29Å; Y1369-H1628 AromaticContact CE2-CE1 4Å; Y1369-H1628 AromaticContact CZ-CE1 3.56Å; Y1369-H1628 PolarHBondContact OH-CE1 2.76Å
1370	I	75.3	Confident	66.3	Low	8 Å²	8	47 Å²	47	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-45.5	-179.9	-64.1	173	0	0	0	110	F1353 R1355 M1366 R1367 A1372 M1373 I1374	F1353-I1370 HydrophobicContact CD1-CG2 4.25Å; F1353-I1370 HydrophobicContact CD2-CD1 4Å; F1353-I1370 HydrophobicContact CE1-CG2 3.71Å; F1353-I1370 HydrophobicContact CE2-CD1 4.11Å; F1353-I1370 HydrophobicContact CG-CD1 4.37Å; F1353-I1370 HydrophobicContact CZ-CD1 4.5Å; F1353-I1370 HydrophobicContact CZ-CG2 3.9Å; R1355-I1370 HydrophobicContact CG-CD1 4.47Å; M1366-I1370 PolarHBondContact O-N 3.35Å; R1367-I1370 PolarHBondContact O-N 3.47Å; I1370-A1372 VanDerWaalsContact C-N 3.31Å; I1370-A1372 PolarHBondContact O-N 2.99Å; I1370-M1373 PolarHBondContact O-N 2.76Å; I1370-I1374 HydrophobicContact CG2-CD1 3.62Å; I1370-I1374 HydrophobicContact CG2-CG1 4.36Å; I1370-I1374 WeakPolarHBondContact O-CB 3.42Å; I1370-I1374 VanDerWaalsContact O-CG1 3.31Å; I1370-I1374 WeakPolarHBondContact O-CG1 3.39Å; I1370-I1374 PolarHBondContact O-N 3.18Å
1371	D	76.3	Confident	67	Low	70 Å²	70	40.5 Å²	40.5	37%	0.374	22%	0.215	S	C	.	.	H	α-helix	trans	-63.6	-35.3	176.7	-74.8	-12	0	0	0	111.8	R1367 S1375	R1367-D1371 VanDerWaalsContact CG-OD2 3.31Å; R1367-D1371 WeakPolarHBondContact CG-OD2 3.31Å; R1367-D1371 IonicContact NE-OD2 3.89Å; R1367-D1371 VanDerWaalsContact O-CB 3.31Å; R1367-D1371 WeakPolarHBondContact O-CB 3.47Å; R1367-D1371 PolarHBondContact O-N 2.94Å; D1371-S1375 WeakPolarHBondContact O-CB 3.41Å; D1371-S1375 PolarHBondContact O-N 2.87Å; D1371-S1375 PolarHBondContact O-OG 3.16Å
1372	A	76.5	Confident	67.7	Low	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67.7	-41.4	173.7	0	0	0	0	0	112.7	P1368 Y1369 I1370 Y1376 R1626	P1368-A1372 WeakPolarHBondContact O-CB 3.31Å; P1368-A1372 PolarHBondContact O-N 2.96Å; P1368-A1372 VanDerWaalsContact O-N 3.07Å; Y1369-A1372 PolarHBondContact O-N 3.47Å; I1370-A1372 VanDerWaalsContact C-N 3.31Å; I1370-A1372 PolarHBondContact O-N 2.99Å; A1372-Y1376 WeakPolarHBondContact O-CD2 3.5Å; A1372-Y1376 PolarHBondContact O-N 3.06Å; A1372-R1626 HydrophobicContact CB-CB 3.98Å
1373	M	76.1	Confident	68.5	Low	8 Å²	8	31.7 Å²	31.7	4%	0.039	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-44.2	174.7	-69.7	-179.5	-176.6	0	0	111.6	Y1369 I1370 G1377 L1378 M1447 F1477 L1620 A1623	Y1369-M1373 WeakPolarHBondContact O-CG 3.32Å; Y1369-M1373 PolarHBondContact O-N 3.28Å; I1370-M1373 PolarHBondContact O-N 2.76Å; M1373-G1377 CarbonylContact O-C 3.56Å; M1373-G1377 VanDerWaalsContact O-CA 3.31Å; M1373-G1377 WeakPolarHBondContact O-CA 3.47Å; M1373-G1377 PolarHBondContact O-N 2.91Å; M1373-L1378 HydrophobicContact SD-CD2 4.48Å; M1373-M1447 HydrophobicContact CB-CE 3.83Å; M1373-M1447 HydrophobicContact CB-SD 4.19Å; M1373-M1447 HydrophobicContact CG-CE 4.33Å; M1373-M1447 HydrophobicContact SD-CE 3.57Å; M1373-M1447 VanDerWaalsContact SD-CE 3.57Å; M1373-F1477 HydrophobicContact CE-CD1 4.38Å; M1373-F1477 HydrophobicContact CE-CD2 4.18Å; M1373-F1477 HydrophobicContact CE-CE1 4.46Å; M1373-F1477 HydrophobicContact CE-CE2 4.26Å; M1373-F1477 HydrophobicContact CE-CG 4.24Å; M1373-F1477 HydrophobicContact CE-CZ 4.4Å; M1373-F1477 HydrophobicContact SD-CD2 4.11Å; M1373-F1477 HydrophobicContact SD-CE2 4.31Å; M1373-L1620 HydrophobicContact CE-CD1 4Å; M1373-A1623 HydrophobicContact CE-CB 3.47Å; M1373-A1623 VanDerWaalsContact CE-CB 3.47Å; M1373-A1623 HydrophobicContact CG-CB 3.62Å; M1373-A1623 HydrophobicContact SD-CB 4.4Å
1374	I	72.4	Confident	68.4	Low	11 Å²	11	36.3 Å²	36.3	6%	0.056	18%	0.18	C	C	.	.	H	α-helix	trans	-72	-32.1	-179.4	-66.5	171.8	0	0	0	112.5	I1370 S1400 W1402 T1440 M1447	I1370-I1374 HydrophobicContact CG2-CD1 3.62Å; I1370-I1374 HydrophobicContact CG2-CG1 4.36Å; I1370-I1374 WeakPolarHBondContact O-CB 3.42Å; I1370-I1374 VanDerWaalsContact O-CG1 3.31Å; I1370-I1374 WeakPolarHBondContact O-CG1 3.39Å; I1370-I1374 PolarHBondContact O-N 3.18Å; I1374-S1400 WeakPolarHBondContact CG2-OG 3.14Å; I1374-W1402 HydrophobicContact CD1-CH2 4.29Å; I1374-W1402 HydrophobicContact CD1-CZ2 3.67Å; I1374-T1440 HydrophobicContact CG1-CG2 4.47Å; I1374-M1447 HydrophobicContact CD1-SD 4.48Å; I1374-M1447 HydrophobicContact CG1-SD 3.71Å
1375	S	71.9	Confident	68	Low	29 Å²	29	35.1 Å²	35.1	20%	0.203	17%	0.17	C	C	.	.	H	α-helix	trans	-84.7	-30.3	-175	-61.4	0	0	0	0	114.2	D1371	D1371-S1375 WeakPolarHBondContact O-CB 3.41Å; D1371-S1375 PolarHBondContact O-N 2.87Å; D1371-S1375 PolarHBondContact O-OG 3.16Å
1376	Y	70.9	Confident	67.3	Low	27 Å²	27	38 Å²	38	11%	0.106	18%	0.181	C	C	.	.	H	α-helix	trans	-125.4	3.2	-170.8	-53	-65	0	0	0	114.1	A1372 R1626 R1635 E1636	A1372-Y1376 WeakPolarHBondContact O-CD2 3.5Å; A1372-Y1376 PolarHBondContact O-N 3.06Å; Y1376-R1626 HydrophobicContact CD2-CB 4.48Å; Y1376-R1626 PolarHBondContact O-NH1 2.87Å; Y1376-R1635 HydrophobicContact CE1-CB 4.49Å; Y1376-R1635 HydrophobicContact CE2-CB 3.86Å; Y1376-E1636 HydrophobicContact CD1-CG 3.7Å; Y1376-E1636 HydrophobicContact CE1-CG 3.54Å
1377	G	67.8	Low	66.3	Low	8 Å²	8	43.3 Å²	43.3	8%	0.082	20%	0.2	C	C	.	.			trans	73.1	168.1	-178	0	0	0	0	0	113.8	M1373 G1379 R1626	M1373-G1377 CarbonylContact O-C 3.56Å; M1373-G1377 VanDerWaalsContact O-CA 3.31Å; M1373-G1377 WeakPolarHBondContact O-CA 3.47Å; M1373-G1377 PolarHBondContact O-N 2.91Å; G1377-G1379 PolarHBondContact O-N 3.42Å; G1377-R1626 PolarHBondContact O-NH1 3.31Å
1378	L	64.5	Low	65.1	Low	9 Å²	9	43.8 Å²	43.8	5%	0.047	22%	0.216	C	C	.	.	S	Bend	trans	-75.5	-0.5	-174.9	-65.1	156.8	0	0	0	114	S1351 M1373 D1445 M1447 F1477 A1619	S1351-L1378 WeakPolarHBondContact OG-CD1 3.44Å; M1373-L1378 HydrophobicContact SD-CD2 4.48Å; L1378-D1445 HydrophobicContact CD1-CB 4.31Å; L1378-D1445 PolarHBondContact N-OD2 3.28Å; L1378-D1445 VanDerWaalsContact N-OD2 3.11Å; L1378-M1447 HydrophobicContact CD2-CE 4.38Å; L1378-F1477 HydrophobicContact CD2-CE2 4.03Å; L1378-A1619 WeakPolarHBondContact O-CB 3.46Å
1379	G	64.8	Low	63.8	Low	6 Å²	6	53 Å²	53	6%	0.062	25%	0.245	C	C	.	.	S	Bend	trans	-138.1	-169.3	-169.2	0	0	0	0	0	115.3	G1377 R1381 R1626	G1377-G1379 PolarHBondContact O-N 3.42Å; G1379-R1381 VanDerWaalsContact C-N 3.31Å; G1379-R1381 PolarHBondContact O-N 3.42Å; G1379-R1626 PolarHBondContact O-NH1 2.75Å; G1379-R1626 PolarHBondContact O-NH2 2.76Å
1380	N	63.6	Low	62.1	Low	9 Å²	9	56.4 Å²	56.4	5%	0.048	26%	0.263	C	S	.	.	S	Bend	trans	-93.5	13.7	-172.3	-60.5	-10.2	0	0	0	112.5	C1382 H1383 N1622 I1640	N1380-C1382 VanDerWaalsContact C-N 3.33Å; N1380-C1382 PolarHBondContact O-N 2.88Å; N1380-H1383 PolarHBondContact O-N 3.46Å; N1380-N1622 VanDerWaalsContact OD1-CG 3.3Å; N1380-N1622 PolarHBondContact OD1-ND2 3.31Å; N1380-N1622 VanDerWaalsContact OD1-ND2 3.16Å; N1380-N1622 PolarHBondContact OD1-OD1 2.77Å; N1380-I1640 PolarHBondContact ND2-O 2.81Å
1381	R	59.9	Low	60.6	Low	60 Å²	60	60 Å²	60	23%	0.226	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.1	-172.4	-74.3	-170.6	179.1	-179.1	7.7	114.1	S1321 G1379 H1383 D1444	S1321-R1381 PolarHBondContact O-NH2 2.71Å; S1321-R1381 VanDerWaalsContact O-NH2 3.08Å; S1321-R1381 PolarHBondContact OG-NE 3.02Å; G1379-R1381 VanDerWaalsContact C-N 3.31Å; G1379-R1381 PolarHBondContact O-N 3.42Å; R1381-H1383 VanDerWaalsContact C-N 3.3Å; R1381-H1383 PolarHBondContact O-N 2.97Å; R1381-D1444 IonicContact NH1-OD2 2.72Å; R1381-D1444 PolarHBondContact NH1-OD2 3.35Å
1382	C	60.7	Low	59.1	Low	5 Å²	5	61.7 Å²	61.7	3%	0.034	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-5.6	-175	-68.2	0	0	0	0	115.4	N1380 C1395	N1380-C1382 VanDerWaalsContact C-N 3.33Å; N1380-C1382 PolarHBondContact O-N 2.88Å; C1382-C1395 WeakPolarHBondContact CA-SG 3.44Å; C1382-C1395 HydrophobicContact CB-CB 3.75Å; C1382-C1395 WeakPolarHBondContact CB-SG 3.42Å; C1382-C1395 WeakPolarHBondContact SG-CB 3.3Å; C1382-C1395 CovalentContact SG-SG 2.04Å; C1382-C1395 PolarHBondContact SG-SG 2.93Å
1383	H	61.3	Low	57.9	Low	29 Å²	29	66.8 Å²	66.8	13%	0.134	34%	0.339	C	S	.	.	S	Bend	trans	-74.7	151	-179.4	-176	65.3	0	0	0	113.2	A559 N1380 R1381 Q1385 Y1386 E1637	A559-H1383 WeakPolarHBondContact CB-CE1 3.46Å; N1380-H1383 PolarHBondContact O-N 3.46Å; R1381-H1383 VanDerWaalsContact C-N 3.3Å; R1381-H1383 PolarHBondContact O-N 2.97Å; H1383-Q1385 PolarHBondContact O-N 3.28Å; H1383-Y1386 WeakPolarHBondContact O-CB 3.45Å; H1383-Y1386 PolarHBondContact O-N 3.36Å; H1383-E1637 PolarHBondContact ND1-O 3.3Å; H1383-E1637 VanDerWaalsContact ND1-O 3.14Å
1384	Q	50.4	Low	56.8	Low	137 Å²	137	69.2 Å²	69.2	64%	0.64	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-62	-36.7	-163.1	-151.6	172.4	15.1	0	0	114.5	Y1386 R1387	Q1384-Y1386 PolarHBondContact O-N 3.14Å; Q1384-R1387 PolarHBondContact O-N 3.09Å
1385	Q	52.7	Low	56	Low	123 Å²	123	69.9 Å²	69.9	58%	0.575	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-60.6	-23.9	174.4	-79.1	-176.2	-22.3	0	0	113.7	H1383 T1388	H1383-Q1385 PolarHBondContact O-N 3.28Å; Q1385-T1388 PolarHBondContact O-OG1 3.09Å
1386	Y	52.3	Low	55.1	Low	92 Å²	92	69.6 Å²	69.6	36%	0.361	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-92.6	-15.2	-178.7	-69.6	-73.5	0	0	0	114.3	R1317 H1383 Q1384 T1388	R1317-Y1386 PolarHBondContact NE-OH 2.81Å; R1317-Y1386 PolarHBondContact NH1-OH 3.05Å; R1317-Y1386 PolarHBondContact NH2-OH 3.01Å; H1383-Y1386 WeakPolarHBondContact O-CB 3.45Å; H1383-Y1386 PolarHBondContact O-N 3.36Å; Q1384-Y1386 PolarHBondContact O-N 3.14Å; Y1386-T1388 PolarHBondContact O-N 2.74Å; Y1386-T1388 VanDerWaalsContact O-N 3.14Å
1387	R	48.4	Very low	54.2	Low	119 Å²	119	72.1 Å²	72.1	45%	0.449	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-62.5	-18.4	177.4	-72.8	-174	176.3	-174.8	-2.5	113.4	Q1384 R1389 L1390 E1636	Q1384-R1387 PolarHBondContact O-N 3.09Å; R1387-R1389 PolarHBondContact O-N 3.31Å; R1387-R1389 VanDerWaalsContact O-N 3.16Å; R1387-L1390 VanDerWaalsContact O-O 3.09Å; R1387-E1636 IonicContact NH2-OE2 3.31Å; R1387-E1636 PolarHBondContact NH2-OE2 3.11Å
1388	T	46.9	Very low	53.5	Low	123 Å²	123	79.9 Å²	79.9	76%	0.755	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-69.8	-6.8	-177.6	54.8	0	0	0	0	115.4	Q1385 Y1386	Q1385-T1388 PolarHBondContact O-OG1 3.09Å; Y1386-T1388 PolarHBondContact O-N 2.74Å; Y1386-T1388 VanDerWaalsContact O-N 3.14Å
1389	R	48.4	Very low	53	Low	237 Å²	237	88.8 Å²	88.8	89%	0.894	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-125.4	4.3	177.7	-69.3	-172.1	178.6	-175.3	0.4	115.2	R1387	R1387-R1389 PolarHBondContact O-N 3.31Å; R1387-R1389 VanDerWaalsContact O-N 3.16Å
1390	L	42.2	Very low	52.8	Low	75 Å²	75	90.3 Å²	90.3	39%	0.393	47%	0.468	S	S	.	.	S	Bend	trans	-141.5	146.7	-175.2	-79.7	164.1	0	0	0	111.3	R1387	R1387-L1390 VanDerWaalsContact O-O 3.09Å
1391	P	45.2	Very low	52.8	Low	83 Å²	83	99.1 Å²	99.1	54%	0.539	50%	0.501	S	S	.	.			trans	-66.9	145	-179.8	27.9	-34.4	0	0	0	112.1	S1393 T1394	P1391-S1393 PolarHBondContact O-N 2.95Å; P1391-T1394 PolarHBondContact O-OG1 3.2Å
1392	S	43.7	Very low	53.5	Low	106 Å²	106	100 Å²	100	74%	0.741	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-66.9	-6.8	-172.4	52.1	0	0	0	0	115.9	T1394	S1392-T1394 PolarHBondContact O-N 3.29Å
1393	S	52	Low	54	Low	106 Å²	106	105.1 Å²	105.1	74%	0.741	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-82.7	-5.2	-173.3	58.3	0	0	0	0	115.4	P1391	P1391-S1393 PolarHBondContact O-N 2.95Å
1394	T	53.3	Low	54.4	Low	59 Å²	59	108.7 Å²	108.7	36%	0.362	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-92.9	-13.4	-171.8	50.7	0	0	0	0	115.1	P1391 S1392	P1391-T1394 PolarHBondContact O-OG1 3.2Å; S1392-T1394 PolarHBondContact O-N 3.29Å
1395	C	55.2	Low	55	Low	25 Å²	25	105.1 Å²	105.1	17%	0.169	52%	0.521	C	S	.	.	S	Bend	trans	-119.6	118.1	178.4	-64.9	0	0	0	0	109.6	C1382	C1382-C1395 WeakPolarHBondContact CA-SG 3.44Å; C1382-C1395 HydrophobicContact CB-CB 3.75Å; C1382-C1395 WeakPolarHBondContact CB-SG 3.42Å; C1382-C1395 WeakPolarHBondContact SG-CB 3.3Å; C1382-C1395 CovalentContact SG-SG 2.04Å; C1382-C1395 PolarHBondContact SG-SG 2.93Å
1396	G	53.5	Low	55.3	Low	23 Å²	23	103 Å²	103	24%	0.237	52%	0.518	C	S	.	.	S	Bend	trans	159	147.5	-179.9	0	0	0	0	0	113.3	K1398 R1442 E1636	G1396-K1398 PolarHBondContact O-N 2.99Å; G1396-R1442 PolarHBondContact O-NH2 3.19Å; G1396-E1636 WeakPolarHBondContact CA-OE1 3.32Å
1397	A	51.9	Low	55.5	Low	80 Å²	80	101.7 Å²	101.7	66%	0.661	52%	0.519	S	S	*	.			trans	-79.9	96	-178.3	0	0	0	0	0	112.7
1398	K	52.6	Low	55.6	Low	172 Å²	172	100.3 Å²	100.3	75%	0.748	53%	0.526	S	S	*	.			trans	-110.4	155.2	159.2	-63.9	-175.7	175.8	-178	0	108.2	G1396 S1400 R1442	G1396-K1398 PolarHBondContact O-N 2.99Å; K1398-S1400 PolarHBondContact O-N 2.84Å; K1398-R1442 VanDerWaalsContact N-NH2 3.12Å; K1398-R1442 PolarHBondContact O-NH1 2.93Å; K1398-R1442 PolarHBondContact O-NH2 3.45Å
1399	K	54	Low	55.6	Low	196 Å²	196	100.4 Å²	100.4	85%	0.852	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-61.5	127.8	175.1	-69.5	-177.1	176	-178.4	0	110.3
1400	S	60.3	Low	55.6	Low	38 Å²	38	97.9 Å²	97.9	27%	0.266	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-85.9	138.4	171.7	44.9	0	0	0	0	110.5	I1374 K1398	I1374-S1400 WeakPolarHBondContact CG2-OG 3.14Å; K1398-S1400 PolarHBondContact O-N 2.84Å
1401	W	65.1	Low	55.6	Low	194 Å²	194	102.9 Å²	102.9	74%	0.735	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-99.1	134.7	173.8	-61.3	96.4	0	0	0	109.7
1402	W	73.3	Confident	55.7	Low	77 Å²	77	104.3 Å²	104.3	29%	0.292	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-88.1	120.1	174.9	-75	100	0	0	0	110.3	F1353 I1374 R1438 T1440 D1449	F1353-W1402 AromaticContact CE1-CH2 3.64Å; F1353-W1402 HydrophobicContact CE1-CH2 3.64Å; F1353-W1402 HydrophobicContact CE1-CZ2 4.12Å; F1353-W1402 AromaticContact CZ-CH2 3.53Å; F1353-W1402 HydrophobicContact CZ-CH2 3.53Å; F1353-W1402 AromaticContact CZ-CZ2 3.82Å; F1353-W1402 HydrophobicContact CZ-CZ2 3.82Å; I1374-W1402 HydrophobicContact CD1-CH2 4.29Å; I1374-W1402 HydrophobicContact CD1-CZ2 3.67Å; W1402-R1438 HydrophobicContact CD2-CB 4.48Å; W1402-R1438 HydrophobicContact CE3-CB 3.75Å; W1402-R1438 HydrophobicContact CZ3-CB 4.31Å; W1402-T1440 HydrophobicContact CE3-CG2 4.3Å; W1402-T1440 HydrophobicContact CH2-CG2 3.92Å; W1402-T1440 HydrophobicContact CZ2-CG2 4.28Å; W1402-T1440 HydrophobicContact CZ3-CG2 3.94Å; W1402-D1449 HydrophobicContact CH2-CB 4.06Å; W1402-D1449 HydrophobicContact CZ3-CB 3.93Å
1403	Y	72.3	Confident	55.5	Low	113 Å²	113	102.1 Å²	102.1	44%	0.443	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	148.4	173.7	-56.5	-80.8	0	0	0	109.9	R1438 Y1439	Y1403-R1438 CarbonylContact O-C 3.47Å; Y1403-R1438 VanDerWaalsContact O-CA 3.26Å; Y1403-R1438 WeakPolarHBondContact O-CA 3.45Å; Y1403-Y1439 HydrophobicContact CD2-CE2 4.24Å; Y1403-Y1439 HydrophobicContact CG-CE2 4.39Å; Y1403-Y1439 PolarHBondContact N-O 2.84Å; Y1403-Y1439 WeakPolarHBondContact O-CD1 3.11Å; Y1403-Y1439 PolarHBondContact O-N 2.69Å
1404	H	69.3	Low	55.3	Low	104 Å²	104	99.7 Å²	99.7	48%	0.481	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	138.5	172.7	-67.8	74.9	0	0	0	109.3	P1406 R1438	H1404-P1406 WeakPolarHBondContact O-CD 3.43Å; H1404-R1438 PolarHBondContact CE1-NE 2.87Å; H1404-R1438 PolarHBondContact NE2-NE 2.88Å
1405	Y	63.1	Low	55.2	Low	62 Å²	62	99.9 Å²	99.9	24%	0.243	52%	0.521	C	S	.	.	P	Polyproline II helix	trans	-73	123.7	177.4	-164.1	-88.6	0	0	0	110.8	T1407 P1436 Y1437 Y1439	Y1405-T1407 PolarHBondContact O-N 3.32Å; Y1405-P1436 WeakPolarHBondContact O-CB 3.31Å; Y1405-Y1437 HydrophobicContact CD2-CE2 4.47Å; Y1405-Y1437 AromaticContact CD2-CZ 3.97Å; Y1405-Y1437 HydrophobicContact CG-CE1 4.19Å; Y1405-Y1437 PolarHBondContact N-O 3.33Å; Y1405-Y1439 HydrophobicContact CD2-CE1 4.44Å
1406	P	58.5	Low	55	Low	78 Å²	78	99.4 Å²	99.4	51%	0.506	52%	0.518	S	S	.	.			trans	-75.1	114	179.9	29.3	-32.8	0	0	0	110.9	L1339 H1404	L1339-P1406 HydrophobicContact CD1-CG 4.39Å; H1404-P1406 WeakPolarHBondContact O-CD 3.43Å
1407	T	56.1	Low	55.1	Low	65 Å²	65	102.7 Å²	102.7	40%	0.399	53%	0.534	S	S	.	.			trans	-91.6	143.7	171.7	48.1	0	0	0	0	111.3	Y1405	Y1405-T1407 PolarHBondContact O-N 3.32Å
1408	P	50.7	Low	55.5	Low	90 Å²	90	99.5 Å²	99.5	58%	0.584	51%	0.506	S	S	*	.			trans	-65.5	140.4	171.8	27.7	-33.3	0	0	0	110.5	Q1410	P1408-Q1410 PolarHBondContact O-N 2.98Å
1409	S	47.9	Very low	56.1	Low	126 Å²	126	95.4 Å²	95.4	88%	0.881	49%	0.49	S	S	*	.			trans	-74.4	86	-172.3	57	0	0	0	0	113
1410	Q	46.8	Very low	56.4	Low	183 Å²	183	88 Å²	88	86%	0.855	46%	0.462	S	S	*	.			trans	-127.6	155.3	163.7	-75.1	-171.4	-26.1	0	0	110.7	P1408	P1408-Q1410 PolarHBondContact O-N 2.98Å
1411	Q	43.4	Very low	56.5	Low	180 Å²	180	88.8 Å²	88.8	84%	0.841	46%	0.463	S	S	*	.			trans	-64.7	138	-158.6	-75.2	178.8	-28.4	0	0	114.9	N1413	Q1411-N1413 PolarHBondContact O-N 2.95Å
1412	V	45.8	Very low	56	Low	113 Å²	113	89 Å²	89	69%	0.685	47%	0.473	S	S	*	.			trans	-71	113.6	170.6	-179.2	0	0	0	0	109.2
1413	N	40.1	Very low	54.9	Low	61 Å²	61	90.2 Å²	90.2	33%	0.326	49%	0.485	S	S	.	.			trans	-168.1	140.1	148.8	-94.6	-20.4	0	0	0	110.6	Q1411 R1430	Q1411-N1413 PolarHBondContact O-N 2.95Å; N1413-R1430 PolarHBondContact O-NH1 3.44Å; N1413-R1430 PolarHBondContact O-NH2 2.96Å
1414	D	47.8	Very low	54	Low	54 Å²	54	86.3 Å²	86.3	29%	0.289	47%	0.471	S	S	.	.	S	Bend	trans	60.9	147.9	174.7	-53.9	-18.1	0	0	0	117.9	N1434 V1526 F1528	D1414-N1434 PolarHBondContact O-ND2 2.94Å; D1414-N1434 VanDerWaalsContact O-ND2 3.16Å; D1414-V1526 WeakPolarHBondContact OD2-CG1 3.48Å; D1414-F1528 WeakPolarHBondContact OD1-CB 2.98Å; D1414-F1528 PolarHBondContact OD1-N 3.47Å
1415	S	50.6	Low	53.1	Low	64 Å²	64	84.2 Å²	84.2	45%	0.448	46%	0.461	S	S	.	.			trans	-71.4	131.1	173.6	43.2	0	0	0	0	110.2	V1417	S1415-V1417 PolarHBondContact O-N 3.29Å; S1415-V1417 VanDerWaalsContact O-N 3.07Å
1416	A	51.2	Low	53	Low	14 Å²	14	81.9 Å²	81.9	12%	0.116	45%	0.453	C	S	.	.			trans	-76.1	99.6	-175.3	0	0	0	0	0	111.3	C1418 R1430 M1461	A1416-C1418 PolarHBondContact O-N 3.31Å; A1416-R1430 HydrophobicContact CB-CB 4.49Å; A1416-M1461 HydrophobicContact CB-CE 4.02Å; A1416-M1461 HydrophobicContact CB-SD 3.93Å
1417	V	55.8	Low	52.9	Low	93 Å²	93	80.8 Å²	80.8	56%	0.564	44%	0.444	S	S	*	.			trans	-73.9	96.2	177.6	-176.8	0	0	0	0	110	S1415	S1415-V1417 PolarHBondContact O-N 3.29Å; S1415-V1417 VanDerWaalsContact O-N 3.07Å
1418	C	61.3	Low	53	Low	12 Å²	12	79.4 Å²	79.4	8%	0.081	44%	0.437	C	S	.	.			trans	-75.2	130.1	170.6	-54.5	0	0	0	0	110.6	A1416 F1426 V1427 C1428 M1461	A1416-C1418 PolarHBondContact O-N 3.31Å; C1418-F1426 HydrophobicContact CB-CD1 4.46Å; C1418-F1426 HydrophobicContact CB-CE1 3.62Å; C1418-F1426 HydrophobicContact CB-CE2 3.85Å; C1418-F1426 HydrophobicContact CB-CZ 3.24Å; C1418-V1427 VanDerWaalsContact CA-O 3.32Å; C1418-V1427 WeakPolarHBondContact CA-O 3.19Å; C1418-C1428 HydrophobicContact CB-CB 4.11Å; C1418-C1428 WeakPolarHBondContact CB-SG 3.33Å; C1418-C1428 WeakPolarHBondContact SG-CB 3.36Å; C1418-C1428 CovalentContact SG-SG 2.04Å; C1418-C1428 PolarHBondContact SG-SG 3.46Å; C1418-M1461 VanDerWaalsContact SG-CG 3.52Å
1419	H	64.2	Low	53.4	Low	87 Å²	87	82.8 Å²	82.8	40%	0.403	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	160.7	-179.1	59.4	-86.1	0	0	0	110.7	V1427	H1419-V1427 PolarHBondContact N-O 3.09Å; H1419-V1427 PolarHBondContact O-N 3.49Å
1420	C	60	Low	53.8	Low	40 Å²	40	81.4 Å²	81.4	27%	0.27	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124	172.3	-55.6	0	0	0	0	108.6	C641 H1425	C641-C1420 HydrophobicContact CB-CB 3.88Å; C641-C1420 WeakPolarHBondContact CB-SG 3.49Å; C641-C1420 WeakPolarHBondContact SG-CB 2.99Å; C641-C1420 CovalentContact SG-SG 2.03Å; C641-C1420 PolarHBondContact SG-SG 2.81Å; C1420-H1425 VanDerWaalsContact CA-O 3.3Å; C1420-H1425 WeakPolarHBondContact CA-O 3.34Å
1421	N	62.9	Low	54	Low	54 Å²	54	76.4 Å²	76.4	29%	0.289	40%	0.404	S	S	.	.			trans	-78.5	172.7	177.1	81.5	-16.5	0	0	0	111.5	D1423 M1424 H1425 V1427	N1421-D1423 PolarHBondContact O-N 3.28Å; N1421-D1423 WeakPolarHBondContact OD1-CA 3.28Å; N1421-D1423 PolarHBondContact OD1-N 3.15Å; N1421-M1424 PolarHBondContact O-N 3.32Å; N1421-M1424 PolarHBondContact OD1-N 3.02Å; N1421-H1425 PolarHBondContact N-O 3.47Å; N1421-H1425 WeakPolarHBondContact OD1-CA 3.29Å; N1421-H1425 WeakPolarHBondContact OD1-CB 3.18Å; N1421-H1425 PolarHBondContact OD1-N 2.8Å; N1421-H1425 PolarHBondContact OD1-O 2.86Å; N1421-V1427 HydrophobicContact CB-CG2 4.41Å
1422	E	55.4	Low	54.5	Low	199 Å²	199	73.6 Å²	73.6	93%	0.93	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-31	179.6	-60.2	-175.2	153.1	0	0	112.7	M1424	E1422-M1424 VanDerWaalsContact C-N 3.27Å; E1422-M1424 PolarHBondContact O-N 3.41Å
1423	D	49	Very low	54.9	Low	103 Å²	103	69.6 Å²	69.6	55%	0.551	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	14.6	176.2	-68.3	-46.6	0	0	0	114.4	K813 N1421 H1425	K813-D1423 PolarHBondContact NZ-O 2.92Å; N1421-D1423 PolarHBondContact O-N 3.28Å; N1421-D1423 WeakPolarHBondContact OD1-CA 3.28Å; N1421-D1423 PolarHBondContact OD1-N 3.15Å; D1423-H1425 VanDerWaalsContact C-N 3.28Å; D1423-H1425 PolarHBondContact O-CD2 3.42Å; D1423-H1425 PolarHBondContact O-N 2.99Å
1424	M	53.8	Low	55.6	Low	31 Å²	31	69.3 Å²	69.3	15%	0.153	36%	0.361	C	S	.	.	S	Bend	trans	68.9	16.5	177.4	-60.4	-78.4	-76.1	0	0	115.8	F6 Y642 R643 N1421 E1422	F6-M1424 HydrophobicContact CB-CE 3.35Å; F6-M1424 HydrophobicContact CB-SD 3.51Å; F6-M1424 VanDerWaalsContact CB-SD 3.51Å; F6-M1424 HydrophobicContact CD1-CE 3.84Å; F6-M1424 HydrophobicContact CD2-CE 3.36Å; F6-M1424 HydrophobicContact CD2-SD 3.27Å; F6-M1424 WeakPolarHBondContact CD2-SD 3.27Å; F6-M1424 HydrophobicContact CE1-CE 4.42Å; F6-M1424 HydrophobicContact CE2-CE 4Å; F6-M1424 HydrophobicContact CE2-SD 4.12Å; F6-M1424 HydrophobicContact CG-CE 3.26Å; F6-M1424 HydrophobicContact CG-SD 3.64Å; F6-M1424 HydrophobicContact CZ-CE 4.48Å; Y642-M1424 WeakPolarHBondContact O-CE 3.5Å; R643-M1424 HydrophobicContact CB-CE 4.38Å; N1421-M1424 PolarHBondContact O-N 3.32Å; N1421-M1424 PolarHBondContact OD1-N 3.02Å; E1422-M1424 VanDerWaalsContact C-N 3.27Å; E1422-M1424 PolarHBondContact O-N 3.41Å
1425	H	50.8	Low	56	Low	60 Å²	60	72 Å²	72	28%	0.278	37%	0.37	S	S	.	.			trans	-86.1	127.9	172.8	-68.9	-85	0	0	0	111.1	K813 C1420 N1421 D1423 V1427	K813-H1425 WeakPolarHBondContact CD-NE2 3.29Å; K813-H1425 VanDerWaalsContact CE-CE1 3.47Å; K813-H1425 WeakPolarHBondContact CE-CE1 3.19Å; K813-H1425 WeakPolarHBondContact CE-NE2 3.39Å; K813-H1425 PolarHBondContact NZ-NE2 3.41Å; C1420-H1425 VanDerWaalsContact CA-O 3.3Å; C1420-H1425 WeakPolarHBondContact CA-O 3.34Å; N1421-H1425 PolarHBondContact N-O 3.47Å; N1421-H1425 WeakPolarHBondContact OD1-CA 3.29Å; N1421-H1425 WeakPolarHBondContact OD1-CB 3.18Å; N1421-H1425 PolarHBondContact OD1-N 2.8Å; N1421-H1425 PolarHBondContact OD1-O 2.86Å; D1423-H1425 VanDerWaalsContact C-N 3.28Å; D1423-H1425 PolarHBondContact O-CD2 3.42Å; D1423-H1425 PolarHBondContact O-N 2.99Å; H1425-V1427 HydrophobicContact CB-CG2 3.9Å; H1425-V1427 PolarHBondContact O-N 3.3Å; H1425-V1427 VanDerWaalsContact O-N 3.17Å
1426	F	60.9	Low	56.4	Low	13 Å²	13	72.1 Å²	72.1	6%	0.057	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	102.6	162.3	-170.2	-100	0	0	0	108.8	N640 C1418 C1428 M1460 M1464	N640-F1426 HydrophobicContact CB-CD2 4.4Å; N640-F1426 HydrophobicContact CB-CG 4.3Å; N640-F1426 WeakPolarHBondContact OD1-CZ 3.16Å; C1418-F1426 HydrophobicContact CB-CD1 4.46Å; C1418-F1426 HydrophobicContact CB-CE1 3.62Å; C1418-F1426 HydrophobicContact CB-CE2 3.85Å; C1418-F1426 HydrophobicContact CB-CZ 3.24Å; F1426-C1428 WeakPolarHBondContact CE1-SG 3.44Å; F1426-M1460 HydrophobicContact CE1-CB 4.22Å; F1426-M1460 HydrophobicContact CE2-SD 4.38Å; F1426-M1460 HydrophobicContact CZ-CB 3.7Å; F1426-M1460 HydrophobicContact CZ-CG 4.42Å; F1426-M1460 HydrophobicContact CZ-SD 4.31Å; F1426-M1464 HydrophobicContact CB-CE 3.94Å; F1426-M1464 HydrophobicContact CD1-CE 4.47Å; F1426-M1464 HydrophobicContact CD1-CG 3.98Å
1427	V	57.3	Low	57.2	Low	54 Å²	54	73.5 Å²	73.5	33%	0.327	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.9	-178.3	-178.9	0	0	0	0	109	C1418 H1419 N1421 H1425	C1418-V1427 VanDerWaalsContact CA-O 3.32Å; C1418-V1427 WeakPolarHBondContact CA-O 3.19Å; H1419-V1427 PolarHBondContact N-O 3.09Å; H1419-V1427 PolarHBondContact O-N 3.49Å; N1421-V1427 HydrophobicContact CB-CG2 4.41Å; H1425-V1427 HydrophobicContact CB-CG2 3.9Å; H1425-V1427 PolarHBondContact O-N 3.3Å; H1425-V1427 VanDerWaalsContact O-N 3.17Å
1428	C	57.8	Low	58.1	Low	36 Å²	36	74.9 Å²	74.9	24%	0.243	37%	0.367	C	S	.	.			trans	-110.2	125.2	167.4	-60.8	0	0	0	0	108.2	C1418 F1426 R1430	C1418-C1428 HydrophobicContact CB-CB 4.11Å; C1418-C1428 WeakPolarHBondContact CB-SG 3.33Å; C1418-C1428 WeakPolarHBondContact SG-CB 3.36Å; C1418-C1428 CovalentContact SG-SG 2.04Å; C1418-C1428 PolarHBondContact SG-SG 3.46Å; F1426-C1428 WeakPolarHBondContact CE1-SG 3.44Å; C1428-R1430 PolarHBondContact O-N 2.63Å; C1428-R1430 VanDerWaalsContact O-N 3.16Å
1429	E	58.1	Low	58.6	Low	161 Å²	161	76 Å²	76	75%	0.752	37%	0.37	S	S	*	.	S	Bend	trans	-64.3	-18.5	179.2	-64.3	-173.1	157.3	0	0	113.3
1430	R	56.4	Low	59.1	Low	98 Å²	98	72.1 Å²	72.1	37%	0.37	35%	0.352	S	S	.	.			trans	-135.9	138.5	173.2	-59.5	-170.2	-167	153.9	18.9	111.1	N1413 A1416 C1428 N1434	N1413-R1430 PolarHBondContact O-NH1 3.44Å; N1413-R1430 PolarHBondContact O-NH2 2.96Å; A1416-R1430 HydrophobicContact CB-CB 4.49Å; C1428-R1430 PolarHBondContact O-N 2.63Å; C1428-R1430 VanDerWaalsContact O-N 3.16Å; R1430-N1434 PolarHBondContact NH1-ND2 3.29Å
1431	P	52.1	Low	59.2	Low	78 Å²	78	73 Å²	73	51%	0.506	36%	0.357	S	S	.	.	S	Bend	trans	-87	-2.1	-175.3	33.2	-35.8	0	0	0	115.4
1432	Y	54	Low	59.1	Low	120 Å²	120	73.2 Å²	73.2	47%	0.471	35%	0.353	S	S	.	.	S	Bend	trans	-130.9	141.2	-178	-61.1	-67.5	0	0	0	111.7	N1434 H1465	Y1432-N1434 PolarHBondContact O-N 3.1Å; Y1432-H1465 AromaticContact CE1-NE2 3.99Å
1433	P	53.6	Low	58.9	Low	30 Å²	30	65.1 Å²	65.1	20%	0.195	32%	0.319	C	S	.	.			trans	-66.5	126.3	167.2	28	-32.5	0	0	0	109.8	K1435 M1453	P1433-K1435 PolarHBondContact O-N 2.73Å; P1433-K1435 VanDerWaalsContact O-N 3.08Å; P1433-M1453 HydrophobicContact CB-SD 4.33Å
1434	N	53.7	Low	59.2	Low	55 Å²	55	62.4 Å²	62.4	29%	0.294	30%	0.304	S	S	.	.	S	Bend	trans	-67.7	-7.1	-173.6	-66.5	-37.4	0	0	0	114.7	D1414 R1430 Y1432	D1414-N1434 PolarHBondContact O-ND2 2.94Å; D1414-N1434 VanDerWaalsContact O-ND2 3.16Å; R1430-N1434 PolarHBondContact NH1-ND2 3.29Å; Y1432-N1434 PolarHBondContact O-N 3.1Å
1435	K	57.9	Low	59.4	Low	109 Å²	109	61.6 Å²	61.6	47%	0.474	30%	0.301	S	S	.	.	S	Bend	trans	-107	126.5	-177.9	-75.6	-179.5	172.7	178.6	0	111.4	P1433 Y1437 D1452 M1453	P1433-K1435 PolarHBondContact O-N 2.73Å; P1433-K1435 VanDerWaalsContact O-N 3.08Å; K1435-Y1437 PolarHBondContact O-N 2.89Å; K1435-D1452 WeakPolarHBondContact CD-O 3.41Å; K1435-D1452 PolarHBondContact NZ-O 2.75Å; K1435-M1453 HydrophobicContact CB-CG 4.41Å; K1435-M1453 HydrophobicContact CB-SD 4.37Å; K1435-M1453 HydrophobicContact CD-CG 4.43Å
1436	P	57.5	Low	60.1	Low	68 Å²	68	59.2 Å²	59.2	44%	0.442	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-73.4	118.6	173.4	29.9	-33.1	0	0	0	110.5	Y1405	Y1405-P1436 WeakPolarHBondContact O-CB 3.31Å
1437	Y	68.5	Low	60.5	Low	42 Å²	42	59.1 Å²	59.1	17%	0.165	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-88.3	161.7	175	62.2	-89.3	0	0	0	111.6	Y1405 K1435 A1448 L1450 M1453	Y1405-Y1437 HydrophobicContact CD2-CE2 4.47Å; Y1405-Y1437 AromaticContact CD2-CZ 3.97Å; Y1405-Y1437 HydrophobicContact CG-CE1 4.19Å; Y1405-Y1437 PolarHBondContact N-O 3.33Å; K1435-Y1437 PolarHBondContact O-N 2.89Å; Y1437-A1448 HydrophobicContact CD2-CB 3.92Å; Y1437-A1448 HydrophobicContact CE2-CB 4.03Å; Y1437-L1450 HydrophobicContact CD2-CD2 4.42Å; Y1437-L1450 HydrophobicContact CG-CD2 4.34Å; Y1437-M1453 HydrophobicContact CD1-CE 4.11Å; Y1437-M1453 HydrophobicContact CG-CE 4.22Å
1438	R	75.2	Confident	61.3	Low	122 Å²	122	56.9 Å²	56.9	46%	0.46	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145.4	177.6	-65.6	176.9	177.5	165.3	2.1	110.7	W1402 Y1403 H1404 A1448 D1449	W1402-R1438 HydrophobicContact CD2-CB 4.48Å; W1402-R1438 HydrophobicContact CE3-CB 3.75Å; W1402-R1438 HydrophobicContact CZ3-CB 4.31Å; Y1403-R1438 CarbonylContact O-C 3.47Å; Y1403-R1438 VanDerWaalsContact O-CA 3.26Å; Y1403-R1438 WeakPolarHBondContact O-CA 3.45Å; H1404-R1438 PolarHBondContact CE1-NE 2.87Å; H1404-R1438 PolarHBondContact NE2-NE 2.88Å; R1438-A1448 CarbonylContact O-C 3.57Å; R1438-A1448 VanDerWaalsContact O-CA 3.31Å; R1438-A1448 WeakPolarHBondContact O-CA 3.1Å; R1438-D1449 HydrophobicContact CB-CB 4.26Å; R1438-D1449 PolarHBondContact O-N 2.92Å
1439	Y	72.5	Confident	62.3	Low	36 Å²	36	56 Å²	56	14%	0.141	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	153	174.8	71.8	-82.6	0	0	0	112.3	Y1403 Y1405 T1441 V1446 M1447	Y1403-Y1439 HydrophobicContact CD2-CE2 4.24Å; Y1403-Y1439 HydrophobicContact CG-CE2 4.39Å; Y1403-Y1439 PolarHBondContact N-O 2.84Å; Y1403-Y1439 WeakPolarHBondContact O-CD1 3.11Å; Y1403-Y1439 PolarHBondContact O-N 2.69Å; Y1405-Y1439 HydrophobicContact CD2-CE1 4.44Å; Y1439-T1441 HydrophobicContact CD2-CG2 3.92Å; Y1439-T1441 HydrophobicContact CE2-CG2 3.88Å; Y1439-V1446 HydrophobicContact CD2-CG1 4.33Å; Y1439-M1447 CarbonylContact C-O 3.53Å; Y1439-M1447 VanDerWaalsContact CA-O 3.3Å; Y1439-M1447 WeakPolarHBondContact CA-O 3.42Å
1440	T	73.7	Confident	63.1	Low	5 Å²	5	48.3 Å²	48.3	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.2	170.8	173.2	0	0	0	0	109.4	I1374 W1402 V1446 M1447	I1374-T1440 HydrophobicContact CG1-CG2 4.47Å; W1402-T1440 HydrophobicContact CE3-CG2 4.3Å; W1402-T1440 HydrophobicContact CH2-CG2 3.92Å; W1402-T1440 HydrophobicContact CZ2-CG2 4.28Å; W1402-T1440 HydrophobicContact CZ3-CG2 3.94Å; T1440-V1446 WeakPolarHBondContact O-CA 3.36Å; T1440-M1447 HydrophobicContact CG2-CB 3.96Å; T1440-M1447 PolarHBondContact N-O 3.31Å; T1440-M1447 PolarHBondContact O-N 3.49Å
1441	T	63.1	Low	63.9	Low	60 Å²	60	44.8 Å²	44.8	37%	0.368	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	106.2	177.5	54.7	0	0	0	0	108.8	Y1439 V1446	Y1439-T1441 HydrophobicContact CD2-CG2 3.92Å; Y1439-T1441 HydrophobicContact CE2-CG2 3.88Å; T1441-V1446 HydrophobicContact CG2-CG1 4.33Å; T1441-V1446 HydrophobicContact CG2-CG2 4.22Å
1442	R	59.5	Low	64.6	Low	57 Å²	57	46.9 Å²	46.9	22%	0.215	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	138.9	-175.4	-150.8	161.2	-177.1	-102	-24.3	111.3	G1396 K1398 D1444 D1445	G1396-R1442 PolarHBondContact O-NH2 3.19Å; K1398-R1442 VanDerWaalsContact N-NH2 3.12Å; K1398-R1442 PolarHBondContact O-NH1 2.93Å; K1398-R1442 PolarHBondContact O-NH2 3.45Å; R1442-D1444 PolarHBondContact O-N 3.43Å; R1442-D1445 PolarHBondContact N-O 2.97Å; R1442-D1445 PolarHBondContact O-N 3.48Å
1443	S	52.3	Low	65.3	Low	30 Å²	30	42.6 Å²	42.6	21%	0.21	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	53.5	-180	55.6	0	0	0	0	115.1	D1445	S1443-D1445 PolarHBondContact O-N 3.12Å
1444	D	54.3	Low	66.1	Low	45 Å²	45	44.4 Å²	44.4	24%	0.241	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	12.9	-175.3	-56.2	-17.3	0	0	0	115.3	L1348 C1349 R1381 R1442	L1348-D1444 VanDerWaalsContact CA-O 3.24Å; L1348-D1444 WeakPolarHBondContact CA-O 3.31Å; C1349-D1444 PolarHBondContact N-O 3.06Å; C1349-D1444 VanDerWaalsContact N-O 3.09Å; R1381-D1444 IonicContact NH1-OD2 2.72Å; R1381-D1444 PolarHBondContact NH1-OD2 3.35Å; R1442-D1444 PolarHBondContact O-N 3.43Å
1445	D	58.2	Low	67	Low	15 Å²	15	41.9 Å²	41.9	8%	0.08	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	145.5	178.5	-64.8	-18.6	0	0	0	109.6	C1349 L1378 R1442 S1443	C1349-D1445 WeakPolarHBondContact CB-OD1 3.27Å; C1349-D1445 CarbonylContact O-C 3.57Å; C1349-D1445 WeakPolarHBondContact O-CA 3.28Å; C1349-D1445 PolarHBondContact SG-OD1 2.97Å; L1378-D1445 HydrophobicContact CD1-CB 4.31Å; L1378-D1445 PolarHBondContact N-OD2 3.28Å; L1378-D1445 VanDerWaalsContact N-OD2 3.11Å; R1442-D1445 PolarHBondContact N-O 2.97Å; R1442-D1445 PolarHBondContact O-N 3.48Å; S1443-D1445 PolarHBondContact O-N 3.12Å
1446	V	64.9	Low	67.6	Low	9 Å²	9	37 Å²	37	6%	0.055	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.8	176.4	-174.2	0	0	0	0	108.4	L1348 C1349 Y1350 S1351 Y1439 T1440 T1441	L1348-V1446 HydrophobicContact CB-CG2 4.23Å; L1348-V1446 HydrophobicContact CD1-CG2 4.48Å; L1348-V1446 HydrophobicContact CD2-CG2 4.06Å; L1348-V1446 HydrophobicContact CG-CG2 4.5Å; C1349-V1446 PolarHBondContact O-N 3.01Å; Y1350-V1446 CarbonylContact C-O 3.56Å; Y1350-V1446 WeakPolarHBondContact CA-O 3.36Å; Y1350-V1446 HydrophobicContact CD1-CB 3.77Å; Y1350-V1446 HydrophobicContact CD1-CG1 3.94Å; Y1350-V1446 HydrophobicContact CD1-CG2 4.38Å; Y1350-V1446 HydrophobicContact CE1-CB 3.87Å; Y1350-V1446 HydrophobicContact CE1-CG1 3.86Å; Y1350-V1446 HydrophobicContact CE1-CG2 4.06Å; Y1350-V1446 HydrophobicContact CG-CB 4.39Å; S1351-V1446 PolarHBondContact N-O 3.02Å; Y1439-V1446 HydrophobicContact CD2-CG1 4.33Å; T1440-V1446 WeakPolarHBondContact O-CA 3.36Å; T1441-V1446 HydrophobicContact CG2-CG1 4.33Å; T1441-V1446 HydrophobicContact CG2-CG2 4.22Å
1447	M	70.3	Confident	68	Low	11 Å²	11	35.5 Å²	35.5	5%	0.054	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.8	-178.7	-162.3	171.6	-148	0	0	110.4	S1351 F1353 M1373 I1374 L1378 Y1439 T1440	S1351-M1447 WeakPolarHBondContact O-CA 3.44Å; F1353-M1447 HydrophobicContact CD1-CE 3.7Å; F1353-M1447 HydrophobicContact CD1-CG 3.99Å; F1353-M1447 HydrophobicContact CD1-SD 3.9Å; F1353-M1447 HydrophobicContact CE1-CE 4.41Å; F1353-M1447 HydrophobicContact CE1-CG 4.13Å; F1353-M1447 HydrophobicContact CE1-SD 4.03Å; M1373-M1447 HydrophobicContact CB-CE 3.83Å; M1373-M1447 HydrophobicContact CB-SD 4.19Å; M1373-M1447 HydrophobicContact CG-CE 4.33Å; M1373-M1447 HydrophobicContact SD-CE 3.57Å; M1373-M1447 VanDerWaalsContact SD-CE 3.57Å; I1374-M1447 HydrophobicContact CD1-SD 4.48Å; I1374-M1447 HydrophobicContact CG1-SD 3.71Å; L1378-M1447 HydrophobicContact CD2-CE 4.38Å; Y1439-M1447 CarbonylContact C-O 3.53Å; Y1439-M1447 VanDerWaalsContact CA-O 3.3Å; Y1439-M1447 WeakPolarHBondContact CA-O 3.42Å; T1440-M1447 HydrophobicContact CG2-CB 3.96Å; T1440-M1447 PolarHBondContact N-O 3.31Å; T1440-M1447 PolarHBondContact O-N 3.49Å
1448	A	73.6	Confident	68.2	Low	7 Å²	7	34.3 Å²	34.3	6%	0.058	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	142.7	179.6	0	0	0	0	0	112.8	S1351 S1352 F1353 Y1437 R1438 L1450	S1351-A1448 PolarHBondContact O-N 3.02Å; S1352-A1448 CarbonylContact C-O 3.57Å; S1352-A1448 WeakPolarHBondContact CA-O 3.44Å; F1353-A1448 PolarHBondContact N-O 3.08Å; Y1437-A1448 HydrophobicContact CD2-CB 3.92Å; Y1437-A1448 HydrophobicContact CE2-CB 4.03Å; R1438-A1448 CarbonylContact O-C 3.57Å; R1438-A1448 VanDerWaalsContact O-CA 3.31Å; R1438-A1448 WeakPolarHBondContact O-CA 3.1Å; A1448-L1450 HydrophobicContact CB-CD2 4.2Å
1449	D	78.3	Confident	67.9	Low	17 Å²	17	28.5 Å²	28.5	9%	0.091	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	110.2	173.2	-169.9	-21	0	0	0	108.1	F1353 R1355 W1402 R1438 S1451	F1353-D1449 HydrophobicContact CE2-CB 3.91Å; F1353-D1449 VanDerWaalsContact CE2-CG 3.44Å; F1353-D1449 HydrophobicContact CZ-CB 3.88Å; R1355-D1449 IonicContact CZ-OD2 2.72Å; R1355-D1449 VanDerWaalsContact CZ-OD2 3.25Å; R1355-D1449 IonicContact NH1-OD2 2.78Å; R1355-D1449 IonicContact NH2-OD2 2.84Å; R1355-D1449 PolarHBondContact NH2-OD2 2.91Å; W1402-D1449 HydrophobicContact CH2-CB 4.06Å; W1402-D1449 HydrophobicContact CZ3-CB 3.93Å; R1438-D1449 HydrophobicContact CB-CB 4.26Å; R1438-D1449 PolarHBondContact O-N 2.92Å; D1449-S1451 WeakPolarHBondContact OD1-CB 3.44Å; D1449-S1451 PolarHBondContact OD1-N 2.71Å; D1449-S1451 PolarHBondContact OD1-OG 3.49Å
1450	L	74.7	Confident	67.7	Low	1 Å²	1	26.9 Å²	26.9	1%	0.005	14%	0.144	C	C	.	.			trans	-103.6	8.8	-175.1	-55.1	178.6	0	0	0	112.9	F1353 T1354 Y1437 A1448 D1452 M1453 W1458 V1476	F1353-L1450 PolarHBondContact O-N 2.78Å; T1354-L1450 HydrophobicContact CG2-CB 3.87Å; Y1437-L1450 HydrophobicContact CD2-CD2 4.42Å; Y1437-L1450 HydrophobicContact CG-CD2 4.34Å; A1448-L1450 HydrophobicContact CB-CD2 4.2Å; L1450-D1452 PolarHBondContact O-N 3.15Å; L1450-M1453 HydrophobicContact CB-CE 4.21Å; L1450-M1453 HydrophobicContact CD2-CE 3.38Å; L1450-M1453 HydrophobicContact CG-CE 4.34Å; L1450-M1453 PolarHBondContact O-N 2.72Å; L1450-W1458 HydrophobicContact CD1-CD2 4.18Å; L1450-W1458 HydrophobicContact CD1-CE3 3.81Å; L1450-W1458 HydrophobicContact CD1-CH2 4.06Å; L1450-W1458 HydrophobicContact CD1-CZ2 4.41Å; L1450-W1458 HydrophobicContact CD1-CZ3 3.75Å; L1450-W1458 HydrophobicContact CD2-CD2 4.31Å; L1450-W1458 HydrophobicContact CD2-CH2 4.28Å; L1450-W1458 HydrophobicContact CD2-CZ2 3.89Å; L1450-V1476 HydrophobicContact CD1-CG1 4.33Å; L1450-V1476 HydrophobicContact CD1-CG2 4.2Å
1451	S	73.2	Confident	67.2	Low	24 Å²	24	27.6 Å²	27.6	17%	0.168	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-26.3	-166.6	-51.8	0	0	0	0	115.6	R1355 D1449	R1355-S1451 WeakPolarHBondContact CB-OG 3.27Å; R1355-S1451 PolarHBondContact N-OG 3.14Å; D1449-S1451 WeakPolarHBondContact OD1-CB 3.44Å; D1449-S1451 PolarHBondContact OD1-N 2.71Å; D1449-S1451 PolarHBondContact OD1-OG 3.49Å
1452	D	68.8	Low	67.1	Low	121 Å²	121	25.2 Å²	25.2	65%	0.647	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	10.7	179.8	-68.9	-47.1	0	0	0	114.1	K1435 L1450	K1435-D1452 WeakPolarHBondContact CD-O 3.41Å; K1435-D1452 PolarHBondContact NZ-O 2.75Å; L1450-D1452 PolarHBondContact O-N 3.15Å
1453	M	68.2	Low	67.1	Low	31 Å²	31	22.9 Å²	22.9	15%	0.153	13%	0.125	C	C	.	.	S	Bend	trans	-128.6	152	-174.2	-61.8	-165.3	-62.1	0	0	113.5	P1433 K1435 Y1437 L1450 I1455 W1458	P1433-M1453 HydrophobicContact CB-SD 4.33Å; K1435-M1453 HydrophobicContact CB-CG 4.41Å; K1435-M1453 HydrophobicContact CB-SD 4.37Å; K1435-M1453 HydrophobicContact CD-CG 4.43Å; Y1437-M1453 HydrophobicContact CD1-CE 4.11Å; Y1437-M1453 HydrophobicContact CG-CE 4.22Å; L1450-M1453 HydrophobicContact CB-CE 4.21Å; L1450-M1453 HydrophobicContact CD2-CE 3.38Å; L1450-M1453 HydrophobicContact CG-CE 4.34Å; L1450-M1453 PolarHBondContact O-N 2.72Å; M1453-I1455 PolarHBondContact O-N 3.19Å; M1453-W1458 HydrophobicContact CE-CG 3.99Å
1454	N	70.5	Confident	67.1	Low	67 Å²	67	25.7 Å²	25.7	36%	0.358	14%	0.135	S	C	.	.			trans	-70.8	120.4	167.9	179.1	-49.4	0	0	0	109.1	D43 T1456 E1457 W1458	D43-N1454 VanDerWaalsContact OD2-CA 3.29Å; D43-N1454 WeakPolarHBondContact OD2-CA 3.31Å; D43-N1454 PolarHBondContact OD2-OD1 2.91Å; N1454-T1456 PolarHBondContact OD1-N 3.12Å; N1454-T1456 VanDerWaalsContact OD1-N 3.15Å; N1454-E1457 HydrophobicContact CB-CB 4.18Å; N1454-E1457 HydrophobicContact CB-CG 4.39Å; N1454-E1457 PolarHBondContact OD1-N 2.87Å; N1454-W1458 WeakPolarHBondContact O-CB 3.41Å; N1454-W1458 PolarHBondContact O-N 3.24Å
1455	I	70.9	Confident	66.9	Low	2 Å²	2	26.9 Å²	26.9	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-70.1	-48.4	-172.5	-53.4	174.1	0	0	0	109.7	D43 T1354 M1453 E1457 W1458 I1459 V1476 D1478 W1604	D43-I1455 HydrophobicContact CB-CD1 4.29Å; D43-I1455 HydrophobicContact CB-CG1 4.41Å; D43-I1455 PolarHBondContact OD2-N 3.48Å; T1354-I1455 HydrophobicContact CG2-CD1 3.64Å; T1354-I1455 HydrophobicContact CG2-CG1 3.81Å; M1453-I1455 PolarHBondContact O-N 3.19Å; I1455-E1457 PolarHBondContact O-N 3.38Å; I1455-W1458 PolarHBondContact O-N 3.34Å; I1455-I1459 HydrophobicContact CG2-CD1 3.76Å; I1455-I1459 HydrophobicContact CG2-CG1 4.31Å; I1455-I1459 VanDerWaalsContact O-CG1 3.31Å; I1455-I1459 WeakPolarHBondContact O-CG1 3.12Å; I1455-I1459 PolarHBondContact O-N 3.46Å; I1455-V1476 HydrophobicContact CD1-CG1 4.32Å; I1455-V1476 HydrophobicContact CG2-CB 4.33Å; I1455-V1476 HydrophobicContact CG2-CG1 4.17Å; I1455-V1476 HydrophobicContact CG2-CG2 4.07Å; I1455-D1478 HydrophobicContact CD1-CB 4.13Å; I1455-W1604 HydrophobicContact CB-CZ2 4.46Å; I1455-W1604 HydrophobicContact CG2-CD2 4.27Å; I1455-W1604 HydrophobicContact CG2-CZ2 4.27Å
1456	T	70.5	Confident	66.5	Low	7 Å²	7	29.4 Å²	29.4	4%	0.043	15%	0.148	C	C	.	.	H	α-helix	trans	-58	-46.7	-179	-61.9	0	0	0	0	111.5	T10 D43 P638 N1454 M1460	T10-T1456 HydrophobicContact CG2-CG2 4.23Å; D43-T1456 VanDerWaalsContact OD1-CB 3.31Å; D43-T1456 WeakPolarHBondContact OD1-CB 3.42Å; D43-T1456 PolarHBondContact OD1-N 2.91Å; D43-T1456 PolarHBondContact OD1-OG1 3.16Å; P638-T1456 HydrophobicContact CB-CG2 4.2Å; P638-T1456 HydrophobicContact CG-CG2 4Å; N1454-T1456 PolarHBondContact OD1-N 3.12Å; N1454-T1456 VanDerWaalsContact OD1-N 3.15Å; T1456-M1460 WeakPolarHBondContact O-CG 3.38Å; T1456-M1460 PolarHBondContact O-N 2.78Å
1457	E	67.7	Low	65.7	Low	36 Å²	36	33.3 Å²	33.3	17%	0.168	16%	0.162	C	C	.	.	H	α-helix	trans	-69.1	-41.7	177	-69.7	-170.5	153.9	0	0	112.7	N1454 I1455 I1459 M1460 M1461	N1454-E1457 HydrophobicContact CB-CB 4.18Å; N1454-E1457 HydrophobicContact CB-CG 4.39Å; N1454-E1457 PolarHBondContact OD1-N 2.87Å; I1455-E1457 PolarHBondContact O-N 3.38Å; E1457-I1459 PolarHBondContact O-N 3.36Å; E1457-M1460 PolarHBondContact O-N 3.35Å; E1457-M1461 HydrophobicContact CB-CE 3.84Å; E1457-M1461 WeakPolarHBondContact O-CB 3.39Å; E1457-M1461 WeakPolarHBondContact O-CG 3.47Å; E1457-M1461 PolarHBondContact O-N 2.81Å
1458	W	71.7	Confident	64.3	Low	18 Å²	18	41.3 Å²	41.3	7%	0.068	20%	0.197	C	C	.	.	H	α-helix	trans	-62.9	-42.7	178.4	-179.8	89.2	0	0	0	111.8	L1450 M1453 N1454 I1455 M1460 T1462	L1450-W1458 HydrophobicContact CD1-CD2 4.18Å; L1450-W1458 HydrophobicContact CD1-CE3 3.81Å; L1450-W1458 HydrophobicContact CD1-CH2 4.06Å; L1450-W1458 HydrophobicContact CD1-CZ2 4.41Å; L1450-W1458 HydrophobicContact CD1-CZ3 3.75Å; L1450-W1458 HydrophobicContact CD2-CD2 4.31Å; L1450-W1458 HydrophobicContact CD2-CH2 4.28Å; L1450-W1458 HydrophobicContact CD2-CZ2 3.89Å; M1453-W1458 HydrophobicContact CE-CG 3.99Å; N1454-W1458 WeakPolarHBondContact O-CB 3.41Å; N1454-W1458 PolarHBondContact O-N 3.24Å; I1455-W1458 PolarHBondContact O-N 3.34Å; W1458-M1460 VanDerWaalsContact C-N 3.35Å; W1458-M1460 PolarHBondContact O-N 2.73Å; W1458-T1462 HydrophobicContact CD2-CG2 4.16Å; W1458-T1462 HydrophobicContact CG-CG2 4.4Å; W1458-T1462 HydrophobicContact CZ2-CG2 4.2Å; W1458-T1462 WeakPolarHBondContact O-CB 3.39Å; W1458-T1462 VanDerWaalsContact O-CG2 3.28Å; W1458-T1462 WeakPolarHBondContact O-CG2 3.35Å; W1458-T1462 PolarHBondContact O-N 2.83Å; W1458-T1462 PolarHBondContact O-OG1 2.64Å
1459	I	69.9	Low	62.6	Low	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-47.2	176.1	-70	170.3	0	0	0	110.3	F637 P638 I1455 E1457 T1462 E1463 V1476 W1604	F637-I1459 HydrophobicContact CD1-CD1 4.08Å; F637-I1459 HydrophobicContact CD2-CD1 4.32Å; F637-I1459 HydrophobicContact CD2-CG2 3.46Å; F637-I1459 VanDerWaalsContact CD2-CG2 3.46Å; F637-I1459 HydrophobicContact CE1-CD1 3.87Å; F637-I1459 HydrophobicContact CE2-CD1 4.11Å; F637-I1459 HydrophobicContact CE2-CG1 4.17Å; F637-I1459 HydrophobicContact CE2-CG2 3.71Å; F637-I1459 HydrophobicContact CG-CD1 4.28Å; F637-I1459 HydrophobicContact CG-CG2 4.09Å; F637-I1459 HydrophobicContact CZ-CD1 3.84Å; F637-I1459 HydrophobicContact CZ-CG1 4.22Å; P638-I1459 HydrophobicContact CG-CB 4.44Å; P638-I1459 HydrophobicContact CG-CG2 4.23Å; I1455-I1459 HydrophobicContact CG2-CD1 3.76Å; I1455-I1459 HydrophobicContact CG2-CG1 4.31Å; I1455-I1459 VanDerWaalsContact O-CG1 3.31Å; I1455-I1459 WeakPolarHBondContact O-CG1 3.12Å; I1455-I1459 PolarHBondContact O-N 3.46Å; E1457-I1459 PolarHBondContact O-N 3.36Å; I1459-T1462 PolarHBondContact O-OG1 3.5Å; I1459-E1463 WeakPolarHBondContact O-CB 3.24Å; I1459-E1463 PolarHBondContact O-N 3.38Å; I1459-V1476 HydrophobicContact CD1-CG2 4.35Å; I1459-W1604 HydrophobicContact CD1-CD2 4.48Å; I1459-W1604 HydrophobicContact CD1-CE3 3.96Å; I1459-W1604 HydrophobicContact CD1-CZ3 4.42Å
1460	M	66.5	Low	60.8	Low	2 Å²	2	43.8 Å²	43.8	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-68.9	-47.5	-177	-70.5	178.9	135.5	0	0	113.4	K8 P638 S639 F1426 T1456 E1457 W1458 T1462 E1463 M1464	K8-M1460 HydrophobicContact CD-CE 4.4Å; K8-M1460 HydrophobicContact CD-SD 4.24Å; K8-M1460 WeakPolarHBondContact CE-SD 3.39Å; K8-M1460 HydrophobicContact CG-CE 3.52Å; K8-M1460 HydrophobicContact CG-SD 3.99Å; P638-M1460 HydrophobicContact CB-CE 3.72Å; P638-M1460 HydrophobicContact CB-CG 4.42Å; P638-M1460 HydrophobicContact CB-SD 4.26Å; P638-M1460 HydrophobicContact CG-CE 4.23Å; P638-M1460 HydrophobicContact CG-CG 3.91Å; P638-M1460 HydrophobicContact CG-SD 4.27Å; S639-M1460 WeakPolarHBondContact O-CE 3.32Å; F1426-M1460 HydrophobicContact CE1-CB 4.22Å; F1426-M1460 HydrophobicContact CE2-SD 4.38Å; F1426-M1460 HydrophobicContact CZ-CB 3.7Å; F1426-M1460 HydrophobicContact CZ-CG 4.42Å; F1426-M1460 HydrophobicContact CZ-SD 4.31Å; T1456-M1460 WeakPolarHBondContact O-CG 3.38Å; T1456-M1460 PolarHBondContact O-N 2.78Å; E1457-M1460 PolarHBondContact O-N 3.35Å; W1458-M1460 VanDerWaalsContact C-N 3.35Å; W1458-M1460 PolarHBondContact O-N 2.73Å; M1460-T1462 VanDerWaalsContact C-N 3.3Å; M1460-T1462 PolarHBondContact O-N 3.22Å; M1460-E1463 PolarHBondContact O-N 3.11Å; M1460-M1464 PolarHBondContact O-N 2.96Å
1461	M	63.6	Low	59.2	Low	19 Å²	19	44.7 Å²	44.7	9%	0.094	21%	0.21	C	C	.	.	H	α-helix	trans	-57.9	-44	175.6	-77.7	-171.3	-117.7	0	0	111.5	A1416 C1418 E1457	A1416-M1461 HydrophobicContact CB-CE 4.02Å; A1416-M1461 HydrophobicContact CB-SD 3.93Å; C1418-M1461 VanDerWaalsContact SG-CG 3.52Å; E1457-M1461 HydrophobicContact CB-CE 3.84Å; E1457-M1461 WeakPolarHBondContact O-CB 3.39Å; E1457-M1461 WeakPolarHBondContact O-CG 3.47Å; E1457-M1461 PolarHBondContact O-N 2.81Å
1462	T	61.7	Low	57.8	Low	10 Å²	10	44.5 Å²	44.5	6%	0.061	21%	0.212	C	C	.	.	H	α-helix	trans	-74.7	-31.3	179.6	59.2	0	0	0	0	112.6	W1458 I1459 M1460 M1464 H1465 Y1466 R1470	W1458-T1462 HydrophobicContact CD2-CG2 4.16Å; W1458-T1462 HydrophobicContact CG-CG2 4.4Å; W1458-T1462 HydrophobicContact CZ2-CG2 4.2Å; W1458-T1462 WeakPolarHBondContact O-CB 3.39Å; W1458-T1462 VanDerWaalsContact O-CG2 3.28Å; W1458-T1462 WeakPolarHBondContact O-CG2 3.35Å; W1458-T1462 PolarHBondContact O-N 2.83Å; W1458-T1462 PolarHBondContact O-OG1 2.64Å; I1459-T1462 PolarHBondContact O-OG1 3.5Å; M1460-T1462 VanDerWaalsContact C-N 3.3Å; M1460-T1462 PolarHBondContact O-N 3.22Å; T1462-M1464 PolarHBondContact O-N 3.48Å; T1462-H1465 PolarHBondContact O-N 2.98Å; T1462-Y1466 VanDerWaalsContact O-CB 3.31Å; T1462-Y1466 WeakPolarHBondContact O-CB 3.43Å; T1462-Y1466 VanDerWaalsContact O-CD2 3.29Å; T1462-Y1466 WeakPolarHBondContact O-CD2 3.43Å; T1462-Y1466 PolarHBondContact O-N 3.42Å; T1462-R1470 PolarHBondContact OG1-NH2 2.92Å
1463	E	59.9	Low	57.1	Low	9 Å²	9	39.9 Å²	39.9	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-58.6	-45.5	176.6	-168.8	-163.8	147.1	0	0	111.7	N640 I1459 M1460 Y1466 R1467 W1473	N640-E1463 PolarHBondContact ND2-OE2 3.25Å; I1459-E1463 WeakPolarHBondContact O-CB 3.24Å; I1459-E1463 PolarHBondContact O-N 3.38Å; M1460-E1463 PolarHBondContact O-N 3.11Å; E1463-Y1466 CarbonylContact O-C 3.56Å; E1463-R1467 HydrophobicContact CG-CG 4.39Å; E1463-R1467 WeakPolarHBondContact O-CA 3.38Å; E1463-R1467 VanDerWaalsContact O-CB 3.25Å; E1463-R1467 WeakPolarHBondContact O-CB 3.44Å; E1463-R1467 PolarHBondContact O-N 2.9Å; E1463-R1467 IonicContact OE1-CZ 2.74Å; E1463-R1467 IonicContact OE1-NE 3.29Å; E1463-R1467 PolarHBondContact OE1-NE 3.39Å; E1463-R1467 IonicContact OE1-NH2 2.73Å; E1463-R1467 PolarHBondContact OE1-NH2 3.18Å; E1463-R1467 VanDerWaalsContact OE1-NH2 3.09Å; E1463-W1473 HydrophobicContact CG-CH2 4.02Å; E1463-W1473 HydrophobicContact CG-CZ3 4.01Å
1464	M	51.7	Low	56.6	Low	89 Å²	89	38.8 Å²	38.8	44%	0.438	18%	0.181	S	C	.	.	H	α-helix	trans	-60.6	-50.8	178.8	-101	-70.3	-158.2	0	0	112.7	F1426 M1460 T1462 Y1466 R1467	F1426-M1464 HydrophobicContact CB-CE 3.94Å; F1426-M1464 HydrophobicContact CD1-CE 4.47Å; F1426-M1464 HydrophobicContact CD1-CG 3.98Å; M1460-M1464 PolarHBondContact O-N 2.96Å; T1462-M1464 PolarHBondContact O-N 3.48Å; M1464-Y1466 PolarHBondContact O-N 2.87Å; M1464-R1467 PolarHBondContact O-N 3.48Å
1465	H	49.3	Very low	56.5	Low	70 Å²	70	35.7 Å²	35.7	32%	0.324	16%	0.164	S	C	.	.	H	α-helix	trans	-70.8	-33.6	-175.4	-151	79.2	0	0	0	112.2	Y1432 T1462	Y1432-H1465 AromaticContact CE1-NE2 3.99Å; T1462-H1465 PolarHBondContact O-N 2.98Å
1466	Y	49.8	Very low	56.3	Low	67 Å²	67	35.6 Å²	35.6	26%	0.263	16%	0.164	S	C	.	.	H	α-helix	trans	-89.6	-9.4	175.7	-72.5	-89	0	0	0	114	T1462 E1463 M1464 K1468 K1469 R1470	T1462-Y1466 VanDerWaalsContact O-CB 3.31Å; T1462-Y1466 WeakPolarHBondContact O-CB 3.43Å; T1462-Y1466 VanDerWaalsContact O-CD2 3.29Å; T1462-Y1466 WeakPolarHBondContact O-CD2 3.43Å; T1462-Y1466 PolarHBondContact O-N 3.42Å; E1463-Y1466 CarbonylContact O-C 3.56Å; M1464-Y1466 PolarHBondContact O-N 2.87Å; Y1466-K1468 PolarHBondContact O-N 3.37Å; Y1466-K1469 CarbonylContact O-C 3.55Å; Y1466-K1469 PolarHBondContact O-N 3.06Å; Y1466-R1470 HydrophobicContact CD1-CG 4.46Å; Y1466-R1470 HydrophobicContact CG-CG 4.32Å; Y1466-R1470 VanDerWaalsContact O-CB 3.32Å; Y1466-R1470 WeakPolarHBondContact O-CB 3.36Å; Y1466-R1470 PolarHBondContact O-N 3.18Å
1467	R	48	Very low	56.7	Low	92 Å²	92	35.2 Å²	35.2	35%	0.347	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-24.1	176.6	-117.2	-176.4	-167.6	-154.4	-1.1	113	W589 P591 E1463 M1464	W589-R1467 HydrophobicContact CZ3-CG 4.39Å; P591-R1467 VanDerWaalsContact CB-NH1 3.31Å; P591-R1467 PolarHBondContact O-NH2 3.28Å; E1463-R1467 HydrophobicContact CG-CG 4.39Å; E1463-R1467 WeakPolarHBondContact O-CA 3.38Å; E1463-R1467 VanDerWaalsContact O-CB 3.25Å; E1463-R1467 WeakPolarHBondContact O-CB 3.44Å; E1463-R1467 PolarHBondContact O-N 2.9Å; E1463-R1467 IonicContact OE1-CZ 2.74Å; E1463-R1467 IonicContact OE1-NE 3.29Å; E1463-R1467 PolarHBondContact OE1-NE 3.39Å; E1463-R1467 IonicContact OE1-NH2 2.73Å; E1463-R1467 PolarHBondContact OE1-NH2 3.18Å; E1463-R1467 VanDerWaalsContact OE1-NH2 3.09Å; M1464-R1467 PolarHBondContact O-N 3.48Å
1468	K	40.8	Very low	57.1	Low	179 Å²	179	33.5 Å²	33.5	78%	0.778	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-4.1	174.4	-63.4	-174.7	175.7	-176.2	0	115.1	Y1466	Y1466-K1468 PolarHBondContact O-N 3.37Å
1469	K	38.2	Very low	57.4	Low	32 Å²	32	32.8 Å²	32.8	14%	0.139	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-150.3	-2.7	-167.5	-52.5	-171.4	-147.7	-173.4	0	116.9	Q827 L1331 D1333 Y1466 C1471	Q827-K1469 VanDerWaalsContact CD-NZ 3.26Å; Q827-K1469 VanDerWaalsContact NE2-NZ 3.18Å; Q827-K1469 VanDerWaalsContact OE1-CE 3.24Å; L1331-K1469 WeakPolarHBondContact O-CB 3.44Å; D1333-K1469 IonicContact OD2-NZ 3.99Å; D1333-K1469 PolarHBondContact OD2-NZ 3.45Å; Y1466-K1469 CarbonylContact O-C 3.55Å; Y1466-K1469 PolarHBondContact O-N 3.06Å; K1469-C1471 PolarHBondContact O-N 2.86Å
1470	R	41.8	Very low	57.4	Low	43 Å²	43	33.4 Å²	33.4	16%	0.162	15%	0.154	C	C	.	.			trans	-74.2	103.2	-166.4	-136.4	165.7	-156.1	174.5	8.4	111.3	T1462 Y1466 G1472	T1462-R1470 PolarHBondContact OG1-NH2 2.92Å; Y1466-R1470 HydrophobicContact CD1-CG 4.46Å; Y1466-R1470 HydrophobicContact CG-CG 4.32Å; Y1466-R1470 VanDerWaalsContact O-CB 3.32Å; Y1466-R1470 WeakPolarHBondContact O-CB 3.36Å; Y1466-R1470 PolarHBondContact O-N 3.18Å; R1470-G1472 PolarHBondContact O-N 3.4Å
1471	C	40.7	Very low	57.4	Low	21 Å²	21	36.7 Å²	36.7	14%	0.142	17%	0.171	C	C	.	.	S	Bend	trans	-75.2	70.3	171.7	-61.1	0	0	0	0	110.4	Y1324 P1329 K1469	Y1324-C1471 VanDerWaalsContact CE1-O 3.29Å; Y1324-C1471 WeakPolarHBondContact CE1-O 3.21Å; P1329-C1471 VanDerWaalsContact C-SG 3.59Å; P1329-C1471 WeakPolarHBondContact CA-SG 3.36Å; P1329-C1471 HydrophobicContact CB-CB 4.27Å; K1469-C1471 PolarHBondContact O-N 2.86Å
1472	G	44.1	Very low	57	Low	20 Å²	20	37.7 Å²	37.7	21%	0.206	18%	0.178	C	C	.	.	S	Bend	trans	83.6	164	-179.7	0	0	0	0	0	115.1	Y1324 R1470	Y1324-G1472 VanDerWaalsContact CE1-CA 3.47Å; R1470-G1472 PolarHBondContact O-N 3.4Å
1473	W	54.2	Low	56.5	Low	23 Å²	23	44.2 Å²	44.2	9%	0.087	21%	0.206	C	C	.	.			trans	-99.4	112.5	-165.1	-66.7	95.8	0	0	0	112.5	W589 Y1324 E1463 N1606	W589-W1473 AromaticContact CH2-CH2 3.47Å; W589-W1473 HydrophobicContact CH2-CH2 3.47Å; W589-W1473 VanDerWaalsContact CH2-CH2 3.47Å; W589-W1473 AromaticContact CH2-CZ2 3.16Å; W589-W1473 HydrophobicContact CH2-CZ2 3.16Å; W589-W1473 AromaticContact CZ2-CE2 3.66Å; W589-W1473 AromaticContact CZ2-CH2 3.96Å; W589-W1473 HydrophobicContact CZ2-CH2 3.96Å; W589-W1473 AromaticContact CZ2-CZ2 3.17Å; W589-W1473 HydrophobicContact CZ2-CZ2 3.17Å; W589-W1473 AromaticContact CZ2-NE1 3.83Å; W589-W1473 HydrophobicContact CZ3-CH2 4.32Å; W589-W1473 HydrophobicContact CZ3-CZ2 4.1Å; Y1324-W1473 PolarHBondContact OH-N 2.82Å; Y1324-W1473 PolarHBondContact OH-O 3.11Å; E1463-W1473 HydrophobicContact CG-CH2 4.02Å; E1463-W1473 HydrophobicContact CG-CZ3 4.01Å; W1473-N1606 HydrophobicContact CB-CB 4.19Å; W1473-N1606 HydrophobicContact CD2-CB 4.38Å; W1473-N1606 HydrophobicContact CE3-CB 4.35Å; W1473-N1606 HydrophobicContact CG-CB 4.26Å; W1473-N1606 WeakPolarHBondContact CZ3-ND2 3.47Å
1474	P	57.4	Low	55.7	Low	9 Å²	9	50.1 Å²	50.1	6%	0.058	23%	0.228	C	C	.	.			trans	-62.8	152	176.1	27.6	-34	0	0	0	110.3	F637 Y1350	F637-P1474 WeakPolarHBondContact CZ-O 3.38Å; Y1350-P1474 WeakPolarHBondContact O-CA 3.3Å
1475	T	67.5	Low	55.1	Low	1 Å²	1	49.3 Å²	49.3	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	149.5	167.8	44.8	0	0	0	0	110.6	S1351 S1352 W1604 F1616	S1351-T1475 CarbonylContact C-O 3.6Å; S1352-T1475 PolarHBondContact N-O 3.37Å; T1475-W1604 WeakPolarHBondContact CA-O 3.21Å; T1475-W1604 VanDerWaalsContact CB-O 3.23Å; T1475-W1604 WeakPolarHBondContact CB-O 3.18Å; T1475-W1604 WeakPolarHBondContact CG2-O 3.35Å; T1475-F1616 HydrophobicContact CG2-CB 4.46Å; T1475-F1616 HydrophobicContact CG2-CD1 3.86Å; T1475-F1616 HydrophobicContact CG2-CD2 3.3Å; T1475-F1616 HydrophobicContact CG2-CE1 3.83Å; T1475-F1616 HydrophobicContact CG2-CE2 3.3Å; T1475-F1616 HydrophobicContact CG2-CG 3.61Å; T1475-F1616 HydrophobicContact CG2-CZ 3.57Å; T1475-F1616 WeakPolarHBondContact OG1-CD1 3.36Å; T1475-F1616 WeakPolarHBondContact OG1-CE1 3.4Å
1476	V	68.4	Low	54.6	Low	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.9	177.6	-166.7	0	0	0	0	107.9	S1352 T1354 L1450 I1455 I1459 W1604	S1352-V1476 WeakPolarHBondContact O-CA 3.5Å; T1354-V1476 HydrophobicContact CG2-CG1 4.4Å; L1450-V1476 HydrophobicContact CD1-CG1 4.33Å; L1450-V1476 HydrophobicContact CD1-CG2 4.2Å; I1455-V1476 HydrophobicContact CD1-CG1 4.32Å; I1455-V1476 HydrophobicContact CG2-CB 4.33Å; I1455-V1476 HydrophobicContact CG2-CG1 4.17Å; I1455-V1476 HydrophobicContact CG2-CG2 4.07Å; I1459-V1476 HydrophobicContact CD1-CG2 4.35Å; V1476-W1604 HydrophobicContact CB-CB 3.91Å; V1476-W1604 HydrophobicContact CB-CG 4.04Å; V1476-W1604 HydrophobicContact CG2-CB 4.4Å; V1476-W1604 PolarHBondContact N-O 2.75Å; V1476-W1604 WeakPolarHBondContact O-CB 3.4Å; V1476-W1604 PolarHBondContact O-N 3.27Å
1477	F	77.6	Confident	53.8	Low	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	107.3	167.8	-65.2	-75.3	0	0	0	108.4	S1352 F1353 T1354 M1373 L1378 F1479 V1601 V1603 A1619 L1620	S1352-F1477 PolarHBondContact O-N 3.03Å; F1353-F1477 WeakPolarHBondContact CA-O 3.39Å; F1353-F1477 HydrophobicContact CB-CB 4.38Å; F1353-F1477 WeakPolarHBondContact CB-O 3.18Å; T1354-F1477 PolarHBondContact N-O 2.94Å; T1354-F1477 VanDerWaalsContact N-O 3.08Å; M1373-F1477 HydrophobicContact CE-CD1 4.38Å; M1373-F1477 HydrophobicContact CE-CD2 4.18Å; M1373-F1477 HydrophobicContact CE-CE1 4.46Å; M1373-F1477 HydrophobicContact CE-CE2 4.26Å; M1373-F1477 HydrophobicContact CE-CG 4.24Å; M1373-F1477 HydrophobicContact CE-CZ 4.4Å; M1373-F1477 HydrophobicContact SD-CD2 4.11Å; M1373-F1477 HydrophobicContact SD-CE2 4.31Å; L1378-F1477 HydrophobicContact CD2-CE2 4.03Å; F1477-F1479 HydrophobicContact CB-CD2 4.31Å; F1477-F1479 HydrophobicContact CB-CE2 3.6Å; F1477-F1479 HydrophobicContact CB-CZ 4.17Å; F1477-F1479 WeakPolarHBondContact O-CD2 3.14Å; F1477-V1601 HydrophobicContact CD1-CG1 4.39Å; F1477-V1603 HydrophobicContact CD1-CG2 4.16Å; F1477-V1603 HydrophobicContact CE1-CG1 4.2Å; F1477-V1603 HydrophobicContact CE1-CG2 4.13Å; F1477-A1619 HydrophobicContact CZ-CB 4.48Å; F1477-L1620 HydrophobicContact CD1-CD1 4.34Å; F1477-L1620 HydrophobicContact CE1-CB 4.09Å; F1477-L1620 HydrophobicContact CE1-CD1 4.43Å
1478	D	76.1	Confident	53	Low	0 Å²	0	57 Å²	57	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.4	-176	177	39.2	0	0	0	110	W44 T1354 I1455 V1601 K1602	W44-D1478 VanDerWaalsContact CZ3-OD1 3.28Å; W44-D1478 WeakPolarHBondContact CZ3-OD1 3.42Å; T1354-D1478 VanDerWaalsContact OG1-CA 3.26Å; T1354-D1478 WeakPolarHBondContact OG1-CA 3.4Å; T1354-D1478 VanDerWaalsContact OG1-CB 3.32Å; T1354-D1478 WeakPolarHBondContact OG1-CB 3.27Å; T1354-D1478 PolarHBondContact OG1-OD1 3.16Å; I1455-D1478 HydrophobicContact CD1-CB 4.13Å; D1478-V1601 CarbonylContact O-C 3.59Å; D1478-V1601 WeakPolarHBondContact O-CA 3.43Å; D1478-K1602 HydrophobicContact CB-CB 4.15Å; D1478-K1602 PolarHBondContact N-O 2.73Å; D1478-K1602 PolarHBondContact O-N 2.89Å
1479	F	77.8	Confident	52.5	Low	2 Å²	2	55.4 Å²	55.4	1%	0.009	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.3	-168.7	-63.9	-104.9	0	0	0	110.8	F1353 M1366 Y1369 F1477 N1600 V1601	F1353-F1479 HydrophobicContact CB-CE2 4.35Å; M1366-F1479 HydrophobicContact CE-CB 3.49Å; M1366-F1479 VanDerWaalsContact CE-CB 3.49Å; M1366-F1479 HydrophobicContact CE-CD2 4.22Å; M1366-F1479 HydrophobicContact CE-CG 3.98Å; M1366-F1479 HydrophobicContact SD-CB 3.15Å; M1366-F1479 WeakPolarHBondContact SD-CB 3.32Å; M1366-F1479 HydrophobicContact SD-CD1 3.5Å; M1366-F1479 WeakPolarHBondContact SD-CD1 3.37Å; M1366-F1479 HydrophobicContact SD-CD2 3.91Å; M1366-F1479 HydrophobicContact SD-CE1 4.28Å; M1366-F1479 HydrophobicContact SD-CG 3.29Å; M1366-F1479 WeakPolarHBondContact SD-CG 3.26Å; Y1369-F1479 HydrophobicContact CG-CE1 4.5Å; F1477-F1479 HydrophobicContact CB-CD2 4.31Å; F1477-F1479 HydrophobicContact CB-CE2 3.6Å; F1477-F1479 HydrophobicContact CB-CZ 4.17Å; F1477-F1479 WeakPolarHBondContact O-CD2 3.14Å; F1479-N1600 WeakPolarHBondContact CA-O 3.46Å; F1479-V1601 HydrophobicContact CD1-CB 4.37Å; F1479-V1601 HydrophobicContact CD1-CG1 4.15Å; F1479-V1601 HydrophobicContact CD1-CG2 3.52Å; F1479-V1601 HydrophobicContact CE1-CG1 4.08Å; F1479-V1601 HydrophobicContact CE1-CG2 3.67Å; F1479-V1601 HydrophobicContact CG-CG1 4.46Å; F1479-V1601 HydrophobicContact CG-CG2 4.41Å; F1479-V1601 HydrophobicContact CZ-CG1 4.35Å
1480	F	70.7	Confident	52.1	Low	14 Å²	14	63.8 Å²	63.8	6%	0.061	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	158.2	-170.6	65.3	-77.2	0	0	0	113	W44 L46 F633 N1600 K1602	W44-F1480 HydrophobicContact CE3-CB 3.99Å; W44-F1480 HydrophobicContact CZ3-CB 4.24Å; L46-F1480 HydrophobicContact CD1-CE2 4.26Å; L46-F1480 HydrophobicContact CD2-CE2 3.79Å; L46-F1480 HydrophobicContact CD2-CZ 3.65Å; L46-F1480 HydrophobicContact CG-CE2 4Å; L46-F1480 HydrophobicContact CG-CZ 4.36Å; F633-F1480 HydrophobicContact CD2-CZ 4.11Å; F633-F1480 HydrophobicContact CE2-CZ 4.4Å; F1480-N1600 HydrophobicContact CD1-CB 4.11Å; F1480-N1600 HydrophobicContact CD2-CB 4.18Å; F1480-N1600 HydrophobicContact CE1-CB 3.54Å; F1480-N1600 HydrophobicContact CE2-CB 3.67Å; F1480-N1600 HydrophobicContact CG-CB 4.38Å; F1480-N1600 HydrophobicContact CZ-CB 3.32Å; F1480-N1600 PolarHBondContact N-O 2.81Å; F1480-N1600 PolarHBondContact O-N 3.4Å; F1480-K1602 HydrophobicContact CD1-CB 4.48Å; F1480-K1602 HydrophobicContact CE1-CB 3.79Å
1481	D	65.3	Low	51.3	Low	71 Å²	71	68.7 Å²	68.7	38%	0.38	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.3	179.1	-77.6	2.9	0	0	0	111.3	F1483 K1598 H1599	D1481-F1483 PolarHBondContact O-N 2.88Å; D1481-K1598 WeakPolarHBondContact CA-O 3.17Å; D1481-H1599 IonicContact OD1-CE1 3.35Å; D1481-H1599 IonicContact OD1-CG 3.02Å; D1481-H1599 IonicContact OD1-ND1 3.93Å; D1481-H1599 PolarHBondContact OD1-ND1 3.29Å; D1481-H1599 IonicContact OD2-CE1 3.56Å; D1481-H1599 IonicContact OD2-ND1 2.66Å
1482	T	56.8	Low	50.7	Low	39 Å²	39	73.9 Å²	73.9	24%	0.239	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-29.1	-165.3	-37.2	0	0	0	0	114.8	L46 R1484 P1597 K1598 N1600	L46-T1482 HydrophobicContact CD1-CG2 4.42Å; T1482-R1484 PolarHBondContact O-N 3.4Å; T1482-P1597 PolarHBondContact OG1-O 3.25Å; T1482-K1598 PolarHBondContact N-O 3.43Å; T1482-K1598 PolarHBondContact OG1-O 3.46Å; T1482-N1600 PolarHBondContact OG1-ND2 3.02Å
1483	F	49.8	Very low	49.8	Very low	147 Å²	147	82 Å²	82	65%	0.645	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	9.9	-166.1	-84.4	-82.6	0	0	0	115.8	D1481 F1485	D1481-F1483 PolarHBondContact O-N 2.88Å; F1483-F1485 VanDerWaalsContact C-N 3.33Å; F1483-F1485 PolarHBondContact O-N 3.49Å
1484	R	44.7	Very low	48.3	Very low	134 Å²	134	84 Å²	84	51%	0.506	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-7.8	-173.1	-138.8	179.7	-160.7	-162.6	0.3	115.8	N1358 T1482	N1358-R1484 PolarHBondContact ND2-NH2 3.33Å; N1358-R1484 VanDerWaalsContact ND2-NH2 3.12Å; T1482-R1484 PolarHBondContact O-N 3.4Å
1485	F	37.4	Very low	46.8	Very low	71 Å²	71	89.7 Å²	89.7	31%	0.311	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	4.1	-158.6	-105.2	-74.3	0	0	0	117.5	W44 K51 F1483	W44-F1485 HydrophobicContact CB-CE2 4.01Å; W44-F1485 HydrophobicContact CB-CZ 4.22Å; K51-F1485 VanDerWaalsContact NZ-CD1 3.33Å; F1483-F1485 VanDerWaalsContact C-N 3.33Å; F1483-F1485 PolarHBondContact O-N 3.49Å
1486	S	39.9	Very low	44.8	Very low	96 Å²	96	98.6 Å²	98.6	67%	0.671	50%	0.5	S	S	*	.	S	Bend	trans	-78.6	-13.9	-178.5	64.9	0	0	0	0	115.2
1487	N	33.4	Very low	42.7	Very low	131 Å²	131	107.2 Å²	107.2	70%	0.701	54%	0.54	S	S	*	.	S	Bend	trans	-117.1	-1.3	-166.4	-74.2	20.7	0	0	0	115.8
1488	E	29.8	Very low	40.1	Very low	164 Å²	164	114.3 Å²	114.3	77%	0.766	58%	0.578	S	S	*	*	S	Bend	trans	-107.2	9.5	-176	-74.6	-171.3	159.9	0	0	115.1
1489	L	30.6	Very low	37.6	Very low	145 Å²	145	118.2 Å²	118.2	76%	0.759	60%	0.601	S	S	*	*	S	Bend	trans	-99.3	8	173.5	-107	161.2	0	0	0	114.4	N1491	L1489-N1491 PolarHBondContact O-N 2.82Å
1490	Y	30.5	Very low	35.1	Very low	208 Å²	208	124.9 Å²	124.9	82%	0.816	63%	0.627	S	S	*	*			trans	-96.4	35.2	177.6	-91.9	-77.7	0	0	0	113.6
1491	N	25.8	Very low	32.8	Very low	146 Å²	146	132.4 Å²	132.4	78%	0.781	67%	0.667	S	S	*	*			trans	-141.8	41.9	177.3	-103	-21.9	0	0	0	112.9	L1489	L1489-N1491 PolarHBondContact O-N 2.82Å
1492	V	26.9	Very low	30.8	Very low	130 Å²	130	136.6 Å²	136.6	79%	0.788	68%	0.677	S	S	*	*			trans	-123.1	68.7	159.2	-171.7	0	0	0	0	107.5	G1494	V1492-G1494 PolarHBondContact O-N 3.3Å
1493	E	24.5	Very low	29.3	Very low	190 Å²	190	139.3 Å²	139.3	89%	0.888	70%	0.698	S	S	*	*			trans	-68.2	116.9	167.4	-69.8	-172.4	145.8	0	0	108.4
1494	G	24.6	Very low	28.1	Very low	65 Å²	65	142 Å²	142	67%	0.67	71%	0.712	S	S	*	*			trans	-179	-12.8	-175.4	0	0	0	0	0	118.6	V1492	V1492-G1494 PolarHBondContact O-N 3.3Å
1495	L	24.1	Very low	27.6	Very low	130 Å²	130	140.6 Å²	140.6	68%	0.681	72%	0.723	S	S	*	*	S	Bend	trans	-158.1	138.6	170.7	-107.1	136.8	0	0	0	111.4
1496	F	26.5	Very low	27.1	Very low	188 Å²	188	144.3 Å²	144.3	83%	0.825	74%	0.739	S	S	*	*			trans	72.2	80.6	-176.2	-64.9	-81	0	0	0	117.7	N1498	F1496-N1498 PolarHBondContact O-N 2.72Å
1497	E	23.2	Very low	26.2	Very low	180 Å²	180	148.2 Å²	148.2	84%	0.841	75%	0.751	S	S	*	*			trans	-68	119.5	146.9	-73.2	-174.9	129.2	0	0	110.1
1498	N	23.9	Very low	25.6	Very low	149 Å²	149	144.6 Å²	144.6	80%	0.797	74%	0.739	S	S	*	*				164.6	146.5	120.7	-87.1	-57.8	0	0	0	111.5	F1496	F1496-N1498 PolarHBondContact O-N 2.72Å
1499	V	24.5	Very low	25.3	Very low	82 Å²	82	143.9 Å²	143.9	50%	0.497	74%	0.74	S	S	.	*	S	Bend	trans	73.4	70.7	170.5	-169.7	0	0	0	0	116.3	S457	S457-V1499 WeakPolarHBondContact O-CG1 3.4Å
1500	W	25.1	Very low	24.8	Very low	142 Å²	142	140.7 Å²	140.7	54%	0.538	73%	0.729	S	S	.	*				172.5	101.4	113.4	-100.8	94	0	0	0	111.9	V458 A460	V458-W1500 VanDerWaalsContact O-CZ2 3.26Å; V458-W1500 WeakPolarHBondContact O-CZ2 3.16Å; A460-W1500 HydrophobicContact CB-CG 4.32Å; A460-W1500 VanDerWaalsContact N-NE1 3.1Å
1501	L	22.6	Very low	24.6	Very low	172 Å²	172	135.3 Å²	135.3	90%	0.901	72%	0.719	S	S	*	*			trans	-146.3	93.2	169.2	-117.1	175.9	0	0	0	111.7
1502	R	23.3	Very low	24.5	Very low	160 Å²	160	135 Å²	135	60%	0.604	72%	0.717	S	S	*	*			trans	171.8	127.1	159.2	-96.4	164	-168.1	-159.7	5.7	106	C1510	R1502-C1510 VanDerWaalsContact CZ-SG 3.6Å
1503	S	23.8	Very low	24.2	Very low	95 Å²	95	135.6 Å²	135.6	66%	0.664	71%	0.714	S	S	*	*			cis	-157.7	130.7	3.2	52.8	0	0	0	0	111.6
1504	H	26.2	Very low	24.1	Very low	205 Å²	205	131.3 Å²	131.3	95%	0.949	71%	0.705	S	S	*	*	S	Bend	trans	-149.7	26.9	155	-105.9	-59.9	0	0	0	114.2
1505	S	33.3	Very low	24	Very low	104 Å²	104	133.5 Å²	133.5	73%	0.727	71%	0.71	S	S	*	*			trans	-124.8	141	137.1	72.2	0	0	0	0	106.8
1506	K	26	Very low	24.2	Very low	149 Å²	149	132.9 Å²	132.9	65%	0.648	71%	0.714	S	S	*	*			cis	-138.7	-179.1	30.4	-152.2	-174.1	-160	177.7	0	105.9	A1508	K1506-A1508 WeakPolarHBondContact CD-O 3.23Å; K1506-A1508 PolarHBondContact O-N 3.14Å
1507	L	22	Very low	24	Very low	177 Å²	177	128.6 Å²	128.6	93%	0.927	71%	0.713	S	S	*	*	S	Bend		-9.4	53.1	89.4	-155.9	126.8	0	0	0	114.7
1508	A	21.6	Very low	24	Very low	55 Å²	55	128.9 Å²	128.9	46%	0.455	71%	0.712	S	S	.	*	S	Bend	trans	15.1	164.5	-164.5	0	0	0	0	0	124.6	K1506	K1506-A1508 WeakPolarHBondContact CD-O 3.23Å; K1506-A1508 PolarHBondContact O-N 3.14Å
1509	L	22.6	Very low	23.9	Very low	150 Å²	150	128.7 Å²	128.7	79%	0.785	71%	0.711	S	S	*	*			trans	96.6	90.9	154.8	-58.6	143	0	0	0	119.6
1510	C	21	Very low	23.8	Very low	78 Å²	78	136.2 Å²	136.2	53%	0.527	73%	0.731	S	S	.	*				3.3	167.7	102.7	-87.7	0	0	0	0	119.9	R1502	R1502-C1510 VanDerWaalsContact CZ-SG 3.6Å
1511	P	26.1	Very low	23.7	Very low	94 Å²	94	133.2 Å²	133.2	61%	0.61	74%	0.744	S	S	*	*			cis	-149.4	179.2	-18.1	38.9	-18.1	0	0	0	118.3
1512	L	22.1	Very low	23.7	Very low	139 Å²	139	134.6 Å²	134.6	73%	0.728	74%	0.743	S	S	*	*			trans	78.6	129.9	134.8	-86.3	161.6	0	0	0	124.8
1513	I	21.6	Very low	23.6	Very low	144 Å²	144	132.5 Å²	132.5	74%	0.738	75%	0.748	S	S	*	*			trans	110	125.3	138.5	-67.9	155.5	0	0	0	121.7
1514	S	22.6	Very low	23.7	Very low	99 Å²	99	137.3 Å²	137.3	69%	0.692	76%	0.757	S	S	*	*			trans	65.3	102.7	155.4	66.1	0	0	0	0	123.9
1515	S	21.9	Very low	23.5	Very low	111 Å²	111	135.2 Å²	135.2	78%	0.776	75%	0.751	S	S	*	*				31.6	152.3	97.1	-171.9	0	0	0	0	120.1
1516	P	29	Very low	23	Very low	117 Å²	117	134.8 Å²	134.8	76%	0.76	74%	0.744	S	S	*	*			cis	-135.5	163.2	-31.4	36.8	-21.2	0	0	0	114.5
1517	A	22.5	Very low	22.8	Very low	99 Å²	99	135.7 Å²	135.7	82%	0.818	75%	0.748	S	S	*	*			trans	179.9	120.7	147.5	0	0	0	0	0	117.1
1518	F	22.1	Very low	23.2	Very low	186 Å²	186	134.5 Å²	134.5	82%	0.816	74%	0.735	S	S	*	*				50.9	106.3	128.4	-110.7	-99.1	0	0	0	123.9
1519	N	21.9	Very low	23.3	Very low	145 Å²	145	135.7 Å²	135.7	78%	0.775	75%	0.753	S	S	*	*				12.2	118.1	120.5	-114.4	-23.8	0	0	0	119.5
1520	R	22.2	Very low	23.3	Very low	240 Å²	240	132.5 Å²	132.5	91%	0.906	76%	0.756	S	S	*	*			trans	169.3	144.6	133.9	-97.4	168.4	-175.2	-174.6	3.3	112.5
1521	G	23.1	Very low	23.5	Very low	79 Å²	79	139.9 Å²	139.9	81%	0.814	78%	0.775	S	S	*	*			trans	111.8	87.2	143.8	0	0	0	0	0	119.6
1522	F	22.5	Very low	23.3	Very low	201 Å²	201	141.1 Å²	141.1	88%	0.882	79%	0.786	S	S	*	*			trans	-21	143.9	153.4	-106.1	-112.4	0	0	0	120.9
1523	T	22.4	Very low	23.6	Very low	116 Å²	116	142 Å²	142	71%	0.712	79%	0.789	S	S	*	*			trans	71.6	129.3	145.6	41.9	0	0	0	0	124.7
1524	K	24.5	Very low	23.7	Very low	195 Å²	195	139.5 Å²	139.5	85%	0.848	79%	0.791	S	S	*	*			trans	54.2	118.1	151.1	-74	-174.8	174.1	-179.5	0	119.1
1525	I	22.3	Very low	23.9	Very low	162 Å²	162	142.1 Å²	142.1	83%	0.831	80%	0.797	S	S	*	*				-175	124.4	111.6	-91.8	153.1	0	0	0	112.6
1526	V	23.8	Very low	24.1	Very low	94 Å²	94	141.7 Å²	141.7	57%	0.57	79%	0.791	S	S	*	*			trans	9.3	126.1	145.3	-157	0	0	0	0	120.2	D1414	D1414-V1526 WeakPolarHBondContact OD2-CG1 3.48Å
1527	K	22	Very low	24	Very low	168 Å²	168	141.7 Å²	141.7	73%	0.73	79%	0.791	S	S	*	*				161.4	122.4	117.6	-90.2	-177.8	-178.2	176	0	113.7
1528	F	29.1	Very low	24.1	Very low	152 Å²	152	144.5 Å²	144.5	67%	0.667	79%	0.788	S	S	*	*			trans	-75	148.4	152.9	-94.3	-88.9	0	0	0	112.3	D1414	D1414-F1528 WeakPolarHBondContact OD1-CB 2.98Å; D1414-F1528 PolarHBondContact OD1-N 3.47Å
1529	G	23.4	Very low	24.4	Very low	81 Å²	81	141.3 Å²	141.3	84%	0.835	78%	0.783	S	S	*	*			trans	164.3	114.9	162.2	0	0	0	0	0	114.7
1530	G	23.5	Very low	24.8	Very low	82 Å²	82	141.6 Å²	141.6	85%	0.845	77%	0.774	S	S	*	*			trans	137.6	98.7	167	0	0	0	0	0	114.8
1531	Y	24.9	Very low	25.3	Very low	234 Å²	234	135.6 Å²	135.6	92%	0.918	76%	0.764	S	S	*	*			trans	-94.1	137.3	158.4	-86.7	-90	0	0	0	109
1532	S	22.1	Very low	26.1	Very low	120 Å²	120	138.2 Å²	138.2	84%	0.839	76%	0.759	S	S	*	*			trans	-135.5	155.9	159.7	-168.8	0	0	0	0	110.1
1533	I	27.7	Very low	27.1	Very low	156 Å²	156	132.3 Å²	132.3	80%	0.8	74%	0.74	S	S	*	*			trans	-94.1	135.7	-164.3	-65	156.6	0	0	0	110.7
1534	A	23.6	Very low	28.4	Very low	93 Å²	93	132.9 Å²	132.9	77%	0.769	73%	0.732	S	S	*	*			trans	-149.9	127.9	156	0	0	0	0	0	110.2
1535	N	26.8	Very low	29.6	Very low	154 Å²	154	127.5 Å²	127.5	82%	0.824	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-77	136.9	179.3	-66.9	-19.5	0	0	0	111.5
1536	P	27.6	Very low	31.1	Very low	102 Å²	102	125.6 Å²	125.6	66%	0.662	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-94.5	145.9	156.7	34.8	-28.9	0	0	0	111
1537	P	25.4	Very low	32.6	Very low	116 Å²	116	124.6 Å²	124.6	75%	0.753	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-79.6	144.9	179.4	32.1	-34.4	0	0	0	112.6	V1539	P1537-V1539 PolarHBondContact O-N 3.31Å
1538	E	25.8	Very low	34.1	Very low	159 Å²	159	118 Å²	118	74%	0.743	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-71	116.7	168.9	-63.4	-176.6	147.5	0	0	110.5	Y1540	E1538-Y1540 HydrophobicContact CB-CD2 4.33Å; E1538-Y1540 HydrophobicContact CB-CE2 4.3Å; E1538-Y1540 HydrophobicContact CG-CE2 4.32Å
1539	V	27.6	Very low	35.3	Very low	118 Å²	118	112.8 Å²	112.8	72%	0.715	64%	0.641	S	S	*	*			trans	-127.1	84.6	162.3	-174.2	0	0	0	0	108.9	P1537 V1541	P1537-V1539 PolarHBondContact O-N 3.31Å; V1539-V1541 HydrophobicContact CG1-CG2 4.06Å; V1539-V1541 PolarHBondContact O-N 3.47Å
1540	Y	30.2	Very low	37	Very low	152 Å²	152	116.7 Å²	116.7	60%	0.596	63%	0.631	S	S	*	*			trans	-74.8	101.8	170.2	-71.9	-75.6	0	0	0	110.3	E1538 N1542	E1538-Y1540 HydrophobicContact CB-CD2 4.33Å; E1538-Y1540 HydrophobicContact CB-CE2 4.3Å; E1538-Y1540 HydrophobicContact CG-CE2 4.32Å; Y1540-N1542 PolarHBondContact O-N 2.92Å
1541	V	34.2	Very low	38.7	Very low	113 Å²	113	115.2 Å²	115.2	69%	0.685	60%	0.603	S	S	*	*			trans	-87.3	87.9	167.7	-168	0	0	0	0	109.4	V1539 V1543	V1539-V1541 HydrophobicContact CG1-CG2 4.06Å; V1539-V1541 PolarHBondContact O-N 3.47Å; V1541-V1543 VanDerWaalsContact C-N 3.28Å; V1541-V1543 HydrophobicContact CG1-CG2 3.75Å; V1541-V1543 PolarHBondContact O-N 2.88Å
1542	N	39.7	Very low	40.2	Very low	135 Å²	135	105.8 Å²	105.8	72%	0.722	57%	0.57	S	S	*	*			trans	-71.3	85.4	164.1	-78.4	-21.2	0	0	0	108.8	Y1540 K1544	Y1540-N1542 PolarHBondContact O-N 2.92Å; N1542-K1544 PolarHBondContact O-N 2.97Å
1543	V	43.7	Very low	42	Very low	77 Å²	77	104.8 Å²	104.8	47%	0.467	55%	0.552	S	S	.	*			trans	-65.1	124.7	170.8	-176.5	0	0	0	0	108.5	V1541 D1547	V1541-V1543 VanDerWaalsContact C-N 3.28Å; V1541-V1543 HydrophobicContact CG1-CG2 3.75Å; V1541-V1543 PolarHBondContact O-N 2.88Å; V1543-D1547 HydrophobicContact CG1-CB 4.42Å
1544	K	48.3	Very low	43.6	Very low	128 Å²	128	101 Å²	101	56%	0.557	53%	0.533	S	S	*	.			trans	-71.8	144.4	174.2	-69.5	-177.4	173.5	-172.4	0	109.8	N1542 E1546 D1547	N1542-K1544 PolarHBondContact O-N 2.97Å; K1544-E1546 HydrophobicContact CB-CB 4.37Å; K1544-E1546 WeakPolarHBondContact CD-OE2 3.35Å; K1544-E1546 IonicContact NZ-OE2 3.89Å; K1544-E1546 PolarHBondContact O-N 3.41Å; K1544-D1547 PolarHBondContact O-N 2.8Å
1545	I	49.5	Very low	45.1	Very low	81 Å²	81	99.5 Å²	99.5	42%	0.415	51%	0.511	S	S	.	.	H	α-helix	trans	-53.8	-39.3	175.7	-67.6	170.6	0	0	0	110.5	D1547 L1548 E1549 A1589	I1545-D1547 VanDerWaalsContact C-N 3.28Å; I1545-D1547 PolarHBondContact O-N 3.44Å; I1545-L1548 PolarHBondContact O-N 3.11Å; I1545-E1549 HydrophobicContact CG2-CG 4.19Å; I1545-E1549 WeakPolarHBondContact CG2-OE1 3.32Å; I1545-E1549 WeakPolarHBondContact O-CG 3.44Å; I1545-E1549 PolarHBondContact O-N 3.18Å; I1545-A1589 HydrophobicContact CG2-CB 4.08Å
1546	E	53.9	Low	46.7	Very low	122 Å²	122	96.4 Å²	96.4	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-52.1	-36.6	176.2	-60.8	167.3	167.5	0	0	114.1	K1544 R1550	K1544-E1546 HydrophobicContact CB-CB 4.37Å; K1544-E1546 WeakPolarHBondContact CD-OE2 3.35Å; K1544-E1546 IonicContact NZ-OE2 3.89Å; K1544-E1546 PolarHBondContact O-N 3.41Å; E1546-R1550 WeakPolarHBondContact O-CB 3.33Å; E1546-R1550 PolarHBondContact O-N 2.79Å; E1546-R1550 VanDerWaalsContact O-N 3.14Å
1547	D	55.7	Low	48.1	Very low	73 Å²	73	98.6 Å²	98.6	39%	0.39	48%	0.484	S	S	.	.	H	α-helix	trans	-81.5	-35.5	-177.3	-65.2	-46.3	0	0	0	112	V1543 K1544 I1545 R1550 N1551	V1543-D1547 HydrophobicContact CG1-CB 4.42Å; K1544-D1547 PolarHBondContact O-N 2.8Å; I1545-D1547 VanDerWaalsContact C-N 3.28Å; I1545-D1547 PolarHBondContact O-N 3.44Å; D1547-R1550 PolarHBondContact O-N 3.06Å; D1547-N1551 VanDerWaalsContact O-CG 3.27Å; D1547-N1551 PolarHBondContact O-N 3.14Å; D1547-N1551 PolarHBondContact O-ND2 2.86Å
1548	L	53.5	Low	49.7	Very low	30 Å²	30	96 Å²	96	16%	0.157	46%	0.461	C	S	.	.	H	α-helix	trans	-67.9	-41.7	174	-170.8	72.7	0	0	0	110.7	A66 Q67 I1545 N1551 V1552 A1589	A66-L1548 HydrophobicContact CB-CD1 3.88Å; Q67-L1548 HydrophobicContact CG-CD1 4.45Å; I1545-L1548 PolarHBondContact O-N 3.11Å; L1548-N1551 PolarHBondContact O-N 2.89Å; L1548-V1552 WeakPolarHBondContact O-CG2 3.49Å; L1548-V1552 PolarHBondContact O-N 3.1Å; L1548-A1589 HydrophobicContact CD2-CB 4.49Å
1549	E	55.1	Low	51	Low	42 Å²	42	90.5 Å²	90.5	20%	0.196	44%	0.437	C	S	.	.	H	α-helix	trans	-58.7	-48	173.7	-72.7	173.7	179.6	0	0	111.2	I1545 N1551 E1553 T1586 A1589	I1545-E1549 HydrophobicContact CG2-CG 4.19Å; I1545-E1549 WeakPolarHBondContact CG2-OE1 3.32Å; I1545-E1549 WeakPolarHBondContact O-CG 3.44Å; I1545-E1549 PolarHBondContact O-N 3.18Å; E1549-N1551 PolarHBondContact O-N 3.1Å; E1549-E1553 WeakPolarHBondContact O-CB 3.3Å; E1549-E1553 PolarHBondContact O-N 2.95Å; E1549-T1586 VanDerWaalsContact OE1-CA 3.23Å; E1549-T1586 WeakPolarHBondContact OE1-CA 3.2Å; E1549-T1586 WeakPolarHBondContact OE1-CG2 3.36Å; E1549-A1589 HydrophobicContact CG-CB 4.27Å
1550	R	59	Low	52.4	Low	164 Å²	164	87.7 Å²	87.7	62%	0.619	42%	0.417	S	S	*	.	H	α-helix	trans	-57.4	-48.4	176.5	-110	178.6	177.9	159.3	0.8	113.2	E1546 D1547 E1553 I1554	E1546-R1550 WeakPolarHBondContact O-CB 3.33Å; E1546-R1550 PolarHBondContact O-N 2.79Å; E1546-R1550 VanDerWaalsContact O-N 3.14Å; D1547-R1550 PolarHBondContact O-N 3.06Å; R1550-E1553 PolarHBondContact O-N 2.83Å; R1550-I1554 WeakPolarHBondContact O-CB 3.39Å; R1550-I1554 WeakPolarHBondContact O-CD1 3.44Å; R1550-I1554 VanDerWaalsContact O-CG1 3.23Å; R1550-I1554 WeakPolarHBondContact O-CG1 3.5Å; R1550-I1554 PolarHBondContact O-N 3.13Å
1551	N	58.6	Low	53.5	Low	51 Å²	51	83.7 Å²	83.7	27%	0.273	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-38.9	-173.8	-71.6	-20.3	0	0	0	112.1	D1547 L1548 E1549 L1555	D1547-N1551 VanDerWaalsContact O-CG 3.27Å; D1547-N1551 PolarHBondContact O-N 3.14Å; D1547-N1551 PolarHBondContact O-ND2 2.86Å; L1548-N1551 PolarHBondContact O-N 2.89Å; E1549-N1551 PolarHBondContact O-N 3.1Å; N1551-L1555 WeakPolarHBondContact O-CB 3.45Å; N1551-L1555 PolarHBondContact O-N 3.4Å
1552	V	56.6	Low	54.5	Low	36 Å²	36	80.3 Å²	80.3	22%	0.218	38%	0.382	C	S	.	.	H	α-helix	trans	-66.4	-41.4	174.1	174.8	0	0	0	0	111.1	L1548 L1555 Y1556	L1548-V1552 WeakPolarHBondContact O-CG2 3.49Å; L1548-V1552 PolarHBondContact O-N 3.1Å; V1552-L1555 PolarHBondContact O-N 3.38Å; V1552-Y1556 WeakPolarHBondContact O-CB 3.44Å; V1552-Y1556 PolarHBondContact O-N 3.32Å
1553	E	59.4	Low	55.1	Low	99 Å²	99	77.6 Å²	77.6	46%	0.463	36%	0.364	S	S	.	.	H	α-helix	trans	-67.3	-38.8	179.1	-151.5	-162	153.6	0	0	112.5	E1549 R1550 R1557	E1549-E1553 WeakPolarHBondContact O-CB 3.3Å; E1549-E1553 PolarHBondContact O-N 2.95Å; R1550-E1553 PolarHBondContact O-N 2.83Å; E1553-R1557 VanDerWaalsContact O-CB 3.28Å; E1553-R1557 WeakPolarHBondContact O-CB 3.11Å; E1553-R1557 PolarHBondContact O-N 2.86Å; E1553-R1557 IonicContact OE1-NH2 2.75Å; E1553-R1557 PolarHBondContact OE1-NH2 3.04Å
1554	I	61.8	Low	55.4	Low	76 Å²	76	80 Å²	80	39%	0.39	37%	0.37	S	S	.	.	H	α-helix	trans	-66.6	-46.1	175.8	-69.4	164.2	0	0	0	110.9	V72 R1550 Y1556 R1557 E1558	V72-I1554 HydrophobicContact CG1-CG2 3.99Å; R1550-I1554 WeakPolarHBondContact O-CB 3.39Å; R1550-I1554 WeakPolarHBondContact O-CD1 3.44Å; R1550-I1554 VanDerWaalsContact O-CG1 3.23Å; R1550-I1554 WeakPolarHBondContact O-CG1 3.5Å; R1550-I1554 PolarHBondContact O-N 3.13Å; I1554-Y1556 VanDerWaalsContact C-N 3.35Å; I1554-Y1556 PolarHBondContact O-N 3.26Å; I1554-R1557 PolarHBondContact O-N 2.82Å; I1554-E1558 HydrophobicContact CG2-CG 4.42Å; I1554-E1558 WeakPolarHBondContact O-CG 3.38Å; I1554-E1558 PolarHBondContact O-N 3.44Å
1555	L	54.8	Low	55.5	Low	61 Å²	61	83 Å²	83	32%	0.319	38%	0.383	S	S	.	.	H	α-helix	trans	-61.3	-43.9	178.6	-172.5	71.3	0	0	0	111.3	N1551 V1552 L1559	N1551-L1555 WeakPolarHBondContact O-CB 3.45Å; N1551-L1555 PolarHBondContact O-N 3.4Å; V1552-L1555 PolarHBondContact O-N 3.38Å; L1555-L1559 WeakPolarHBondContact O-CB 3.27Å; L1555-L1559 PolarHBondContact O-N 3.43Å; L1555-L1559 VanDerWaalsContact O-N 3.08Å
1556	Y	59.9	Low	55.3	Low	90 Å²	90	81 Å²	81	35%	0.353	37%	0.374	S	S	.	.	H	α-helix	trans	-61.6	-42.9	174.6	-176	-102.1	0	0	0	112	V1552 I1554 M1560	V1552-Y1556 WeakPolarHBondContact O-CB 3.44Å; V1552-Y1556 PolarHBondContact O-N 3.32Å; I1554-Y1556 VanDerWaalsContact C-N 3.35Å; I1554-Y1556 PolarHBondContact O-N 3.26Å; Y1556-M1560 HydrophobicContact CD1-CG 4.48Å; Y1556-M1560 HydrophobicContact CE1-CG 4.21Å; Y1556-M1560 HydrophobicContact CE2-CG 4.47Å; Y1556-M1560 VanDerWaalsContact O-CG 3.27Å; Y1556-M1560 WeakPolarHBondContact O-CG 3.36Å; Y1556-M1560 PolarHBondContact O-N 2.86Å
1557	R	58.2	Low	54.9	Low	148 Å²	148	82.1 Å²	82.1	56%	0.558	38%	0.384	S	S	*	.	H	α-helix	trans	-67.3	-40.6	179.9	-166.1	-179.1	-65.6	-170	1.9	112.8	E1553 I1554 N1561	E1553-R1557 VanDerWaalsContact O-CB 3.28Å; E1553-R1557 WeakPolarHBondContact O-CB 3.11Å; E1553-R1557 PolarHBondContact O-N 2.86Å; E1553-R1557 IonicContact OE1-NH2 2.75Å; E1553-R1557 PolarHBondContact OE1-NH2 3.04Å; I1554-R1557 PolarHBondContact O-N 2.82Å; R1557-N1561 WeakPolarHBondContact O-CB 3.46Å; R1557-N1561 VanDerWaalsContact O-CG 3.25Å; R1557-N1561 PolarHBondContact O-N 2.83Å; R1557-N1561 PolarHBondContact O-ND2 3.05Å
1558	E	58.4	Low	54.3	Low	61 Å²	61	81.8 Å²	81.8	29%	0.285	39%	0.385	S	S	.	.	H	α-helix	trans	-69.7	-38.8	177	-69.7	-76.6	-172.4	0	0	112.2	K76 I1554 N1561 F1562	K76-E1558 WeakPolarHBondContact CE-OE1 3.35Å; K76-E1558 IonicContact NZ-OE1 3.43Å; K76-E1558 PolarHBondContact NZ-OE1 3.4Å; I1554-E1558 HydrophobicContact CG2-CG 4.42Å; I1554-E1558 WeakPolarHBondContact O-CG 3.38Å; I1554-E1558 PolarHBondContact O-N 3.44Å; E1558-N1561 PolarHBondContact O-N 3.01Å; E1558-F1562 PolarHBondContact O-N 2.77Å
1559	L	53.5	Low	53.7	Low	44 Å²	44	86.4 Å²	86.4	23%	0.23	41%	0.41	C	S	.	.	H	α-helix	trans	-59.3	-48.6	172.1	-101.8	158	0	0	0	111.9	F243 L1555 N1561 F1562 F1563	F243-L1559 HydrophobicContact CE1-CD1 4.34Å; F243-L1559 HydrophobicContact CE1-CD2 4.25Å; F243-L1559 HydrophobicContact CZ-CD1 4.08Å; F243-L1559 HydrophobicContact CZ-CD2 4.01Å; F243-L1559 HydrophobicContact CZ-CG 4.41Å; L1555-L1559 WeakPolarHBondContact O-CB 3.27Å; L1555-L1559 PolarHBondContact O-N 3.43Å; L1555-L1559 VanDerWaalsContact O-N 3.08Å; L1559-N1561 VanDerWaalsContact C-N 3.35Å; L1559-N1561 PolarHBondContact O-N 3.24Å; L1559-F1562 WeakPolarHBondContact O-CB 3.38Å; L1559-F1562 PolarHBondContact O-N 3.3Å; L1559-F1563 HydrophobicContact CD2-CE2 3.84Å; L1559-F1563 WeakPolarHBondContact O-CD2 3.41Å; L1559-F1563 PolarHBondContact O-N 3.43Å; L1559-F1563 VanDerWaalsContact O-N 3.1Å
1560	M	56.1	Low	53.2	Low	59 Å²	59	88.7 Å²	88.7	29%	0.291	42%	0.423	S	S	.	.	H	α-helix	trans	-66.2	-35.9	178.6	-65.7	-64.2	-81.1	0	0	112.2	Y1556 F1563 Q1564	Y1556-M1560 HydrophobicContact CD1-CG 4.48Å; Y1556-M1560 HydrophobicContact CE1-CG 4.21Å; Y1556-M1560 HydrophobicContact CE2-CG 4.47Å; Y1556-M1560 VanDerWaalsContact O-CG 3.27Å; Y1556-M1560 WeakPolarHBondContact O-CG 3.36Å; Y1556-M1560 PolarHBondContact O-N 2.86Å; M1560-F1563 PolarHBondContact O-N 3.46Å; M1560-Q1564 WeakPolarHBondContact O-CB 3.13Å; M1560-Q1564 WeakPolarHBondContact O-CG 3.29Å; M1560-Q1564 PolarHBondContact O-N 3.42Å
1561	N	54.4	Low	52.5	Low	67 Å²	67	86.2 Å²	86.2	36%	0.358	42%	0.422	S	S	.	.	H	α-helix	trans	-64.4	-36.2	172.4	-79.7	-16.4	0	0	0	112.8	R1557 E1558 L1559 Q1564 K1565	R1557-N1561 WeakPolarHBondContact O-CB 3.46Å; R1557-N1561 VanDerWaalsContact O-CG 3.25Å; R1557-N1561 PolarHBondContact O-N 2.83Å; R1557-N1561 PolarHBondContact O-ND2 3.05Å; E1558-N1561 PolarHBondContact O-N 3.01Å; L1559-N1561 VanDerWaalsContact C-N 3.35Å; L1559-N1561 PolarHBondContact O-N 3.24Å; N1561-Q1564 PolarHBondContact O-N 3.17Å; N1561-K1565 PolarHBondContact O-N 2.88Å
1562	F	54.4	Low	51.9	Low	42 Å²	42	88.5 Å²	88.5	18%	0.184	44%	0.438	C	S	.	.	H	α-helix	trans	-65.4	-48.1	174.9	177.7	-92.7	0	0	0	111.1	L79 L435 E1558 L1559 Q1564 K1565 T1566	L79-F1562 HydrophobicContact CB-CD2 4.16Å; L79-F1562 HydrophobicContact CB-CE2 4.34Å; L79-F1562 HydrophobicContact CD2-CD1 4.23Å; L79-F1562 HydrophobicContact CD2-CD2 3.79Å; L79-F1562 HydrophobicContact CD2-CE1 4.24Å; L79-F1562 HydrophobicContact CD2-CE2 3.79Å; L79-F1562 HydrophobicContact CD2-CG 4.02Å; L79-F1562 HydrophobicContact CD2-CZ 4.02Å; L79-F1562 HydrophobicContact CG-CD2 4.4Å; L435-F1562 HydrophobicContact CD1-CE1 3.89Å; L435-F1562 HydrophobicContact CD1-CZ 4.09Å; E1558-F1562 PolarHBondContact O-N 2.77Å; L1559-F1562 WeakPolarHBondContact O-CB 3.38Å; L1559-F1562 PolarHBondContact O-N 3.3Å; F1562-Q1564 VanDerWaalsContact C-N 3.31Å; F1562-Q1564 PolarHBondContact O-N 2.97Å; F1562-K1565 PolarHBondContact O-N 2.74Å; F1562-T1566 HydrophobicContact CE1-CG2 4.31Å; F1562-T1566 HydrophobicContact CZ-CG2 4.31Å; F1562-T1566 PolarHBondContact O-N 2.78Å
1563	F	51.3	Low	51.2	Low	79 Å²	79	91.5 Å²	91.5	35%	0.346	45%	0.452	S	S	.	.	H	α-helix	trans	-59.1	-40.4	174.3	-72.4	-64.1	0	0	0	112.3	L1559 M1560 T1566	L1559-F1563 HydrophobicContact CD2-CE2 3.84Å; L1559-F1563 WeakPolarHBondContact O-CD2 3.41Å; L1559-F1563 PolarHBondContact O-N 3.43Å; L1559-F1563 VanDerWaalsContact O-N 3.1Å; M1560-F1563 PolarHBondContact O-N 3.46Å; F1563-T1566 PolarHBondContact O-N 3.11Å; F1563-T1566 PolarHBondContact O-OG1 3.09Å
1564	Q	51.3	Low	50.4	Low	128 Å²	128	93.7 Å²	93.7	60%	0.598	46%	0.462	S	S	*	.	H	α-helix	trans	-64.4	-37.7	175.3	-77.1	-178.8	-16.2	0	0	113.8	M1560 N1561 F1562 T1566	M1560-Q1564 WeakPolarHBondContact O-CB 3.13Å; M1560-Q1564 WeakPolarHBondContact O-CG 3.29Å; M1560-Q1564 PolarHBondContact O-N 3.42Å; N1561-Q1564 PolarHBondContact O-N 3.17Å; F1562-Q1564 VanDerWaalsContact C-N 3.31Å; F1562-Q1564 PolarHBondContact O-N 2.97Å; Q1564-T1566 VanDerWaalsContact C-N 3.3Å; Q1564-T1566 PolarHBondContact O-N 3.03Å
1565	K	49	Very low	49.5	Very low	190 Å²	190	100.4 Å²	100.4	83%	0.826	48%	0.483	S	S	*	.	H	α-helix	trans	-72.1	-16.5	-179.3	-83.9	-176.1	172.9	-178.4	0	115	N1561 F1562 N1567	N1561-K1565 PolarHBondContact O-N 2.88Å; F1562-K1565 PolarHBondContact O-N 2.74Å; K1565-N1567 VanDerWaalsContact C-N 3.3Å; K1565-N1567 PolarHBondContact O-N 2.99Å
1566	T	46.5	Very low	48.8	Very low	38 Å²	38	105.6 Å²	105.6	23%	0.233	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	5.1	-174.7	56.2	0	0	0	0	115.1	K434 F1562 F1563 Q1564	K434-T1566 PolarHBondContact NZ-O 2.82Å; F1562-T1566 HydrophobicContact CE1-CG2 4.31Å; F1562-T1566 HydrophobicContact CZ-CG2 4.31Å; F1562-T1566 PolarHBondContact O-N 2.78Å; F1563-T1566 PolarHBondContact O-N 3.11Å; F1563-T1566 PolarHBondContact O-OG1 3.09Å; Q1564-T1566 VanDerWaalsContact C-N 3.3Å; Q1564-T1566 PolarHBondContact O-N 3.03Å
1567	N	45.2	Very low	47.5	Very low	146 Å²	146	104.8 Å²	104.8	78%	0.781	52%	0.524	S	S	*	.			trans	63.9	54.6	175.8	-137.5	18.1	0	0	0	113.7	K1565	K1565-N1567 VanDerWaalsContact C-N 3.3Å; K1565-N1567 PolarHBondContact O-N 2.99Å
1568	V	42.9	Very low	46.5	Very low	66 Å²	66	101.2 Å²	101.2	40%	0.4	52%	0.519	S	S	.	.			trans	-85.3	129.3	166.2	179.8	0	0	0	0	108.6	L1570	V1568-L1570 PolarHBondContact O-N 2.87Å; V1568-L1570 VanDerWaalsContact O-N 3.1Å
1569	N	41.2	Very low	45.6	Very low	127 Å²	127	107.6 Å²	107.6	68%	0.679	55%	0.546	S	S	*	.			trans	-76.8	100.4	-171.7	-139.2	0.8	0	0	0	110.9	D1571	N1569-D1571 VanDerWaalsContact C-N 3.27Å; N1569-D1571 PolarHBondContact O-N 3.08Å
1570	L	44.4	Very low	45.2	Very low	90 Å²	90	111.7 Å²	111.7	47%	0.471	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-69.2	-19.5	-165.5	-134.4	78.8	0	0	0	114.7	V1568 T1572 L1573	V1568-L1570 PolarHBondContact O-N 2.87Å; V1568-L1570 VanDerWaalsContact O-N 3.1Å; L1570-T1572 VanDerWaalsContact C-N 3.27Å; L1570-T1572 PolarHBondContact O-N 2.59Å; L1570-L1573 PolarHBondContact O-N 3.33Å
1571	D	45	Very low	44.7	Very low	113 Å²	113	110.7 Å²	110.7	60%	0.604	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-67.7	-21.4	-174.7	-74.1	-15.5	0	0	0	114.1	N1569	N1569-D1571 VanDerWaalsContact C-N 3.27Å; N1569-D1571 PolarHBondContact O-N 3.08Å
1572	T	44.5	Very low	44.4	Very low	99 Å²	99	113 Å²	113	61%	0.607	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-78.4	-32.8	179	-25.3	0	0	0	0	112	L1570	L1570-T1572 VanDerWaalsContact C-N 3.27Å; L1570-T1572 PolarHBondContact O-N 2.59Å
1573	L	42.7	Very low	44.3	Very low	98 Å²	98	116 Å²	116	51%	0.513	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-74.9	-27.5	-178.1	-80.3	161.7	0	0	0	113.3	L1570 R1575	L1570-L1573 PolarHBondContact O-N 3.33Å; L1573-R1575 VanDerWaalsContact C-N 3.3Å; L1573-R1575 PolarHBondContact O-N 2.98Å
1574	Q	42.7	Very low	44.6	Very low	146 Å²	146	115.9 Å²	115.9	68%	0.682	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-69.8	-22.8	-178.8	-69.6	-167.1	-0.1	0	0	114	H1576 G1577	Q1574-H1576 PolarHBondContact O-N 2.96Å; Q1574-G1577 PolarHBondContact O-N 2.8Å
1575	R	42.8	Very low	44.7	Very low	216 Å²	216	110.9 Å²	110.9	82%	0.815	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-71.4	-12.4	-177.8	-66	-173.5	-170.9	165.2	5.3	114.6	L1573	L1573-R1575 VanDerWaalsContact C-N 3.3Å; L1573-R1575 PolarHBondContact O-N 2.98Å
1576	H	40.9	Very low	45.1	Very low	170 Å²	170	104.9 Å²	104.9	79%	0.787	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-105.3	11	178	-76.2	-43.8	0	0	0	115	Q1574 T1578	Q1574-H1576 PolarHBondContact O-N 2.96Å; H1576-T1578 VanDerWaalsContact C-N 3.33Å; H1576-T1578 PolarHBondContact O-N 2.89Å
1577	G	32.8	Very low	45.6	Very low	74 Å²	74	105.8 Å²	105.8	76%	0.763	56%	0.557	S	S	*	*			trans	71.4	14.8	159.2	0	0	0	0	0	117	Q1574	Q1574-G1577 PolarHBondContact O-N 2.8Å
1578	T	37.1	Very low	46.2	Very low	73 Å²	73	100.9 Å²	100.9	45%	0.448	53%	0.53	S	S	.	.			trans	-96.9	109.8	-178.9	41.3	0	0	0	0	112.2	H1576	H1576-T1578 VanDerWaalsContact C-N 3.33Å; H1576-T1578 PolarHBondContact O-N 2.89Å
1579	K	39.3	Very low	46.9	Very low	195 Å²	195	98.2 Å²	98.2	85%	0.848	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-76.7	127.4	159.4	-79.2	-177	175.4	178.9	0	108.5
1580	W	44.4	Very low	47.7	Very low	129 Å²	129	98.4 Å²	98.4	49%	0.489	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-55.1	125.7	164.1	-74.9	75	0	0	0	108.6	Y426	Y426-W1580 AromaticContact CD1-CH2 3.66Å; Y426-W1580 HydrophobicContact CD1-CH2 3.66Å; Y426-W1580 AromaticContact CD1-CZ3 3.94Å; Y426-W1580 HydrophobicContact CD1-CZ3 3.94Å; Y426-W1580 HydrophobicContact CE1-CE3 4.09Å; Y426-W1580 AromaticContact CE1-CH2 3.52Å; Y426-W1580 HydrophobicContact CE1-CH2 3.52Å; Y426-W1580 HydrophobicContact CE1-CZ2 4.4Å; Y426-W1580 AromaticContact CE1-CZ3 3.34Å; Y426-W1580 HydrophobicContact CE1-CZ3 3.34Å
1581	P	45.2	Very low	48.4	Very low	39 Å²	39	95.8 Å²	95.8	25%	0.253	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-66.1	133	-178.5	26	-32.9	0	0	0	109.4	L1583	P1581-L1583 PolarHBondContact O-N 3.29Å; P1581-L1583 VanDerWaalsContact O-N 3.08Å
1582	P	49.7	Very low	49	Very low	116 Å²	116	91.2 Å²	91.2	75%	0.753	47%	0.471	S	S	*	.			trans	-64.2	115	171	27	-32.3	0	0	0	108	N1584	P1582-N1584 VanDerWaalsContact C-N 3.35Å; P1582-N1584 PolarHBondContact O-N 3.37Å
1583	L	52	Low	49.7	Very low	103 Å²	103	90.5 Å²	90.5	54%	0.539	46%	0.464	S	S	.	.			trans	-68.6	96	176	-150.7	117.6	0	0	0	107.3	P1581 S1585 L1588	P1581-L1583 PolarHBondContact O-N 3.29Å; P1581-L1583 VanDerWaalsContact O-N 3.08Å; L1583-S1585 PolarHBondContact O-N 3.25Å; L1583-L1588 HydrophobicContact CD2-CD2 4.04Å
1584	N	56.2	Low	50.5	Low	78 Å²	78	87.6 Å²	87.6	42%	0.417	45%	0.448	S	S	.	.			trans	-71.4	94.2	-173.3	-168.1	-4.8	0	0	0	109.4	P1582 T1586 I1587 L1588	P1582-N1584 VanDerWaalsContact C-N 3.35Å; P1582-N1584 PolarHBondContact O-N 3.37Å; N1584-T1586 PolarHBondContact O-N 3.27Å; N1584-T1586 PolarHBondContact OD1-OG1 2.93Å; N1584-I1587 HydrophobicContact CB-CB 4.4Å; N1584-I1587 HydrophobicContact CB-CD1 4.02Å; N1584-I1587 HydrophobicContact CB-CG1 4.12Å; N1584-I1587 WeakPolarHBondContact ND2-CD1 3.05Å; N1584-I1587 WeakPolarHBondContact O-CB 3.04Å; N1584-I1587 PolarHBondContact O-N 2.67Å; N1584-L1588 PolarHBondContact O-N 3.08Å
1585	S	54.9	Low	51.2	Low	23 Å²	23	82 Å²	82	16%	0.161	42%	0.422	C	S	.	.	H	α-helix	trans	-52.9	-38.3	-174.4	52.5	0	0	0	0	112	L1583 I1587 L1588 A1589	L1583-S1585 PolarHBondContact O-N 3.25Å; S1585-I1587 VanDerWaalsContact C-N 3.3Å; S1585-I1587 PolarHBondContact O-N 3.04Å; S1585-L1588 PolarHBondContact O-N 3.23Å; S1585-A1589 VanDerWaalsContact O-CB 3.22Å; S1585-A1589 WeakPolarHBondContact O-CB 3.31Å; S1585-A1589 PolarHBondContact O-N 3.48Å
1586	T	56.3	Low	52	Low	63 Å²	63	73.5 Å²	73.5	39%	0.387	40%	0.396	S	S	.	.	H	α-helix	trans	-56.9	-39.2	175.4	66.8	0	0	0	0	113.5	E1549 N1584 K1590	E1549-T1586 VanDerWaalsContact OE1-CA 3.23Å; E1549-T1586 WeakPolarHBondContact OE1-CA 3.2Å; E1549-T1586 WeakPolarHBondContact OE1-CG2 3.36Å; N1584-T1586 PolarHBondContact O-N 3.27Å; N1584-T1586 PolarHBondContact OD1-OG1 2.93Å; T1586-K1590 WeakPolarHBondContact O-CB 3.48Å; T1586-K1590 PolarHBondContact O-N 2.91Å
1587	I	57.8	Low	53.1	Low	57 Å²	57	66 Å²	66	29%	0.292	36%	0.362	S	S	.	.	H	α-helix	trans	-75.4	-43.9	-178.1	-63	-176.4	0	0	0	110.2	V411 L415 N1584 S1585 K1590 L1591	V411-I1587 HydrophobicContact CG1-CG2 3.19Å; L415-I1587 HydrophobicContact CD1-CG2 3.88Å; N1584-I1587 HydrophobicContact CB-CB 4.4Å; N1584-I1587 HydrophobicContact CB-CD1 4.02Å; N1584-I1587 HydrophobicContact CB-CG1 4.12Å; N1584-I1587 WeakPolarHBondContact ND2-CD1 3.05Å; N1584-I1587 WeakPolarHBondContact O-CB 3.04Å; N1584-I1587 PolarHBondContact O-N 2.67Å; S1585-I1587 VanDerWaalsContact C-N 3.3Å; S1585-I1587 PolarHBondContact O-N 3.04Å; I1587-K1590 PolarHBondContact O-N 2.74Å; I1587-L1591 WeakPolarHBondContact O-CB 3.45Å; I1587-L1591 PolarHBondContact O-N 2.94Å
1588	L	57.7	Low	54.5	Low	44 Å²	44	66.8 Å²	66.8	23%	0.23	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-42.9	177.7	-170.8	69.6	0	0	0	111.3	F62 L1583 N1584 S1585 L1591 L1592	F62-L1588 HydrophobicContact CE1-CD2 4.07Å; F62-L1588 HydrophobicContact CZ-CD2 4.29Å; L1583-L1588 HydrophobicContact CD2-CD2 4.04Å; N1584-L1588 PolarHBondContact O-N 3.08Å; S1585-L1588 PolarHBondContact O-N 3.23Å; L1588-L1591 PolarHBondContact O-N 2.9Å; L1588-L1592 HydrophobicContact CG-CD1 4.16Å; L1588-L1592 WeakPolarHBondContact O-CB 3.29Å; L1588-L1592 VanDerWaalsContact O-CG 3.26Å; L1588-L1592 WeakPolarHBondContact O-CG 3.46Å; L1588-L1592 PolarHBondContact O-N 2.93Å
1589	A	57.6	Low	56.3	Low	9 Å²	9	64.7 Å²	64.7	7%	0.074	33%	0.33	C	S	.	.	H	α-helix	trans	-63.8	-40.4	176.2	0	0	0	0	0	112	I1545 L1548 E1549 S1585 L1592 N1593	I1545-A1589 HydrophobicContact CG2-CB 4.08Å; L1548-A1589 HydrophobicContact CD2-CB 4.49Å; E1549-A1589 HydrophobicContact CG-CB 4.27Å; S1585-A1589 VanDerWaalsContact O-CB 3.22Å; S1585-A1589 WeakPolarHBondContact O-CB 3.31Å; S1585-A1589 PolarHBondContact O-N 3.48Å; A1589-L1592 PolarHBondContact O-N 2.73Å; A1589-N1593 WeakPolarHBondContact O-CB 3.07Å; A1589-N1593 PolarHBondContact O-N 3.34Å; A1589-N1593 VanDerWaalsContact O-N 3.14Å
1590	K	57.6	Low	58	Low	132 Å²	132	55.5 Å²	55.5	57%	0.574	29%	0.29	S	S	*	.	H	α-helix	trans	-63.3	-47.8	175.4	-166.3	173.9	-176.4	-176.5	0	111.4	T1586 I1587 L1592 N1593 E1594	T1586-K1590 WeakPolarHBondContact O-CB 3.48Å; T1586-K1590 PolarHBondContact O-N 2.91Å; I1587-K1590 PolarHBondContact O-N 2.74Å; K1590-L1592 PolarHBondContact O-N 3.19Å; K1590-N1593 PolarHBondContact O-N 3.36Å; K1590-N1593 VanDerWaalsContact O-N 3.1Å; K1590-E1594 WeakPolarHBondContact O-CG 3.25Å; K1590-E1594 PolarHBondContact O-N 3.3Å
1591	L	60	Low	59.8	Low	34 Å²	34	49.5 Å²	49.5	18%	0.178	27%	0.267	C	S	.	.	H	α-helix	trans	-60.4	-44.8	176.8	-169.6	131.2	0	0	0	112.1	F412 I1587 L1588 N1593 E1594 M1595	F412-L1591 HydrophobicContact CB-CD1 3.97Å; F412-L1591 HydrophobicContact CD2-CD1 4.05Å; F412-L1591 HydrophobicContact CD2-CD2 4.43Å; I1587-L1591 WeakPolarHBondContact O-CB 3.45Å; I1587-L1591 PolarHBondContact O-N 2.94Å; L1588-L1591 PolarHBondContact O-N 2.9Å; L1591-N1593 PolarHBondContact O-N 2.93Å; L1591-E1594 PolarHBondContact O-N 3.33Å; L1591-M1595 WeakPolarHBondContact O-CG 3.27Å; L1591-M1595 PolarHBondContact O-N 2.91Å
1592	L	57.8	Low	61.5	Low	17 Å²	17	47.8 Å²	47.8	9%	0.089	26%	0.256	C	S	.	.	H	α-helix	trans	-62.7	-24.7	175.8	-73.5	169.4	0	0	0	113.8	I59 F62 R63 L1588 A1589 K1590	I59-L1592 HydrophobicContact CG2-CD2 3.73Å; F62-L1592 HydrophobicContact CD1-CD1 4.48Å; F62-L1592 HydrophobicContact CE1-CD1 4.44Å; R63-L1592 PolarHBondContact NH1-O 3.46Å; L1588-L1592 HydrophobicContact CG-CD1 4.16Å; L1588-L1592 WeakPolarHBondContact O-CB 3.29Å; L1588-L1592 VanDerWaalsContact O-CG 3.26Å; L1588-L1592 WeakPolarHBondContact O-CG 3.46Å; L1588-L1592 PolarHBondContact O-N 2.93Å; A1589-L1592 PolarHBondContact O-N 2.73Å; K1590-L1592 PolarHBondContact O-N 3.19Å
1593	N	58.8	Low	63.1	Low	84 Å²	84	42.3 Å²	42.3	45%	0.449	22%	0.22	S	C	.	.	H	α-helix	trans	-89.1	-12.8	179	-143.8	19.1	0	0	0	113.3	A1589 K1590 L1591	A1589-N1593 WeakPolarHBondContact O-CB 3.07Å; A1589-N1593 PolarHBondContact O-N 3.34Å; A1589-N1593 VanDerWaalsContact O-N 3.14Å; K1590-N1593 PolarHBondContact O-N 3.36Å; K1590-N1593 VanDerWaalsContact O-N 3.1Å; L1591-N1593 PolarHBondContact O-N 2.93Å
1594	E	58.4	Low	64.6	Low	38 Å²	38	37.8 Å²	37.8	18%	0.178	20%	0.196	C	C	.	.	H	α-helix	trans	-99.7	-13.8	-179.6	-66.5	-175.3	138.6	0	0	113.1	G20 K629 K1590 L1591 S1596	G20-E1594 WeakPolarHBondContact CA-O 3.37Å; K629-E1594 IonicContact NZ-OE1 3.82Å; K629-E1594 PolarHBondContact NZ-OE1 3.11Å; K1590-E1594 WeakPolarHBondContact O-CG 3.25Å; K1590-E1594 PolarHBondContact O-N 3.3Å; L1591-E1594 PolarHBondContact O-N 3.33Å; E1594-S1596 VanDerWaalsContact C-N 3.35Å; E1594-S1596 PolarHBondContact O-N 3.45Å
1595	M	57.9	Low	65.6	Low	28 Å²	28	34.1 Å²	34.1	14%	0.138	18%	0.176	C	C	.	.	S	Bend	trans	-72.2	-17.2	179.1	-67.6	-88.5	-63.5	0	0	114.9	F22 T23 I59 L1591	F22-M1595 HydrophobicContact CB-CE 4.17Å; F22-M1595 HydrophobicContact CB-SD 3.41Å; F22-M1595 WeakPolarHBondContact CB-SD 3.37Å; F22-M1595 HydrophobicContact CD1-CE 3.58Å; F22-M1595 HydrophobicContact CD1-SD 4Å; F22-M1595 HydrophobicContact CD2-SD 4.29Å; F22-M1595 HydrophobicContact CE1-CE 4.22Å; F22-M1595 HydrophobicContact CG-CE 3.84Å; F22-M1595 HydrophobicContact CG-SD 3.61Å; T23-M1595 PolarHBondContact OG1-O 3.42Å; I59-M1595 HydrophobicContact CD1-CE 3.46Å; I59-M1595 VanDerWaalsContact CD1-CE 3.46Å; L1591-M1595 WeakPolarHBondContact O-CG 3.27Å; L1591-M1595 PolarHBondContact O-N 2.91Å
1596	S	60.1	Low	66.6	Low	37 Å²	37	33.7 Å²	33.7	26%	0.259	17%	0.172	S	C	.	.	S	Bend	trans	-158.8	117.1	172.6	40.3	0	0	0	0	112.1	E1594	E1594-S1596 VanDerWaalsContact C-N 3.35Å; E1594-S1596 PolarHBondContact O-N 3.45Å
1597	P	63.9	Low	67.5	Low	14 Å²	14	31.3 Å²	31.3	9%	0.091	16%	0.157	C	C	.	.			trans	-69	153.1	171.4	26.3	-30	0	0	0	111.3	S19 T1482	S19-P1597 WeakPolarHBondContact O-CD 3.45Å; T1482-P1597 PolarHBondContact OG1-O 3.25Å
1598	K	62.4	Low	68.1	Low	90 Å²	90	29 Å²	29	39%	0.391	15%	0.145	S	C	.	.	S	Bend	trans	-69.5	-37.4	-178.1	-173.4	179.9	-177.9	-176.6	0	112.8	D1481 T1482	D1481-K1598 WeakPolarHBondContact CA-O 3.17Å; T1482-K1598 PolarHBondContact N-O 3.43Å; T1482-K1598 PolarHBondContact OG1-O 3.46Å
1599	H	74.2	Confident	68.7	Low	28 Å²	28	26.9 Å²	26.9	13%	0.13	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.4	-174.1	-57.5	-59.8	0	0	0	110.2	V630 G631 F1365 D1481	V630-H1599 WeakPolarHBondContact CA-O 3.44Å; G631-H1599 PolarHBondContact N-O 3.13Å; F1365-H1599 HydrophobicContact CD1-CB 4.07Å; F1365-H1599 AromaticContact CD1-CG 3.93Å; F1365-H1599 AromaticContact CD1-ND1 3.92Å; F1365-H1599 HydrophobicContact CD2-CB 4.36Å; F1365-H1599 AromaticContact CD2-CD2 3.94Å; F1365-H1599 HydrophobicContact CE1-CB 3.59Å; F1365-H1599 AromaticContact CE1-CG 3.98Å; F1365-H1599 HydrophobicContact CE2-CB 3.89Å; F1365-H1599 HydrophobicContact CG-CB 4.45Å; F1365-H1599 AromaticContact CG-CG 4Å; F1365-H1599 HydrophobicContact CZ-CB 3.5Å; F1365-H1599 VanDerWaalsContact CZ-CB 3.5Å; D1481-H1599 IonicContact OD1-CE1 3.35Å; D1481-H1599 IonicContact OD1-CG 3.02Å; D1481-H1599 IonicContact OD1-ND1 3.93Å; D1481-H1599 PolarHBondContact OD1-ND1 3.29Å; D1481-H1599 IonicContact OD2-CE1 3.56Å; D1481-H1599 IonicContact OD2-ND1 2.66Å
1600	N	76	Confident	69.5	Low	3 Å²	3	27.8 Å²	27.8	2%	0.016	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	154.5	-177.1	-59.7	-59.2	0	0	0	113	G631 F633 F1479 F1480 T1482	G631-N1600 CarbonylContact O-C 3.47Å; G631-N1600 VanDerWaalsContact O-CA 3.26Å; G631-N1600 WeakPolarHBondContact O-CA 3.24Å; F633-N1600 HydrophobicContact CD2-CB 4.29Å; F633-N1600 HydrophobicContact CE2-CB 4.23Å; F1479-N1600 WeakPolarHBondContact CA-O 3.46Å; F1480-N1600 HydrophobicContact CD1-CB 4.11Å; F1480-N1600 HydrophobicContact CD2-CB 4.18Å; F1480-N1600 HydrophobicContact CE1-CB 3.54Å; F1480-N1600 HydrophobicContact CE2-CB 3.67Å; F1480-N1600 HydrophobicContact CG-CB 4.38Å; F1480-N1600 HydrophobicContact CZ-CB 3.32Å; F1480-N1600 PolarHBondContact N-O 2.81Å; F1480-N1600 PolarHBondContact O-N 3.4Å; T1482-N1600 PolarHBondContact OG1-ND2 3.02Å
1601	V	81.3	Confident	70.5	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.012	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	120.2	171.1	-169.3	0	0	0	0	109.4	V630 G631 V632 F633 F1477 D1478 F1479 L1620	V630-V1601 HydrophobicContact CG1-CG2 3.81Å; G631-V1601 PolarHBondContact O-N 3.23Å; V632-V1601 WeakPolarHBondContact CA-O 3.25Å; F633-V1601 PolarHBondContact N-O 2.92Å; F1477-V1601 HydrophobicContact CD1-CG1 4.39Å; D1478-V1601 CarbonylContact O-C 3.59Å; D1478-V1601 WeakPolarHBondContact O-CA 3.43Å; F1479-V1601 HydrophobicContact CD1-CB 4.37Å; F1479-V1601 HydrophobicContact CD1-CG1 4.15Å; F1479-V1601 HydrophobicContact CD1-CG2 3.52Å; F1479-V1601 HydrophobicContact CE1-CG1 4.08Å; F1479-V1601 HydrophobicContact CE1-CG2 3.67Å; F1479-V1601 HydrophobicContact CG-CG1 4.46Å; F1479-V1601 HydrophobicContact CG-CG2 4.41Å; F1479-V1601 HydrophobicContact CZ-CG1 4.35Å; V1601-L1620 HydrophobicContact CB-CD2 4.22Å; V1601-L1620 HydrophobicContact CG1-CD1 4.12Å; V1601-L1620 HydrophobicContact CG1-CD2 4.05Å
1602	K	80.9	Confident	71.3	Confident	4 Å²	4	20.3 Å²	20.3	2%	0.017	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	112.2	171.2	-179.4	-176.2	-62.9	-177	0	108.4	D43 D45 F633 Q635 D1478 F1480 W1604	D43-K1602 PolarHBondContact O-NZ 2.75Å; D45-K1602 PolarHBondContact O-NZ 2.96Å; F633-K1602 CarbonylContact O-C 3.43Å; F633-K1602 WeakPolarHBondContact O-CA 3.37Å; Q635-K1602 HydrophobicContact CB-CD 3.97Å; Q635-K1602 HydrophobicContact CB-CG 3.63Å; Q635-K1602 HydrophobicContact CG-CD 4.15Å; Q635-K1602 HydrophobicContact CG-CG 4.35Å; D1478-K1602 HydrophobicContact CB-CB 4.15Å; D1478-K1602 PolarHBondContact N-O 2.73Å; D1478-K1602 PolarHBondContact O-N 2.89Å; F1480-K1602 HydrophobicContact CD1-CB 4.48Å; F1480-K1602 HydrophobicContact CE1-CB 3.79Å; K1602-W1604 HydrophobicContact CD-CZ2 4.04Å; K1602-W1604 PolarHBondContact O-N 2.8Å
1603	V	83.7	Confident	72.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	103	176	-177.5	0	0	0	0	108.2	V632 F633 Q635 F1477 F1616 M1617 L1620	V632-V1603 HydrophobicContact CG1-CG2 4.05Å; F633-V1603 PolarHBondContact O-N 2.68Å; Q635-V1603 PolarHBondContact N-O 3.49Å; F1477-V1603 HydrophobicContact CD1-CG2 4.16Å; F1477-V1603 HydrophobicContact CE1-CG1 4.2Å; F1477-V1603 HydrophobicContact CE1-CG2 4.13Å; V1603-F1616 HydrophobicContact CG1-CB 4.1Å; V1603-M1617 HydrophobicContact CG2-SD 4.44Å; V1603-L1620 HydrophobicContact CG2-CD2 3.73Å
1604	W	82.7	Confident	73.6	Confident	8 Å²	8	15.7 Å²	15.7	3%	0.03	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	120.8	172.2	-66.4	79.9	0	0	0	109.8	Q635 F637 I1455 I1459 T1475 V1476 K1602	Q635-W1604 HydrophobicContact CB-CD2 4.09Å; Q635-W1604 HydrophobicContact CB-CE3 4.28Å; Q635-W1604 HydrophobicContact CB-CG 4.31Å; Q635-W1604 HydrophobicContact CG-CD2 3.51Å; Q635-W1604 HydrophobicContact CG-CE3 3.32Å; Q635-W1604 HydrophobicContact CG-CG 4.23Å; Q635-W1604 HydrophobicContact CG-CH2 3.8Å; Q635-W1604 HydrophobicContact CG-CZ2 3.97Å; Q635-W1604 HydrophobicContact CG-CZ3 3.46Å; Q635-W1604 VanDerWaalsContact CG-CZ3 3.46Å; Q635-W1604 CarbonylContact O-C 3.28Å; Q635-W1604 WeakPolarHBondContact O-CA 3.33Å; F637-W1604 HydrophobicContact CD1-CB 4.07Å; F637-W1604 HydrophobicContact CE1-CB 3.66Å; I1455-W1604 HydrophobicContact CB-CZ2 4.46Å; I1455-W1604 HydrophobicContact CG2-CD2 4.27Å; I1455-W1604 HydrophobicContact CG2-CZ2 4.27Å; I1459-W1604 HydrophobicContact CD1-CD2 4.48Å; I1459-W1604 HydrophobicContact CD1-CE3 3.96Å; I1459-W1604 HydrophobicContact CD1-CZ3 4.42Å; T1475-W1604 WeakPolarHBondContact CA-O 3.21Å; T1475-W1604 VanDerWaalsContact CB-O 3.23Å; T1475-W1604 WeakPolarHBondContact CB-O 3.18Å; T1475-W1604 WeakPolarHBondContact CG2-O 3.35Å; V1476-W1604 HydrophobicContact CB-CB 3.91Å; V1476-W1604 HydrophobicContact CB-CG 4.04Å; V1476-W1604 HydrophobicContact CG2-CB 4.4Å; V1476-W1604 PolarHBondContact N-O 2.75Å; V1476-W1604 WeakPolarHBondContact O-CB 3.4Å; V1476-W1604 PolarHBondContact O-N 3.27Å; K1602-W1604 HydrophobicContact CD-CZ2 4.04Å; K1602-W1604 PolarHBondContact O-N 2.8Å
1605	Y	78.6	Confident	74.6	Confident	2 Å²	2	14 Å²	14	1%	0.008	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	150.2	-178.6	76.4	-80.4	0	0	0	112.6	L601 I604 A634 Q635 Q636 F637 N1607 S1612 L1613	L601-Y1605 WeakPolarHBondContact CD2-OH 3.32Å; I604-Y1605 HydrophobicContact CD1-CE1 4.32Å; I604-Y1605 WeakPolarHBondContact CD1-OH 3.45Å; A634-Y1605 HydrophobicContact CB-CD1 4.38Å; A634-Y1605 HydrophobicContact CB-CE1 3.97Å; Q635-Y1605 WeakPolarHBondContact O-CD1 3.42Å; Q635-Y1605 PolarHBondContact O-N 2.89Å; Q636-Y1605 HydrophobicContact CG-CE1 3.78Å; Q636-Y1605 HydrophobicContact CG-CE2 4.1Å; Q636-Y1605 VanDerWaalsContact CG-CZ 3.43Å; Q636-Y1605 WeakPolarHBondContact CG-OH 3.31Å; F637-Y1605 VanDerWaalsContact CD1-C 3.42Å; F637-Y1605 WeakPolarHBondContact CD1-O 3.48Å; F637-Y1605 PolarHBondContact N-O 3.49Å; Y1605-N1607 HydrophobicContact CD2-CB 4.43Å; Y1605-N1607 HydrophobicContact CE2-CB 3.85Å; Y1605-S1612 WeakPolarHBondContact CD2-OG 3.4Å; Y1605-L1613 HydrophobicContact CD1-CB 4.46Å; Y1605-L1613 HydrophobicContact CD1-CD1 3.85Å; Y1605-L1613 HydrophobicContact CD2-CB 3.85Å; Y1605-L1613 HydrophobicContact CE1-CD1 4.13Å; Y1605-L1613 HydrophobicContact CE1-CD2 4.42Å; Y1605-L1613 HydrophobicContact CE2-CB 4.03Å; Y1605-L1613 HydrophobicContact CG-CB 4.08Å; Y1605-L1613 HydrophobicContact CG-CD1 4.18Å
1606	N	75.5	Confident	75.6	Confident	14 Å²	14	12.9 Å²	12.9	8%	0.075	7%	0.065	C	C	.	.			trans	-98.7	114.7	170.9	-177.6	-6	0	0	0	111	F637 W1473 Q1608 G1609 S1612	F637-N1606 HydrophobicContact CB-CB 4.35Å; F637-N1606 HydrophobicContact CD2-CB 4.05Å; F637-N1606 HydrophobicContact CG-CB 4.09Å; W1473-N1606 HydrophobicContact CB-CB 4.19Å; W1473-N1606 HydrophobicContact CD2-CB 4.38Å; W1473-N1606 HydrophobicContact CE3-CB 4.35Å; W1473-N1606 HydrophobicContact CG-CB 4.26Å; W1473-N1606 WeakPolarHBondContact CZ3-ND2 3.47Å; N1606-Q1608 PolarHBondContact ND2-OE1 3.3Å; N1606-Q1608 PolarHBondContact O-N 3.06Å; N1606-Q1608 WeakPolarHBondContact OD1-CB 3.26Å; N1606-Q1608 PolarHBondContact OD1-N 3.32Å; N1606-Q1608 PolarHBondContact OD1-OE1 3.04Å; N1606-Q1608 VanDerWaalsContact OD1-OE1 3.1Å; N1606-G1609 PolarHBondContact O-N 2.66Å; N1606-S1612 VanDerWaalsContact O-CB 3.3Å; N1606-S1612 WeakPolarHBondContact O-CB 3.47Å; N1606-S1612 PolarHBondContact O-OG 2.9Å
1607	N	75.1	Confident	76.7	Confident	12 Å²	12	11.2 Å²	11.2	6%	0.064	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-8	-177.9	-158.6	47.8	0	0	0	115.5	R594 D600 L601 Y1605 G1609	R594-N1607 HydrophobicContact CB-CB 4.29Å; R594-N1607 WeakPolarHBondContact CD-O 3.45Å; R594-N1607 PolarHBondContact NH1-O 3.29Å; R594-N1607 PolarHBondContact O-ND2 3.01Å; D600-N1607 PolarHBondContact O-ND2 2.69Å; L601-N1607 HydrophobicContact CD2-CB 4.29Å; L601-N1607 VanDerWaalsContact CD2-ND2 3.27Å; L601-N1607 WeakPolarHBondContact CD2-ND2 3.39Å; Y1605-N1607 HydrophobicContact CD2-CB 4.43Å; Y1605-N1607 HydrophobicContact CE2-CB 3.85Å; N1607-G1609 CarbonylContact O-C 3.56Å; N1607-G1609 PolarHBondContact O-N 3.23Å
1608	Q	69.4	Low	77.7	Confident	8 Å²	8	10.6 Å²	10.6	4%	0.037	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-23	173.3	-70.7	161.6	-40.9	0	0	112.7	D579 W589 Q592 N1606	D579-Q1608 PolarHBondContact N-O 3.5Å; W589-Q1608 HydrophobicContact CH2-CG 4.5Å; W589-Q1608 HydrophobicContact CZ2-CB 3.85Å; W589-Q1608 HydrophobicContact CZ2-CG 4.04Å; Q592-Q1608 PolarHBondContact O-NE2 2.77Å; N1606-Q1608 PolarHBondContact ND2-OE1 3.3Å; N1606-Q1608 PolarHBondContact O-N 3.06Å; N1606-Q1608 WeakPolarHBondContact OD1-CB 3.26Å; N1606-Q1608 PolarHBondContact OD1-N 3.32Å; N1606-Q1608 PolarHBondContact OD1-OE1 3.04Å; N1606-Q1608 VanDerWaalsContact OD1-OE1 3.1Å
1609	G	70.1	Confident	78.5	Confident	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.032	C	C	.	.	B	Isolated β-bridge	trans	-84.8	112.1	157.2	0	0	0	0	0	109.5	Y1323 N1606 N1607 V1611 S1612	Y1323-G1609 WeakPolarHBondContact OH-CA 3.45Å; N1606-G1609 PolarHBondContact O-N 2.66Å; N1607-G1609 CarbonylContact O-C 3.56Å; N1607-G1609 PolarHBondContact O-N 3.23Å; G1609-V1611 PolarHBondContact O-N 2.78Å; G1609-V1611 VanDerWaalsContact O-N 3.12Å; G1609-S1612 WeakPolarHBondContact O-CB 3.41Å; G1609-S1612 PolarHBondContact O-N 2.86Å; G1609-S1612 PolarHBondContact O-OG 2.87Å
1610	W	74.8	Confident	78.9	Confident	29 Å²	29	5.6 Å²	5.6	11%	0.11	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.4	-174.7	-63.4	11.3	0	0	0	111.8	D572 K573 Q576 I577 D579 Y603	D572-W1610 HydrophobicContact CB-CB 4.33Å; D572-W1610 HydrophobicContact CB-CD2 4.48Å; D572-W1610 HydrophobicContact CB-CE3 3.87Å; K573-W1610 HydrophobicContact CB-CZ3 4.21Å; Q576-W1610 HydrophobicContact CB-CE3 3.9Å; Q576-W1610 HydrophobicContact CB-CH2 3.67Å; Q576-W1610 HydrophobicContact CB-CZ2 4.28Å; Q576-W1610 HydrophobicContact CB-CZ3 3.45Å; Q576-W1610 VanDerWaalsContact CB-CZ3 3.45Å; Q576-W1610 HydrophobicContact CG-CH2 4.47Å; I577-W1610 PolarHBondContact O-N 2.95Å; D579-W1610 PolarHBondContact OD1-NE1 3.47Å; Y603-W1610 WeakPolarHBondContact CD2-O 3.25Å; Y603-W1610 WeakPolarHBondContact CE2-O 3.3Å
1611	V	78.5	Confident	79.4	Confident	5 Å²	5	5.9 Å²	5.9	3%	0.03	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	12.9	-178.2	-56.7	0	0	0	0	114.6	I577 Y603 L1316 F1318 Y1323 G1609 S1615	I577-V1611 HydrophobicContact CG2-CG2 3.58Å; Y603-V1611 HydrophobicContact CE2-CG1 4.27Å; L1316-V1611 HydrophobicContact CD2-CG1 3.71Å; F1318-V1611 HydrophobicContact CD1-CB 3.96Å; F1318-V1611 HydrophobicContact CD1-CG1 4.42Å; F1318-V1611 HydrophobicContact CE1-CB 3.69Å; F1318-V1611 HydrophobicContact CE1-CG1 3.78Å; Y1323-V1611 HydrophobicContact CD2-CG2 3.99Å; G1609-V1611 PolarHBondContact O-N 2.78Å; G1609-V1611 VanDerWaalsContact O-N 3.12Å; V1611-S1615 VanDerWaalsContact O-CB 3.31Å; V1611-S1615 WeakPolarHBondContact O-CB 3.47Å; V1611-S1615 PolarHBondContact O-N 2.94Å; V1611-S1615 PolarHBondContact O-OG 2.73Å
1612	S	76.7	Confident	79.5	Confident	3 Å²	3	5.8 Å²	5.8	2%	0.021	3%	0.029	C	C	.	.	H	α-helix	trans	-55.5	-63.1	-176.4	53.6	0	0	0	0	111.2	Y1605 N1606 G1609 S1615 F1616	Y1605-S1612 WeakPolarHBondContact CD2-OG 3.4Å; N1606-S1612 VanDerWaalsContact O-CB 3.3Å; N1606-S1612 WeakPolarHBondContact O-CB 3.47Å; N1606-S1612 PolarHBondContact O-OG 2.9Å; G1609-S1612 WeakPolarHBondContact O-CB 3.41Å; G1609-S1612 PolarHBondContact O-N 2.86Å; G1609-S1612 PolarHBondContact O-OG 2.87Å; S1612-S1615 WeakPolarHBondContact O-CB 3.36Å; S1612-S1615 PolarHBondContact O-N 3.35Å; S1612-S1615 VanDerWaalsContact O-N 3.13Å; S1612-F1616 WeakPolarHBondContact O-CD2 3.48Å; S1612-F1616 PolarHBondContact O-N 2.75Å
1613	L	82.5	Confident	79.5	Confident	4 Å²	4	5.8 Å²	5.8	2%	0.021	3%	0.03	C	C	.	.	H	α-helix	trans	-51.6	-57.8	-177.9	178.3	66.6	0	0	0	114	M16 I604 A634 Y1605 S1615 F1616 M1617	M16-L1613 HydrophobicContact CE-CD2 4.15Å; I604-L1613 HydrophobicContact CD1-CD2 3.6Å; I604-L1613 HydrophobicContact CG1-CD2 3.25Å; A634-L1613 HydrophobicContact CB-CD1 3.72Å; A634-L1613 HydrophobicContact CB-CD2 4.34Å; Y1605-L1613 HydrophobicContact CD1-CB 4.46Å; Y1605-L1613 HydrophobicContact CD1-CD1 3.85Å; Y1605-L1613 HydrophobicContact CD2-CB 3.85Å; Y1605-L1613 HydrophobicContact CE1-CD1 4.13Å; Y1605-L1613 HydrophobicContact CE1-CD2 4.42Å; Y1605-L1613 HydrophobicContact CE2-CB 4.03Å; Y1605-L1613 HydrophobicContact CG-CB 4.08Å; Y1605-L1613 HydrophobicContact CG-CD1 4.18Å; L1613-S1615 PolarHBondContact O-N 3.07Å; L1613-F1616 PolarHBondContact O-N 3.44Å; L1613-F1616 VanDerWaalsContact O-N 3.11Å; L1613-M1617 HydrophobicContact CD1-CG 3.97Å; L1613-M1617 HydrophobicContact CG-CG 4.27Å; L1613-M1617 WeakPolarHBondContact O-CB 3.35Å; L1613-M1617 WeakPolarHBondContact O-CG 3.41Å; L1613-M1617 PolarHBondContact O-N 3.35Å
1614	P	82.9	Confident	79.5	Confident	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-62	-28.6	-178.8	22.9	-33.8	0	0	0	113.1	Y603 F608 Q612 F1318 S1618	Y603-P1614 HydrophobicContact CD1-CG 4.13Å; Y603-P1614 HydrophobicContact CD2-CG 4.39Å; Y603-P1614 HydrophobicContact CE1-CG 4.33Å; Y603-P1614 HydrophobicContact CG-CG 4.17Å; F608-P1614 HydrophobicContact CE1-CB 4.4Å; Q612-P1614 PolarHBondContact NE2-O 3.32Å; Q612-P1614 VanDerWaalsContact OE1-CB 3.29Å; F1318-P1614 HydrophobicContact CD1-CB 4.14Å; F1318-P1614 HydrophobicContact CD1-CG 3.98Å; F1318-P1614 HydrophobicContact CD2-CB 4.14Å; F1318-P1614 HydrophobicContact CE1-CB 3.94Å; F1318-P1614 HydrophobicContact CE1-CG 3.53Å; F1318-P1614 HydrophobicContact CE2-CB 3.93Å; F1318-P1614 HydrophobicContact CE2-CG 4.36Å; F1318-P1614 HydrophobicContact CG-CB 4.22Å; F1318-P1614 HydrophobicContact CZ-CB 3.8Å; F1318-P1614 HydrophobicContact CZ-CG 3.72Å; P1614-S1618 WeakPolarHBondContact O-CB 3.31Å; P1614-S1618 PolarHBondContact O-N 2.85Å
1615	S	78.5	Confident	79.6	Confident	3 Å²	3	7.4 Å²	7.4	2%	0.021	4%	0.036	C	C	.	.	H	α-helix	trans	-69.8	-40.5	174.3	-57.7	0	0	0	0	112.9	V1611 S1612 L1613 A1619	V1611-S1615 VanDerWaalsContact O-CB 3.31Å; V1611-S1615 WeakPolarHBondContact O-CB 3.47Å; V1611-S1615 PolarHBondContact O-N 2.94Å; V1611-S1615 PolarHBondContact O-OG 2.73Å; S1612-S1615 WeakPolarHBondContact O-CB 3.36Å; S1612-S1615 PolarHBondContact O-N 3.35Å; S1612-S1615 VanDerWaalsContact O-N 3.13Å; L1613-S1615 PolarHBondContact O-N 3.07Å; S1615-A1619 PolarHBondContact O-N 3.28Å; S1615-A1619 VanDerWaalsContact O-N 3.12Å
1616	F	80.4	Confident	79.9	Confident	5 Å²	5	7.5 Å²	7.5	2%	0.022	4%	0.036	C	C	.	.	H	α-helix	trans	-82	-27.1	178.4	-65.9	-67.8	0	0	0	113.3	P1320 Y1324 T1475 V1603 S1612 L1613 A1619 L1620	P1320-F1616 HydrophobicContact CB-CD1 4.43Å; P1320-F1616 HydrophobicContact CB-CE1 3.93Å; P1320-F1616 HydrophobicContact CB-CZ 4.49Å; P1320-F1616 HydrophobicContact CG-CD1 4.16Å; P1320-F1616 HydrophobicContact CG-CE1 4.17Å; Y1324-F1616 HydrophobicContact CE2-CZ 4.48Å; T1475-F1616 HydrophobicContact CG2-CB 4.46Å; T1475-F1616 HydrophobicContact CG2-CD1 3.86Å; T1475-F1616 HydrophobicContact CG2-CD2 3.3Å; T1475-F1616 HydrophobicContact CG2-CE1 3.83Å; T1475-F1616 HydrophobicContact CG2-CE2 3.3Å; T1475-F1616 HydrophobicContact CG2-CG 3.61Å; T1475-F1616 HydrophobicContact CG2-CZ 3.57Å; T1475-F1616 WeakPolarHBondContact OG1-CD1 3.36Å; T1475-F1616 WeakPolarHBondContact OG1-CE1 3.4Å; V1603-F1616 HydrophobicContact CG1-CB 4.1Å; S1612-F1616 WeakPolarHBondContact O-CD2 3.48Å; S1612-F1616 PolarHBondContact O-N 2.75Å; L1613-F1616 PolarHBondContact O-N 3.44Å; L1613-F1616 VanDerWaalsContact O-N 3.11Å; F1616-A1619 WeakPolarHBondContact O-CB 3.31Å; F1616-A1619 PolarHBondContact O-N 3.44Å; F1616-L1620 PolarHBondContact O-N 3.42Å
1617	M	83.5	Confident	80.1	Confident	1 Å²	1	7.4 Å²	7.4	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-59.1	-48.3	163.9	-73.9	-62.3	-63.2	0	0	110.4	M16 D613 V632 V1603 L1613 A1619 L1620 S1621	M16-M1617 HydrophobicContact CG-CE 4.24Å; D613-M1617 HydrophobicContact CB-CE 3.94Å; V632-M1617 HydrophobicContact CB-CE 4.45Å; V632-M1617 HydrophobicContact CG1-CE 3.88Å; V632-M1617 HydrophobicContact CG1-SD 3.7Å; V1603-M1617 HydrophobicContact CG2-SD 4.44Å; L1613-M1617 HydrophobicContact CD1-CG 3.97Å; L1613-M1617 HydrophobicContact CG-CG 4.27Å; L1613-M1617 WeakPolarHBondContact O-CB 3.35Å; L1613-M1617 WeakPolarHBondContact O-CG 3.41Å; L1613-M1617 PolarHBondContact O-N 3.35Å; M1617-A1619 VanDerWaalsContact C-N 3.29Å; M1617-A1619 PolarHBondContact O-N 3.09Å; M1617-L1620 PolarHBondContact O-N 2.97Å; M1617-L1620 VanDerWaalsContact O-N 3.12Å; M1617-S1621 PolarHBondContact O-N 3.05Å; M1617-S1621 PolarHBondContact O-OG 2.8Å; M1617-S1621 VanDerWaalsContact O-OG 3.1Å
1618	S	83.5	Confident	80.4	Confident	2 Å²	2	9 Å²	9	1%	0.014	5%	0.045	C	C	.	.	H	α-helix	trans	-60.8	-37.2	176	-171.2	0	0	0	0	112.2	P1614 S1621 N1622	P1614-S1618 WeakPolarHBondContact O-CB 3.31Å; P1614-S1618 PolarHBondContact O-N 2.85Å; S1618-S1621 PolarHBondContact O-N 2.93Å; S1618-N1622 WeakPolarHBondContact O-CB 3.47Å; S1618-N1622 PolarHBondContact O-N 3.26Å; S1618-N1622 PolarHBondContact O-ND2 3.05Å
1619	A	78.9	Confident	81	Confident	4 Å²	4	8.9 Å²	8.9	3%	0.033	4%	0.044	C	C	.	.	H	α-helix	trans	-61	-45.8	173.2	0	0	0	0	0	112.4	P1320 L1378 F1477 S1615 F1616 M1617 N1622 A1623	P1320-A1619 HydrophobicContact CG-CB 3.93Å; L1378-A1619 WeakPolarHBondContact O-CB 3.46Å; F1477-A1619 HydrophobicContact CZ-CB 4.48Å; S1615-A1619 PolarHBondContact O-N 3.28Å; S1615-A1619 VanDerWaalsContact O-N 3.12Å; F1616-A1619 WeakPolarHBondContact O-CB 3.31Å; F1616-A1619 PolarHBondContact O-N 3.44Å; M1617-A1619 VanDerWaalsContact C-N 3.29Å; M1617-A1619 PolarHBondContact O-N 3.09Å; A1619-N1622 PolarHBondContact O-N 3.14Å; A1619-A1623 PolarHBondContact O-N 2.8Å
1620	L	83.5	Confident	81.4	Confident	9 Å²	9	12.1 Å²	12.1	5%	0.047	7%	0.065	C	C	.	.	H	α-helix	trans	-64.2	-43.5	177.2	-177	61.3	0	0	0	112	V632 M1373 F1477 V1601 V1603 F1616 M1617 N1622 A1623 R1624	V632-L1620 HydrophobicContact CG1-CD2 3.91Å; V632-L1620 HydrophobicContact CG2-CD2 3.9Å; M1373-L1620 HydrophobicContact CE-CD1 4Å; F1477-L1620 HydrophobicContact CD1-CD1 4.34Å; F1477-L1620 HydrophobicContact CE1-CB 4.09Å; F1477-L1620 HydrophobicContact CE1-CD1 4.43Å; V1601-L1620 HydrophobicContact CB-CD2 4.22Å; V1601-L1620 HydrophobicContact CG1-CD1 4.12Å; V1601-L1620 HydrophobicContact CG1-CD2 4.05Å; V1603-L1620 HydrophobicContact CG2-CD2 3.73Å; F1616-L1620 PolarHBondContact O-N 3.42Å; M1617-L1620 PolarHBondContact O-N 2.97Å; M1617-L1620 VanDerWaalsContact O-N 3.12Å; L1620-N1622 VanDerWaalsContact C-N 3.34Å; L1620-N1622 PolarHBondContact O-N 3.5Å; L1620-A1623 PolarHBondContact O-N 2.93Å; L1620-R1624 WeakPolarHBondContact O-CB 3.03Å; L1620-R1624 PolarHBondContact O-N 3.46Å
1621	S	85.5	Confident	81.2	Confident	8 Å²	8	17 Å²	17	6%	0.056	9%	0.093	C	C	.	.	H	α-helix	trans	-58	-44.9	174.8	-60.5	0	0	0	0	111.8	D616 I620 M1617 S1618 R1624 L1625	D616-S1621 WeakPolarHBondContact CB-OG 3.4Å; D616-S1621 VanDerWaalsContact CG-OG 3.28Å; D616-S1621 VanDerWaalsContact OD2-CB 3.25Å; D616-S1621 WeakPolarHBondContact OD2-CB 3.41Å; D616-S1621 PolarHBondContact OD2-OG 2.68Å; I620-S1621 WeakPolarHBondContact CD1-O 3.33Å; M1617-S1621 PolarHBondContact O-N 3.05Å; M1617-S1621 PolarHBondContact O-OG 2.8Å; M1617-S1621 VanDerWaalsContact O-OG 3.1Å; S1618-S1621 PolarHBondContact O-N 2.93Å; S1621-R1624 PolarHBondContact O-N 3.24Å; S1621-L1625 WeakPolarHBondContact O-CB 3.31Å; S1621-L1625 PolarHBondContact O-N 3.38Å
1622	N	83.8	Confident	80.9	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-67	-37.5	176.6	-81.2	-79.3	0	0	0	112.9	N1380 S1618 A1619 L1620 R1626 S1639 I1640	N1380-N1622 VanDerWaalsContact OD1-CG 3.3Å; N1380-N1622 PolarHBondContact OD1-ND2 3.31Å; N1380-N1622 VanDerWaalsContact OD1-ND2 3.16Å; N1380-N1622 PolarHBondContact OD1-OD1 2.77Å; S1618-N1622 WeakPolarHBondContact O-CB 3.47Å; S1618-N1622 PolarHBondContact O-N 3.26Å; S1618-N1622 PolarHBondContact O-ND2 3.05Å; A1619-N1622 PolarHBondContact O-N 3.14Å; L1620-N1622 VanDerWaalsContact C-N 3.34Å; L1620-N1622 PolarHBondContact O-N 3.5Å; N1622-R1626 WeakPolarHBondContact O-CB 3.41Å; N1622-R1626 VanDerWaalsContact O-CG 3.31Å; N1622-R1626 WeakPolarHBondContact O-CG 3.28Å; N1622-R1626 PolarHBondContact O-N 3.45Å; N1622-S1639 WeakPolarHBondContact OD1-CA 3.16Å; N1622-I1640 PolarHBondContact ND2-O 3.25Å; N1622-I1640 PolarHBondContact OD1-N 3.43Å
1623	A	81.4	Confident	80.9	Confident	3 Å²	3	29 Å²	29	3%	0.025	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-45.3	173.1	0	0	0	0	0	111.5	M1373 A1619 L1620 L1625 R1626 A1627	M1373-A1623 HydrophobicContact CE-CB 3.47Å; M1373-A1623 VanDerWaalsContact CE-CB 3.47Å; M1373-A1623 HydrophobicContact CG-CB 3.62Å; M1373-A1623 HydrophobicContact SD-CB 4.4Å; A1619-A1623 PolarHBondContact O-N 2.8Å; L1620-A1623 PolarHBondContact O-N 2.93Å; A1623-L1625 PolarHBondContact O-N 3.16Å; A1623-R1626 PolarHBondContact O-N 3.27Å; A1623-A1627 WeakPolarHBondContact O-CB 3.44Å; A1623-A1627 PolarHBondContact O-N 3.34Å
1624	R	84.3	Confident	80.5	Confident	42 Å²	42	31.3 Å²	31.3	16%	0.158	17%	0.172	C	C	.	.	H	α-helix	trans	-59.8	-43.6	176.3	-177.4	178.2	-176.3	177.9	2.4	112	I620 L628 Y1369 L1620 S1621 H1628	I620-R1624 HydrophobicContact CD1-CB 4.19Å; I620-R1624 HydrophobicContact CD1-CG 4.22Å; I620-R1624 HydrophobicContact CG2-CG 4.13Å; L628-R1624 PolarHBondContact O-NH2 3.21Å; Y1369-R1624 HydrophobicContact CD1-CB 4.34Å; Y1369-R1624 HydrophobicContact CE1-CB 3.79Å; Y1369-R1624 HydrophobicContact CE1-CG 3.86Å; L1620-R1624 WeakPolarHBondContact O-CB 3.03Å; L1620-R1624 PolarHBondContact O-N 3.46Å; S1621-R1624 PolarHBondContact O-N 3.24Å; R1624-H1628 PolarHBondContact O-N 3.5Å; R1624-H1628 PolarHBondContact O-ND1 3.32Å
1625	L	84.7	Confident	80.2	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-57.1	174.3	179.4	57.7	0	0	0	111.3	I620 Q623 T624 S1621 A1623 A1627 H1628 I1629 I1640	I620-L1625 HydrophobicContact CG1-CB 4.16Å; I620-L1625 HydrophobicContact CG1-CD1 4.49Å; Q623-L1625 HydrophobicContact CB-CD1 4Å; Q623-L1625 VanDerWaalsContact OE1-CD1 3.3Å; T624-L1625 HydrophobicContact CG2-CD1 3.8Å; S1621-L1625 WeakPolarHBondContact O-CB 3.31Å; S1621-L1625 PolarHBondContact O-N 3.38Å; A1623-L1625 PolarHBondContact O-N 3.16Å; L1625-A1627 PolarHBondContact O-N 2.9Å; L1625-H1628 PolarHBondContact O-N 2.82Å; L1625-H1628 VanDerWaalsContact O-N 3.16Å; L1625-I1629 HydrophobicContact CD1-CD1 3.96Å; L1625-I1629 HydrophobicContact CD1-CG1 4.24Å; L1625-I1629 HydrophobicContact CG-CD1 3.92Å; L1625-I1629 WeakPolarHBondContact O-CG1 3.49Å; L1625-I1629 PolarHBondContact O-N 2.86Å; L1625-I1640 HydrophobicContact CD2-CD1 4.01Å; L1625-I1640 HydrophobicContact CD2-CG1 3.92Å
1626	R	83.8	Confident	79.9	Confident	4 Å²	4	36 Å²	36	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-26.5	-177.3	-68.2	176.2	-170.6	155	3.3	113.5	A1372 Y1376 G1377 G1379 N1622 A1623 R1635	A1372-R1626 HydrophobicContact CB-CB 3.98Å; Y1376-R1626 HydrophobicContact CD2-CB 4.48Å; Y1376-R1626 PolarHBondContact O-NH1 2.87Å; G1377-R1626 PolarHBondContact O-NH1 3.31Å; G1379-R1626 PolarHBondContact O-NH1 2.75Å; G1379-R1626 PolarHBondContact O-NH2 2.76Å; N1622-R1626 WeakPolarHBondContact O-CB 3.41Å; N1622-R1626 VanDerWaalsContact O-CG 3.31Å; N1622-R1626 WeakPolarHBondContact O-CG 3.28Å; N1622-R1626 PolarHBondContact O-N 3.45Å; A1623-R1626 PolarHBondContact O-N 3.27Å; R1626-R1635 WeakPolarHBondContact O-CD 3.38Å
1627	A	80.5	Confident	79.8	Confident	13 Å²	13	39 Å²	39	11%	0.107	21%	0.205	C	C	.	.	H	α-helix	trans	-72.1	-32.2	175.8	0	0	0	0	0	113.6	P1368 Y1369 A1623 L1625	P1368-A1627 HydrophobicContact CB-CB 3.88Å; Y1369-A1627 HydrophobicContact CD1-CB 4.22Å; Y1369-A1627 HydrophobicContact CG-CB 4.29Å; A1623-A1627 WeakPolarHBondContact O-CB 3.44Å; A1623-A1627 PolarHBondContact O-N 3.34Å; L1625-A1627 PolarHBondContact O-N 2.9Å
1628	H	81.6	Confident	79.7	Confident	46 Å²	46	40.2 Å²	40.2	21%	0.213	21%	0.21	C	C	.	.	H	α-helix	trans	-103.2	-5.3	-172.9	-73.4	77.9	0	0	0	114.7	T624 S626 L628 Y1369 R1624 L1625	T624-H1628 HydrophobicContact CG2-CB 3.83Å; S626-H1628 PolarHBondContact OG-CD2 2.7Å; S626-H1628 VanDerWaalsContact OG-CD2 3.25Å; L628-H1628 WeakPolarHBondContact CD2-NE2 3.38Å; Y1369-H1628 AromaticContact CE2-CE1 4Å; Y1369-H1628 AromaticContact CZ-CE1 3.56Å; Y1369-H1628 PolarHBondContact OH-CE1 2.76Å; R1624-H1628 PolarHBondContact O-N 3.5Å; R1624-H1628 PolarHBondContact O-ND1 3.32Å; L1625-H1628 PolarHBondContact O-N 2.82Å; L1625-H1628 VanDerWaalsContact O-N 3.16Å
1629	I	81.7	Confident	79.7	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	21%	0.21	C	C	.	.	S	Bend	trans	-67.3	130.6	173.9	-75.7	163.4	0	0	0	110.2	T624 L1625 M1633 R1635 Y1638	T624-I1629 HydrophobicContact CG2-CG1 4.09Å; L1625-I1629 HydrophobicContact CD1-CD1 3.96Å; L1625-I1629 HydrophobicContact CD1-CG1 4.24Å; L1625-I1629 HydrophobicContact CG-CD1 3.92Å; L1625-I1629 WeakPolarHBondContact O-CG1 3.49Å; L1625-I1629 PolarHBondContact O-N 2.86Å; I1629-M1633 HydrophobicContact CG2-CB 3.74Å; I1629-R1635 HydrophobicContact CB-CG 4.47Å; I1629-R1635 HydrophobicContact CG2-CG 4.27Å; I1629-Y1638 VanDerWaalsContact CD1-CB 3.44Å; I1629-Y1638 HydrophobicContact CD1-CD1 3.74Å; I1629-Y1638 HydrophobicContact CD1-CD2 3.79Å; I1629-Y1638 HydrophobicContact CD1-CE1 4.41Å; I1629-Y1638 HydrophobicContact CD1-CE2 4.47Å; I1629-Y1638 HydrophobicContact CD1-CG 3.38Å
1630	P	77.5	Confident	80.1	Confident	68 Å²	68	40.1 Å²	40.1	44%	0.442	21%	0.208	S	C	.	.			trans	-54.5	143.1	176.5	-26.8	34.5	0	0	0	113	N1632 M1633	P1630-N1632 PolarHBondContact O-N 2.65Å; P1630-M1633 PolarHBondContact O-N 3.07Å
1631	N	71.2	Confident	80.1	Confident	132 Å²	132	39.7 Å²	39.7	71%	0.706	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.1	-175.3	-67.8	-17.6	0	0	0	114.9	M1633 R1635	N1631-M1633 VanDerWaalsContact C-N 3.25Å; N1631-M1633 PolarHBondContact O-N 3.21Å; N1631-R1635 PolarHBondContact OD1-NH2 2.86Å
1632	N	73.2	Confident	80.2	Confident	164 Å²	164	39.3 Å²	39.3	88%	0.877	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-3	177.9	-64.5	1.6	0	0	0	113.7	P1630	P1630-N1632 PolarHBondContact O-N 2.65Å
1633	M	74.9	Confident	80.3	Confident	96 Å²	96	40 Å²	40	47%	0.473	21%	0.207	S	C	.	.	S	Bend	trans	-118.3	143.6	-178.3	-62.9	-176.4	-175.9	0	0	112.4	I1629 P1630 N1631 R1635 Y1638	I1629-M1633 HydrophobicContact CG2-CB 3.74Å; P1630-M1633 PolarHBondContact O-N 3.07Å; N1631-M1633 VanDerWaalsContact C-N 3.25Å; N1631-M1633 PolarHBondContact O-N 3.21Å; M1633-R1635 PolarHBondContact O-N 2.95Å; M1633-Y1638 HydrophobicContact CB-CE2 4.4Å; M1633-Y1638 PolarHBondContact SD-OH 3.13Å
1634	S	75.8	Confident	80.5	Confident	52 Å²	52	39.9 Å²	39.9	36%	0.364	21%	0.206	S	C	.	.			trans	-69.4	94.5	179.3	42.5	0	0	0	0	111.9	E1636 E1637	S1634-E1636 PolarHBondContact O-N 3.3Å; S1634-E1637 PolarHBondContact O-N 2.66Å; S1634-E1637 PolarHBondContact OG-OE1 3.06Å
1635	R	76.6	Confident	80.4	Confident	61 Å²	61	39.8 Å²	39.8	23%	0.23	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-21.3	179.3	-61.3	177.6	-177.7	177.1	0.6	114.8	Y1376 R1626 I1629 N1631 M1633	Y1376-R1635 HydrophobicContact CE1-CB 4.49Å; Y1376-R1635 HydrophobicContact CE2-CB 3.86Å; R1626-R1635 WeakPolarHBondContact O-CD 3.38Å; I1629-R1635 HydrophobicContact CB-CG 4.47Å; I1629-R1635 HydrophobicContact CG2-CG 4.27Å; N1631-R1635 PolarHBondContact OD1-NH2 2.86Å; M1633-R1635 PolarHBondContact O-N 2.95Å
1636	E	72.4	Confident	80.1	Confident	41 Å²	41	40 Å²	40	19%	0.192	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-27.8	175.6	-68.3	-177.1	-157.7	0	0	114.4	Y1376 R1387 G1396 S1634 Y1638	Y1376-E1636 HydrophobicContact CD1-CG 3.7Å; Y1376-E1636 HydrophobicContact CE1-CG 3.54Å; R1387-E1636 IonicContact NH2-OE2 3.31Å; R1387-E1636 PolarHBondContact NH2-OE2 3.11Å; G1396-E1636 WeakPolarHBondContact CA-OE1 3.32Å; S1634-E1636 PolarHBondContact O-N 3.3Å; E1636-Y1638 VanDerWaalsContact C-N 3.31Å
1637	E	77	Confident	79.5	Confident	69 Å²	69	40.1 Å²	40.1	32%	0.322	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-20.1	-176.4	-71.9	176.2	-146.8	0	0	112.7	K558 H1383 S1634	K558-E1637 HydrophobicContact CD-CB 4.04Å; K558-E1637 VanDerWaalsContact CD-OE2 3.23Å; K558-E1637 WeakPolarHBondContact CD-OE2 3.13Å; K558-E1637 WeakPolarHBondContact CE-OE2 3.15Å; K558-E1637 IonicContact NZ-OE2 3.15Å; K558-E1637 PolarHBondContact NZ-OE2 3.11Å; H1383-E1637 PolarHBondContact ND1-O 3.3Å; H1383-E1637 VanDerWaalsContact ND1-O 3.14Å; S1634-E1637 PolarHBondContact O-N 2.66Å; S1634-E1637 PolarHBondContact OG-OE1 3.06Å
1638	Y	82.3	Confident	78.5	Confident	26 Å²	26	48 Å²	48	10%	0.102	24%	0.242	C	C	.	.			trans	-92.8	127.8	-174.9	-70.8	-102	0	0	0	112.2	K558 I1629 M1633 E1636	K558-Y1638 HydrophobicContact CB-CD1 4.14Å; K558-Y1638 HydrophobicContact CB-CD2 4.4Å; K558-Y1638 HydrophobicContact CB-CE1 4.07Å; K558-Y1638 HydrophobicContact CB-CE2 4.31Å; K558-Y1638 HydrophobicContact CB-CG 4.31Å; K558-Y1638 HydrophobicContact CD-CE2 3.87Å; K558-Y1638 HydrophobicContact CG-CE1 4.05Å; K558-Y1638 HydrophobicContact CG-CE2 4.1Å; K558-Y1638 WeakPolarHBondContact O-CA 3.15Å; K558-Y1638 WeakPolarHBondContact O-CD1 3.42Å; I1629-Y1638 VanDerWaalsContact CD1-CB 3.44Å; I1629-Y1638 HydrophobicContact CD1-CD1 3.74Å; I1629-Y1638 HydrophobicContact CD1-CD2 3.79Å; I1629-Y1638 HydrophobicContact CD1-CE1 4.41Å; I1629-Y1638 HydrophobicContact CD1-CE2 4.47Å; I1629-Y1638 HydrophobicContact CD1-CG 3.38Å; M1633-Y1638 HydrophobicContact CB-CE2 4.4Å; M1633-Y1638 PolarHBondContact SD-OH 3.13Å; E1636-Y1638 VanDerWaalsContact C-N 3.31Å
1639	S	83.1	Confident	77.3	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.021	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	143.7	175	64.1	0	0	0	0	112.8	K558 A559 L560 N1622	K558-S1639 PolarHBondContact O-N 3.28Å; A559-S1639 CarbonylContact C-O 3.57Å; A559-S1639 WeakPolarHBondContact CA-O 3.34Å; A559-S1639 WeakPolarHBondContact CB-OG 3.21Å; L560-S1639 PolarHBondContact N-O 3.3Å; N1622-S1639 WeakPolarHBondContact OD1-CA 3.16Å
1640	I	86.4	Confident	75.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.6	172.1	-57.2	164.1	0	0	0	109	L560 Y562 D616 I619 I620 N1380 N1622 L1625	L560-I1640 WeakPolarHBondContact O-CA 3.33Å; Y562-I1640 HydrophobicContact CD1-CG2 4.4Å; Y562-I1640 HydrophobicContact CE1-CG2 3.92Å; D616-I1640 VanDerWaalsContact OD1-CG2 3.24Å; D616-I1640 WeakPolarHBondContact OD1-CG2 3.34Å; I619-I1640 HydrophobicContact CB-CD1 4.04Å; I619-I1640 HydrophobicContact CD1-CG2 4.3Å; I619-I1640 HydrophobicContact CG2-CD1 3.64Å; I619-I1640 HydrophobicContact CG2-CG1 3.94Å; I620-I1640 HydrophobicContact CD1-CD1 4.36Å; I620-I1640 HydrophobicContact CG1-CD1 3.73Å; N1380-I1640 PolarHBondContact ND2-O 2.81Å; N1622-I1640 PolarHBondContact ND2-O 3.25Å; N1622-I1640 PolarHBondContact OD1-N 3.43Å; L1625-I1640 HydrophobicContact CD2-CD1 4.01Å; L1625-I1640 HydrophobicContact CD2-CG1 3.92Å
1641	A	84.2	Confident	74.3	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.008	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126	178.9	0	0	0	0	0	112	L560 E561 Y562	L560-A1641 PolarHBondContact O-N 3.12Å; E561-A1641 WeakPolarHBondContact CA-O 3Å; E561-A1641 HydrophobicContact CB-CB 4.28Å; E561-A1641 HydrophobicContact CG-CB 4.21Å; Y562-A1641 PolarHBondContact N-O 3.5Å
1642	T	87.4	Confident	73.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136.1	179.7	54.3	0	0	0	0	110.6	Y562 Q612 F1318	Y562-T1642 HydrophobicContact CD1-CG2 4.43Å; Y562-T1642 HydrophobicContact CE1-CG2 3.62Å; Y562-T1642 HydrophobicContact CE2-CG2 4.2Å; Y562-T1642 VanDerWaalsContact CZ-CG2 3.49Å; Y562-T1642 WeakPolarHBondContact OH-CG2 3.41Å; Q612-T1642 HydrophobicContact CG-CG2 4.17Å; Q612-T1642 PolarHBondContact NE2-OG1 3.16Å; F1318-T1642 WeakPolarHBondContact CD2-O 3.4Å; F1318-T1642 WeakPolarHBondContact CD2-OG1 3.3Å; F1318-T1642 PolarHBondContact N-O 3.38Å
1643	I	86.1	Confident	71.7	Confident	15 Å²	15	45 Å²	45	8%	0.077	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127	176.6	-43.6	179.8	0	0	0	109	E561 Y562 K563 I564 L1316 R1317	E561-I1643 HydrophobicContact CG-CD1 3.82Å; E561-I1643 HydrophobicContact CG-CG1 4.1Å; E561-I1643 WeakPolarHBondContact OE1-CD1 3.26Å; Y562-I1643 PolarHBondContact O-N 3.24Å; K563-I1643 CarbonylContact C-O 3.56Å; K563-I1643 WeakPolarHBondContact CA-O 3.39Å; K563-I1643 HydrophobicContact CB-CB 4.48Å; K563-I1643 HydrophobicContact CG-CB 4.15Å; K563-I1643 HydrophobicContact CG-CD1 3.91Å; K563-I1643 HydrophobicContact CG-CG1 4.47Å; I564-I1643 PolarHBondContact N-O 3.1Å; L1316-I1643 WeakPolarHBondContact O-CA 3.26Å; L1316-I1643 WeakPolarHBondContact O-CG2 3.5Å; R1317-I1643 HydrophobicContact CB-CG1 4.26Å; R1317-I1643 HydrophobicContact CG-CG1 4.33Å
1644	N	85.5	Confident	70.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	122.3	159.7	-179.9	9.5	0	0	0	108.8	T574 Y603 F608 L1316 F1318	T574-N1644 HydrophobicContact CG2-CB 4.22Å; T574-N1644 WeakPolarHBondContact CG2-ND2 3.46Å; Y603-N1644 PolarHBondContact OH-ND2 2.84Å; F608-N1644 HydrophobicContact CE2-CB 3.95Å; F608-N1644 HydrophobicContact CZ-CB 3.83Å; L1316-N1644 PolarHBondContact N-O 3.17Å; L1316-N1644 PolarHBondContact O-N 3.45Å; F1318-N1644 HydrophobicContact CE1-CB 4.44Å; F1318-N1644 HydrophobicContact CE2-CB 3.75Å; F1318-N1644 HydrophobicContact CZ-CB 3.5Å; F1318-N1644 VanDerWaalsContact CZ-CB 3.5Å
1645	H	82.9	Confident	68.4	Low	40 Å²	40	43 Å²	43	19%	0.185	21%	0.211	C	C	.	.			trans	-134.9	94	172.4	-172.3	47.2	0	0	0	109.6	I564 R565	I564-H1645 PolarHBondContact O-N 3.13Å; I564-H1645 VanDerWaalsContact O-N 3.09Å; R565-H1645 VanDerWaalsContact CA-O 3.29Å; R565-H1645 WeakPolarHBondContact CA-O 3.36Å; R565-H1645 HydrophobicContact CG-CB 4.44Å; R565-H1645 WeakPolarHBondContact CG-O 3.2Å
1646	P	77	Confident	66.7	Low	6 Å²	6	44.1 Å²	44.1	4%	0.039	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-57.1	143.8	-178.2	-24.6	33.4	0	0	0	112.5	M566 D568 V571 T574	M566-P1646 WeakPolarHBondContact O-CA 3.49Å; D568-P1646 HydrophobicContact CB-CB 4.29Å; V571-P1646 HydrophobicContact CG2-CB 4.29Å; V571-P1646 HydrophobicContact CG2-CG 3.99Å; T574-P1646 HydrophobicContact CG2-CG 3.92Å
1647	M	72.5	Confident	65.2	Low	6 Å²	6	44.6 Å²	44.6	3%	0.03	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-79.2	138.3	174.5	-157	177.5	81.1	0	0	110.1	F540 M566 N1649	F540-M1647 HydrophobicContact CD1-CE 4.42Å; F540-M1647 HydrophobicContact CE1-CE 4.22Å; F540-M1647 HydrophobicContact CE1-SD 3.87Å; F540-M1647 HydrophobicContact CZ-SD 3.96Å; M566-M1647 PolarHBondContact O-N 2.68Å; M1647-N1649 PolarHBondContact O-N 3.33Å
1648	K	59.6	Low	63.8	Low	179 Å²	179	42.4 Å²	42.4	78%	0.778	21%	0.214	S	C	*	.	P	Polyproline II helix	trans	-73.5	119.8	177.1	-64.8	179.3	-179.4	176.9	0	109.9
1649	N	55.1	Low	62.2	Low	43 Å²	43	43.9 Å²	43.9	23%	0.23	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-75.2	142.6	178.3	-74.4	-14	0	0	0	111.6	M1647 E1653	M1647-N1649 PolarHBondContact O-N 3.33Å; N1649-E1653 PolarHBondContact ND2-OE2 2.95Å
1650	I	50.7	Low	60.6	Low	84 Å²	84	48.1 Å²	48.1	43%	0.431	24%	0.244	S	C	.	.			trans	-94.2	-17.9	-169.2	-70.7	-167.9	0	0	0	115.7	S532	S532-I1650 WeakPolarHBondContact OG-CD1 3.21Å; S532-I1650 VanDerWaalsContact OG-CG1 3.29Å; S532-I1650 WeakPolarHBondContact OG-CG1 3.46Å
1651	V	47.3	Very low	59	Low	85 Å²	85	48.9 Å²	48.9	52%	0.515	25%	0.249	S	C	.	.	S	Bend	trans	-138.6	-74.2	-177.7	-160.7	0	0	0	0	114.4	S1654	V1651-S1654 PolarHBondContact O-OG 2.91Å
1652	D	45.5	Very low	57.7	Low	91 Å²	91	50.1 Å²	50.1	49%	0.487	26%	0.255	S	S	.	.	S	Bend	trans	-86.9	-25.6	-151.9	-64.8	-34.9	0	0	0	117.3
1653	E	43.4	Very low	56.3	Low	48 Å²	48	52.8 Å²	52.8	22%	0.224	28%	0.277	C	S	.	.	S	Bend	trans	-93.8	-8.4	-178.8	-72.1	-166.1	141.3	0	0	114.4	Y569 N1649 M1655 L1656 H1657	Y569-E1653 WeakPolarHBondContact CB-OE2 3.35Å; Y569-E1653 WeakPolarHBondContact CD1-OE2 3.41Å; N1649-E1653 PolarHBondContact ND2-OE2 2.95Å; E1653-M1655 PolarHBondContact O-N 2.78Å; E1653-L1656 PolarHBondContact O-N 2.76Å; E1653-H1657 PolarHBondContact O-N 2.96Å
1654	S	41.7	Very low	55	Low	25 Å²	25	53 Å²	53	18%	0.175	28%	0.281	C	S	.	.	H	α-helix	trans	-52.2	-40.6	166.7	65.7	0	0	0	0	110.1	V1651 L1656 H1657 N1658	V1651-S1654 PolarHBondContact O-OG 2.91Å; S1654-L1656 VanDerWaalsContact C-N 3.3Å; S1654-L1656 PolarHBondContact O-N 3.22Å; S1654-H1657 PolarHBondContact O-N 3.33Å; S1654-N1658 WeakPolarHBondContact O-CA 3.47Å; S1654-N1658 WeakPolarHBondContact O-CB 3.41Å; S1654-N1658 PolarHBondContact O-N 3.29Å; S1654-N1658 PolarHBondContact O-ND2 3.34Å; S1654-N1658 PolarHBondContact O-OD1 3.03Å
1655	M	39.8	Very low	53.8	Low	79 Å²	79	53.6 Å²	53.6	39%	0.389	28%	0.284	S	S	.	.	H	α-helix	trans	-57.3	-33.2	173.5	-72.2	-73.1	-171	0	0	114.6	E1653 K1659 I1856	E1653-M1655 PolarHBondContact O-N 2.78Å; M1655-K1659 PolarHBondContact O-N 3.39Å; M1655-I1856 HydrophobicContact CE-CD1 3.67Å; M1655-I1856 HydrophobicContact CE-CG1 3.79Å; M1655-I1856 HydrophobicContact SD-CD1 4.43Å; M1655-I1856 HydrophobicContact SD-CG1 4.35Å
1656	L	40	Very low	53	Low	86 Å²	86	53.3 Å²	53.3	45%	0.45	28%	0.283	S	S	.	.	H	α-helix	trans	-84.8	-41.5	-179.1	-148.1	89.9	0	0	0	111.4	E1653 S1654 N1658 K1659	E1653-L1656 PolarHBondContact O-N 2.76Å; S1654-L1656 VanDerWaalsContact C-N 3.3Å; S1654-L1656 PolarHBondContact O-N 3.22Å; L1656-N1658 PolarHBondContact O-N 3.42Å; L1656-K1659 HydrophobicContact CD1-CD 4.33Å; L1656-K1659 WeakPolarHBondContact O-CB 3.05Å; L1656-K1659 PolarHBondContact O-N 3Å
1657	H	41.8	Very low	52.5	Low	51 Å²	51	55.1 Å²	55.1	24%	0.236	30%	0.296	C	S	.	.	H	α-helix	trans	-70.4	-22.8	173	-145.9	-55.1	0	0	0	112.1	D568 K573 E1653 S1654 K1659	D568-H1657 IonicContact OD2-CD2 3.13Å; K573-H1657 WeakPolarHBondContact CE-NE2 3.33Å; K573-H1657 PolarHBondContact NZ-CD2 2.82Å; K573-H1657 VanDerWaalsContact NZ-CD2 3.35Å; K573-H1657 PolarHBondContact NZ-NE2 3.32Å; E1653-H1657 PolarHBondContact O-N 2.96Å; S1654-H1657 PolarHBondContact O-N 3.33Å; H1657-K1659 VanDerWaalsContact C-N 3.31Å
1658	N	47.9	Very low	52.3	Low	22 Å²	22	55 Å²	55	12%	0.118	30%	0.295	C	S	.	.	H	α-helix	trans	-68.3	-20.1	165.6	-74.6	-12.9	0	0	0	111.9	S1654 L1656 D1660 S1661 I1662	S1654-N1658 WeakPolarHBondContact O-CA 3.47Å; S1654-N1658 WeakPolarHBondContact O-CB 3.41Å; S1654-N1658 PolarHBondContact O-N 3.29Å; S1654-N1658 PolarHBondContact O-ND2 3.34Å; S1654-N1658 PolarHBondContact O-OD1 3.03Å; L1656-N1658 PolarHBondContact O-N 3.42Å; N1658-D1660 VanDerWaalsContact C-N 3.28Å; N1658-D1660 PolarHBondContact O-N 3.39Å; N1658-S1661 CarbonylContact O-C 3.49Å; N1658-S1661 PolarHBondContact O-N 3.44Å; N1658-S1661 PolarHBondContact O-OG 3.33Å; N1658-I1662 HydrophobicContact CB-CD1 3.68Å; N1658-I1662 HydrophobicContact CB-CG1 4.03Å; N1658-I1662 WeakPolarHBondContact O-CA 3.3Å; N1658-I1662 WeakPolarHBondContact O-CB 3.33Å; N1658-I1662 WeakPolarHBondContact O-CD1 3.35Å; N1658-I1662 WeakPolarHBondContact O-CG1 3.43Å; N1658-I1662 PolarHBondContact O-N 3.41Å
1659	K	48.2	Very low	52.7	Low	58 Å²	58	46.7 Å²	46.7	25%	0.252	26%	0.26	S	S	.	.	H	α-helix	trans	-58.1	-41.3	-179.6	-73.9	-173.3	175.5	-177.6	0	112.4	M1655 L1656 H1657 A1663	M1655-K1659 PolarHBondContact O-N 3.39Å; L1656-K1659 HydrophobicContact CD1-CD 4.33Å; L1656-K1659 WeakPolarHBondContact O-CB 3.05Å; L1656-K1659 PolarHBondContact O-N 3Å; H1657-K1659 VanDerWaalsContact C-N 3.31Å; K1659-A1663 PolarHBondContact O-N 2.99Å; K1659-A1663 VanDerWaalsContact O-N 3.11Å
1660	D	48.7	Very low	53.5	Low	92 Å²	92	46.4 Å²	46.4	49%	0.492	26%	0.258	S	S	.	.	H	α-helix	trans	-69.9	-38.9	174.3	-64.5	-24.4	0	0	0	111.9	L1311 N1658 A1663 A1664	L1311-D1660 HydrophobicContact CD1-CB 4.42Å; N1658-D1660 VanDerWaalsContact C-N 3.28Å; N1658-D1660 PolarHBondContact O-N 3.39Å; D1660-A1663 PolarHBondContact O-N 3.12Å; D1660-A1664 PolarHBondContact O-N 3.39Å; D1660-A1664 VanDerWaalsContact O-N 3.15Å
1661	S	54.5	Low	54.5	Low	16 Å²	16	42.8 Å²	42.8	11%	0.112	24%	0.241	C	C	.	.	H	α-helix	trans	-69	-41.7	177.7	103.4	0	0	0	0	111.6	N1658 A1663 A1664 E1665	N1658-S1661 CarbonylContact O-C 3.49Å; N1658-S1661 PolarHBondContact O-N 3.44Å; N1658-S1661 PolarHBondContact O-OG 3.33Å; S1661-A1663 VanDerWaalsContact C-N 3.32Å; S1661-A1663 PolarHBondContact O-N 3.3Å; S1661-A1664 CarbonylContact O-C 3.53Å; S1661-A1664 WeakPolarHBondContact O-CB 3.26Å; S1661-A1664 PolarHBondContact O-N 3.13Å; S1661-A1664 VanDerWaalsContact O-N 3.12Å; S1661-E1665 WeakPolarHBondContact CB-OE1 3.43Å; S1661-E1665 VanDerWaalsContact O-CB 3.29Å; S1661-E1665 WeakPolarHBondContact O-CB 3.39Å; S1661-E1665 WeakPolarHBondContact O-CG 3.47Å; S1661-E1665 PolarHBondContact O-N 3.34Å; S1661-E1665 PolarHBondContact OG-OE1 3.38Å
1662	I	56.2	Low	55.7	Low	26 Å²	26	39 Å²	39	13%	0.133	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-40.5	176.1	-75.9	169.3	0	0	0	110.2	N1658 M1666 M1812 V1852	N1658-I1662 HydrophobicContact CB-CD1 3.68Å; N1658-I1662 HydrophobicContact CB-CG1 4.03Å; N1658-I1662 WeakPolarHBondContact O-CA 3.3Å; N1658-I1662 WeakPolarHBondContact O-CB 3.33Å; N1658-I1662 WeakPolarHBondContact O-CD1 3.35Å; N1658-I1662 WeakPolarHBondContact O-CG1 3.43Å; N1658-I1662 PolarHBondContact O-N 3.41Å; I1662-M1666 WeakPolarHBondContact O-CB 3.25Å; I1662-M1666 PolarHBondContact O-N 3.19Å; I1662-M1812 HydrophobicContact CB-CE 4.46Å; I1662-M1812 HydrophobicContact CG2-CE 3.04Å; I1662-V1852 HydrophobicContact CG1-CG2 4.22Å
1663	A	57.9	Low	57.1	Low	56 Å²	56	34.8 Å²	34.8	46%	0.463	20%	0.195	S	C	.	.	H	α-helix	trans	-66.3	-43	173.2	0	0	0	0	0	112.1	K1659 D1660 S1661 S1667	K1659-A1663 PolarHBondContact O-N 2.99Å; K1659-A1663 VanDerWaalsContact O-N 3.11Å; D1660-A1663 PolarHBondContact O-N 3.12Å; S1661-A1663 VanDerWaalsContact C-N 3.32Å; S1661-A1663 PolarHBondContact O-N 3.3Å; A1663-S1667 PolarHBondContact O-N 3.39Å
1664	A	59.4	Low	58.6	Low	19 Å²	19	36.5 Å²	36.5	16%	0.157	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-42	174.2	0	0	0	0	0	112.1	I1304 D1660 S1661 S1667 L1668	I1304-A1664 HydrophobicContact CG2-CB 4.37Å; I1304-A1664 VanDerWaalsContact CG2-O 3.31Å; I1304-A1664 WeakPolarHBondContact CG2-O 3.5Å; D1660-A1664 PolarHBondContact O-N 3.39Å; D1660-A1664 VanDerWaalsContact O-N 3.15Å; S1661-A1664 CarbonylContact O-C 3.53Å; S1661-A1664 WeakPolarHBondContact O-CB 3.26Å; S1661-A1664 PolarHBondContact O-N 3.13Å; S1661-A1664 VanDerWaalsContact O-N 3.12Å; A1664-S1667 PolarHBondContact O-N 3.32Å; A1664-S1667 PolarHBondContact O-OG 3.48Å; A1664-L1668 PolarHBondContact O-N 3.06Å
1665	E	60.6	Low	60.2	Low	14 Å²	14	35.4 Å²	35.4	7%	0.065	20%	0.196	C	C	.	.	H	α-helix	trans	-68.6	-37.1	178.3	-72.2	160.4	-149.9	0	0	112.2	S1661 L1668 A1669 K1851 N1855	S1661-E1665 WeakPolarHBondContact CB-OE1 3.43Å; S1661-E1665 VanDerWaalsContact O-CB 3.29Å; S1661-E1665 WeakPolarHBondContact O-CB 3.39Å; S1661-E1665 WeakPolarHBondContact O-CG 3.47Å; S1661-E1665 PolarHBondContact O-N 3.34Å; S1661-E1665 PolarHBondContact OG-OE1 3.38Å; E1665-L1668 WeakPolarHBondContact O-CB 3.05Å; E1665-L1668 PolarHBondContact O-N 3.31Å; E1665-A1669 WeakPolarHBondContact O-CB 3.19Å; E1665-A1669 PolarHBondContact O-N 3.07Å; E1665-K1851 HydrophobicContact CG-CD 3.94Å; E1665-K1851 HydrophobicContact CG-CG 4.31Å; E1665-N1855 PolarHBondContact OE1-ND2 3.18Å; E1665-N1855 PolarHBondContact OE2-ND2 3.35Å
1666	M	65.5	Low	61.9	Low	34 Å²	34	31.8 Å²	31.8	17%	0.167	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-46.4	168.4	-179	-175.6	172.4	0	0	110.4	I1662 L1668 A1669 L1670 S1809 M1812	I1662-M1666 WeakPolarHBondContact O-CB 3.25Å; I1662-M1666 PolarHBondContact O-N 3.19Å; M1666-L1668 VanDerWaalsContact C-N 3.28Å; M1666-L1668 PolarHBondContact O-N 3.06Å; M1666-A1669 PolarHBondContact O-N 3.11Å; M1666-A1669 VanDerWaalsContact O-N 3.16Å; M1666-L1670 HydrophobicContact CE-CD1 4.25Å; M1666-L1670 HydrophobicContact CG-CD1 4.43Å; M1666-L1670 HydrophobicContact CG-CG 4.43Å; M1666-L1670 WeakPolarHBondContact O-CB 3.3Å; M1666-L1670 VanDerWaalsContact O-CG 3.28Å; M1666-L1670 WeakPolarHBondContact O-CG 3.42Å; M1666-L1670 PolarHBondContact O-N 2.92Å; M1666-S1809 VanDerWaalsContact CE-CA 3.49Å; M1666-S1809 WeakPolarHBondContact CE-OG 3.25Å; M1666-M1812 HydrophobicContact CB-CE 3.87Å; M1666-M1812 HydrophobicContact CB-SD 4.22Å; M1666-M1812 HydrophobicContact CG-CE 4.18Å; M1666-M1812 HydrophobicContact CG-SD 3.95Å; M1666-M1812 HydrophobicContact SD-CE 3.8Å; M1666-M1812 HydrophobicContact SD-SD 3.6Å; M1666-M1812 VanDerWaalsContact SD-SD 3.6Å
1667	S	66.6	Low	63.8	Low	44 Å²	44	27.7 Å²	27.7	31%	0.308	16%	0.157	S	C	.	.	H	α-helix	trans	-62.9	-34.4	177.4	75.4	0	0	0	0	112.7	I1304 A1663 A1664 L1670 A1671	I1304-S1667 VanDerWaalsContact CG2-OG 3.31Å; I1304-S1667 WeakPolarHBondContact CG2-OG 3.33Å; A1663-S1667 PolarHBondContact O-N 3.39Å; A1664-S1667 PolarHBondContact O-N 3.32Å; A1664-S1667 PolarHBondContact O-OG 3.48Å; S1667-L1670 PolarHBondContact O-N 2.73Å; S1667-A1671 PolarHBondContact O-N 2.99Å
1668	L	67.9	Low	65.5	Low	3 Å²	3	26.2 Å²	26.2	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-64	-49.5	170.4	-175	66.7	0	0	0	111.4	A1301 I1304 V1305 A1664 E1665 M1666 L1670 A1671 F1672	A1301-L1668 HydrophobicContact CB-CD1 3.53Å; I1304-L1668 HydrophobicContact CG2-CB 4.28Å; V1305-L1668 HydrophobicContact CG2-CD1 4.01Å; V1305-L1668 HydrophobicContact CG2-CD2 4.19Å; A1664-L1668 PolarHBondContact O-N 3.06Å; E1665-L1668 WeakPolarHBondContact O-CB 3.05Å; E1665-L1668 PolarHBondContact O-N 3.31Å; M1666-L1668 VanDerWaalsContact C-N 3.28Å; M1666-L1668 PolarHBondContact O-N 3.06Å; L1668-L1670 VanDerWaalsContact C-N 3.3Å; L1668-L1670 PolarHBondContact O-N 2.91Å; L1668-A1671 WeakPolarHBondContact O-CB 3.37Å; L1668-A1671 PolarHBondContact O-N 3Å; L1668-A1671 VanDerWaalsContact O-N 3.09Å; L1668-F1672 HydrophobicContact CD1-CD2 4.26Å; L1668-F1672 HydrophobicContact CD1-CE2 3.78Å; L1668-F1672 HydrophobicContact CG-CD2 4.14Å; L1668-F1672 HydrophobicContact CG-CE2 3.93Å; L1668-F1672 VanDerWaalsContact O-CD2 3.3Å; L1668-F1672 WeakPolarHBondContact O-CD2 3.39Å; L1668-F1672 PolarHBondContact O-N 3.17Å
1669	A	68.4	Low	66.9	Low	4 Å²	4	25.3 Å²	25.3	3%	0.033	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-37.4	177.2	0	0	0	0	0	112.3	E1665 M1666 F1672 L1673 W1847 T1848	E1665-A1669 WeakPolarHBondContact O-CB 3.19Å; E1665-A1669 PolarHBondContact O-N 3.07Å; M1666-A1669 PolarHBondContact O-N 3.11Å; M1666-A1669 VanDerWaalsContact O-N 3.16Å; A1669-F1672 PolarHBondContact O-N 3.2Å; A1669-L1673 WeakPolarHBondContact O-CB 3.4Å; A1669-L1673 PolarHBondContact O-N 2.9Å; A1669-W1847 HydrophobicContact CB-CB 4.07Å; A1669-T1848 HydrophobicContact CB-CG2 3.6Å
1670	L	71.7	Confident	68.4	Low	37 Å²	37	22.6 Å²	22.6	19%	0.194	14%	0.136	C	C	.	.	H	α-helix	trans	-66.5	-34.6	173.4	-68.2	-175	0	0	0	112.5	M1666 S1667 L1668 L1673 M1674 T1805	M1666-L1670 HydrophobicContact CE-CD1 4.25Å; M1666-L1670 HydrophobicContact CG-CD1 4.43Å; M1666-L1670 HydrophobicContact CG-CG 4.43Å; M1666-L1670 WeakPolarHBondContact O-CB 3.3Å; M1666-L1670 VanDerWaalsContact O-CG 3.28Å; M1666-L1670 WeakPolarHBondContact O-CG 3.42Å; M1666-L1670 PolarHBondContact O-N 2.92Å; S1667-L1670 PolarHBondContact O-N 2.73Å; L1668-L1670 VanDerWaalsContact C-N 3.3Å; L1668-L1670 PolarHBondContact O-N 2.91Å; L1670-L1673 HydrophobicContact CD2-CD2 3.94Å; L1670-L1673 WeakPolarHBondContact O-CB 3.24Å; L1670-L1673 PolarHBondContact O-N 2.95Å; L1670-M1674 WeakPolarHBondContact O-CB 3.47Å; L1670-M1674 PolarHBondContact O-N 2.73Å; L1670-T1805 HydrophobicContact CD2-CG2 3.71Å
1671	A	71.2	Confident	70	Confident	8 Å²	8	18.2 Å²	18.2	7%	0.066	11%	0.112	C	C	.	.	H	α-helix	trans	-66.8	-42.6	173.8	0	0	0	0	0	111.9	L1300 S1667 L1668 M1674 A1675	L1300-A1671 HydrophobicContact CB-CB 4.18Å; S1667-A1671 PolarHBondContact O-N 2.99Å; L1668-A1671 WeakPolarHBondContact O-CB 3.37Å; L1668-A1671 PolarHBondContact O-N 3Å; L1668-A1671 VanDerWaalsContact O-N 3.09Å; A1671-M1674 PolarHBondContact O-N 3.31Å; A1671-A1675 PolarHBondContact O-N 3.49Å; A1671-A1675 VanDerWaalsContact O-N 3.08Å
1672	F	72.1	Confident	71.2	Confident	6 Å²	6	17.7 Å²	17.7	3%	0.026	11%	0.109	C	C	.	.	H	α-helix	trans	-64	-42.3	172.3	-79.9	-78.5	0	0	0	112.1	L1297 L1668 A1669 M1674 A1675 F1676 A1728 L1732 W1847	L1297-F1672 HydrophobicContact CD2-CD1 3.28Å; L1297-F1672 HydrophobicContact CD2-CE1 3.36Å; L1297-F1672 HydrophobicContact CD2-CG 4.02Å; L1297-F1672 HydrophobicContact CD2-CZ 4.12Å; L1668-F1672 HydrophobicContact CD1-CD2 4.26Å; L1668-F1672 HydrophobicContact CD1-CE2 3.78Å; L1668-F1672 HydrophobicContact CG-CD2 4.14Å; L1668-F1672 HydrophobicContact CG-CE2 3.93Å; L1668-F1672 VanDerWaalsContact O-CD2 3.3Å; L1668-F1672 WeakPolarHBondContact O-CD2 3.39Å; L1668-F1672 PolarHBondContact O-N 3.17Å; A1669-F1672 PolarHBondContact O-N 3.2Å; F1672-M1674 PolarHBondContact O-N 2.89Å; F1672-A1675 PolarHBondContact O-N 2.92Å; F1672-F1676 HydrophobicContact CB-CD2 4.49Å; F1672-F1676 HydrophobicContact CB-CE2 4.48Å; F1672-F1676 AromaticContact CD1-CE2 3.95Å; F1672-F1676 HydrophobicContact CD1-CE2 3.95Å; F1672-F1676 WeakPolarHBondContact O-CD2 3.02Å; F1672-F1676 PolarHBondContact O-N 3.12Å; F1672-A1728 HydrophobicContact CE1-CB 4.47Å; F1672-L1732 HydrophobicContact CE1-CD1 4.27Å; F1672-L1732 HydrophobicContact CE1-CG 4.44Å; F1672-L1732 HydrophobicContact CE2-CD2 4.18Å; F1672-L1732 HydrophobicContact CZ-CD1 3.99Å; F1672-L1732 HydrophobicContact CZ-CD2 3.69Å; F1672-L1732 HydrophobicContact CZ-CG 3.88Å; F1672-W1847 HydrophobicContact CB-CD2 4.41Å; F1672-W1847 HydrophobicContact CB-CE3 3.98Å; F1672-W1847 HydrophobicContact CB-CH2 4.19Å; F1672-W1847 HydrophobicContact CB-CZ3 3.88Å; F1672-W1847 HydrophobicContact CD1-CE3 4.29Å; F1672-W1847 AromaticContact CD1-CH2 3.33Å; F1672-W1847 HydrophobicContact CD1-CH2 3.33Å; F1672-W1847 HydrophobicContact CD1-CZ2 4.29Å; F1672-W1847 AromaticContact CD1-CZ3 3.34Å; F1672-W1847 HydrophobicContact CD1-CZ3 3.34Å; F1672-W1847 AromaticContact CD2-CE3 3.75Å; F1672-W1847 HydrophobicContact CD2-CE3 3.75Å; F1672-W1847 HydrophobicContact CD2-CH2 4.24Å; F1672-W1847 AromaticContact CD2-CZ3 3.36Å; F1672-W1847 HydrophobicContact CD2-CZ3 3.36Å; F1672-W1847 AromaticContact CE1-CH2 3.66Å; F1672-W1847 HydrophobicContact CE1-CH2 3.66Å; F1672-W1847 AromaticContact CE1-CZ3 3.61Å; F1672-W1847 HydrophobicContact CE1-CZ3 3.61Å; F1672-W1847 HydrophobicContact CE2-CE3 4.33Å; F1672-W1847 AromaticContact CE2-CZ3 3.65Å; F1672-W1847 HydrophobicContact CE2-CZ3 3.65Å; F1672-W1847 AromaticContact CG-CE3 3.75Å; F1672-W1847 HydrophobicContact CG-CE3 3.75Å; F1672-W1847 AromaticContact CG-CH2 3.67Å; F1672-W1847 HydrophobicContact CG-CH2 3.67Å; F1672-W1847 AromaticContact CG-CZ3 3.23Å; F1672-W1847 HydrophobicContact CG-CZ3 3.23Å; F1672-W1847 HydrophobicContact CZ-CH2 4.28Å; F1672-W1847 AromaticContact CZ-CZ3 3.78Å; F1672-W1847 HydrophobicContact CZ-CZ3 3.78Å
1673	L	75.9	Confident	72.5	Confident	2 Å²	2	16.8 Å²	16.8	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-56.5	-49.6	173.1	174.9	70.4	0	0	0	111.5	A1669 L1670 A1675 F1676 C1677 F1801 T1805 P1840 M1843 A1844	A1669-L1673 WeakPolarHBondContact O-CB 3.4Å; A1669-L1673 PolarHBondContact O-N 2.9Å; L1670-L1673 HydrophobicContact CD2-CD2 3.94Å; L1670-L1673 WeakPolarHBondContact O-CB 3.24Å; L1670-L1673 PolarHBondContact O-N 2.95Å; L1673-A1675 VanDerWaalsContact C-N 3.3Å; L1673-A1675 PolarHBondContact O-N 2.79Å; L1673-F1676 PolarHBondContact O-N 3.24Å; L1673-C1677 VanDerWaalsContact CD1-SG 3.51Å; L1673-C1677 VanDerWaalsContact O-CB 3.28Å; L1673-C1677 WeakPolarHBondContact O-CB 3.48Å; L1673-C1677 PolarHBondContact O-N 3.11Å; L1673-C1677 PolarHBondContact O-SG 3.02Å; L1673-F1801 HydrophobicContact CD2-CD2 4.19Å; L1673-F1801 HydrophobicContact CD2-CE2 4.49Å; L1673-F1801 HydrophobicContact CG-CD2 4.25Å; L1673-T1805 HydrophobicContact CD2-CG2 3.86Å; L1673-P1840 HydrophobicContact CD1-CB 4.16Å; L1673-P1840 VanDerWaalsContact CD1-O 3.26Å; L1673-P1840 WeakPolarHBondContact CD1-O 3.03Å; L1673-M1843 HydrophobicContact CD1-CE 3.56Å; L1673-A1844 HydrophobicContact CD1-CB 4.25Å; L1673-A1844 HydrophobicContact CD2-CB 4.03Å
1674	M	75.5	Confident	73.6	Confident	85 Å²	85	14.1 Å²	14.1	42%	0.419	8%	0.082	S	C	.	.	H	α-helix	trans	-57.2	-44.9	177.9	-166.4	-175	-175.8	0	0	111.6	L1670 A1671 F1672 S1678 F1801	L1670-M1674 WeakPolarHBondContact O-CB 3.47Å; L1670-M1674 PolarHBondContact O-N 2.73Å; A1671-M1674 PolarHBondContact O-N 3.31Å; F1672-M1674 PolarHBondContact O-N 2.89Å; M1674-S1678 PolarHBondContact O-N 2.75Å; M1674-F1801 HydrophobicContact CB-CD2 3.78Å; M1674-F1801 HydrophobicContact CB-CE2 3.61Å; M1674-F1801 HydrophobicContact CB-CZ 4.46Å; M1674-F1801 HydrophobicContact CG-CD2 4.04Å; M1674-F1801 HydrophobicContact CG-CE2 3.99Å; M1674-F1801 HydrophobicContact CG-CZ 4.49Å
1675	A	73.7	Confident	74.7	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-60.4	-53.4	177.7	0	0	0	0	0	111.4	L1297 A1671 F1672 L1673 S1678 V1679	L1297-A1675 HydrophobicContact CD1-CB 4.12Å; L1297-A1675 HydrophobicContact CD2-CB 3.8Å; L1297-A1675 HydrophobicContact CG-CB 3.7Å; A1671-A1675 PolarHBondContact O-N 3.49Å; A1671-A1675 VanDerWaalsContact O-N 3.08Å; F1672-A1675 PolarHBondContact O-N 2.92Å; L1673-A1675 VanDerWaalsContact C-N 3.3Å; L1673-A1675 PolarHBondContact O-N 2.79Å; A1675-S1678 WeakPolarHBondContact O-CB 3.44Å; A1675-S1678 PolarHBondContact O-N 3.2Å; A1675-S1678 PolarHBondContact O-OG 3.32Å; A1675-V1679 PolarHBondContact O-N 3.13Å
1676	F	75.9	Confident	75.8	Confident	3 Å²	3	16.2 Å²	16.2	1%	0.013	9%	0.089	C	C	.	.	H	α-helix	trans	-73.7	-33.6	-175.6	-69.8	-57.5	0	0	0	114.2	F1672 L1673 S1678 V1679 T1680 Y1721 M1725 A1728 M1843 W1847	F1672-F1676 HydrophobicContact CB-CD2 4.49Å; F1672-F1676 HydrophobicContact CB-CE2 4.48Å; F1672-F1676 AromaticContact CD1-CE2 3.95Å; F1672-F1676 HydrophobicContact CD1-CE2 3.95Å; F1672-F1676 WeakPolarHBondContact O-CD2 3.02Å; F1672-F1676 PolarHBondContact O-N 3.12Å; L1673-F1676 PolarHBondContact O-N 3.24Å; F1676-S1678 VanDerWaalsContact C-N 3.26Å; F1676-S1678 PolarHBondContact O-N 3.47Å; F1676-V1679 HydrophobicContact CD1-CG2 4.21Å; F1676-V1679 WeakPolarHBondContact O-CA 3.21Å; F1676-V1679 WeakPolarHBondContact O-CB 3.29Å; F1676-V1679 PolarHBondContact O-N 2.85Å; F1676-T1680 PolarHBondContact O-N 2.83Å; F1676-Y1721 HydrophobicContact CD1-CE2 4.19Å; F1676-M1725 HydrophobicContact CD1-CE 3.49Å; F1676-M1725 VanDerWaalsContact CD1-CE 3.49Å; F1676-M1725 HydrophobicContact CD1-SD 4.46Å; F1676-M1725 HydrophobicContact CD2-CE 3.83Å; F1676-M1725 HydrophobicContact CE1-CE 3.27Å; F1676-M1725 HydrophobicContact CE1-CG 4.23Å; F1676-M1725 HydrophobicContact CE1-SD 3.65Å; F1676-M1725 HydrophobicContact CE2-CE 3.6Å; F1676-M1725 HydrophobicContact CE2-SD 4.07Å; F1676-M1725 HydrophobicContact CG-CE 3.79Å; F1676-M1725 HydrophobicContact CZ-CE 3.33Å; F1676-M1725 HydrophobicContact CZ-SD 3.42Å; F1676-M1725 WeakPolarHBondContact CZ-SD 3.01Å; F1676-A1728 HydrophobicContact CZ-CB 3.84Å; F1676-M1843 HydrophobicContact CB-CE 3.71Å; F1676-M1843 HydrophobicContact CB-SD 3.96Å; F1676-M1843 HydrophobicContact CD2-SD 4.35Å; F1676-M1843 HydrophobicContact CG-SD 4.42Å; F1676-W1847 HydrophobicContact CE2-CH2 4.17Å; F1676-W1847 AromaticContact CE2-CZ2 3.92Å; F1676-W1847 HydrophobicContact CE2-CZ2 3.92Å
1677	C	80.3	Confident	76.6	Confident	1 Å²	1	14.8 Å²	14.8	1%	0.007	8%	0.082	C	C	.	.	H	α-helix	trans	-59.4	-37.5	168.7	-72.9	0	0	0	0	111.9	L1673 V1679 T1680 A1681 M1775 N1800 F1801	L1673-C1677 VanDerWaalsContact CD1-SG 3.51Å; L1673-C1677 VanDerWaalsContact O-CB 3.28Å; L1673-C1677 WeakPolarHBondContact O-CB 3.48Å; L1673-C1677 PolarHBondContact O-N 3.11Å; L1673-C1677 PolarHBondContact O-SG 3.02Å; C1677-V1679 VanDerWaalsContact C-N 3.3Å; C1677-V1679 PolarHBondContact O-N 2.79Å; C1677-T1680 PolarHBondContact O-OG1 3.03Å; C1677-A1681 VanDerWaalsContact O-CB 3.23Å; C1677-A1681 WeakPolarHBondContact O-CB 3.47Å; C1677-A1681 PolarHBondContact O-N 3.12Å; C1677-A1681 VanDerWaalsContact O-N 3.1Å; C1677-M1775 HydrophobicContact CB-CE 4.3Å; C1677-N1800 HydrophobicContact CB-CB 4.08Å; C1677-F1801 HydrophobicContact CB-CB 4.48Å
1678	S	77	Confident	77.5	Confident	20 Å²	20	12.7 Å²	12.7	14%	0.14	7%	0.068	C	C	.	.	H	α-helix	trans	-69.4	-26.9	173.3	88.2	0	0	0	0	112.9	R1293 M1674 A1675 F1676 S1682	R1293-S1678 WeakPolarHBondContact CD-OG 3.34Å; R1293-S1678 PolarHBondContact NE-OG 3.25Å; R1293-S1678 VanDerWaalsContact NE-OG 3.1Å; R1293-S1678 PolarHBondContact NH2-O 2.9Å; M1674-S1678 PolarHBondContact O-N 2.75Å; A1675-S1678 WeakPolarHBondContact O-CB 3.44Å; A1675-S1678 PolarHBondContact O-N 3.2Å; A1675-S1678 PolarHBondContact O-OG 3.32Å; F1676-S1678 VanDerWaalsContact C-N 3.26Å; F1676-S1678 PolarHBondContact O-N 3.47Å; S1678-S1682 PolarHBondContact O-N 3.41Å
1679	V	77.7	Confident	78.3	Confident	3 Å²	3	15.1 Å²	15.1	2%	0.018	8%	0.079	C	C	.	.	H	α-helix	trans	-66.4	-59.2	173.3	-176.4	0	0	0	0	110.1	A1675 F1676 C1677 A1681 S1682 F1683 Y1721	A1675-V1679 PolarHBondContact O-N 3.13Å; F1676-V1679 HydrophobicContact CD1-CG2 4.21Å; F1676-V1679 WeakPolarHBondContact O-CA 3.21Å; F1676-V1679 WeakPolarHBondContact O-CB 3.29Å; F1676-V1679 PolarHBondContact O-N 2.85Å; C1677-V1679 VanDerWaalsContact C-N 3.3Å; C1677-V1679 PolarHBondContact O-N 2.79Å; V1679-A1681 VanDerWaalsContact C-N 3.32Å; V1679-A1681 PolarHBondContact O-N 3.41Å; V1679-S1682 PolarHBondContact O-N 2.91Å; V1679-S1682 PolarHBondContact O-OG 3.12Å; V1679-F1683 HydrophobicContact CG1-CE1 4.41Å; V1679-F1683 HydrophobicContact CG1-CE2 3.9Å; V1679-F1683 HydrophobicContact CG1-CZ 3.61Å; V1679-Y1721 HydrophobicContact CB-CD2 4.23Å; V1679-Y1721 HydrophobicContact CB-CE2 4.23Å; V1679-Y1721 HydrophobicContact CG1-CD2 3.57Å; V1679-Y1721 HydrophobicContact CG1-CE2 4.07Å
1680	T	79.9	Confident	79	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-63.4	-38.9	-174	58.2	0	0	0	0	112.2	F1676 C1677 S1682 F1683 Y1721 M1775	F1676-T1680 PolarHBondContact O-N 2.83Å; C1677-T1680 PolarHBondContact O-OG1 3.03Å; T1680-S1682 VanDerWaalsContact C-N 3.26Å; T1680-S1682 PolarHBondContact O-N 3.17Å; T1680-F1683 PolarHBondContact O-N 2.83Å; T1680-Y1721 HydrophobicContact CG2-CD2 4.2Å; T1680-Y1721 HydrophobicContact CG2-CE2 3.7Å; T1680-M1775 HydrophobicContact CG2-CB 4.21Å; T1680-M1775 HydrophobicContact CG2-CE 3.89Å; T1680-M1775 HydrophobicContact CG2-CG 3.85Å; T1680-M1775 HydrophobicContact CG2-SD 4.27Å; T1680-M1775 VanDerWaalsContact OG1-CE 3.29Å; T1680-M1775 WeakPolarHBondContact OG1-CE 3.32Å
1681	A	82	Confident	79.5	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.6	-31.2	174.3	0	0	0	0	0	113.3	C1677 V1679 F1683 S1684 F1793 L1796 S1797	C1677-A1681 VanDerWaalsContact O-CB 3.23Å; C1677-A1681 WeakPolarHBondContact O-CB 3.47Å; C1677-A1681 PolarHBondContact O-N 3.12Å; C1677-A1681 VanDerWaalsContact O-N 3.1Å; V1679-A1681 VanDerWaalsContact C-N 3.32Å; V1679-A1681 PolarHBondContact O-N 3.41Å; A1681-F1683 VanDerWaalsContact C-N 3.35Å; A1681-F1683 PolarHBondContact O-N 2.83Å; A1681-S1684 WeakPolarHBondContact O-CB 3.28Å; A1681-S1684 PolarHBondContact O-N 2.92Å; A1681-S1684 PolarHBondContact O-OG 3.04Å; A1681-F1793 HydrophobicContact CB-CD2 3.99Å; A1681-F1793 HydrophobicContact CB-CE2 4.23Å; A1681-L1796 HydrophobicContact CB-CB 3.86Å; A1681-S1797 WeakPolarHBondContact CB-OG 3.48Å
1682	S	80.4	Confident	79.8	Confident	6 Å²	6	19.2 Å²	19.2	4%	0.042	10%	0.104	C	C	.	.	H	α-helix	trans	-72.7	-24.6	-178.6	67.4	0	0	0	0	114.5	R1293 S1678 V1679 T1680 S1684 I1685	R1293-S1682 PolarHBondContact NH1-OG 3.12Å; R1293-S1682 PolarHBondContact NH2-OG 3.45Å; S1678-S1682 PolarHBondContact O-N 3.41Å; V1679-S1682 PolarHBondContact O-N 2.91Å; V1679-S1682 PolarHBondContact O-OG 3.12Å; T1680-S1682 VanDerWaalsContact C-N 3.26Å; T1680-S1682 PolarHBondContact O-N 3.17Å; S1682-S1684 PolarHBondContact O-N 3.06Å; S1682-I1685 VanDerWaalsContact O-CB 3.31Å; S1682-I1685 WeakPolarHBondContact O-CB 3.36Å; S1682-I1685 WeakPolarHBondContact O-CG1 3.5Å; S1682-I1685 PolarHBondContact O-N 2.94Å
1683	F	82	Confident	80	Confident	7 Å²	7	20.9 Å²	20.9	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-64.3	-26.4	173.8	-55.9	-41.2	0	0	0	111.9	V1679 T1680 A1681 I1685 D1717 V1720 Y1721 I1776 Y1780	V1679-F1683 HydrophobicContact CG1-CE1 4.41Å; V1679-F1683 HydrophobicContact CG1-CE2 3.9Å; V1679-F1683 HydrophobicContact CG1-CZ 3.61Å; T1680-F1683 PolarHBondContact O-N 2.83Å; A1681-F1683 VanDerWaalsContact C-N 3.35Å; A1681-F1683 PolarHBondContact O-N 2.83Å; F1683-I1685 VanDerWaalsContact C-N 3.26Å; F1683-I1685 PolarHBondContact O-N 3.12Å; F1683-D1717 HydrophobicContact CB-CB 4.16Å; F1683-D1717 WeakPolarHBondContact CB-OD2 3.35Å; F1683-D1717 HydrophobicContact CD1-CB 3.61Å; F1683-D1717 WeakPolarHBondContact CD1-OD1 3.23Å; F1683-D1717 HydrophobicContact CD2-CB 3.88Å; F1683-D1717 HydrophobicContact CE1-CB 3.84Å; F1683-D1717 HydrophobicContact CE2-CB 4.08Å; F1683-D1717 HydrophobicContact CG-CB 3.62Å; F1683-D1717 HydrophobicContact CZ-CB 4.06Å; F1683-D1717 WeakPolarHBondContact CZ-O 3.39Å; F1683-V1720 HydrophobicContact CE1-CB 4.09Å; F1683-V1720 HydrophobicContact CE1-CG1 3.92Å; F1683-V1720 HydrophobicContact CZ-CB 4.35Å; F1683-V1720 HydrophobicContact CZ-CG1 4.3Å; F1683-Y1721 HydrophobicContact CE2-CD2 4.08Å; F1683-Y1721 HydrophobicContact CZ-CD2 4.41Å; F1683-I1776 HydrophobicContact CD2-CD1 4.24Å; F1683-I1776 HydrophobicContact CD2-CG1 3.91Å; F1683-I1776 HydrophobicContact CE2-CD1 3.97Å; F1683-I1776 HydrophobicContact CE2-CG1 4.01Å; F1683-Y1780 HydrophobicContact CB-CE1 4.2Å
1684	S	82.5	Confident	80.2	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.5	-25.5	172.9	79.3	0	0	0	0	113.8	A1681 S1682 F1686 A1687 V1688 L1796	A1681-S1684 WeakPolarHBondContact O-CB 3.28Å; A1681-S1684 PolarHBondContact O-N 2.92Å; A1681-S1684 PolarHBondContact O-OG 3.04Å; S1682-S1684 PolarHBondContact O-N 3.06Å; S1684-F1686 PolarHBondContact O-N 3.2Å; S1684-A1687 PolarHBondContact O-N 2.96Å; S1684-V1688 WeakPolarHBondContact O-CG2 3.23Å; S1684-V1688 PolarHBondContact O-N 3.43Å; S1684-L1796 WeakPolarHBondContact OG-CD1 3.36Å
1685	I	81.8	Confident	80.6	Confident	45 Å²	45	19.7 Å²	19.7	23%	0.231	11%	0.112	C	C	.	.	H	α-helix	trans	-57.5	-50.4	-176.1	-64.8	171	0	0	0	110.1	S1682 F1683 A1687 V1688 E1689 P1789 F1793	S1682-I1685 VanDerWaalsContact O-CB 3.31Å; S1682-I1685 WeakPolarHBondContact O-CB 3.36Å; S1682-I1685 WeakPolarHBondContact O-CG1 3.5Å; S1682-I1685 PolarHBondContact O-N 2.94Å; F1683-I1685 VanDerWaalsContact C-N 3.26Å; F1683-I1685 PolarHBondContact O-N 3.12Å; I1685-A1687 PolarHBondContact O-N 3.29Å; I1685-V1688 PolarHBondContact O-N 3.24Å; I1685-E1689 WeakPolarHBondContact O-CB 3.31Å; I1685-E1689 PolarHBondContact O-N 2.63Å; I1685-P1789 HydrophobicContact CG2-CB 4.04Å; I1685-F1793 HydrophobicContact CD1-CB 3.92Å; I1685-F1793 HydrophobicContact CD1-CD2 4.06Å; I1685-F1793 HydrophobicContact CD1-CG 3.89Å; I1685-F1793 HydrophobicContact CG1-CB 3.67Å; I1685-F1793 HydrophobicContact CG1-CD2 4.42Å; I1685-F1793 HydrophobicContact CG1-CG 4.19Å
1686	F	82.9	Confident	81.1	Confident	31 Å²	31	20.5 Å²	20.5	14%	0.136	12%	0.116	C	C	.	.	H	α-helix	trans	-65.7	-38	-179.4	-68.4	-73.8	0	0	0	112.4	R1275 N1278 I1279 S1684 E1689 D1690	R1275-F1686 VanDerWaalsContact NH2-CD2 3.26Å; N1278-F1686 HydrophobicContact CB-CE1 4Å; I1279-F1686 HydrophobicContact CG1-CZ 4.11Å; S1684-F1686 PolarHBondContact O-N 3.2Å; F1686-E1689 PolarHBondContact O-N 3.08Å; F1686-D1690 WeakPolarHBondContact O-CB 3.47Å; F1686-D1690 PolarHBondContact O-N 2.8Å
1687	A	84.2	Confident	81.5	Confident	4 Å²	4	21.9 Å²	21.9	3%	0.033	12%	0.122	C	C	.	.	H	α-helix	trans	-66.8	-38.8	177.4	0	0	0	0	0	112.3	S1684 I1685 K1691 W1710	S1684-A1687 PolarHBondContact O-N 2.96Å; I1685-A1687 PolarHBondContact O-N 3.29Å; A1687-K1691 WeakPolarHBondContact O-CB 3.33Å; A1687-K1691 PolarHBondContact O-N 3.23Å; A1687-W1710 HydrophobicContact CB-CH2 4.31Å; A1687-W1710 HydrophobicContact CB-CZ3 4.24Å
1688	V	85	Confident	81.7	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-76.4	-34.4	175.6	-178.4	0	0	0	0	111.2	S1684 I1685 K1691 A1692 F1786 P1789	S1684-V1688 WeakPolarHBondContact O-CG2 3.23Å; S1684-V1688 PolarHBondContact O-N 3.43Å; I1685-V1688 PolarHBondContact O-N 3.24Å; V1688-K1691 WeakPolarHBondContact O-CB 3.37Å; V1688-K1691 PolarHBondContact O-N 3.33Å; V1688-A1692 VanDerWaalsContact O-CB 3.23Å; V1688-A1692 WeakPolarHBondContact O-CB 3.05Å; V1688-A1692 PolarHBondContact O-N 3.06Å; V1688-F1786 HydrophobicContact CG1-CB 4.28Å; V1688-F1786 HydrophobicContact CG2-CB 4.23Å; V1688-P1789 HydrophobicContact CB-CB 4.34Å; V1688-P1789 HydrophobicContact CB-CG 4.38Å; V1688-P1789 HydrophobicContact CG1-CB 4.3Å; V1688-P1789 HydrophobicContact CG1-CG 4.05Å
1689	E	83.8	Confident	82.2	Confident	54 Å²	54	21.1 Å²	21.1	25%	0.252	12%	0.116	S	C	.	.	H	α-helix	trans	-67.7	-44.1	177.2	-172.2	178	-150.8	0	0	111.7	I1685 F1686 K1691 A1692 S1693 P1789 R2074	I1685-E1689 WeakPolarHBondContact O-CB 3.31Å; I1685-E1689 PolarHBondContact O-N 2.63Å; F1686-E1689 PolarHBondContact O-N 3.08Å; E1689-K1691 PolarHBondContact O-N 3.49Å; E1689-A1692 PolarHBondContact O-N 2.81Å; E1689-S1693 WeakPolarHBondContact O-CB 3.1Å; E1689-S1693 PolarHBondContact O-N 2.73Å; E1689-S1693 PolarHBondContact O-OG 2.81Å; E1689-P1789 HydrophobicContact CB-CB 4.4Å; E1689-P1789 HydrophobicContact CB-CG 3.9Å; E1689-P1789 HydrophobicContact CG-CG 4.48Å; E1689-R2074 VanDerWaalsContact CD-NH2 3.33Å; E1689-R2074 IonicContact OE1-CZ 3.33Å; E1689-R2074 IonicContact OE1-NH1 2.89Å; E1689-R2074 PolarHBondContact OE1-NH1 3.23Å; E1689-R2074 IonicContact OE1-NH2 2.78Å; E1689-R2074 IonicContact OE2-CZ 2.97Å; E1689-R2074 IonicContact OE2-NH1 3.82Å; E1689-R2074 PolarHBondContact OE2-NH1 3.06Å; E1689-R2074 IonicContact OE2-NH2 2.71Å; E1689-R2074 PolarHBondContact OE2-NH2 3.3Å
1690	D	84	Confident	82.5	Confident	3 Å²	3	22.8 Å²	22.8	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-63.8	-29.3	172.7	-88.4	-5.1	0	0	0	112.4	Y1271 K1274 F1686 D1694 A1695 K1696 Y1709	Y1271-D1690 PolarHBondContact OH-OD2 2.93Å; K1274-D1690 IonicContact NZ-OD1 3.55Å; K1274-D1690 PolarHBondContact NZ-OD1 3.41Å; K1274-D1690 IonicContact NZ-OD2 3.69Å; K1274-D1690 PolarHBondContact NZ-OD2 3.25Å; F1686-D1690 WeakPolarHBondContact O-CB 3.47Å; F1686-D1690 PolarHBondContact O-N 2.8Å; D1690-D1694 CarbonylContact O-C 3.51Å; D1690-A1695 PolarHBondContact O-N 3.28Å; D1690-K1696 HydrophobicContact CB-CB 4.16Å; D1690-K1696 WeakPolarHBondContact O-CB 3.01Å; D1690-K1696 PolarHBondContact O-N 3.02Å; D1690-Y1709 PolarHBondContact OD2-OH 3.27Å
1691	K	83	Confident	82.5	Confident	74 Å²	74	23.3 Å²	23.3	32%	0.322	13%	0.126	S	C	.	.	H	α-helix	trans	-75.7	-42.9	173.5	-179.9	-171.8	171	-163.9	0	111.8	A1687 V1688 E1689 D1694 L1784 F1786	A1687-K1691 WeakPolarHBondContact O-CB 3.33Å; A1687-K1691 PolarHBondContact O-N 3.23Å; V1688-K1691 WeakPolarHBondContact O-CB 3.37Å; V1688-K1691 PolarHBondContact O-N 3.33Å; E1689-K1691 PolarHBondContact O-N 3.49Å; K1691-D1694 PolarHBondContact O-N 2.98Å; K1691-L1784 PolarHBondContact NZ-O 3.25Å; K1691-F1786 PolarHBondContact NZ-O 2.88Å
1692	A	76.6	Confident	82.4	Confident	59 Å²	59	23.3 Å²	23.3	49%	0.488	13%	0.127	S	C	.	.	H	α-helix	trans	-72.5	-33.1	-177.1	0	0	0	0	0	112.9	V1688 E1689 D1694 Q1787	V1688-A1692 VanDerWaalsContact O-CB 3.23Å; V1688-A1692 WeakPolarHBondContact O-CB 3.05Å; V1688-A1692 PolarHBondContact O-N 3.06Å; E1689-A1692 PolarHBondContact O-N 2.81Å; A1692-D1694 VanDerWaalsContact C-N 3.28Å; A1692-Q1787 WeakPolarHBondContact CB-O 3.31Å
1693	S	75.8	Confident	82.2	Confident	41 Å²	41	24.3 Å²	24.3	29%	0.287	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	1.8	173.2	59.4	0	0	0	0	113.8	E1689 A1695 A2070	E1689-S1693 WeakPolarHBondContact O-CB 3.1Å; E1689-S1693 PolarHBondContact O-N 2.73Å; E1689-S1693 PolarHBondContact O-OG 2.81Å; S1693-A1695 PolarHBondContact O-N 3.27Å; S1693-A1695 WeakPolarHBondContact OG-CB 3.19Å; S1693-A2070 WeakPolarHBondContact O-CA 3.17Å; S1693-A2070 VanDerWaalsContact O-CB 3.24Å; S1693-A2070 WeakPolarHBondContact O-CB 3.18Å
1694	D	80	Confident	82.2	Confident	60 Å²	60	24.4 Å²	24.4	32%	0.321	14%	0.138	S	C	.	.	S	Bend	trans	57.6	3	-170.4	-89.4	-38.7	0	0	0	116.2	D1690 K1691 A1692 K1696 H1697 L1698 K2040 A2070	D1690-D1694 CarbonylContact O-C 3.51Å; K1691-D1694 PolarHBondContact O-N 2.98Å; A1692-D1694 VanDerWaalsContact C-N 3.28Å; D1694-K1696 VanDerWaalsContact C-N 3.26Å; D1694-K1696 PolarHBondContact O-N 3.47Å; D1694-H1697 WeakPolarHBondContact O-CB 3.38Å; D1694-H1697 PolarHBondContact O-N 3.26Å; D1694-L1698 PolarHBondContact O-N 3.31Å; D1694-L1698 VanDerWaalsContact O-N 3.13Å; D1694-K2040 IonicContact OD1-NZ 3.3Å; D1694-K2040 PolarHBondContact OD1-NZ 2.83Å; D1694-K2040 IonicContact OD2-NZ 3.78Å; D1694-K2040 PolarHBondContact OD2-NZ 3.47Å; D1694-A2070 HydrophobicContact CB-CB 4.03Å
1695	A	83.6	Confident	82.1	Confident	2 Å²	2	27.5 Å²	27.5	2%	0.017	15%	0.15	C	C	.	.	H	α-helix	trans	-58.4	-36	179.4	0	0	0	0	0	112.4	D1690 S1693 H1697 L1698 H1699	D1690-A1695 PolarHBondContact O-N 3.28Å; S1693-A1695 PolarHBondContact O-N 3.27Å; S1693-A1695 WeakPolarHBondContact OG-CB 3.19Å; A1695-H1697 VanDerWaalsContact C-N 3.3Å; A1695-H1697 PolarHBondContact O-N 3.1Å; A1695-L1698 PolarHBondContact O-N 3.46Å; A1695-L1698 VanDerWaalsContact O-N 3.16Å; A1695-H1699 PolarHBondContact O-CD2 3.35Å; A1695-H1699 VanDerWaalsContact O-CG 3.27Å; A1695-H1699 PolarHBondContact O-N 3.5Å; A1695-H1699 PolarHBondContact O-NE2 3Å
1696	K	85.9	Confident	82.2	Confident	18 Å²	18	28.4 Å²	28.4	8%	0.078	15%	0.151	C	C	.	.	H	α-helix	trans	-56.9	-42.3	173.9	-173.3	176	175.1	-174.5	0	112.1	D1690 D1694 F1700 Y1709 W1710 E1918	D1690-K1696 HydrophobicContact CB-CB 4.16Å; D1690-K1696 WeakPolarHBondContact O-CB 3.01Å; D1690-K1696 PolarHBondContact O-N 3.02Å; D1694-K1696 VanDerWaalsContact C-N 3.26Å; D1694-K1696 PolarHBondContact O-N 3.47Å; K1696-F1700 HydrophobicContact CD-CE2 4.31Å; K1696-F1700 HydrophobicContact CD-CZ 4.35Å; K1696-F1700 VanDerWaalsContact CE-CZ 3.46Å; K1696-F1700 HydrophobicContact CG-CD2 4.47Å; K1696-F1700 HydrophobicContact CG-CE2 3.84Å; K1696-F1700 HydrophobicContact CG-CZ 3.91Å; K1696-F1700 WeakPolarHBondContact O-CG 3.38Å; K1696-F1700 PolarHBondContact O-N 2.73Å; K1696-Y1709 HydrophobicContact CD-CE1 4.08Å; K1696-Y1709 HydrophobicContact CG-CE1 4.4Å; K1696-Y1709 HydrophobicContact CG-CE2 4.37Å; K1696-W1710 VanDerWaalsContact NZ-CZ2 3.29Å; K1696-E1918 VanDerWaalsContact CE-OE1 3.25Å; K1696-E1918 WeakPolarHBondContact CE-OE1 3.14Å; K1696-E1918 IonicContact NZ-OE1 2.74Å; K1696-E1918 PolarHBondContact NZ-OE1 3.27Å; K1696-E1918 IonicContact NZ-OE2 3.7Å; K1696-E1918 PolarHBondContact NZ-OE2 3.44Å
1697	H	83.5	Confident	82.3	Confident	31 Å²	31	30.7 Å²	30.7	14%	0.144	16%	0.159	C	C	.	.	H	α-helix	trans	-65.8	-45.4	176.1	-175.8	64.6	0	0	0	110.6	D1694 A1695 H1699 F1700 V1701 T2038	D1694-H1697 WeakPolarHBondContact O-CB 3.38Å; D1694-H1697 PolarHBondContact O-N 3.26Å; A1695-H1697 VanDerWaalsContact C-N 3.3Å; A1695-H1697 PolarHBondContact O-N 3.1Å; H1697-H1699 VanDerWaalsContact C-N 3.33Å; H1697-H1699 PolarHBondContact O-N 2.96Å; H1697-F1700 PolarHBondContact O-N 3.2Å; H1697-F1700 VanDerWaalsContact O-N 3.16Å; H1697-V1701 WeakPolarHBondContact O-CG2 3.5Å; H1697-V1701 PolarHBondContact O-N 3.08Å; H1697-T2038 PolarHBondContact CE1-O 3.18Å; H1697-T2038 VanDerWaalsContact CE1-O 3.29Å; H1697-T2038 PolarHBondContact NE2-OG1 2.85Å
1698	L	84.9	Confident	82.4	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-61.1	-37.9	178.1	-173.8	57.8	0	0	0	112.7	D1694 A1695 S1702 Y2064 A2070 Y2084 I2131	D1694-L1698 PolarHBondContact O-N 3.31Å; D1694-L1698 VanDerWaalsContact O-N 3.13Å; A1695-L1698 PolarHBondContact O-N 3.46Å; A1695-L1698 VanDerWaalsContact O-N 3.16Å; L1698-S1702 VanDerWaalsContact O-CB 3.27Å; L1698-S1702 WeakPolarHBondContact O-CB 3.29Å; L1698-S1702 PolarHBondContact O-N 3.48Å; L1698-S1702 PolarHBondContact O-OG 3.43Å; L1698-Y2064 VanDerWaalsContact CD1-O 3.31Å; L1698-Y2064 WeakPolarHBondContact CD1-O 3.15Å; L1698-A2070 HydrophobicContact CB-CB 4.46Å; L1698-A2070 HydrophobicContact CD2-CB 4.15Å; L1698-Y2084 HydrophobicContact CD2-CE1 4.48Å; L1698-Y2084 WeakPolarHBondContact CD2-OH 3.33Å; L1698-Y2084 HydrophobicContact CG-CE1 4.13Å; L1698-I2131 HydrophobicContact CD2-CG2 4.41Å
1699	H	86.6	Confident	82.6	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.009	16%	0.158	C	C	.	.	H	α-helix	trans	-61.9	-43.3	173.8	-63.6	-42.8	0	0	0	112.2	A1695 H1697 S1702 G1703 M1704 Y2084 I2087	A1695-H1699 PolarHBondContact O-CD2 3.35Å; A1695-H1699 VanDerWaalsContact O-CG 3.27Å; A1695-H1699 PolarHBondContact O-N 3.5Å; A1695-H1699 PolarHBondContact O-NE2 3Å; H1697-H1699 VanDerWaalsContact C-N 3.33Å; H1697-H1699 PolarHBondContact O-N 2.96Å; H1699-S1702 PolarHBondContact O-N 3.27Å; H1699-G1703 PolarHBondContact O-N 3.26Å; H1699-M1704 HydrophobicContact CB-CB 4.27Å; H1699-M1704 HydrophobicContact CB-SD 4.21Å; H1699-M1704 WeakPolarHBondContact O-CB 3.42Å; H1699-M1704 PolarHBondContact O-N 3.14Å; H1699-Y2084 AromaticContact CE1-CE1 3.96Å; H1699-Y2084 AromaticContact CE1-CZ 3.58Å; H1699-Y2084 PolarHBondContact CE1-OH 2.73Å; H1699-Y2084 AromaticContact ND1-CE1 3.5Å; H1699-Y2084 AromaticContact ND1-CZ 3.63Å; H1699-Y2084 PolarHBondContact ND1-OH 2.94Å; H1699-I2087 HydrophobicContact CB-CD1 4.46Å; H1699-I2087 VanDerWaalsContact ND1-CD1 3.27Å; H1699-I2087 WeakPolarHBondContact ND1-CD1 3.48Å
1700	F	83.6	Confident	82.9	Confident	38 Å²	38	28.2 Å²	28.2	17%	0.167	15%	0.146	C	C	.	.	H	α-helix	trans	-69	-40.8	178.5	-64.4	-23.2	0	0	0	112.9	K1696 H1697 S1702 G1703 M1704 R1706 Y1709 E1918	K1696-F1700 HydrophobicContact CD-CE2 4.31Å; K1696-F1700 HydrophobicContact CD-CZ 4.35Å; K1696-F1700 VanDerWaalsContact CE-CZ 3.46Å; K1696-F1700 HydrophobicContact CG-CD2 4.47Å; K1696-F1700 HydrophobicContact CG-CE2 3.84Å; K1696-F1700 HydrophobicContact CG-CZ 3.91Å; K1696-F1700 WeakPolarHBondContact O-CG 3.38Å; K1696-F1700 PolarHBondContact O-N 2.73Å; H1697-F1700 PolarHBondContact O-N 3.2Å; H1697-F1700 VanDerWaalsContact O-N 3.16Å; F1700-S1702 VanDerWaalsContact C-N 3.29Å; F1700-S1702 PolarHBondContact O-N 3.29Å; F1700-G1703 PolarHBondContact O-N 2.04Å; F1700-M1704 HydrophobicContact CD1-CB 4.48Å; F1700-R1706 HydrophobicContact CD1-CG 4.26Å; F1700-R1706 HydrophobicContact CD2-CG 4.36Å; F1700-R1706 HydrophobicContact CE1-CB 4.34Å; F1700-R1706 HydrophobicContact CE1-CG 4.1Å; F1700-R1706 HydrophobicContact CE2-CG 4.18Å; F1700-R1706 HydrophobicContact CG-CG 4.4Å; F1700-R1706 HydrophobicContact CZ-CB 4.32Å; F1700-R1706 HydrophobicContact CZ-CG 4.05Å; F1700-Y1709 HydrophobicContact CE1-CG 4.09Å; F1700-Y1709 HydrophobicContact CZ-CD1 4.45Å; F1700-Y1709 HydrophobicContact CZ-CG 4.4Å; F1700-E1918 WeakPolarHBondContact CE2-OE1 3.46Å
1701	V	80.2	Confident	83.1	Confident	10 Å²	10	31 Å²	31	6%	0.061	16%	0.161	C	C	.	.	H	α-helix	trans	-66	-35.1	176	179	0	0	0	0	110.9	H1697 G1703 I2062 Y2064	H1697-V1701 WeakPolarHBondContact O-CG2 3.5Å; H1697-V1701 PolarHBondContact O-N 3.08Å; V1701-G1703 PolarHBondContact O-N 3.14Å; V1701-I2062 HydrophobicContact CG1-CB 3.86Å; V1701-I2062 HydrophobicContact CG1-CG2 4.14Å; V1701-I2062 PolarHBondContact O-N 2.61Å; V1701-Y2064 HydrophobicContact CG1-CG 4.45Å
1702	S	79.5	Confident	83.4	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.007	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	3.7	174.8	-55.6	0	0	0	0	114.9	L1698 H1699 F1700	L1698-S1702 VanDerWaalsContact O-CB 3.27Å; L1698-S1702 WeakPolarHBondContact O-CB 3.29Å; L1698-S1702 PolarHBondContact O-N 3.48Å; L1698-S1702 PolarHBondContact O-OG 3.43Å; H1699-S1702 PolarHBondContact O-N 3.27Å; F1700-S1702 VanDerWaalsContact C-N 3.29Å; F1700-S1702 PolarHBondContact O-N 3.29Å
1703	G	76.2	Confident	83.9	Confident	27 Å²	27	24.8 Å²	24.8	28%	0.278	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	101.5	5	175.1	0	0	0	0	0	116.7	Q1267 H1699 F1700 V1701 R1705	Q1267-G1703 PolarHBondContact NE2-O 3.47Å; H1699-G1703 PolarHBondContact O-N 3.26Å; F1700-G1703 PolarHBondContact O-N 2.04Å; V1701-G1703 PolarHBondContact O-N 3.14Å; G1703-R1705 PolarHBondContact O-N 3.37Å
1704	M	81.9	Confident	84.5	Confident	8 Å²	8	24.5 Å²	24.5	4%	0.039	12%	0.116	C	C	.	.			trans	-69.2	125.4	172.4	-172.3	172.9	-76.1	0	0	111	Y1271 H1699 F1700 Y1709 I2087	Y1271-M1704 HydrophobicContact CD2-CE 3.82Å; Y1271-M1704 HydrophobicContact CD2-SD 4.29Å; Y1271-M1704 HydrophobicContact CG-CE 4.15Å; H1699-M1704 HydrophobicContact CB-CB 4.27Å; H1699-M1704 HydrophobicContact CB-SD 4.21Å; H1699-M1704 WeakPolarHBondContact O-CB 3.42Å; H1699-M1704 PolarHBondContact O-N 3.14Å; F1700-M1704 HydrophobicContact CD1-CB 4.48Å; M1704-Y1709 HydrophobicContact SD-CD2 3.87Å; M1704-Y1709 HydrophobicContact SD-CG 4.35Å; M1704-I2087 HydrophobicContact CB-CG2 3.95Å; M1704-I2087 HydrophobicContact CE-CD1 3.74Å; M1704-I2087 HydrophobicContact CE-CG1 3.72Å; M1704-I2087 HydrophobicContact CE-CG2 4.44Å
1705	R	80.9	Confident	84.9	Confident	66 Å²	66	24.5 Å²	24.5	25%	0.249	12%	0.118	C	C	.	.			trans	-70.6	137.3	175.8	-60.6	174.2	179.5	168.7	-1.5	110.4	G1703 W1707 L1708 Y1709	G1703-R1705 PolarHBondContact O-N 3.37Å; R1705-W1707 VanDerWaalsContact C-N 3.35Å; R1705-W1707 PolarHBondContact O-N 3.18Å; R1705-L1708 HydrophobicContact CB-CB 4.15Å; R1705-L1708 HydrophobicContact CB-CD1 3.82Å; R1705-L1708 HydrophobicContact CG-CD1 4.19Å; R1705-L1708 VanDerWaalsContact O-CB 3.3Å; R1705-L1708 WeakPolarHBondContact O-CB 3.47Å; R1705-L1708 PolarHBondContact O-N 3.03Å; R1705-L1708 VanDerWaalsContact O-N 3.12Å; R1705-Y1709 PolarHBondContact O-N 3.29Å
1706	R	84.4	Confident	85.1	Confident	63 Å²	63	25.4 Å²	25.4	24%	0.238	12%	0.122	C	C	.	.	H	α-helix	trans	-57.7	-39.8	-173.6	-63.4	-179.1	-174.5	-162.4	-1	114.2	F1700 E1918 Y1919	F1700-R1706 HydrophobicContact CD1-CG 4.26Å; F1700-R1706 HydrophobicContact CD2-CG 4.36Å; F1700-R1706 HydrophobicContact CE1-CB 4.34Å; F1700-R1706 HydrophobicContact CE1-CG 4.1Å; F1700-R1706 HydrophobicContact CE2-CG 4.18Å; F1700-R1706 HydrophobicContact CG-CG 4.4Å; F1700-R1706 HydrophobicContact CZ-CB 4.32Å; F1700-R1706 HydrophobicContact CZ-CG 4.05Å; R1706-E1918 HydrophobicContact CB-CG 4.18Å; R1706-E1918 HydrophobicContact CG-CG 4.43Å; R1706-E1918 PolarHBondContact NH1-O 3.43Å; R1706-Y1919 HydrophobicContact CB-CE2 4.31Å
1707	W	84.7	Confident	85.1	Confident	80 Å²	80	24.6 Å²	24.6	30%	0.303	12%	0.118	S	C	.	.	H	α-helix	trans	-71.4	-35.5	178.5	62.4	-97.6	0	0	0	112.8	V1264 R1705 Y1709 W1710 I1711 L1915	V1264-W1707 HydrophobicContact CG1-CH2 4.37Å; R1705-W1707 VanDerWaalsContact C-N 3.35Å; R1705-W1707 PolarHBondContact O-N 3.18Å; W1707-Y1709 PolarHBondContact O-N 3.41Å; W1707-W1710 PolarHBondContact O-N 3.06Å; W1707-W1710 VanDerWaalsContact O-N 3.17Å; W1707-I1711 HydrophobicContact CE3-CD1 3.64Å; W1707-I1711 HydrophobicContact CE3-CG1 4.38Å; W1707-I1711 HydrophobicContact CZ3-CD1 3.84Å; W1707-I1711 PolarHBondContact O-N 3.25Å; W1707-L1915 HydrophobicContact CB-CD1 4.4Å; W1707-L1915 HydrophobicContact CB-CD2 3.74Å
1708	L	87.2	Confident	85.1	Confident	4 Å²	4	25 Å²	25	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-63	-40.8	178.5	-109.8	143.3	0	0	0	112.4	V1264 Q1267 V1268 R1705 W1710 I1711 A1712	V1264-L1708 HydrophobicContact CB-CD1 4.47Å; V1264-L1708 HydrophobicContact CG1-CD1 4.29Å; V1264-L1708 HydrophobicContact CG1-CD2 4.12Å; V1264-L1708 HydrophobicContact CG2-CD1 4.06Å; Q1267-L1708 HydrophobicContact CB-CD2 4.17Å; V1268-L1708 HydrophobicContact CG2-CD2 3.36Å; R1705-L1708 HydrophobicContact CB-CB 4.15Å; R1705-L1708 HydrophobicContact CB-CD1 3.82Å; R1705-L1708 HydrophobicContact CG-CD1 4.19Å; R1705-L1708 VanDerWaalsContact O-CB 3.3Å; R1705-L1708 WeakPolarHBondContact O-CB 3.47Å; R1705-L1708 PolarHBondContact O-N 3.03Å; R1705-L1708 VanDerWaalsContact O-N 3.12Å; L1708-W1710 VanDerWaalsContact C-N 3.31Å; L1708-W1710 PolarHBondContact O-N 3.31Å; L1708-I1711 PolarHBondContact O-N 2.89Å; L1708-A1712 WeakPolarHBondContact O-CB 3.26Å; L1708-A1712 PolarHBondContact O-N 2.74Å
1709	Y	88.6	Confident	85.1	Confident	1 Å²	1	29.9 Å²	29.9	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-54.7	-46.6	171.5	174.1	-93.5	0	0	0	111.8	Y1271 D1690 K1696 F1700 M1704 R1705 W1707 N1713	Y1271-Y1709 HydrophobicContact CE1-CE2 4.48Å; Y1271-Y1709 AromaticContact CE2-CD2 3.85Å; Y1271-Y1709 HydrophobicContact CE2-CD2 3.85Å; Y1271-Y1709 AromaticContact CE2-CE2 3.67Å; Y1271-Y1709 HydrophobicContact CE2-CE2 3.67Å; Y1271-Y1709 AromaticContact CZ-CD2 3.87Å; Y1271-Y1709 AromaticContact CZ-CE2 3.53Å; Y1271-Y1709 WeakPolarHBondContact OH-CE2 3.44Å; D1690-Y1709 PolarHBondContact OD2-OH 3.27Å; K1696-Y1709 HydrophobicContact CD-CE1 4.08Å; K1696-Y1709 HydrophobicContact CG-CE1 4.4Å; K1696-Y1709 HydrophobicContact CG-CE2 4.37Å; F1700-Y1709 HydrophobicContact CE1-CG 4.09Å; F1700-Y1709 HydrophobicContact CZ-CD1 4.45Å; F1700-Y1709 HydrophobicContact CZ-CG 4.4Å; M1704-Y1709 HydrophobicContact SD-CD2 3.87Å; M1704-Y1709 HydrophobicContact SD-CG 4.35Å; R1705-Y1709 PolarHBondContact O-N 3.29Å; W1707-Y1709 PolarHBondContact O-N 3.41Å; Y1709-N1713 WeakPolarHBondContact CE1-ND2 3.45Å; Y1709-N1713 VanDerWaalsContact CZ-ND2 3.34Å; Y1709-N1713 PolarHBondContact O-N 2.88Å; Y1709-N1713 VanDerWaalsContact O-N 3.14Å; Y1709-N1713 PolarHBondContact O-ND2 3.17Å
1710	W	89.7	Confident	84.7	Confident	1 Å²	1	31.8 Å²	31.8	0%	0.004	16%	0.158	C	C	.	.	H	α-helix	trans	-72.9	-39.5	-178.4	-72.7	121.3	0	0	0	112.8	A1687 K1696 W1707 L1708 N1713 F1714 Y1780 L1784 F1911 L1914 E1918	A1687-W1710 HydrophobicContact CB-CH2 4.31Å; A1687-W1710 HydrophobicContact CB-CZ3 4.24Å; K1696-W1710 VanDerWaalsContact NZ-CZ2 3.29Å; W1707-W1710 PolarHBondContact O-N 3.06Å; W1707-W1710 VanDerWaalsContact O-N 3.17Å; L1708-W1710 VanDerWaalsContact C-N 3.31Å; L1708-W1710 PolarHBondContact O-N 3.31Å; W1710-N1713 PolarHBondContact O-N 3.39Å; W1710-F1714 VanDerWaalsContact O-CB 3.28Å; W1710-F1714 WeakPolarHBondContact O-CB 3.48Å; W1710-F1714 PolarHBondContact O-N 2.94Å; W1710-Y1780 AromaticContact CE3-CD2 3.84Å; W1710-Y1780 HydrophobicContact CE3-CD2 3.84Å; W1710-Y1780 HydrophobicContact CE3-CE2 4.23Å; W1710-Y1780 HydrophobicContact CE3-CG 4.07Å; W1710-Y1780 HydrophobicContact CH2-CG 4.42Å; W1710-Y1780 AromaticContact CZ3-CD1 3.87Å; W1710-Y1780 HydrophobicContact CZ3-CD1 3.87Å; W1710-Y1780 AromaticContact CZ3-CD2 3.84Å; W1710-Y1780 HydrophobicContact CZ3-CD2 3.84Å; W1710-Y1780 HydrophobicContact CZ3-CE1 4.4Å; W1710-Y1780 HydrophobicContact CZ3-CE2 4.39Å; W1710-Y1780 AromaticContact CZ3-CG 3.56Å; W1710-Y1780 HydrophobicContact CZ3-CG 3.56Å; W1710-L1784 HydrophobicContact CH2-CD2 4.4Å; W1710-L1784 HydrophobicContact CZ2-CD2 4.04Å; W1710-F1911 HydrophobicContact CB-CE2 4.05Å; W1710-F1911 HydrophobicContact CB-CZ 3.97Å; W1710-L1914 HydrophobicContact CB-CD2 4.45Å; W1710-L1914 HydrophobicContact CD2-CD2 3.68Å; W1710-L1914 HydrophobicContact CD2-CG 4.15Å; W1710-L1914 HydrophobicContact CE3-CD2 3.79Å; W1710-L1914 HydrophobicContact CG-CD2 4.01Å; W1710-L1914 HydrophobicContact CG-CG 4.45Å; W1710-L1914 HydrophobicContact CH2-CD1 4.07Å; W1710-L1914 HydrophobicContact CZ2-CD1 3.8Å; W1710-L1914 HydrophobicContact CZ2-CD2 4.41Å; W1710-L1914 HydrophobicContact CZ2-CG 4.25Å; W1710-L1914 HydrophobicContact CZ3-CD2 4.22Å; W1710-E1918 WeakPolarHBondContact CZ2-OE2 3.33Å; W1710-E1918 PolarHBondContact NE1-OE2 2.77Å
1711	I	88.4	Confident	84.5	Confident	62 Å²	62	30 Å²	30	32%	0.318	15%	0.151	S	C	.	.	H	α-helix	trans	-62.2	-45.6	173.6	-67.2	-173.1	0	0	0	111	W1707 L1708 N1713 F1714 V1715 F1911	W1707-I1711 HydrophobicContact CE3-CD1 3.64Å; W1707-I1711 HydrophobicContact CE3-CG1 4.38Å; W1707-I1711 HydrophobicContact CZ3-CD1 3.84Å; W1707-I1711 PolarHBondContact O-N 3.25Å; L1708-I1711 PolarHBondContact O-N 2.89Å; I1711-N1713 PolarHBondContact O-N 3.48Å; I1711-F1714 PolarHBondContact O-N 2.6Å; I1711-V1715 HydrophobicContact CG2-CG2 4.12Å; I1711-V1715 WeakPolarHBondContact O-CG2 3.49Å; I1711-V1715 PolarHBondContact O-N 3.07Å; I1711-F1911 HydrophobicContact CG1-CE1 4.1Å; I1711-F1911 HydrophobicContact CG1-CZ 3.64Å
1712	A	88.4	Confident	84.3	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-38.9	-179.6	0	0	0	0	0	112.5	V1268 Y1271 L1708 F1716	V1268-A1712 HydrophobicContact CG1-CB 4.3Å; Y1271-A1712 HydrophobicContact CD1-CB 3.76Å; Y1271-A1712 HydrophobicContact CG-CB 4.5Å; L1708-A1712 WeakPolarHBondContact O-CB 3.26Å; L1708-A1712 PolarHBondContact O-N 2.74Å; A1712-F1716 WeakPolarHBondContact O-CB 3.22Å; A1712-F1716 PolarHBondContact O-N 3.21Å
1713	N	88.5	Confident	84.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.4	-45.7	171.1	-76	-66.2	0	0	0	111.7	Y1271 R1275 Y1709 W1710 I1711 F1716 D1717 Y1780	Y1271-N1713 WeakPolarHBondContact CE1-ND2 3.41Å; Y1271-N1713 VanDerWaalsContact CE1-OD1 3.26Å; Y1271-N1713 WeakPolarHBondContact CE1-OD1 3.43Å; Y1271-N1713 PolarHBondContact OH-ND2 3.33Å; Y1271-N1713 PolarHBondContact OH-OD1 3.23Å; R1275-N1713 PolarHBondContact NH1-OD1 3.18Å; Y1709-N1713 WeakPolarHBondContact CE1-ND2 3.45Å; Y1709-N1713 VanDerWaalsContact CZ-ND2 3.34Å; Y1709-N1713 PolarHBondContact O-N 2.88Å; Y1709-N1713 VanDerWaalsContact O-N 3.14Å; Y1709-N1713 PolarHBondContact O-ND2 3.17Å; W1710-N1713 PolarHBondContact O-N 3.39Å; I1711-N1713 PolarHBondContact O-N 3.48Å; N1713-F1716 PolarHBondContact O-N 3.23Å; N1713-D1717 WeakPolarHBondContact O-CB 3.32Å; N1713-D1717 PolarHBondContact O-N 3.1Å; N1713-Y1780 HydrophobicContact CB-CE2 4.49Å; N1713-Y1780 PolarHBondContact O-OH 3.33Å
1714	F	88.3	Confident	84	Confident	36 Å²	36	37.5 Å²	37.5	16%	0.158	18%	0.178	C	C	.	.	H	α-helix	trans	-60.7	-48.9	-179	175.2	-100.1	0	0	0	112.7	W1710 I1711 F1716 D1717 L1718 V1773 I1776 P1777 Y1780 F1911	W1710-F1714 VanDerWaalsContact O-CB 3.28Å; W1710-F1714 WeakPolarHBondContact O-CB 3.48Å; W1710-F1714 PolarHBondContact O-N 2.94Å; I1711-F1714 PolarHBondContact O-N 2.6Å; F1714-F1716 VanDerWaalsContact C-N 3.35Å; F1714-F1716 PolarHBondContact O-N 3.33Å; F1714-D1717 PolarHBondContact O-N 3.5Å; F1714-L1718 HydrophobicContact CE1-CD2 4.33Å; F1714-L1718 HydrophobicContact CZ-CD2 4.48Å; F1714-L1718 VanDerWaalsContact O-CB 3.31Å; F1714-L1718 WeakPolarHBondContact O-CB 3.33Å; F1714-L1718 PolarHBondContact O-N 3.03Å; F1714-V1773 HydrophobicContact CZ-CB 4.24Å; F1714-V1773 HydrophobicContact CZ-CG1 3.98Å; F1714-V1773 HydrophobicContact CZ-CG2 4.12Å; F1714-I1776 HydrophobicContact CD2-CB 4.24Å; F1714-I1776 HydrophobicContact CD2-CG2 3.83Å; F1714-I1776 HydrophobicContact CE2-CB 4.29Å; F1714-I1776 HydrophobicContact CE2-CG2 4.38Å; F1714-P1777 HydrophobicContact CD2-CG 4.12Å; F1714-P1777 HydrophobicContact CE2-CG 3.98Å; F1714-Y1780 HydrophobicContact CB-CE2 4.4Å; F1714-F1911 HydrophobicContact CB-CE2 4.35Å
1715	V	87.3	Confident	83.5	Confident	59 Å²	59	37.4 Å²	37.4	36%	0.358	18%	0.177	S	C	.	.	H	α-helix	trans	-62.7	-41.7	178.4	173.4	0	0	0	0	111.3	M1272 I1711 L1719	M1272-V1715 HydrophobicContact CE-CG1 4.13Å; I1711-V1715 HydrophobicContact CG2-CG2 4.12Å; I1711-V1715 WeakPolarHBondContact O-CG2 3.49Å; I1711-V1715 PolarHBondContact O-N 3.07Å; V1715-L1719 WeakPolarHBondContact O-CG 3.41Å; V1715-L1719 PolarHBondContact O-N 3.45Å
1716	F	87.4	Confident	83.2	Confident	22 Å²	22	37.6 Å²	37.6	10%	0.096	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-47.6	176.9	-167.5	-82.3	0	0	0	111.8	M1272 R1275 F1276 I1279 A1712 N1713 F1714 L1719 V1720	M1272-F1716 HydrophobicContact CE-CD2 4.26Å; M1272-F1716 HydrophobicContact SD-CB 3.68Å; M1272-F1716 HydrophobicContact SD-CD2 3.85Å; M1272-F1716 HydrophobicContact SD-CG 4.27Å; R1275-F1716 HydrophobicContact CB-CD1 3.94Å; R1275-F1716 HydrophobicContact CB-CD2 3.65Å; R1275-F1716 HydrophobicContact CB-CE1 3.99Å; R1275-F1716 HydrophobicContact CB-CE2 3.68Å; R1275-F1716 HydrophobicContact CB-CG 3.79Å; R1275-F1716 HydrophobicContact CB-CZ 3.86Å; R1275-F1716 HydrophobicContact CG-CD1 4.45Å; R1275-F1716 HydrophobicContact CG-CD2 4.42Å; R1275-F1716 HydrophobicContact CG-CG 4.21Å; F1276-F1716 HydrophobicContact CB-CE2 4.13Å; F1276-F1716 HydrophobicContact CB-CZ 4.48Å; I1279-F1716 HydrophobicContact CD1-CE1 3.44Å; I1279-F1716 VanDerWaalsContact CD1-CE1 3.44Å; I1279-F1716 HydrophobicContact CD1-CZ 3.81Å; A1712-F1716 WeakPolarHBondContact O-CB 3.22Å; A1712-F1716 PolarHBondContact O-N 3.21Å; N1713-F1716 PolarHBondContact O-N 3.23Å; F1714-F1716 VanDerWaalsContact C-N 3.35Å; F1714-F1716 PolarHBondContact O-N 3.33Å; F1716-L1719 WeakPolarHBondContact O-CB 3.26Å; F1716-L1719 PolarHBondContact O-N 3.19Å; F1716-V1720 HydrophobicContact CD1-CG2 4.05Å; F1716-V1720 HydrophobicContact CE1-CG2 3.65Å; F1716-V1720 HydrophobicContact CZ-CG2 4.48Å; F1716-V1720 PolarHBondContact O-N 2.68Å
1717	D	86.8	Confident	82.6	Confident	1 Å²	1	37 Å²	37	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-76.7	-27.1	-174.5	-73.9	-29.1	0	0	0	112.8	R1275 F1683 N1713 F1714 V1720 Y1721 Y1780	R1275-D1717 IonicContact CZ-OD1 3.46Å; R1275-D1717 IonicContact CZ-OD2 3.26Å; R1275-D1717 VanDerWaalsContact CZ-OD2 3.27Å; R1275-D1717 IonicContact NH1-OD2 3.73Å; R1275-D1717 PolarHBondContact NH1-OD2 3.16Å; R1275-D1717 IonicContact NH2-OD1 3.75Å; R1275-D1717 PolarHBondContact NH2-OD1 3.43Å; R1275-D1717 IonicContact NH2-OD2 3.6Å; R1275-D1717 PolarHBondContact NH2-OD2 2.94Å; F1683-D1717 HydrophobicContact CB-CB 4.16Å; F1683-D1717 WeakPolarHBondContact CB-OD2 3.35Å; F1683-D1717 HydrophobicContact CD1-CB 3.61Å; F1683-D1717 WeakPolarHBondContact CD1-OD1 3.23Å; F1683-D1717 HydrophobicContact CD2-CB 3.88Å; F1683-D1717 HydrophobicContact CE1-CB 3.84Å; F1683-D1717 HydrophobicContact CE2-CB 4.08Å; F1683-D1717 HydrophobicContact CG-CB 3.62Å; F1683-D1717 HydrophobicContact CZ-CB 4.06Å; F1683-D1717 WeakPolarHBondContact CZ-O 3.39Å; N1713-D1717 WeakPolarHBondContact O-CB 3.32Å; N1713-D1717 PolarHBondContact O-N 3.1Å; F1714-D1717 PolarHBondContact O-N 3.5Å; D1717-V1720 PolarHBondContact O-N 2.68Å; D1717-Y1721 WeakPolarHBondContact O-CB 3.49Å; D1717-Y1721 PolarHBondContact O-N 2.72Å; D1717-Y1780 PolarHBondContact OD2-OH 3.33Å
1718	L	84.8	Confident	81.9	Confident	38 Å²	38	33.3 Å²	33.3	20%	0.199	17%	0.174	C	C	.	.	H	α-helix	trans	-61	-44	166.5	-175.7	65	0	0	0	111.7	F1714 V1720 Y1721 M1722 L1769 S1772 V1773	F1714-L1718 HydrophobicContact CE1-CD2 4.33Å; F1714-L1718 HydrophobicContact CZ-CD2 4.48Å; F1714-L1718 VanDerWaalsContact O-CB 3.31Å; F1714-L1718 WeakPolarHBondContact O-CB 3.33Å; F1714-L1718 PolarHBondContact O-N 3.03Å; L1718-V1720 PolarHBondContact O-N 3.48Å; L1718-Y1721 PolarHBondContact O-N 2.92Å; L1718-M1722 WeakPolarHBondContact O-CB 3.3Å; L1718-M1722 VanDerWaalsContact O-CG 3.24Å; L1718-M1722 WeakPolarHBondContact O-CG 3.49Å; L1718-M1722 PolarHBondContact O-N 2.91Å; L1718-L1769 HydrophobicContact CD1-CD1 4.31Å; L1718-S1772 VanDerWaalsContact CD1-OG 3.31Å; L1718-S1772 WeakPolarHBondContact CD1-OG 3.38Å; L1718-V1773 HydrophobicContact CD1-CG2 3.95Å; L1718-V1773 HydrophobicContact CD2-CG2 4.48Å
1719	L	83.6	Confident	81.1	Confident	108 Å²	108	35.3 Å²	35.3	57%	0.565	18%	0.184	S	C	*	.	H	α-helix	trans	-63.6	-39.6	176.4	-69.6	169.5	0	0	0	112.4	M1272 V1715 F1716 F1723	M1272-L1719 HydrophobicContact CE-CD1 4.29Å; V1715-L1719 WeakPolarHBondContact O-CG 3.41Å; V1715-L1719 PolarHBondContact O-N 3.45Å; F1716-L1719 WeakPolarHBondContact O-CB 3.26Å; F1716-L1719 PolarHBondContact O-N 3.19Å; L1719-F1723 PolarHBondContact O-N 3.16Å
1720	V	78.8	Confident	80.2	Confident	41 Å²	41	38.8 Å²	38.8	25%	0.248	21%	0.205	C	C	.	.	H	α-helix	trans	-67.3	-39.9	175.1	176.4	0	0	0	0	111.2	F1683 F1716 D1717 L1718 F1723 T1724	F1683-V1720 HydrophobicContact CE1-CB 4.09Å; F1683-V1720 HydrophobicContact CE1-CG1 3.92Å; F1683-V1720 HydrophobicContact CZ-CB 4.35Å; F1683-V1720 HydrophobicContact CZ-CG1 4.3Å; F1716-V1720 HydrophobicContact CD1-CG2 4.05Å; F1716-V1720 HydrophobicContact CE1-CG2 3.65Å; F1716-V1720 HydrophobicContact CZ-CG2 4.48Å; F1716-V1720 PolarHBondContact O-N 2.68Å; D1717-V1720 PolarHBondContact O-N 2.68Å; L1718-V1720 PolarHBondContact O-N 3.48Å; V1720-F1723 PolarHBondContact O-N 3.11Å; V1720-T1724 PolarHBondContact O-N 3.14Å
1721	Y	78.1	Confident	79.3	Confident	1 Å²	1	39.8 Å²	39.8	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-43.5	176.4	-167	-89.6	0	0	0	111.9	F1676 V1679 T1680 F1683 D1717 L1718 F1723 T1724 M1725	F1676-Y1721 HydrophobicContact CD1-CE2 4.19Å; V1679-Y1721 HydrophobicContact CB-CD2 4.23Å; V1679-Y1721 HydrophobicContact CB-CE2 4.23Å; V1679-Y1721 HydrophobicContact CG1-CD2 3.57Å; V1679-Y1721 HydrophobicContact CG1-CE2 4.07Å; T1680-Y1721 HydrophobicContact CG2-CD2 4.2Å; T1680-Y1721 HydrophobicContact CG2-CE2 3.7Å; F1683-Y1721 HydrophobicContact CE2-CD2 4.08Å; F1683-Y1721 HydrophobicContact CZ-CD2 4.41Å; D1717-Y1721 WeakPolarHBondContact O-CB 3.49Å; D1717-Y1721 PolarHBondContact O-N 2.72Å; L1718-Y1721 PolarHBondContact O-N 2.92Å; Y1721-F1723 VanDerWaalsContact C-N 3.31Å; Y1721-F1723 PolarHBondContact O-N 3.2Å; Y1721-T1724 WeakPolarHBondContact O-CA 3.38Å; Y1721-T1724 PolarHBondContact O-N 3.27Å; Y1721-T1724 PolarHBondContact O-OG1 3.18Å; Y1721-M1725 HydrophobicContact CD1-CE 4.48Å; Y1721-M1725 HydrophobicContact CD1-CG 3.85Å; Y1721-M1725 HydrophobicContact CE1-CE 3.35Å; Y1721-M1725 HydrophobicContact CE1-CG 3.57Å; Y1721-M1725 HydrophobicContact CE1-SD 4.31Å; Y1721-M1725 VanDerWaalsContact CZ-CE 3.45Å; Y1721-M1725 PolarHBondContact O-N 2.04Å; Y1721-M1725 WeakPolarHBondContact OH-CE 3.23Å
1722	M	76.4	Confident	78.2	Confident	57 Å²	57	37.5 Å²	37.5	28%	0.281	20%	0.199	S	C	.	.	H	α-helix	trans	-56.4	-43	176	-76	-70	-90.8	0	0	112.5	L1718 T1724 M1725 V1726 F1765 L1769	L1718-M1722 WeakPolarHBondContact O-CB 3.3Å; L1718-M1722 VanDerWaalsContact O-CG 3.24Å; L1718-M1722 WeakPolarHBondContact O-CG 3.49Å; L1718-M1722 PolarHBondContact O-N 2.91Å; M1722-T1724 VanDerWaalsContact C-N 3.34Å; M1722-T1724 PolarHBondContact O-N 3.32Å; M1722-M1725 PolarHBondContact O-N 3.13Å; M1722-V1726 WeakPolarHBondContact O-CG2 3.42Å; M1722-V1726 PolarHBondContact O-N 3.26Å; M1722-F1765 HydrophobicContact CE-CE1 4.22Å; M1722-F1765 HydrophobicContact CE-CE2 4.37Å; M1722-F1765 HydrophobicContact CE-CZ 3.54Å; M1722-F1765 HydrophobicContact SD-CE2 4.3Å; M1722-F1765 HydrophobicContact SD-CZ 3.99Å; M1722-L1769 HydrophobicContact CE-CD1 3.88Å; M1722-L1769 HydrophobicContact CG-CD1 4.29Å; M1722-L1769 HydrophobicContact SD-CD1 3.32Å; M1722-L1769 WeakPolarHBondContact SD-CD1 3.4Å
1723	F	77.2	Confident	77.1	Confident	123 Å²	123	43.5 Å²	43.5	54%	0.539	22%	0.221	S	C	.	.	H	α-helix	trans	-60	-42.4	173.8	179.5	-98.5	0	0	0	112.2	V1290 L1719 V1720 Y1721 M1725 L1727	V1290-F1723 HydrophobicContact CG1-CE1 4.29Å; L1719-F1723 PolarHBondContact O-N 3.16Å; V1720-F1723 PolarHBondContact O-N 3.11Å; Y1721-F1723 VanDerWaalsContact C-N 3.31Å; Y1721-F1723 PolarHBondContact O-N 3.2Å; F1723-M1725 PolarHBondContact O-N 3.4Å; F1723-L1727 HydrophobicContact CE1-CD2 4.31Å; F1723-L1727 WeakPolarHBondContact O-CB 3.32Å; F1723-L1727 PolarHBondContact O-N 2.94Å; F1723-L1727 VanDerWaalsContact O-N 3.12Å
1724	T	72.9	Confident	76.1	Confident	15 Å²	15	49.3 Å²	49.3	9%	0.092	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-32.4	176.8	59.3	0	0	0	0	113.5	V1720 Y1721 M1722 A1728	V1720-T1724 PolarHBondContact O-N 3.14Å; Y1721-T1724 WeakPolarHBondContact O-CA 3.38Å; Y1721-T1724 PolarHBondContact O-N 3.27Å; Y1721-T1724 PolarHBondContact O-OG1 3.18Å; M1722-T1724 VanDerWaalsContact C-N 3.34Å; M1722-T1724 PolarHBondContact O-N 3.32Å; T1724-A1728 PolarHBondContact O-N 3.27Å
1725	M	72.4	Confident	74.9	Confident	7 Å²	7	52.8 Å²	52.8	3%	0.034	26%	0.264	C	S	.	.	H	α-helix	trans	-68.3	-47.3	175.1	-82	-67.7	170.4	0	0	112.3	F1676 Y1721 M1722 F1723 L1727 A1728 I1729 A1768	F1676-M1725 HydrophobicContact CD1-CE 3.49Å; F1676-M1725 VanDerWaalsContact CD1-CE 3.49Å; F1676-M1725 HydrophobicContact CD1-SD 4.46Å; F1676-M1725 HydrophobicContact CD2-CE 3.83Å; F1676-M1725 HydrophobicContact CE1-CE 3.27Å; F1676-M1725 HydrophobicContact CE1-CG 4.23Å; F1676-M1725 HydrophobicContact CE1-SD 3.65Å; F1676-M1725 HydrophobicContact CE2-CE 3.6Å; F1676-M1725 HydrophobicContact CE2-SD 4.07Å; F1676-M1725 HydrophobicContact CG-CE 3.79Å; F1676-M1725 HydrophobicContact CZ-CE 3.33Å; F1676-M1725 HydrophobicContact CZ-SD 3.42Å; F1676-M1725 WeakPolarHBondContact CZ-SD 3.01Å; Y1721-M1725 HydrophobicContact CD1-CE 4.48Å; Y1721-M1725 HydrophobicContact CD1-CG 3.85Å; Y1721-M1725 HydrophobicContact CE1-CE 3.35Å; Y1721-M1725 HydrophobicContact CE1-CG 3.57Å; Y1721-M1725 HydrophobicContact CE1-SD 4.31Å; Y1721-M1725 VanDerWaalsContact CZ-CE 3.45Å; Y1721-M1725 PolarHBondContact O-N 2.04Å; Y1721-M1725 WeakPolarHBondContact OH-CE 3.23Å; M1722-M1725 PolarHBondContact O-N 3.13Å; F1723-M1725 PolarHBondContact O-N 3.4Å; M1725-L1727 VanDerWaalsContact C-N 3.26Å; M1725-L1727 PolarHBondContact O-N 3.39Å; M1725-A1728 PolarHBondContact O-N 3.17Å; M1725-I1729 WeakPolarHBondContact O-CG1 3.35Å; M1725-I1729 PolarHBondContact O-N 3.3Å; M1725-A1768 HydrophobicContact CE-CB 3.77Å; M1725-A1768 HydrophobicContact SD-CB 3.83Å
1726	V	73.5	Confident	73.6	Confident	70 Å²	70	52.4 Å²	52.4	42%	0.424	27%	0.272	S	S	.	.	H	α-helix	trans	-58	-42.6	175.3	172.6	0	0	0	0	110.7	M1722 A1728 I1729 V1730	M1722-V1726 WeakPolarHBondContact O-CG2 3.42Å; M1722-V1726 PolarHBondContact O-N 3.26Å; V1726-A1728 PolarHBondContact O-N 3.3Å; V1726-I1729 PolarHBondContact O-N 2.85Å; V1726-V1730 WeakPolarHBondContact O-CG2 3.44Å; V1726-V1730 PolarHBondContact O-N 3.22Å
1727	L	72.4	Confident	72.2	Confident	50 Å²	50	52 Å²	52	26%	0.262	27%	0.271	S	S	.	.	H	α-helix	trans	-63.9	-39.6	178.3	-170	58.9	0	0	0	112.7	V1290 T1294 F1723 M1725 V1730 I1731	V1290-L1727 HydrophobicContact CG1-CD2 3.92Å; T1294-L1727 HydrophobicContact CG2-CD2 3.4Å; T1294-L1727 VanDerWaalsContact CG2-CD2 3.4Å; T1294-L1727 HydrophobicContact CG2-CG 3.81Å; F1723-L1727 HydrophobicContact CE1-CD2 4.31Å; F1723-L1727 WeakPolarHBondContact O-CB 3.32Å; F1723-L1727 PolarHBondContact O-N 2.94Å; F1723-L1727 VanDerWaalsContact O-N 3.12Å; M1725-L1727 VanDerWaalsContact C-N 3.26Å; M1725-L1727 PolarHBondContact O-N 3.39Å; L1727-V1730 PolarHBondContact O-N 3.07Å; L1727-I1731 WeakPolarHBondContact O-CG1 3.2Å; L1727-I1731 PolarHBondContact O-N 3.38Å; L1727-I1731 VanDerWaalsContact O-N 3.09Å
1728	A	70.1	Confident	70.7	Confident	3 Å²	3	59.3 Å²	59.3	3%	0.025	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-39.1	174.6	0	0	0	0	0	112.6	L1297 F1672 F1676 T1724 M1725 V1726 I1731 L1732	L1297-A1728 HydrophobicContact CD1-CB 4.39Å; F1672-A1728 HydrophobicContact CE1-CB 4.47Å; F1676-A1728 HydrophobicContact CZ-CB 3.84Å; T1724-A1728 PolarHBondContact O-N 3.27Å; M1725-A1728 PolarHBondContact O-N 3.17Å; V1726-A1728 PolarHBondContact O-N 3.3Å; A1728-I1731 PolarHBondContact O-N 3.02Å; A1728-L1732 PolarHBondContact O-N 3.45Å
1729	I	70	Confident	69.2	Low	46 Å²	46	58.3 Å²	58.3	24%	0.236	30%	0.298	C	S	.	.	H	α-helix	trans	-65.7	-39.9	175.5	-67	166	0	0	0	111.2	M1725 V1726 I1731 L1732 R1733 F1765	M1725-I1729 WeakPolarHBondContact O-CG1 3.35Å; M1725-I1729 PolarHBondContact O-N 3.3Å; V1726-I1729 PolarHBondContact O-N 2.85Å; I1729-I1731 VanDerWaalsContact C-N 3.34Å; I1729-I1731 PolarHBondContact O-N 3.44Å; I1729-L1732 PolarHBondContact O-N 3.07Å; I1729-R1733 PolarHBondContact O-N 2.57Å; I1729-F1765 HydrophobicContact CD1-CD2 3.81Å; I1729-F1765 HydrophobicContact CD1-CE2 4.48Å
1730	V	70.4	Confident	68	Low	74 Å²	74	54.1 Å²	54.1	45%	0.448	28%	0.275	S	S	.	.	H	α-helix	trans	-61.3	-42.8	173.9	170.1	0	0	0	0	111.1	V1726 L1727 R1733 I1734	V1726-V1730 WeakPolarHBondContact O-CG2 3.44Å; V1726-V1730 PolarHBondContact O-N 3.22Å; L1727-V1730 PolarHBondContact O-N 3.07Å; V1730-R1733 PolarHBondContact O-N 3.27Å; V1730-I1734 HydrophobicContact CG1-CD1 4.05Å; V1730-I1734 WeakPolarHBondContact O-CG1 3.22Å; V1730-I1734 PolarHBondContact O-N 3.32Å
1731	I	69.5	Low	67	Low	21 Å²	21	52.6 Å²	52.6	11%	0.108	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-49	174.9	-68.7	164.9	0	0	0	110.6	T1294 I1298 L1727 A1728 I1729 R1733 I1734 Y1735	T1294-I1731 HydrophobicContact CG2-CD1 3.94Å; I1298-I1731 HydrophobicContact CD1-CD1 4.37Å; I1298-I1731 HydrophobicContact CG1-CD1 4.26Å; I1298-I1731 HydrophobicContact CG1-CG2 4.48Å; L1727-I1731 WeakPolarHBondContact O-CG1 3.2Å; L1727-I1731 PolarHBondContact O-N 3.38Å; L1727-I1731 VanDerWaalsContact O-N 3.09Å; A1728-I1731 PolarHBondContact O-N 3.02Å; I1729-I1731 VanDerWaalsContact C-N 3.34Å; I1729-I1731 PolarHBondContact O-N 3.44Å; I1731-R1733 VanDerWaalsContact C-N 3.26Å; I1731-R1733 PolarHBondContact O-N 3.34Å; I1731-I1734 PolarHBondContact O-N 3.5Å; I1731-I1734 VanDerWaalsContact O-N 3.13Å; I1731-Y1735 HydrophobicContact CG2-CD2 4.04Å; I1731-Y1735 HydrophobicContact CG2-CE2 3.99Å; I1731-Y1735 VanDerWaalsContact O-CD2 3.27Å; I1731-Y1735 WeakPolarHBondContact O-CD2 3.36Å; I1731-Y1735 PolarHBondContact O-N 3.13Å
1732	L	66.3	Low	65.7	Low	15 Å²	15	55.1 Å²	55.1	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-59.2	-34.7	176.4	-76.4	169.4	0	0	0	112.8	F1672 A1728 I1729 Y1735 G1736 E1737 Y1740 V1741 W1847	F1672-L1732 HydrophobicContact CE1-CD1 4.27Å; F1672-L1732 HydrophobicContact CE1-CG 4.44Å; F1672-L1732 HydrophobicContact CE2-CD2 4.18Å; F1672-L1732 HydrophobicContact CZ-CD1 3.99Å; F1672-L1732 HydrophobicContact CZ-CD2 3.69Å; F1672-L1732 HydrophobicContact CZ-CG 3.88Å; A1728-L1732 PolarHBondContact O-N 3.45Å; I1729-L1732 PolarHBondContact O-N 3.07Å; L1732-Y1735 PolarHBondContact O-N 2.96Å; L1732-G1736 PolarHBondContact O-N 3.16Å; L1732-E1737 HydrophobicContact CD2-CB 4.46Å; L1732-E1737 HydrophobicContact CD2-CG 4.47Å; L1732-Y1740 HydrophobicContact CD1-CD2 4.49Å; L1732-Y1740 HydrophobicContact CD1-CG 4.38Å; L1732-Y1740 HydrophobicContact CD2-CD2 4.21Å; L1732-V1741 HydrophobicContact CB-CG2 3.98Å; L1732-W1847 HydrophobicContact CD1-CH2 4.25Å; L1732-W1847 HydrophobicContact CD1-CZ3 4.15Å
1733	R	64.6	Low	64.5	Low	126 Å²	126	55 Å²	55	48%	0.475	29%	0.294	S	S	.	.	H	α-helix	trans	-70.5	-36.4	175.8	-166.3	160.6	-175.9	83.2	-3.6	112.8	I1729 V1730 I1731 Y1735 G1736 V1741	I1729-R1733 PolarHBondContact O-N 2.57Å; V1730-R1733 PolarHBondContact O-N 3.27Å; I1731-R1733 VanDerWaalsContact C-N 3.26Å; I1731-R1733 PolarHBondContact O-N 3.34Å; R1733-Y1735 VanDerWaalsContact C-N 3.27Å; R1733-Y1735 PolarHBondContact O-N 3.37Å; R1733-G1736 PolarHBondContact O-N 3.43Å; R1733-V1741 HydrophobicContact CB-CG1 3.87Å; R1733-V1741 HydrophobicContact CB-CG2 4.47Å; R1733-V1741 HydrophobicContact CG-CG1 3.85Å; R1733-V1741 VanDerWaalsContact NH1-CG1 3.28Å; R1733-V1741 PolarHBondContact NH1-O 3.1Å
1734	I	66.9	Low	62.9	Low	123 Å²	123	53.2 Å²	53.2	63%	0.631	30%	0.302	S	S	*	.	H	α-helix	trans	-62	-36.4	175.8	-69.6	163.8	0	0	0	110.9	V1730 I1731	V1730-I1734 HydrophobicContact CG1-CD1 4.05Å; V1730-I1734 WeakPolarHBondContact O-CG1 3.22Å; V1730-I1734 PolarHBondContact O-N 3.32Å; I1731-I1734 PolarHBondContact O-N 3.5Å; I1731-I1734 VanDerWaalsContact O-N 3.13Å
1735	Y	64.1	Low	61.6	Low	108 Å²	108	58.2 Å²	58.2	42%	0.424	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-3.2	178.3	-70.8	-69	0	0	0	115.2	I1302 I1731 L1732 R1733 E1737	I1302-Y1735 HydrophobicContact CD1-CE1 4.22Å; I1302-Y1735 HydrophobicContact CD1-CE2 4.18Å; I1302-Y1735 WeakPolarHBondContact CD1-OH 3.45Å; I1302-Y1735 HydrophobicContact CG1-CE1 3.87Å; I1302-Y1735 HydrophobicContact CG1-CE2 3.98Å; I1731-Y1735 HydrophobicContact CG2-CD2 4.04Å; I1731-Y1735 HydrophobicContact CG2-CE2 3.99Å; I1731-Y1735 VanDerWaalsContact O-CD2 3.27Å; I1731-Y1735 WeakPolarHBondContact O-CD2 3.36Å; I1731-Y1735 PolarHBondContact O-N 3.13Å; L1732-Y1735 PolarHBondContact O-N 2.96Å; R1733-Y1735 VanDerWaalsContact C-N 3.27Å; R1733-Y1735 PolarHBondContact O-N 3.37Å; Y1735-E1737 PolarHBondContact O-N 3.37Å
1736	G	60.8	Low	60.1	Low	52 Å²	52	58.7 Å²	58.7	54%	0.536	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	21.9	171.9	0	0	0	0	0	115.7	L1732 R1733 K1738	L1732-G1736 PolarHBondContact O-N 3.16Å; R1733-G1736 PolarHBondContact O-N 3.43Å; G1736-K1738 PolarHBondContact O-N 2.86Å
1737	E	57.9	Low	58.4	Low	14 Å²	14	58.4 Å²	58.4	7%	0.065	34%	0.339	C	S	.	.			trans	-67.7	94.7	-178	-82.7	-67.8	142.8	0	0	112.6	V1305 L1732 Y1735 P1739 Y1740 V1741 K1851	V1305-E1737 WeakPolarHBondContact CG1-OE1 3.44Å; L1732-E1737 HydrophobicContact CD2-CB 4.46Å; L1732-E1737 HydrophobicContact CD2-CG 4.47Å; Y1735-E1737 PolarHBondContact O-N 3.37Å; E1737-P1739 VanDerWaalsContact C-CD 3.49Å; E1737-Y1740 HydrophobicContact CB-CD2 4.2Å; E1737-Y1740 PolarHBondContact O-N 3.49Å; E1737-Y1740 VanDerWaalsContact O-N 3.12Å; E1737-V1741 PolarHBondContact O-N 3.1Å; E1737-V1741 VanDerWaalsContact O-N 3.12Å; E1737-K1851 IonicContact OE1-NZ 3.56Å; E1737-K1851 IonicContact OE2-NZ 2.89Å; E1737-K1851 PolarHBondContact OE2-NZ 3.37Å
1738	K	54.5	Low	56.9	Low	153 Å²	153	62.7 Å²	62.7	67%	0.665	36%	0.361	S	S	*	.	H	α-helix	trans	-45.3	-47.8	179.8	-66.7	-176	179.6	-179.5	0	115.4	G1736 Y1740 V1741 G1742 F1854	G1736-K1738 PolarHBondContact O-N 2.86Å; K1738-Y1740 VanDerWaalsContact C-N 3.25Å; K1738-Y1740 PolarHBondContact O-N 3.12Å; K1738-V1741 PolarHBondContact O-N 2.89Å; K1738-G1742 VanDerWaalsContact O-CA 3.26Å; K1738-G1742 WeakPolarHBondContact O-CA 3.27Å; K1738-G1742 PolarHBondContact O-N 3.33Å; K1738-F1854 HydrophobicContact CB-CE1 4.44Å; K1738-F1854 HydrophobicContact CB-CZ 4.05Å
1739	P	53.7	Low	55.5	Low	18 Å²	18	65.2 Å²	65.2	12%	0.117	38%	0.376	C	S	.	.	H	α-helix	trans	-60	-31.2	-178.8	17.3	-30.3	0	0	0	114.2	E1737 M1850 K1851 F1854	E1737-P1739 VanDerWaalsContact C-CD 3.49Å; P1739-M1850 WeakPolarHBondContact O-CE 3.41Å; P1739-K1851 HydrophobicContact CB-CD 4.39Å; P1739-K1851 HydrophobicContact CB-CG 4.18Å; P1739-K1851 HydrophobicContact CG-CD 3.69Å; P1739-K1851 HydrophobicContact CG-CG 3.96Å; P1739-F1854 HydrophobicContact CB-CB 3.99Å; P1739-F1854 HydrophobicContact CB-CD1 3.72Å; P1739-F1854 HydrophobicContact CB-CD2 4.15Å; P1739-F1854 HydrophobicContact CB-CE1 4.23Å; P1739-F1854 HydrophobicContact CB-CG 3.68Å; P1739-F1854 HydrophobicContact CG-CD1 4.23Å; P1739-F1854 HydrophobicContact CG-CE1 4.49Å
1740	Y	58.5	Low	54	Low	19 Å²	19	68.2 Å²	68.2	8%	0.075	39%	0.391	C	S	.	.	H	α-helix	trans	-98.7	-20.5	-176.1	-58.7	-64.4	0	0	0	113.6	L1732 E1737 K1738 W1847 M1850 K1851	L1732-Y1740 HydrophobicContact CD1-CD2 4.49Å; L1732-Y1740 HydrophobicContact CD1-CG 4.38Å; L1732-Y1740 HydrophobicContact CD2-CD2 4.21Å; E1737-Y1740 HydrophobicContact CB-CD2 4.2Å; E1737-Y1740 PolarHBondContact O-N 3.49Å; E1737-Y1740 VanDerWaalsContact O-N 3.12Å; K1738-Y1740 VanDerWaalsContact C-N 3.25Å; K1738-Y1740 PolarHBondContact O-N 3.12Å; Y1740-W1847 HydrophobicContact CE1-CE3 4.44Å; Y1740-W1847 PolarHBondContact OH-O 2.97Å; Y1740-W1847 VanDerWaalsContact OH-O 3.09Å; Y1740-M1850 HydrophobicContact CD1-CE 4.29Å; Y1740-M1850 HydrophobicContact CD1-SD 3.83Å; Y1740-M1850 HydrophobicContact CE1-CG 4.44Å; Y1740-M1850 HydrophobicContact CE1-SD 3.89Å; Y1740-K1851 HydrophobicContact CE2-CD 3.99Å
1741	V	57.2	Low	52.7	Low	10 Å²	10	71 Å²	71	6%	0.061	40%	0.401	C	S	.	.	H	α-helix	trans	-144.2	9.3	-168.5	-140.7	0	0	0	0	115.4	L1732 R1733 E1737 K1738 T1743	L1732-V1741 HydrophobicContact CB-CG2 3.98Å; R1733-V1741 HydrophobicContact CB-CG1 3.87Å; R1733-V1741 HydrophobicContact CB-CG2 4.47Å; R1733-V1741 HydrophobicContact CG-CG1 3.85Å; R1733-V1741 VanDerWaalsContact NH1-CG1 3.28Å; R1733-V1741 PolarHBondContact NH1-O 3.1Å; E1737-V1741 PolarHBondContact O-N 3.1Å; E1737-V1741 VanDerWaalsContact O-N 3.12Å; K1738-V1741 PolarHBondContact O-N 2.89Å; V1741-T1743 PolarHBondContact O-N 3.31Å
1742	G	50.2	Low	51.3	Low	54 Å²	54	73.7 Å²	73.7	56%	0.557	42%	0.419	S	S	*	.			trans	-69.7	-17.9	-159.5	0	0	0	0	0	118.8	K1738	K1738-G1742 VanDerWaalsContact O-CA 3.26Å; K1738-G1742 WeakPolarHBondContact O-CA 3.27Å; K1738-G1742 PolarHBondContact O-N 3.33Å
1743	T	51.4	Low	50	Low	53 Å²	53	75.6 Å²	75.6	33%	0.325	43%	0.429	S	S	.	.			trans	-90.3	130.4	-172.9	53.6	0	0	0	0	113.1	V1741 N1745 A1746	V1741-T1743 PolarHBondContact O-N 3.31Å; T1743-N1745 VanDerWaalsContact C-N 3.27Å; T1743-N1745 PolarHBondContact O-N 3.12Å; T1743-A1746 WeakPolarHBondContact O-CB 2.99Å; T1743-A1746 PolarHBondContact O-N 3.47Å
1744	A	44.9	Very low	49	Very low	86 Å²	86	76.6 Å²	76.6	71%	0.711	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-26.7	-174.4	0	0	0	0	0	113.9	A1746	A1744-A1746 PolarHBondContact O-N 3.06Å
1745	N	44.2	Very low	47.5	Very low	120 Å²	120	79.2 Å²	79.2	64%	0.642	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.7	-177.7	-64.2	-14.8	0	0	0	113.2	T1743 A1747 L1748 V1749	T1743-N1745 VanDerWaalsContact C-N 3.27Å; T1743-N1745 PolarHBondContact O-N 3.12Å; N1745-A1747 VanDerWaalsContact C-N 3.28Å; N1745-A1747 PolarHBondContact O-N 2.93Å; N1745-A1747 VanDerWaalsContact O-N 3.1Å; N1745-L1748 PolarHBondContact O-N 3.29Å; N1745-L1748 VanDerWaalsContact O-N 3.16Å; N1745-V1749 HydrophobicContact CB-CG2 4.07Å; N1745-V1749 VanDerWaalsContact O-CB 3.23Å; N1745-V1749 WeakPolarHBondContact O-CB 3.19Å; N1745-V1749 VanDerWaalsContact O-CG2 3.28Å; N1745-V1749 WeakPolarHBondContact O-CG2 3.39Å; N1745-V1749 PolarHBondContact O-N 2.83Å
1746	A	40.5	Very low	46	Very low	17 Å²	17	77.6 Å²	77.6	14%	0.14	46%	0.458	C	S	.	.	H	α-helix	trans	-60	-25.8	-168.4	0	0	0	0	0	115.8	T1743 A1744 M1750 L1761	T1743-A1746 WeakPolarHBondContact O-CB 2.99Å; T1743-A1746 PolarHBondContact O-N 3.47Å; A1744-A1746 PolarHBondContact O-N 3.06Å; A1746-M1750 WeakPolarHBondContact O-CB 3.27Å; A1746-M1750 PolarHBondContact O-N 3.44Å; A1746-L1761 HydrophobicContact CB-CD1 4.03Å
1747	A	39.8	Very low	44.9	Very low	64 Å²	64	85.8 Å²	85.8	53%	0.529	48%	0.479	S	S	.	.	H	α-helix	trans	-80.5	-38	177.9	0	0	0	0	0	112.9	N1745	N1745-A1747 VanDerWaalsContact C-N 3.28Å; N1745-A1747 PolarHBondContact O-N 2.93Å; N1745-A1747 VanDerWaalsContact O-N 3.1Å
1748	L	39.5	Very low	44	Very low	141 Å²	141	87 Å²	87	74%	0.738	50%	0.495	S	S	*	.	H	α-helix	trans	-70.7	-40.9	172.8	-151.8	80.9	0	0	0	109.9	N1745 I1751 T1752	N1745-L1748 PolarHBondContact O-N 3.29Å; N1745-L1748 VanDerWaalsContact O-N 3.16Å; L1748-I1751 PolarHBondContact O-N 2.99Å; L1748-I1751 VanDerWaalsContact O-N 3.17Å; L1748-T1752 PolarHBondContact O-N 2.88Å; L1748-T1752 PolarHBondContact O-OG1 3.07Å
1749	V	40.4	Very low	43.5	Very low	56 Å²	56	85 Å²	85	34%	0.339	49%	0.489	S	S	.	.	H	α-helix	trans	-68.2	-31.4	177.3	168.6	0	0	0	0	111.5	N1745 I1751 T1752 I1753	N1745-V1749 HydrophobicContact CB-CG2 4.07Å; N1745-V1749 VanDerWaalsContact O-CB 3.23Å; N1745-V1749 WeakPolarHBondContact O-CB 3.19Å; N1745-V1749 VanDerWaalsContact O-CG2 3.28Å; N1745-V1749 WeakPolarHBondContact O-CG2 3.39Å; N1745-V1749 PolarHBondContact O-N 2.83Å; V1749-I1751 PolarHBondContact O-N 3.39Å; V1749-T1752 WeakPolarHBondContact CA-OG1 3.09Å; V1749-T1752 PolarHBondContact O-N 2.91Å; V1749-T1752 PolarHBondContact O-OG1 2.93Å; V1749-I1753 HydrophobicContact CB-CD1 4.42Å; V1749-I1753 HydrophobicContact CG1-CD1 3.31Å; V1749-I1753 HydrophobicContact CG1-CG1 3.79Å; V1749-I1753 VanDerWaalsContact O-CB 3.27Å; V1749-I1753 WeakPolarHBondContact O-CB 3.14Å; V1749-I1753 VanDerWaalsContact O-CD1 3.27Å; V1749-I1753 WeakPolarHBondContact O-CD1 3.23Å; V1749-I1753 WeakPolarHBondContact O-CG1 3.17Å; V1749-I1753 PolarHBondContact O-N 2.87Å
1750	M	39.1	Very low	43	Very low	109 Å²	109	88.4 Å²	88.4	54%	0.537	51%	0.505	S	S	.	.	H	α-helix	trans	-55.6	-31.8	169.8	-116.9	-170.5	-171	0	0	113.5	A1746 I1754	A1746-M1750 WeakPolarHBondContact O-CB 3.27Å; A1746-M1750 PolarHBondContact O-N 3.44Å; M1750-I1754 WeakPolarHBondContact O-CG1 3.47Å
1751	I	43.8	Very low	42.5	Very low	131 Å²	131	90 Å²	90	67%	0.672	52%	0.515	S	S	*	.	H	α-helix	trans	-83.9	-37.8	-179.4	-63.5	175.4	0	0	0	110.7	L1748 V1749	L1748-I1751 PolarHBondContact O-N 2.99Å; L1748-I1751 VanDerWaalsContact O-N 3.17Å; V1749-I1751 PolarHBondContact O-N 3.39Å
1752	T	39	Very low	42.2	Very low	79 Å²	79	91.7 Å²	91.7	49%	0.485	52%	0.522	S	S	.	.	H	α-helix	trans	-75.5	-29.8	174.2	31.9	0	0	0	0	113.9	L1748 V1749 I1754 M1755 S1756	L1748-T1752 PolarHBondContact O-N 2.88Å; L1748-T1752 PolarHBondContact O-OG1 3.07Å; V1749-T1752 WeakPolarHBondContact CA-OG1 3.09Å; V1749-T1752 PolarHBondContact O-N 2.91Å; V1749-T1752 PolarHBondContact O-OG1 2.93Å; T1752-I1754 VanDerWaalsContact C-N 3.25Å; T1752-I1754 PolarHBondContact O-N 2.64Å; T1752-M1755 CarbonylContact O-C 3.37Å; T1752-M1755 WeakPolarHBondContact O-CA 3.39Å; T1752-M1755 PolarHBondContact O-N 3.08Å; T1752-S1756 PolarHBondContact O-N 3.38Å
1753	I	38.6	Very low	42.3	Very low	54 Å²	54	89.6 Å²	89.6	28%	0.277	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-30.9	175.8	-75.1	161.9	0	0	0	112.6	V1749 M1755 H1762	V1749-I1753 HydrophobicContact CB-CD1 4.42Å; V1749-I1753 HydrophobicContact CG1-CD1 3.31Å; V1749-I1753 HydrophobicContact CG1-CG1 3.79Å; V1749-I1753 VanDerWaalsContact O-CB 3.27Å; V1749-I1753 WeakPolarHBondContact O-CB 3.14Å; V1749-I1753 VanDerWaalsContact O-CD1 3.27Å; V1749-I1753 WeakPolarHBondContact O-CD1 3.23Å; V1749-I1753 WeakPolarHBondContact O-CG1 3.17Å; V1749-I1753 PolarHBondContact O-N 2.87Å; I1753-M1755 PolarHBondContact O-N 2.85Å; I1753-M1755 VanDerWaalsContact O-N 3.15Å; I1753-H1762 WeakPolarHBondContact CD1-NE2 3.26Å; I1753-H1762 WeakPolarHBondContact CG1-NE2 3.5Å; I1753-H1762 WeakPolarHBondContact CG2-NE2 3.35Å
1754	I	43.4	Very low	42.3	Very low	147 Å²	147	88.6 Å²	88.6	75%	0.754	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-11.2	174.7	-67.3	171.4	0	0	0	111.1	M1750 T1752	M1750-I1754 WeakPolarHBondContact O-CG1 3.47Å; T1752-I1754 VanDerWaalsContact C-N 3.25Å; T1752-I1754 PolarHBondContact O-N 2.64Å
1755	M	36.5	Very low	43	Very low	179 Å²	179	88 Å²	88	88%	0.882	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	-17.5	176.9	-73.4	-160	158.3	0	0	117.1	T1752 I1753	T1752-M1755 CarbonylContact O-C 3.37Å; T1752-M1755 WeakPolarHBondContact O-CA 3.39Å; T1752-M1755 PolarHBondContact O-N 3.08Å; I1753-M1755 PolarHBondContact O-N 2.85Å; I1753-M1755 VanDerWaalsContact O-N 3.15Å
1756	S	32.7	Very low	43.9	Very low	74 Å²	74	85.5 Å²	85.5	52%	0.517	46%	0.462	S	S	.	.	S	Bend	trans	-153.6	153	178.2	54.8	0	0	0	0	115.9	T1752	T1752-S1756 PolarHBondContact O-N 3.38Å
1757	F	38.2	Very low	45	Very low	223 Å²	223	84.8 Å²	84.8	98%	0.978	46%	0.456	S	S	*	.			trans	-55.8	134.1	-179.4	-93.1	-113.7	0	0	0	113.4
1758	G	38.3	Very low	46.1	Very low	39 Å²	39	81.9 Å²	81.9	40%	0.402	43%	0.432	S	S	.	.			trans	177.2	115.2	166.3	0	0	0	0	0	114.4	H1762	G1758-H1762 PolarHBondContact O-CD2 3.48Å; G1758-H1762 PolarHBondContact O-CE1 2.82Å; G1758-H1762 PolarHBondContact O-NE2 2.88Å; G1758-H1762 VanDerWaalsContact O-NE2 3.1Å
1759	Q	43.5	Very low	47.5	Very low	112 Å²	112	77.5 Å²	77.5	52%	0.523	41%	0.409	S	S	.	.			trans	-75.2	135.6	177.3	-63.2	145.6	-68.2	0	0	111.5	L1891	Q1759-L1891 HydrophobicContact CG-CD1 3.97Å; Q1759-L1891 VanDerWaalsContact NE2-CD1 3.3Å
1760	L	43.8	Very low	49	Very low	90 Å²	90	75.4 Å²	75.4	47%	0.471	40%	0.397	S	S	.	.	S	Bend	trans	-168.3	-37.8	130.9	-128.6	78.5	0	0	0	112.3	H1762 Y1887	L1760-H1762 VanDerWaalsContact C-N 3.28Å; L1760-Y1887 HydrophobicContact CD1-CD2 4.44Å; L1760-Y1887 HydrophobicContact CD2-CD1 4.18Å; L1760-Y1887 HydrophobicContact CD2-CD2 3.69Å; L1760-Y1887 HydrophobicContact CD2-CE1 4.34Å; L1760-Y1887 HydrophobicContact CD2-CE2 3.86Å; L1760-Y1887 HydrophobicContact CD2-CG 3.91Å
1761	L	47.1	Very low	50.4	Low	52 Å²	52	70.2 Å²	70.2	27%	0.272	37%	0.371	S	S	.	.	S	Bend	trans	-88	0.6	169	-137.8	102.7	0	0	0	112.9	A1746	A1746-L1761 HydrophobicContact CB-CD1 4.03Å
1762	H	50.8	Low	51.7	Low	46 Å²	46	64 Å²	64	21%	0.213	34%	0.339	C	S	.	.	H	α-helix	trans	-74.5	-34.7	-172.6	-78.7	-137.4	0	0	0	113.1	I1753 G1758 L1760 S1764 F1765 L1766	I1753-H1762 WeakPolarHBondContact CD1-NE2 3.26Å; I1753-H1762 WeakPolarHBondContact CG1-NE2 3.5Å; I1753-H1762 WeakPolarHBondContact CG2-NE2 3.35Å; G1758-H1762 PolarHBondContact O-CD2 3.48Å; G1758-H1762 PolarHBondContact O-CE1 2.82Å; G1758-H1762 PolarHBondContact O-NE2 2.88Å; G1758-H1762 VanDerWaalsContact O-NE2 3.1Å; L1760-H1762 VanDerWaalsContact C-N 3.28Å; H1762-S1764 PolarHBondContact O-N 3.38Å; H1762-F1765 PolarHBondContact O-N 2.89Å; H1762-L1766 WeakPolarHBondContact O-CA 3.09Å; H1762-L1766 WeakPolarHBondContact O-CB 3.4Å; H1762-L1766 PolarHBondContact O-N 2.91Å
1763	A	52.2	Low	53.6	Low	9 Å²	9	62.1 Å²	62.1	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-45.3	-164.8	0	0	0	0	0	112.7	H1767 L1890 L1896	A1763-H1767 WeakPolarHBondContact O-CB 3.26Å; A1763-H1767 PolarHBondContact O-N 2.72Å; A1763-L1890 HydrophobicContact CB-CB 3.92Å; A1763-L1896 HydrophobicContact CB-CD1 4.19Å
1764	S	52.2	Low	55.9	Low	32 Å²	32	59.5 Å²	59.5	22%	0.224	31%	0.314	C	S	.	.	H	α-helix	trans	-70.1	-44	178.6	54	0	0	0	0	112.7	H1762 A1768	H1762-S1764 PolarHBondContact O-N 3.38Å; S1764-A1768 WeakPolarHBondContact O-CB 3.48Å; S1764-A1768 PolarHBondContact O-N 3.34Å
1765	F	60.1	Low	57.8	Low	73 Å²	73	52.5 Å²	52.5	32%	0.32	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-42.4	177.9	-179.1	-105.5	0	0	0	112.4	M1722 I1729 H1762 A1768 L1769	M1722-F1765 HydrophobicContact CE-CE1 4.22Å; M1722-F1765 HydrophobicContact CE-CE2 4.37Å; M1722-F1765 HydrophobicContact CE-CZ 3.54Å; M1722-F1765 HydrophobicContact SD-CE2 4.3Å; M1722-F1765 HydrophobicContact SD-CZ 3.99Å; I1729-F1765 HydrophobicContact CD1-CD2 3.81Å; I1729-F1765 HydrophobicContact CD1-CE2 4.48Å; H1762-F1765 PolarHBondContact O-N 2.89Å; F1765-A1768 PolarHBondContact O-N 3.26Å; F1765-L1769 VanDerWaalsContact O-CB 3.29Å; F1765-L1769 WeakPolarHBondContact O-CB 3.35Å; F1765-L1769 PolarHBondContact O-N 2.88Å
1766	L	62.3	Low	60.2	Low	68 Å²	68	44 Å²	44	36%	0.356	24%	0.236	S	C	.	.	H	α-helix	trans	-67.9	-43.8	176.8	-172.7	70.4	0	0	0	110.9	H1762 L1769 T1770	H1762-L1766 WeakPolarHBondContact O-CA 3.09Å; H1762-L1766 WeakPolarHBondContact O-CB 3.4Å; H1762-L1766 PolarHBondContact O-N 2.91Å; L1766-L1769 HydrophobicContact CD1-CD2 4.4Å; L1766-L1769 WeakPolarHBondContact O-CB 3.33Å; L1766-L1769 PolarHBondContact O-N 3.17Å; L1766-T1770 WeakPolarHBondContact O-CG2 3.43Å; L1766-T1770 PolarHBondContact O-N 2.88Å; L1766-T1770 PolarHBondContact O-OG1 3.33Å
1767	H	63.4	Low	62.8	Low	3 Å²	3	40.5 Å²	40.5	1%	0.014	21%	0.212	C	C	.	.	H	α-helix	trans	-63.9	-41	174.3	-176.4	-84.8	0	0	0	111.7	A1763 L1769 T1770 C1771 V1842 A1846 V1900	A1763-H1767 WeakPolarHBondContact O-CB 3.26Å; A1763-H1767 PolarHBondContact O-N 2.72Å; H1767-L1769 VanDerWaalsContact C-N 3.32Å; H1767-L1769 PolarHBondContact O-N 3.17Å; H1767-T1770 WeakPolarHBondContact CA-OG1 3.36Å; H1767-T1770 PolarHBondContact O-N 3.34Å; H1767-T1770 PolarHBondContact O-OG1 3.28Å; H1767-T1770 VanDerWaalsContact O-OG1 3.11Å; H1767-C1771 PolarHBondContact CE1-SG 2.81Å; H1767-C1771 VanDerWaalsContact O-CB 3.27Å; H1767-C1771 WeakPolarHBondContact O-CB 3.46Å; H1767-C1771 PolarHBondContact O-N 3.16Å; H1767-C1771 PolarHBondContact O-SG 2.9Å; H1767-V1842 WeakPolarHBondContact NE2-CG1 3.5Å; H1767-A1846 WeakPolarHBondContact CE1-CB 3.29Å; H1767-V1900 HydrophobicContact CB-CG2 4.21Å
1768	A	64	Low	65.1	Low	3 Å²	3	31 Å²	31	3%	0.025	17%	0.17	C	C	.	.	H	α-helix	trans	-63.7	-36.3	173.4	0	0	0	0	0	112.4	M1725 S1764 F1765 S1772	M1725-A1768 HydrophobicContact CE-CB 3.77Å; M1725-A1768 HydrophobicContact SD-CB 3.83Å; S1764-A1768 WeakPolarHBondContact O-CB 3.48Å; S1764-A1768 PolarHBondContact O-N 3.34Å; F1765-A1768 PolarHBondContact O-N 3.26Å; A1768-S1772 WeakPolarHBondContact O-CB 3.13Å; A1768-S1772 PolarHBondContact O-N 3.1Å
1769	L	69.2	Low	67.4	Low	48 Å²	48	29.1 Å²	29.1	25%	0.251	15%	0.151	S	C	.	.	H	α-helix	trans	-66.1	-49.8	172.8	-174.2	80.7	0	0	0	111.1	L1718 M1722 F1765 L1766 H1767 S1772 V1773	L1718-L1769 HydrophobicContact CD1-CD1 4.31Å; M1722-L1769 HydrophobicContact CE-CD1 3.88Å; M1722-L1769 HydrophobicContact CG-CD1 4.29Å; M1722-L1769 HydrophobicContact SD-CD1 3.32Å; M1722-L1769 WeakPolarHBondContact SD-CD1 3.4Å; F1765-L1769 VanDerWaalsContact O-CB 3.29Å; F1765-L1769 WeakPolarHBondContact O-CB 3.35Å; F1765-L1769 PolarHBondContact O-N 2.88Å; L1766-L1769 HydrophobicContact CD1-CD2 4.4Å; L1766-L1769 WeakPolarHBondContact O-CB 3.33Å; L1766-L1769 PolarHBondContact O-N 3.17Å; H1767-L1769 VanDerWaalsContact C-N 3.32Å; H1767-L1769 PolarHBondContact O-N 3.17Å; L1769-S1772 WeakPolarHBondContact O-CA 3.46Å; L1769-S1772 WeakPolarHBondContact O-CB 3.18Å; L1769-S1772 PolarHBondContact O-N 3.19Å; L1769-S1772 PolarHBondContact O-OG 3.23Å; L1769-V1773 WeakPolarHBondContact O-CG2 3.49Å; L1769-V1773 PolarHBondContact O-N 3.33Å
1770	T	71.1	Confident	69.5	Low	13 Å²	13	23.8 Å²	23.8	8%	0.08	13%	0.126	C	C	.	.	H	α-helix	trans	-66.3	-41.4	-179.5	55.1	0	0	0	0	111.8	L1766 H1767 S1772 V1773 S1774 V1900 T1904	L1766-T1770 WeakPolarHBondContact O-CG2 3.43Å; L1766-T1770 PolarHBondContact O-N 2.88Å; L1766-T1770 PolarHBondContact O-OG1 3.33Å; H1767-T1770 WeakPolarHBondContact CA-OG1 3.36Å; H1767-T1770 PolarHBondContact O-N 3.34Å; H1767-T1770 PolarHBondContact O-OG1 3.28Å; H1767-T1770 VanDerWaalsContact O-OG1 3.11Å; T1770-S1772 VanDerWaalsContact C-N 3.28Å; T1770-S1772 PolarHBondContact O-N 3Å; T1770-V1773 WeakPolarHBondContact O-CB 3.39Å; T1770-V1773 PolarHBondContact O-N 3.44Å; T1770-V1773 VanDerWaalsContact O-N 3.16Å; T1770-S1774 PolarHBondContact O-N 3.18Å; T1770-V1900 HydrophobicContact CG2-CG1 4.17Å; T1770-T1904 HydrophobicContact CG2-CG2 3.51Å
1771	C	69.4	Low	71.5	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-57.4	-40.4	168.7	-71	0	0	0	0	111.4	H1767 V1773 S1774 M1775	H1767-C1771 PolarHBondContact CE1-SG 2.81Å; H1767-C1771 VanDerWaalsContact O-CB 3.27Å; H1767-C1771 WeakPolarHBondContact O-CB 3.46Å; H1767-C1771 PolarHBondContact O-N 3.16Å; H1767-C1771 PolarHBondContact O-SG 2.9Å; C1771-V1773 VanDerWaalsContact C-N 3.35Å; C1771-V1773 PolarHBondContact O-N 3.24Å; C1771-S1774 PolarHBondContact O-N 3.29Å; C1771-M1775 WeakPolarHBondContact O-CB 3.26Å; C1771-M1775 PolarHBondContact O-N 2.96Å
1772	S	69.7	Low	73.3	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65	-38.9	176.7	83	0	0	0	0	112.9	L1718 A1768 L1769 T1770 S1774 I1776	L1718-S1772 VanDerWaalsContact CD1-OG 3.31Å; L1718-S1772 WeakPolarHBondContact CD1-OG 3.38Å; A1768-S1772 WeakPolarHBondContact O-CB 3.13Å; A1768-S1772 PolarHBondContact O-N 3.1Å; L1769-S1772 WeakPolarHBondContact O-CA 3.46Å; L1769-S1772 WeakPolarHBondContact O-CB 3.18Å; L1769-S1772 PolarHBondContact O-N 3.19Å; L1769-S1772 PolarHBondContact O-OG 3.23Å; T1770-S1772 VanDerWaalsContact C-N 3.28Å; T1770-S1772 PolarHBondContact O-N 3Å; S1772-S1774 PolarHBondContact O-N 2.96Å; S1772-I1776 WeakPolarHBondContact O-CB 3.4Å; S1772-I1776 WeakPolarHBondContact O-CD1 3.43Å; S1772-I1776 VanDerWaalsContact O-CG1 3.23Å; S1772-I1776 WeakPolarHBondContact O-CG1 3.38Å; S1772-I1776 PolarHBondContact O-N 3.16Å; S1772-I1776 VanDerWaalsContact O-N 3.16Å
1773	V	80.3	Confident	74.9	Confident	39 Å²	39	18.3 Å²	18.3	24%	0.236	10%	0.099	C	C	.	.	H	α-helix	trans	-65.3	-29.2	177.3	168.1	0	0	0	0	111	F1714 L1718 L1769 T1770 C1771 P1777 A1907	F1714-V1773 HydrophobicContact CZ-CB 4.24Å; F1714-V1773 HydrophobicContact CZ-CG1 3.98Å; F1714-V1773 HydrophobicContact CZ-CG2 4.12Å; L1718-V1773 HydrophobicContact CD1-CG2 3.95Å; L1718-V1773 HydrophobicContact CD2-CG2 4.48Å; L1769-V1773 WeakPolarHBondContact O-CG2 3.49Å; L1769-V1773 PolarHBondContact O-N 3.33Å; T1770-V1773 WeakPolarHBondContact O-CB 3.39Å; T1770-V1773 PolarHBondContact O-N 3.44Å; T1770-V1773 VanDerWaalsContact O-N 3.16Å; C1771-V1773 VanDerWaalsContact C-N 3.35Å; C1771-V1773 PolarHBondContact O-N 3.24Å; V1773-P1777 WeakPolarHBondContact O-CD 3.46Å; V1773-P1777 VanDerWaalsContact O-CG 3.23Å; V1773-P1777 WeakPolarHBondContact O-CG 3.35Å; V1773-A1907 HydrophobicContact CB-CB 4.43Å; V1773-A1907 HydrophobicContact CG1-CB 3.57Å; V1773-A1907 WeakPolarHBondContact O-CB 3.44Å
1774	S	85.5	Confident	76.3	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-84.5	-46.4	174.5	-176.4	0	0	0	0	114.2	T1770 C1771 S1772 I1776 P1777 F1778 P1839 E1903	T1770-S1774 PolarHBondContact O-N 3.18Å; C1771-S1774 PolarHBondContact O-N 3.29Å; S1772-S1774 PolarHBondContact O-N 2.96Å; S1774-I1776 PolarHBondContact O-N 3.38Å; S1774-P1777 WeakPolarHBondContact O-CD 3.45Å; S1774-F1778 WeakPolarHBondContact O-CB 3.46Å; S1774-F1778 PolarHBondContact O-N 3.5Å; S1774-F1778 VanDerWaalsContact O-N 3.09Å; S1774-P1839 WeakPolarHBondContact OG-CG 3.14Å; S1774-E1903 WeakPolarHBondContact CB-OE2 3.45Å; S1774-E1903 PolarHBondContact OG-OE2 3.44Å
1775	M	82.7	Confident	77.7	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-76.1	-22.6	-170.1	-163.7	164.1	146.4	0	0	113.2	C1677 T1680 C1771 S1779 P1839 P1840 M1843	C1677-M1775 HydrophobicContact CB-CE 4.3Å; T1680-M1775 HydrophobicContact CG2-CB 4.21Å; T1680-M1775 HydrophobicContact CG2-CE 3.89Å; T1680-M1775 HydrophobicContact CG2-CG 3.85Å; T1680-M1775 HydrophobicContact CG2-SD 4.27Å; T1680-M1775 VanDerWaalsContact OG1-CE 3.29Å; T1680-M1775 WeakPolarHBondContact OG1-CE 3.32Å; C1771-M1775 WeakPolarHBondContact O-CB 3.26Å; C1771-M1775 PolarHBondContact O-N 2.96Å; M1775-S1779 WeakPolarHBondContact O-CB 3.38Å; M1775-S1779 PolarHBondContact O-N 2.85Å; M1775-S1779 VanDerWaalsContact O-N 3.08Å; M1775-S1779 PolarHBondContact O-OG 3.31Å; M1775-P1839 HydrophobicContact CB-CB 4Å; M1775-P1839 HydrophobicContact CG-CB 4.23Å; M1775-P1839 HydrophobicContact SD-CB 4.34Å; M1775-P1840 HydrophobicContact CE-CG 4.47Å; M1775-P1840 HydrophobicContact SD-CG 4.37Å; M1775-M1843 HydrophobicContact CE-CE 4.09Å; M1775-M1843 HydrophobicContact SD-CE 4.47Å
1776	I	87	Confident	78.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-70.4	-56.3	171.5	-65.4	169.5	0	0	0	111.1	F1683 F1714 S1772 S1774 F1778 S1779 Y1780	F1683-I1776 HydrophobicContact CD2-CD1 4.24Å; F1683-I1776 HydrophobicContact CD2-CG1 3.91Å; F1683-I1776 HydrophobicContact CE2-CD1 3.97Å; F1683-I1776 HydrophobicContact CE2-CG1 4.01Å; F1714-I1776 HydrophobicContact CD2-CB 4.24Å; F1714-I1776 HydrophobicContact CD2-CG2 3.83Å; F1714-I1776 HydrophobicContact CE2-CB 4.29Å; F1714-I1776 HydrophobicContact CE2-CG2 4.38Å; S1772-I1776 WeakPolarHBondContact O-CB 3.4Å; S1772-I1776 WeakPolarHBondContact O-CD1 3.43Å; S1772-I1776 VanDerWaalsContact O-CG1 3.23Å; S1772-I1776 WeakPolarHBondContact O-CG1 3.38Å; S1772-I1776 PolarHBondContact O-N 3.16Å; S1772-I1776 VanDerWaalsContact O-N 3.16Å; S1774-I1776 PolarHBondContact O-N 3.38Å; I1776-F1778 VanDerWaalsContact C-N 3.32Å; I1776-F1778 PolarHBondContact O-N 2.81Å; I1776-S1779 PolarHBondContact O-N 3.15Å; I1776-S1779 VanDerWaalsContact O-N 3.16Å; I1776-Y1780 HydrophobicContact CG2-CD2 4.14Å; I1776-Y1780 HydrophobicContact CG2-CE1 4.38Å; I1776-Y1780 HydrophobicContact CG2-CE2 3.51Å; I1776-Y1780 PolarHBondContact O-N 2.91Å
1777	P	87.2	Confident	79.3	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.006	13%	0.132	C	C	.	.	H	α-helix	trans	-55.3	-41.5	172.2	-27.6	34.4	0	0	0	114	F1714 V1773 S1774 S1779 Y1780 L1781 F1910 F1911	F1714-P1777 HydrophobicContact CD2-CG 4.12Å; F1714-P1777 HydrophobicContact CE2-CG 3.98Å; V1773-P1777 WeakPolarHBondContact O-CD 3.46Å; V1773-P1777 VanDerWaalsContact O-CG 3.23Å; V1773-P1777 WeakPolarHBondContact O-CG 3.35Å; S1774-P1777 WeakPolarHBondContact O-CD 3.45Å; P1777-S1779 PolarHBondContact O-N 2.91Å; P1777-Y1780 PolarHBondContact O-N 3.36Å; P1777-L1781 WeakPolarHBondContact O-CB 3.45Å; P1777-L1781 PolarHBondContact O-N 2.9Å; P1777-F1910 HydrophobicContact CB-CB 3.84Å; P1777-F1911 HydrophobicContact CB-CB 4.29Å; P1777-F1911 HydrophobicContact CB-CD2 4.46Å; P1777-F1911 HydrophobicContact CG-CB 4.35Å; P1777-F1911 HydrophobicContact CG-CD2 4.21Å
1778	F	86.8	Confident	79.8	Confident	22 Å²	22	29.1 Å²	29.1	10%	0.096	14%	0.144	C	C	.	.	H	α-helix	trans	-56.4	-48.5	174.1	179.6	-103.4	0	0	0	111.6	S1774 I1776 Y1780 L1781 L1782 F1838 F1910	S1774-F1778 WeakPolarHBondContact O-CB 3.46Å; S1774-F1778 PolarHBondContact O-N 3.5Å; S1774-F1778 VanDerWaalsContact O-N 3.09Å; I1776-F1778 VanDerWaalsContact C-N 3.32Å; I1776-F1778 PolarHBondContact O-N 2.81Å; F1778-Y1780 VanDerWaalsContact C-N 3.34Å; F1778-Y1780 PolarHBondContact O-N 2.93Å; F1778-L1781 PolarHBondContact O-N 2.8Å; F1778-L1782 HydrophobicContact CD1-CD1 4.1Å; F1778-L1782 HydrophobicContact CE1-CD1 3.55Å; F1778-L1782 HydrophobicContact CE2-CD1 4.37Å; F1778-L1782 HydrophobicContact CZ-CD1 3.71Å; F1778-L1782 PolarHBondContact O-N 3.49Å; F1778-L1782 VanDerWaalsContact O-N 3.1Å; F1778-F1838 HydrophobicContact CZ-CD1 4.49Å; F1778-F1910 HydrophobicContact CB-CD2 4.05Å; F1778-F1910 HydrophobicContact CB-CE2 4.3Å; F1778-F1910 HydrophobicContact CB-CG 4.47Å; F1778-F1910 HydrophobicContact CD2-CD1 4.47Å; F1778-F1910 HydrophobicContact CD2-CD2 4.42Å; F1778-F1910 HydrophobicContact CD2-CE1 4.12Å; F1778-F1910 HydrophobicContact CD2-CE2 4.06Å; F1778-F1910 AromaticContact CD2-CZ 3.92Å; F1778-F1910 HydrophobicContact CD2-CZ 3.92Å
1779	S	86.4	Confident	80.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.8	-36	176.9	-59.5	0	0	0	0	112.5	M1775 I1776 P1777 S1783	M1775-S1779 WeakPolarHBondContact O-CB 3.38Å; M1775-S1779 PolarHBondContact O-N 2.85Å; M1775-S1779 VanDerWaalsContact O-N 3.08Å; M1775-S1779 PolarHBondContact O-OG 3.31Å; I1776-S1779 PolarHBondContact O-N 3.15Å; I1776-S1779 VanDerWaalsContact O-N 3.16Å; P1777-S1779 PolarHBondContact O-N 2.91Å; S1779-S1783 WeakPolarHBondContact O-CB 3.42Å; S1779-S1783 PolarHBondContact O-N 3.44Å
1780	Y	88.4	Confident	80.4	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66.3	-41.2	173.2	-67.9	-28.7	0	0	0	112.8	F1683 W1710 N1713 F1714 D1717 I1776 P1777 F1778 L1782 S1783 L1784 L1914	F1683-Y1780 HydrophobicContact CB-CE1 4.2Å; W1710-Y1780 AromaticContact CE3-CD2 3.84Å; W1710-Y1780 HydrophobicContact CE3-CD2 3.84Å; W1710-Y1780 HydrophobicContact CE3-CE2 4.23Å; W1710-Y1780 HydrophobicContact CE3-CG 4.07Å; W1710-Y1780 HydrophobicContact CH2-CG 4.42Å; W1710-Y1780 AromaticContact CZ3-CD1 3.87Å; W1710-Y1780 HydrophobicContact CZ3-CD1 3.87Å; W1710-Y1780 AromaticContact CZ3-CD2 3.84Å; W1710-Y1780 HydrophobicContact CZ3-CD2 3.84Å; W1710-Y1780 HydrophobicContact CZ3-CE1 4.4Å; W1710-Y1780 HydrophobicContact CZ3-CE2 4.39Å; W1710-Y1780 AromaticContact CZ3-CG 3.56Å; W1710-Y1780 HydrophobicContact CZ3-CG 3.56Å; N1713-Y1780 HydrophobicContact CB-CE2 4.49Å; N1713-Y1780 PolarHBondContact O-OH 3.33Å; F1714-Y1780 HydrophobicContact CB-CE2 4.4Å; D1717-Y1780 PolarHBondContact OD2-OH 3.33Å; I1776-Y1780 HydrophobicContact CG2-CD2 4.14Å; I1776-Y1780 HydrophobicContact CG2-CE1 4.38Å; I1776-Y1780 HydrophobicContact CG2-CE2 3.51Å; I1776-Y1780 PolarHBondContact O-N 2.91Å; P1777-Y1780 PolarHBondContact O-N 3.36Å; F1778-Y1780 VanDerWaalsContact C-N 3.34Å; F1778-Y1780 PolarHBondContact O-N 2.93Å; Y1780-L1782 VanDerWaalsContact C-N 3.34Å; Y1780-L1782 PolarHBondContact O-N 2.99Å; Y1780-S1783 WeakPolarHBondContact O-CB 3.42Å; Y1780-S1783 PolarHBondContact O-N 2.75Å; Y1780-S1783 VanDerWaalsContact O-N 3.1Å; Y1780-S1783 PolarHBondContact O-OG 3.06Å; Y1780-L1784 PolarHBondContact O-N 2.8Å; Y1780-L1914 HydrophobicContact CD2-CD2 4.02Å; Y1780-L1914 HydrophobicContact CG-CD2 4.37Å
1781	L	86.6	Confident	80.6	Confident	24 Å²	24	31.2 Å²	31.2	13%	0.126	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-41.4	-179.5	-164.5	151.4	0	0	0	110.9	P1777 F1778 L1784 L1913 L1914 F1917	P1777-L1781 WeakPolarHBondContact O-CB 3.45Å; P1777-L1781 PolarHBondContact O-N 2.9Å; F1778-L1781 PolarHBondContact O-N 2.8Å; L1781-L1784 WeakPolarHBondContact O-CB 3.36Å; L1781-L1913 HydrophobicContact CD1-CB 3.54Å; L1781-L1913 HydrophobicContact CD1-CD1 4.43Å; L1781-L1914 HydrophobicContact CB-CD1 4.43Å; L1781-F1917 HydrophobicContact CD1-CD2 4.3Å; L1781-F1917 HydrophobicContact CD1-CE2 4.38Å; L1781-F1917 HydrophobicContact CD2-CE2 4.25Å; L1781-F1917 HydrophobicContact CG-CD2 4.29Å; L1781-F1917 HydrophobicContact CG-CE2 4.45Å
1782	L	83.2	Confident	81	Confident	47 Å²	47	31.2 Å²	31.2	25%	0.246	16%	0.157	C	C	.	.	H	α-helix	trans	-69.8	-32.1	171.4	-62	175.7	0	0	0	112.8	F1778 Y1780 L1784 Y1785 L1796	F1778-L1782 HydrophobicContact CD1-CD1 4.1Å; F1778-L1782 HydrophobicContact CE1-CD1 3.55Å; F1778-L1782 HydrophobicContact CE2-CD1 4.37Å; F1778-L1782 HydrophobicContact CZ-CD1 3.71Å; F1778-L1782 PolarHBondContact O-N 3.49Å; F1778-L1782 VanDerWaalsContact O-N 3.1Å; Y1780-L1782 VanDerWaalsContact C-N 3.34Å; Y1780-L1782 PolarHBondContact O-N 2.99Å; L1782-L1784 PolarHBondContact O-N 3.37Å; L1782-L1784 VanDerWaalsContact O-N 3.15Å; L1782-Y1785 PolarHBondContact O-N 3.14Å; L1782-L1796 HydrophobicContact CB-CD2 3.41Å; L1782-L1796 VanDerWaalsContact CB-CD2 3.41Å; L1782-L1796 HydrophobicContact CD1-CD2 3.75Å; L1782-L1796 HydrophobicContact CG-CD2 4.25Å
1783	S	85.1	Confident	81.5	Confident	3 Å²	3	34.1 Å²	34.1	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-58.9	-27.3	177.1	84.1	0	0	0	0	113.5	S1779 Y1780 Y1785 F1786	S1779-S1783 WeakPolarHBondContact O-CB 3.42Å; S1779-S1783 PolarHBondContact O-N 3.44Å; Y1780-S1783 WeakPolarHBondContact O-CB 3.42Å; Y1780-S1783 PolarHBondContact O-N 2.75Å; Y1780-S1783 VanDerWaalsContact O-N 3.1Å; Y1780-S1783 PolarHBondContact O-OG 3.06Å; S1783-Y1785 PolarHBondContact O-N 3.45Å; S1783-Y1785 VanDerWaalsContact O-N 3.12Å; S1783-F1786 PolarHBondContact O-N 2.82Å; S1783-F1786 VanDerWaalsContact O-N 3.1Å
1784	L	82.8	Confident	81.1	Confident	43 Å²	43	34 Å²	34	23%	0.225	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.8	179.3	-65.3	-177.6	0	0	0	113.4	K1691 W1710 Y1780 L1781 L1782 L1914 F1917	K1691-L1784 PolarHBondContact NZ-O 3.25Å; W1710-L1784 HydrophobicContact CH2-CD2 4.4Å; W1710-L1784 HydrophobicContact CZ2-CD2 4.04Å; Y1780-L1784 PolarHBondContact O-N 2.8Å; L1781-L1784 WeakPolarHBondContact O-CB 3.36Å; L1782-L1784 PolarHBondContact O-N 3.37Å; L1782-L1784 VanDerWaalsContact O-N 3.15Å; L1784-L1914 HydrophobicContact CD1-CD1 4.06Å; L1784-L1914 HydrophobicContact CD2-CD1 4.47Å; L1784-L1914 HydrophobicContact CG-CD1 4.27Å; L1784-F1917 HydrophobicContact CD1-CB 3.77Å; L1784-F1917 HydrophobicContact CD1-CG 4.37Å
1785	Y	80.8	Confident	80.9	Confident	131 Å²	131	37 Å²	37	51%	0.514	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-23.6	179.7	-66.8	-80.7	0	0	0	113.6	L1782 S1783 P1990	L1782-Y1785 PolarHBondContact O-N 3.14Å; S1783-Y1785 PolarHBondContact O-N 3.45Å; S1783-Y1785 VanDerWaalsContact O-N 3.12Å; Y1785-P1990 HydrophobicContact CD1-CG 4.41Å; Y1785-P1990 HydrophobicContact CE1-CG 3.84Å
1786	F	79.9	Confident	80.9	Confident	36 Å²	36	37 Å²	37	16%	0.158	19%	0.185	C	C	.	.			trans	-88.1	149.7	-174.7	-59.6	-72.6	0	0	0	113.2	V1688 K1691 S1783 L1791 V1795 L1796	V1688-F1786 HydrophobicContact CG1-CB 4.28Å; V1688-F1786 HydrophobicContact CG2-CB 4.23Å; K1691-F1786 PolarHBondContact NZ-O 2.88Å; S1783-F1786 PolarHBondContact O-N 2.82Å; S1783-F1786 VanDerWaalsContact O-N 3.1Å; F1786-L1791 HydrophobicContact CD1-CD2 3.53Å; F1786-L1791 HydrophobicContact CE1-CD2 3.72Å; F1786-V1795 HydrophobicContact CE1-CB 4.04Å; F1786-V1795 HydrophobicContact CE1-CG1 4.06Å; F1786-V1795 HydrophobicContact CE1-CG2 4.32Å; F1786-V1795 HydrophobicContact CZ-CB 3.88Å; F1786-V1795 HydrophobicContact CZ-CG1 3.67Å; F1786-L1796 HydrophobicContact CD2-CD1 4.46Å; F1786-L1796 HydrophobicContact CE2-CD1 4.23Å; F1786-L1796 HydrophobicContact CE2-CD2 4Å; F1786-L1796 HydrophobicContact CE2-CG 3.88Å
1787	Q	75.9	Confident	80.6	Confident	164 Å²	164	37.9 Å²	37.9	77%	0.766	19%	0.191	S	C	*	.	S	Bend	trans	-113.1	-19	170.6	-66	-176.1	-2.5	0	0	112.8	A1692	A1692-Q1787 WeakPolarHBondContact CB-O 3.31Å
1788	S	74.3	Confident	80.2	Confident	38 Å²	38	41.6 Å²	41.6	27%	0.266	21%	0.21	S	C	.	.			trans	-108.2	122.1	178.8	174.7	0	0	0	0	109.5	S1790 L1791 G1792	S1788-S1790 PolarHBondContact O-N 3.5Å; S1788-L1791 PolarHBondContact O-N 2.85Å; S1788-G1792 PolarHBondContact O-N 3.43Å
1789	P	74.5	Confident	80	Confident	30 Å²	30	42.2 Å²	42.2	20%	0.195	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-41	-174.9	-23.3	32.9	0	0	0	113.8	I1685 V1688 E1689 G1792 F1793	I1685-P1789 HydrophobicContact CG2-CB 4.04Å; V1688-P1789 HydrophobicContact CB-CB 4.34Å; V1688-P1789 HydrophobicContact CB-CG 4.38Å; V1688-P1789 HydrophobicContact CG1-CB 4.3Å; V1688-P1789 HydrophobicContact CG1-CG 4.05Å; E1689-P1789 HydrophobicContact CB-CB 4.4Å; E1689-P1789 HydrophobicContact CB-CG 3.9Å; E1689-P1789 HydrophobicContact CG-CG 4.48Å; P1789-G1792 PolarHBondContact O-N 3.33Å; P1789-F1793 PolarHBondContact O-N 3.19Å
1790	S	70.8	Confident	79.9	Confident	19 Å²	19	42.2 Å²	42.2	13%	0.133	22%	0.217	C	C	.	.	H	α-helix	trans	-69	-39.6	-179	44.7	0	0	0	0	112.5	Q754 S1788 M1794	Q754-S1790 PolarHBondContact OE1-OG 2.88Å; S1788-S1790 PolarHBondContact O-N 3.5Å; S1790-M1794 WeakPolarHBondContact O-CB 3.31Å; S1790-M1794 PolarHBondContact O-N 3.19Å; S1790-M1794 VanDerWaalsContact O-N 3.13Å
1791	L	74.8	Confident	79.6	Confident	59 Å²	59	44.6 Å²	44.6	31%	0.309	23%	0.228	S	C	.	.	H	α-helix	trans	-69.2	-40	173.9	-175.1	142.6	0	0	0	111.5	N756 F1786 S1788 M1794 V1795	N756-L1791 HydrophobicContact CB-CD1 4.14Å; F1786-L1791 HydrophobicContact CD1-CD2 3.53Å; F1786-L1791 HydrophobicContact CE1-CD2 3.72Å; S1788-L1791 PolarHBondContact O-N 2.85Å; L1791-M1794 PolarHBondContact O-N 3.1Å; L1791-V1795 HydrophobicContact CD2-CG2 4Å; L1791-V1795 HydrophobicContact CG-CG2 4.14Å; L1791-V1795 WeakPolarHBondContact O-CB 3.26Å; L1791-V1795 VanDerWaalsContact O-CG2 3.31Å; L1791-V1795 WeakPolarHBondContact O-CG2 3.35Å; L1791-V1795 PolarHBondContact O-N 3.46Å
1792	G	77.5	Confident	79.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.1	-51.9	174.4	0	0	0	0	0	112	S1788 P1789 M1794 L1796	S1788-G1792 PolarHBondContact O-N 3.43Å; P1789-G1792 PolarHBondContact O-N 3.33Å; G1792-M1794 VanDerWaalsContact C-N 3.34Å; G1792-M1794 PolarHBondContact O-N 3.4Å; G1792-L1796 VanDerWaalsContact O-CB 3.24Å; G1792-L1796 WeakPolarHBondContact O-CB 3.37Å; G1792-L1796 WeakPolarHBondContact O-CD1 3.44Å; G1792-L1796 WeakPolarHBondContact O-CG 3.27Å; G1792-L1796 PolarHBondContact O-N 3.1Å
1793	F	80.5	Confident	79.4	Confident	61 Å²	61	48.7 Å²	48.7	27%	0.268	25%	0.245	S	C	.	.	H	α-helix	trans	-53.9	-48.4	175.2	167.7	-113.6	0	0	0	113.1	A1681 I1685 P1789 S1797	A1681-F1793 HydrophobicContact CB-CD2 3.99Å; A1681-F1793 HydrophobicContact CB-CE2 4.23Å; I1685-F1793 HydrophobicContact CD1-CB 3.92Å; I1685-F1793 HydrophobicContact CD1-CD2 4.06Å; I1685-F1793 HydrophobicContact CD1-CG 3.89Å; I1685-F1793 HydrophobicContact CG1-CB 3.67Å; I1685-F1793 HydrophobicContact CG1-CD2 4.42Å; I1685-F1793 HydrophobicContact CG1-CG 4.19Å; P1789-F1793 PolarHBondContact O-N 3.19Å; F1793-S1797 VanDerWaalsContact CE2-OG 3.26Å; F1793-S1797 WeakPolarHBondContact CE2-OG 3.37Å; F1793-S1797 WeakPolarHBondContact O-CB 3.47Å; F1793-S1797 PolarHBondContact O-N 3.41Å; F1793-S1797 PolarHBondContact O-OG 3.36Å
1794	M	73.2	Confident	79.2	Confident	36 Å²	36	48.6 Å²	48.6	18%	0.177	24%	0.244	C	C	.	.	H	α-helix	trans	-67.6	-49.6	-175.3	-170.3	-165.6	-64.9	0	0	111.4	L757 M761 S1790 L1791 G1792 L1796 S1797 I1798	L757-M1794 HydrophobicContact CD1-CE 3.97Å; M761-M1794 HydrophobicContact CG-CE 4.31Å; S1790-M1794 WeakPolarHBondContact O-CB 3.31Å; S1790-M1794 PolarHBondContact O-N 3.19Å; S1790-M1794 VanDerWaalsContact O-N 3.13Å; L1791-M1794 PolarHBondContact O-N 3.1Å; G1792-M1794 VanDerWaalsContact C-N 3.34Å; G1792-M1794 PolarHBondContact O-N 3.4Å; M1794-L1796 VanDerWaalsContact C-N 3.35Å; M1794-L1796 PolarHBondContact O-N 2.89Å; M1794-S1797 PolarHBondContact O-N 2.93Å; M1794-I1798 HydrophobicContact CG-CD1 3.86Å; M1794-I1798 WeakPolarHBondContact O-CB 3.37Å; M1794-I1798 VanDerWaalsContact O-CG1 3.24Å; M1794-I1798 WeakPolarHBondContact O-CG1 3.41Å; M1794-I1798 PolarHBondContact O-N 2.83Å
1795	V	80.7	Confident	79.1	Confident	62 Å²	62	47.1 Å²	47.1	38%	0.376	24%	0.237	S	C	.	.	H	α-helix	trans	-62.7	-42.6	179.2	175.5	0	0	0	0	110.7	F1786 L1791 I1798 S1799	F1786-V1795 HydrophobicContact CE1-CB 4.04Å; F1786-V1795 HydrophobicContact CE1-CG1 4.06Å; F1786-V1795 HydrophobicContact CE1-CG2 4.32Å; F1786-V1795 HydrophobicContact CZ-CB 3.88Å; F1786-V1795 HydrophobicContact CZ-CG1 3.67Å; L1791-V1795 HydrophobicContact CD2-CG2 4Å; L1791-V1795 HydrophobicContact CG-CG2 4.14Å; L1791-V1795 WeakPolarHBondContact O-CB 3.26Å; L1791-V1795 VanDerWaalsContact O-CG2 3.31Å; L1791-V1795 WeakPolarHBondContact O-CG2 3.35Å; L1791-V1795 PolarHBondContact O-N 3.46Å; V1795-I1798 PolarHBondContact O-N 3.08Å; V1795-S1799 VanDerWaalsContact O-CB 3.3Å; V1795-S1799 WeakPolarHBondContact O-CB 3.46Å; V1795-S1799 PolarHBondContact O-N 2.92Å; V1795-S1799 PolarHBondContact O-OG 2.85Å; V1795-S1799 VanDerWaalsContact O-OG 3.07Å
1796	L	82.9	Confident	79.2	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-66.6	-40.5	178	-69.6	171.3	0	0	0	113	A1681 S1684 L1782 F1786 G1792 M1794 I1798 S1799 N1800	A1681-L1796 HydrophobicContact CB-CB 3.86Å; S1684-L1796 WeakPolarHBondContact OG-CD1 3.36Å; L1782-L1796 HydrophobicContact CB-CD2 3.41Å; L1782-L1796 VanDerWaalsContact CB-CD2 3.41Å; L1782-L1796 HydrophobicContact CD1-CD2 3.75Å; L1782-L1796 HydrophobicContact CG-CD2 4.25Å; F1786-L1796 HydrophobicContact CD2-CD1 4.46Å; F1786-L1796 HydrophobicContact CE2-CD1 4.23Å; F1786-L1796 HydrophobicContact CE2-CD2 4Å; F1786-L1796 HydrophobicContact CE2-CG 3.88Å; G1792-L1796 VanDerWaalsContact O-CB 3.24Å; G1792-L1796 WeakPolarHBondContact O-CB 3.37Å; G1792-L1796 WeakPolarHBondContact O-CD1 3.44Å; G1792-L1796 WeakPolarHBondContact O-CG 3.27Å; G1792-L1796 PolarHBondContact O-N 3.1Å; M1794-L1796 VanDerWaalsContact C-N 3.35Å; M1794-L1796 PolarHBondContact O-N 2.89Å; L1796-I1798 VanDerWaalsContact C-N 3.32Å; L1796-I1798 PolarHBondContact O-N 3.1Å; L1796-S1799 WeakPolarHBondContact CA-OG 3.46Å; L1796-S1799 PolarHBondContact O-OG 3.08Å; L1796-N1800 WeakPolarHBondContact O-CB 3.38Å; L1796-N1800 PolarHBondContact O-N 3.13Å; L1796-N1800 PolarHBondContact O-ND2 3.45Å; L1796-N1800 PolarHBondContact O-OD1 3.22Å
1797	S	79.4	Confident	79.3	Confident	18 Å²	18	43.7 Å²	43.7	13%	0.126	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-46.7	176	-59.1	0	0	0	0	110.5	A1681 F1793 M1794 F1801	A1681-S1797 WeakPolarHBondContact CB-OG 3.48Å; F1793-S1797 VanDerWaalsContact CE2-OG 3.26Å; F1793-S1797 WeakPolarHBondContact CE2-OG 3.37Å; F1793-S1797 WeakPolarHBondContact O-CB 3.47Å; F1793-S1797 PolarHBondContact O-N 3.41Å; F1793-S1797 PolarHBondContact O-OG 3.36Å; M1794-S1797 PolarHBondContact O-N 2.93Å; S1797-F1801 VanDerWaalsContact O-CB 3.23Å; S1797-F1801 WeakPolarHBondContact O-CB 3.3Å; S1797-F1801 PolarHBondContact O-N 3Å
1798	I	79.7	Confident	79.4	Confident	78 Å²	78	36 Å²	36	40%	0.4	19%	0.193	S	C	.	.	H	α-helix	trans	-69.7	-45.6	-178.1	-68.2	172.5	0	0	0	111.1	M1794 V1795 L1796 F1801 F1802	M1794-I1798 HydrophobicContact CG-CD1 3.86Å; M1794-I1798 WeakPolarHBondContact O-CB 3.37Å; M1794-I1798 VanDerWaalsContact O-CG1 3.24Å; M1794-I1798 WeakPolarHBondContact O-CG1 3.41Å; M1794-I1798 PolarHBondContact O-N 2.83Å; V1795-I1798 PolarHBondContact O-N 3.08Å; L1796-I1798 VanDerWaalsContact C-N 3.32Å; L1796-I1798 PolarHBondContact O-N 3.1Å; I1798-F1801 PolarHBondContact O-N 2.99Å; I1798-F1802 HydrophobicContact CG2-CD2 3.53Å; I1798-F1802 HydrophobicContact CG2-CE2 3.54Å; I1798-F1802 WeakPolarHBondContact O-CB 3.19Å; I1798-F1802 VanDerWaalsContact O-CD2 3.28Å; I1798-F1802 WeakPolarHBondContact O-CD2 3.46Å; I1798-F1802 PolarHBondContact O-N 2.85Å
1799	S	82.4	Confident	79.6	Confident	36 Å²	36	36.2 Å²	36.2	25%	0.252	19%	0.194	S	C	.	.	H	α-helix	trans	-66.2	-43.6	179.8	65.6	0	0	0	0	111.9	V1795 L1796 F1801 F1802 I1803	V1795-S1799 VanDerWaalsContact O-CB 3.3Å; V1795-S1799 WeakPolarHBondContact O-CB 3.46Å; V1795-S1799 PolarHBondContact O-N 2.92Å; V1795-S1799 PolarHBondContact O-OG 2.85Å; V1795-S1799 VanDerWaalsContact O-OG 3.07Å; L1796-S1799 WeakPolarHBondContact CA-OG 3.46Å; L1796-S1799 PolarHBondContact O-OG 3.08Å; S1799-F1801 VanDerWaalsContact C-N 3.35Å; S1799-F1802 PolarHBondContact O-N 3.47Å; S1799-I1803 WeakPolarHBondContact O-CB 3.49Å; S1799-I1803 WeakPolarHBondContact O-CD1 3.31Å; S1799-I1803 WeakPolarHBondContact O-CG1 3.31Å; S1799-I1803 PolarHBondContact O-N 2.98Å
1800	N	84.2	Confident	80	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.4	-40.4	179.1	-66.7	-4.8	0	0	0	110.8	C1677 L1796 G1804 P1840	C1677-N1800 HydrophobicContact CB-CB 4.08Å; L1796-N1800 WeakPolarHBondContact O-CB 3.38Å; L1796-N1800 PolarHBondContact O-N 3.13Å; L1796-N1800 PolarHBondContact O-ND2 3.45Å; L1796-N1800 PolarHBondContact O-OD1 3.22Å; N1800-G1804 PolarHBondContact O-N 2.82Å; N1800-G1804 VanDerWaalsContact O-N 3.1Å; N1800-P1840 HydrophobicContact CB-CG 4Å; N1800-P1840 WeakPolarHBondContact O-CB 3.46Å
1801	F	82.8	Confident	80.4	Confident	50 Å²	50	36.8 Å²	36.8	22%	0.219	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-51.4	173.2	177.3	-112.5	0	0	0	111.4	L1673 M1674 C1677 S1797 I1798 S1799 I1803 G1804 T1805	L1673-F1801 HydrophobicContact CD2-CD2 4.19Å; L1673-F1801 HydrophobicContact CD2-CE2 4.49Å; L1673-F1801 HydrophobicContact CG-CD2 4.25Å; M1674-F1801 HydrophobicContact CB-CD2 3.78Å; M1674-F1801 HydrophobicContact CB-CE2 3.61Å; M1674-F1801 HydrophobicContact CB-CZ 4.46Å; M1674-F1801 HydrophobicContact CG-CD2 4.04Å; M1674-F1801 HydrophobicContact CG-CE2 3.99Å; M1674-F1801 HydrophobicContact CG-CZ 4.49Å; C1677-F1801 HydrophobicContact CB-CB 4.48Å; S1797-F1801 VanDerWaalsContact O-CB 3.23Å; S1797-F1801 WeakPolarHBondContact O-CB 3.3Å; S1797-F1801 PolarHBondContact O-N 3Å; I1798-F1801 PolarHBondContact O-N 2.99Å; S1799-F1801 VanDerWaalsContact C-N 3.35Å; F1801-I1803 PolarHBondContact O-N 3.11Å; F1801-G1804 PolarHBondContact O-N 3.34Å; F1801-T1805 HydrophobicContact CD1-CG2 4Å; F1801-T1805 HydrophobicContact CD2-CG2 3.61Å; F1801-T1805 HydrophobicContact CE1-CG2 3.72Å; F1801-T1805 HydrophobicContact CE2-CG2 3.29Å; F1801-T1805 HydrophobicContact CG-CG2 3.97Å; F1801-T1805 HydrophobicContact CZ-CG2 3.36Å; F1801-T1805 WeakPolarHBondContact O-CG2 3.18Å; F1801-T1805 PolarHBondContact O-N 3.47Å; F1801-T1805 PolarHBondContact O-OG1 3.42Å
1802	F	82.1	Confident	80.3	Confident	108 Å²	108	34.9 Å²	34.9	47%	0.474	18%	0.183	S	C	.	.	H	α-helix	trans	-64.7	-37.6	-179.8	-82.9	-57.4	0	0	0	113.9	I1798 S1799 G1804 T1805 I1806	I1798-F1802 HydrophobicContact CG2-CD2 3.53Å; I1798-F1802 HydrophobicContact CG2-CE2 3.54Å; I1798-F1802 WeakPolarHBondContact O-CB 3.19Å; I1798-F1802 VanDerWaalsContact O-CD2 3.28Å; I1798-F1802 WeakPolarHBondContact O-CD2 3.46Å; I1798-F1802 PolarHBondContact O-N 2.85Å; S1799-F1802 PolarHBondContact O-N 3.47Å; F1802-G1804 VanDerWaalsContact C-N 3.32Å; F1802-G1804 PolarHBondContact O-N 2.91Å; F1802-T1805 WeakPolarHBondContact CA-OG1 3.5Å; F1802-T1805 PolarHBondContact O-N 2.95Å; F1802-T1805 PolarHBondContact O-OG1 2.82Å; F1802-I1806 HydrophobicContact CB-CD1 4.16Å; F1802-I1806 HydrophobicContact CD1-CD1 4.13Å; F1802-I1806 HydrophobicContact CD1-CG1 4.43Å; F1802-I1806 WeakPolarHBondContact O-CB 3.15Å; F1802-I1806 WeakPolarHBondContact O-CG1 3.22Å; F1802-I1806 PolarHBondContact O-N 3.2Å
1803	I	83.1	Confident	80.1	Confident	49 Å²	49	36.9 Å²	36.9	25%	0.251	20%	0.199	S	C	.	.	H	α-helix	trans	-61.4	-44.6	174.5	-70.8	164.1	0	0	0	109.9	S1799 F1801 G1807 F1838	S1799-I1803 WeakPolarHBondContact O-CB 3.49Å; S1799-I1803 WeakPolarHBondContact O-CD1 3.31Å; S1799-I1803 WeakPolarHBondContact O-CG1 3.31Å; S1799-I1803 PolarHBondContact O-N 2.98Å; F1801-I1803 PolarHBondContact O-N 3.11Å; I1803-G1807 PolarHBondContact O-N 2.82Å; I1803-G1807 VanDerWaalsContact O-N 3.13Å; I1803-F1838 HydrophobicContact CG2-CB 3.7Å; I1803-F1838 HydrophobicContact CG2-CD1 3.88Å; I1803-F1838 HydrophobicContact CG2-CG 3.81Å
1804	G	80.3	Confident	79.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.1	-50.1	175.7	0	0	0	0	0	112.7	N1800 F1801 F1802 S1808	N1800-G1804 PolarHBondContact O-N 2.82Å; N1800-G1804 VanDerWaalsContact O-N 3.1Å; F1801-G1804 PolarHBondContact O-N 3.34Å; F1802-G1804 VanDerWaalsContact C-N 3.32Å; F1802-G1804 PolarHBondContact O-N 2.91Å; G1804-S1808 VanDerWaalsContact O-CB 3.28Å; G1804-S1808 WeakPolarHBondContact O-CB 3.37Å; G1804-S1808 PolarHBondContact O-N 2.69Å; G1804-S1808 PolarHBondContact O-OG 2.85Å
1805	T	81.6	Confident	79.8	Confident	13 Å²	13	37 Å²	37	8%	0.08	20%	0.2	C	C	.	.	H	α-helix	trans	-66.2	-48.1	-176.7	66	0	0	0	0	111.8	L1670 L1673 F1801 F1802 S1808 S1809	L1670-T1805 HydrophobicContact CD2-CG2 3.71Å; L1673-T1805 HydrophobicContact CD2-CG2 3.86Å; F1801-T1805 HydrophobicContact CD1-CG2 4Å; F1801-T1805 HydrophobicContact CD2-CG2 3.61Å; F1801-T1805 HydrophobicContact CE1-CG2 3.72Å; F1801-T1805 HydrophobicContact CE2-CG2 3.29Å; F1801-T1805 HydrophobicContact CG-CG2 3.97Å; F1801-T1805 HydrophobicContact CZ-CG2 3.36Å; F1801-T1805 WeakPolarHBondContact O-CG2 3.18Å; F1801-T1805 PolarHBondContact O-N 3.47Å; F1801-T1805 PolarHBondContact O-OG1 3.42Å; F1802-T1805 WeakPolarHBondContact CA-OG1 3.5Å; F1802-T1805 PolarHBondContact O-N 2.95Å; F1802-T1805 PolarHBondContact O-OG1 2.82Å; T1805-S1808 PolarHBondContact O-OG 3.16Å; T1805-S1809 WeakPolarHBondContact O-CB 3.35Å; T1805-S1809 PolarHBondContact O-N 2.69Å; T1805-S1809 PolarHBondContact O-OG 2.93Å
1806	I	83.5	Confident	79.2	Confident	95 Å²	95	36.8 Å²	36.8	49%	0.487	20%	0.198	S	C	.	.	H	α-helix	trans	-68.9	-45.8	-176	-63.3	170	0	0	0	108.8	F1802 S1808 L1810	F1802-I1806 HydrophobicContact CB-CD1 4.16Å; F1802-I1806 HydrophobicContact CD1-CD1 4.13Å; F1802-I1806 HydrophobicContact CD1-CG1 4.43Å; F1802-I1806 WeakPolarHBondContact O-CB 3.15Å; F1802-I1806 WeakPolarHBondContact O-CG1 3.22Å; F1802-I1806 PolarHBondContact O-N 3.2Å; I1806-S1808 PolarHBondContact O-N 2.83Å; I1806-L1810 WeakPolarHBondContact O-CB 3.24Å; I1806-L1810 PolarHBondContact O-N 3.5Å
1807	G	81.2	Confident	78.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.9	-47.6	176.8	0	0	0	0	0	112.5	I1803 T1811 F1841	I1803-G1807 PolarHBondContact O-N 2.82Å; I1803-G1807 VanDerWaalsContact O-N 3.13Å; G1807-T1811 WeakPolarHBondContact O-CG2 3.43Å; G1807-T1811 PolarHBondContact O-N 3.31Å; G1807-T1811 PolarHBondContact O-OG1 3.44Å; G1807-F1841 VanDerWaalsContact C-CE2 3.46Å; G1807-F1841 WeakPolarHBondContact O-CE2 3.43Å
1808	S	78.7	Confident	77.4	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-68.9	-46.5	-178.8	70.3	0	0	0	0	111.1	G1804 T1805 I1806 L1810 T1811 M1812	G1804-S1808 VanDerWaalsContact O-CB 3.28Å; G1804-S1808 WeakPolarHBondContact O-CB 3.37Å; G1804-S1808 PolarHBondContact O-N 2.69Å; G1804-S1808 PolarHBondContact O-OG 2.85Å; T1805-S1808 PolarHBondContact O-OG 3.16Å; I1806-S1808 PolarHBondContact O-N 2.83Å; S1808-L1810 VanDerWaalsContact C-N 3.33Å; S1808-L1810 PolarHBondContact O-N 3.48Å; S1808-T1811 PolarHBondContact O-OG1 3.1Å; S1808-M1812 WeakPolarHBondContact O-CB 3.48Å; S1808-M1812 PolarHBondContact O-N 3.38Å
1809	S	77.9	Confident	76.3	Confident	41 Å²	41	41.6 Å²	41.6	29%	0.287	22%	0.22	S	C	.	.	H	α-helix	trans	-61.7	-40.1	178.3	-51.5	0	0	0	0	112	M1666 T1805 A1813	M1666-S1809 VanDerWaalsContact CE-CA 3.49Å; M1666-S1809 WeakPolarHBondContact CE-OG 3.25Å; T1805-S1809 WeakPolarHBondContact O-CB 3.35Å; T1805-S1809 PolarHBondContact O-N 2.69Å; T1805-S1809 PolarHBondContact O-OG 2.93Å; S1809-A1813 WeakPolarHBondContact O-CB 3.5Å; S1809-A1813 PolarHBondContact O-N 3.12Å
1810	L	82.1	Confident	74.7	Confident	62 Å²	62	42.5 Å²	42.5	33%	0.325	22%	0.222	S	C	.	.	H	α-helix	trans	-72.3	-48.1	-177.4	-170.4	73.1	0	0	0	111.8	I1806 S1808 M1812 A1813 F1814 L1831 F1835	I1806-L1810 WeakPolarHBondContact O-CB 3.24Å; I1806-L1810 PolarHBondContact O-N 3.5Å; S1808-L1810 VanDerWaalsContact C-N 3.33Å; S1808-L1810 PolarHBondContact O-N 3.48Å; L1810-M1812 VanDerWaalsContact C-N 3.32Å; L1810-M1812 PolarHBondContact O-N 2.91Å; L1810-A1813 PolarHBondContact O-N 3.26Å; L1810-F1814 HydrophobicContact CD1-CD2 4.15Å; L1810-F1814 HydrophobicContact CD1-CE2 3.49Å; L1810-F1814 VanDerWaalsContact CD1-CE2 3.49Å; L1810-F1814 HydrophobicContact CD1-CZ 3.86Å; L1810-F1814 HydrophobicContact CD2-CE2 4.07Å; L1810-F1814 HydrophobicContact CG-CD2 3.86Å; L1810-F1814 HydrophobicContact CG-CE2 3.51Å; L1810-F1814 HydrophobicContact CG-CZ 4.38Å; L1810-F1814 WeakPolarHBondContact O-CB 3.43Å; L1810-F1814 WeakPolarHBondContact O-CD2 3.14Å; L1810-F1814 WeakPolarHBondContact O-CG 3.43Å; L1810-F1814 PolarHBondContact O-N 3.06Å; L1810-L1831 HydrophobicContact CD2-CD1 4.27Å; L1810-F1835 HydrophobicContact CD2-CE2 4.18Å
1811	T	80.2	Confident	73.7	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66	-37.9	177.4	56	0	0	0	0	111.4	G1807 S1808 F1814 E1815 L1831 K1832 F1835 F1841	G1807-T1811 WeakPolarHBondContact O-CG2 3.43Å; G1807-T1811 PolarHBondContact O-N 3.31Å; G1807-T1811 PolarHBondContact O-OG1 3.44Å; S1808-T1811 PolarHBondContact O-OG1 3.1Å; T1811-F1814 PolarHBondContact O-N 3.08Å; T1811-E1815 WeakPolarHBondContact O-CB 3.39Å; T1811-E1815 WeakPolarHBondContact O-CG 3.48Å; T1811-E1815 PolarHBondContact O-N 3.03Å; T1811-L1831 HydrophobicContact CG2-CB 3.94Å; T1811-K1832 HydrophobicContact CG2-CB 4.38Å; T1811-F1835 HydrophobicContact CG2-CD2 4.05Å; T1811-F1841 HydrophobicContact CG2-CE2 3.99Å; T1811-F1841 HydrophobicContact CG2-CZ 4.01Å; T1811-F1841 WeakPolarHBondContact OG1-CE2 3.44Å
1812	M	73.1	Confident	73.2	Confident	18 Å²	18	50.8 Å²	50.8	9%	0.089	26%	0.264	C	S	.	.	H	α-helix	trans	-69.7	-41.2	177.1	-173.8	168.6	166.9	0	0	112.5	I1662 M1666 S1808 L1810 F1814 E1815 V1816	I1662-M1812 HydrophobicContact CB-CE 4.46Å; I1662-M1812 HydrophobicContact CG2-CE 3.04Å; M1666-M1812 HydrophobicContact CB-CE 3.87Å; M1666-M1812 HydrophobicContact CB-SD 4.22Å; M1666-M1812 HydrophobicContact CG-CE 4.18Å; M1666-M1812 HydrophobicContact CG-SD 3.95Å; M1666-M1812 HydrophobicContact SD-CE 3.8Å; M1666-M1812 HydrophobicContact SD-SD 3.6Å; M1666-M1812 VanDerWaalsContact SD-SD 3.6Å; S1808-M1812 WeakPolarHBondContact O-CB 3.48Å; S1808-M1812 PolarHBondContact O-N 3.38Å; L1810-M1812 VanDerWaalsContact C-N 3.32Å; L1810-M1812 PolarHBondContact O-N 2.91Å; M1812-F1814 VanDerWaalsContact C-N 3.34Å; M1812-F1814 PolarHBondContact O-N 3.45Å; M1812-E1815 PolarHBondContact O-N 3.2Å; M1812-V1816 WeakPolarHBondContact O-CB 3.41Å; M1812-V1816 VanDerWaalsContact O-CG2 3.25Å; M1812-V1816 WeakPolarHBondContact O-CG2 3.41Å; M1812-V1816 PolarHBondContact O-N 3.48Å
1813	A	73.3	Confident	73	Confident	42 Å²	42	53.8 Å²	53.8	35%	0.347	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-43.4	171.6	0	0	0	0	0	111	S1809 L1810 V1816 L1817	S1809-A1813 WeakPolarHBondContact O-CB 3.5Å; S1809-A1813 PolarHBondContact O-N 3.12Å; L1810-A1813 PolarHBondContact O-N 3.26Å; A1813-V1816 PolarHBondContact O-N 3.35Å; A1813-L1817 WeakPolarHBondContact O-CB 3.21Å; A1813-L1817 WeakPolarHBondContact O-CD1 3.35Å; A1813-L1817 WeakPolarHBondContact O-CG 3.4Å; A1813-L1817 PolarHBondContact O-N 2.99Å
1814	F	76.5	Confident	72.4	Confident	47 Å²	47	54 Å²	54	21%	0.206	28%	0.278	C	S	.	.	H	α-helix	trans	-72.5	-26.5	176.7	-68.1	-43.4	0	0	0	114.4	L1810 T1811 M1812 G1818 L1824 L1827 A1828 L1831	L1810-F1814 HydrophobicContact CD1-CD2 4.15Å; L1810-F1814 HydrophobicContact CD1-CE2 3.49Å; L1810-F1814 VanDerWaalsContact CD1-CE2 3.49Å; L1810-F1814 HydrophobicContact CD1-CZ 3.86Å; L1810-F1814 HydrophobicContact CD2-CE2 4.07Å; L1810-F1814 HydrophobicContact CG-CD2 3.86Å; L1810-F1814 HydrophobicContact CG-CE2 3.51Å; L1810-F1814 HydrophobicContact CG-CZ 4.38Å; L1810-F1814 WeakPolarHBondContact O-CB 3.43Å; L1810-F1814 WeakPolarHBondContact O-CD2 3.14Å; L1810-F1814 WeakPolarHBondContact O-CG 3.43Å; L1810-F1814 PolarHBondContact O-N 3.06Å; T1811-F1814 PolarHBondContact O-N 3.08Å; M1812-F1814 VanDerWaalsContact C-N 3.34Å; M1812-F1814 PolarHBondContact O-N 3.45Å; F1814-G1818 WeakPolarHBondContact O-CA 3.28Å; F1814-G1818 PolarHBondContact O-N 2.86Å; F1814-L1824 HydrophobicContact CD1-CD2 3.63Å; F1814-L1824 HydrophobicContact CE1-CD2 3.88Å; F1814-L1824 HydrophobicContact CG-CD2 4.5Å; F1814-L1827 HydrophobicContact CD2-CD2 4.17Å; F1814-L1827 HydrophobicContact CE1-CD2 4.43Å; F1814-L1827 HydrophobicContact CE2-CD2 3.9Å; F1814-L1827 HydrophobicContact CZ-CD2 4.05Å; F1814-A1828 HydrophobicContact CB-CB 3.73Å; F1814-L1831 HydrophobicContact CD2-CD1 3.43Å; F1814-L1831 VanDerWaalsContact CD2-CD1 3.43Å; F1814-L1831 HydrophobicContact CE2-CD1 3.46Å; F1814-L1831 VanDerWaalsContact CE2-CD1 3.46Å
1815	E	70.8	Confident	72.1	Confident	53 Å²	53	58.3 Å²	58.3	25%	0.248	30%	0.298	C	S	.	.	H	α-helix	trans	-72.5	-40.6	169.3	-77.3	171.7	-177.3	0	0	111.6	T1811 M1812 Q1819 A1828 K1832 R1845	T1811-E1815 WeakPolarHBondContact O-CB 3.39Å; T1811-E1815 WeakPolarHBondContact O-CG 3.48Å; T1811-E1815 PolarHBondContact O-N 3.03Å; M1812-E1815 PolarHBondContact O-N 3.2Å; E1815-Q1819 PolarHBondContact O-N 2.88Å; E1815-Q1819 VanDerWaalsContact O-N 3.11Å; E1815-A1828 HydrophobicContact CG-CB 3.9Å; E1815-K1832 IonicContact OE1-NZ 3.6Å; E1815-R1845 IonicContact OE1-CZ 2.76Å; E1815-R1845 IonicContact OE1-NH1 2.63Å; E1815-R1845 PolarHBondContact OE1-NH1 3.26Å; E1815-R1845 IonicContact OE1-NH2 3.55Å; E1815-R1845 IonicContact OE2-CZ 2.72Å; E1815-R1845 IonicContact OE2-NH1 3.85Å; E1815-R1845 PolarHBondContact OE2-NH1 3.04Å; E1815-R1845 IonicContact OE2-NH2 3.19Å; E1815-R1845 PolarHBondContact OE2-NH2 3.29Å
1816	V	66.5	Low	72	Confident	57 Å²	57	64.4 Å²	64.4	35%	0.345	32%	0.324	S	S	.	.	H	α-helix	trans	-72.6	-37.8	179.3	171.6	0	0	0	0	112.1	M1812 A1813	M1812-V1816 WeakPolarHBondContact O-CB 3.41Å; M1812-V1816 VanDerWaalsContact O-CG2 3.25Å; M1812-V1816 WeakPolarHBondContact O-CG2 3.41Å; M1812-V1816 PolarHBondContact O-N 3.48Å; A1813-V1816 PolarHBondContact O-N 3.35Å
1817	L	63.5	Low	71.9	Confident	105 Å²	105	63.6 Å²	63.6	55%	0.55	32%	0.32	S	S	.	.	H	α-helix	trans	-81	-34.8	174.8	-65.5	168.1	0	0	0	111.9	A1813 Q1819	A1813-L1817 WeakPolarHBondContact O-CB 3.21Å; A1813-L1817 WeakPolarHBondContact O-CD1 3.35Å; A1813-L1817 WeakPolarHBondContact O-CG 3.4Å; A1813-L1817 PolarHBondContact O-N 2.99Å; L1817-Q1819 VanDerWaalsContact C-N 3.25Å; L1817-Q1819 PolarHBondContact O-N 3.46Å
1818	G	61.9	Low	71.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	4.6	177.5	0	0	0	0	0	114.3	F1814 D1820 Q1825	F1814-G1818 WeakPolarHBondContact O-CA 3.28Å; F1814-G1818 PolarHBondContact O-N 2.86Å; G1818-D1820 PolarHBondContact O-N 2.75Å; G1818-Q1825 WeakPolarHBondContact O-CB 3.1Å
1819	Q	56.4	Low	71.9	Confident	95 Å²	95	67.5 Å²	67.5	44%	0.444	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-33.1	168.7	-96.3	-175	-20.4	0	0	111	K323 E1815 L1817	K323-Q1819 WeakPolarHBondContact CD-O 3.35Å; K323-Q1819 VanDerWaalsContact CE-O 3.29Å; K323-Q1819 WeakPolarHBondContact CE-O 3.34Å; K323-Q1819 PolarHBondContact NZ-O 3.47Å; E1815-Q1819 PolarHBondContact O-N 2.88Å; E1815-Q1819 VanDerWaalsContact O-N 3.11Å; L1817-Q1819 VanDerWaalsContact C-N 3.25Å; L1817-Q1819 PolarHBondContact O-N 3.46Å
1820	D	48.6	Very low	72.2	Confident	55 Å²	55	69.6 Å²	69.6	29%	0.294	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-42	179.6	-59.8	-45.8	0	0	0	113.9	H319 I320 K323 G1818	H319-D1820 HydrophobicContact CB-CB 4.25Å; I320-D1820 VanDerWaalsContact CG1-OD2 3.25Å; I320-D1820 WeakPolarHBondContact CG1-OD2 3.4Å; K323-D1820 WeakPolarHBondContact CD-O 3.46Å; K323-D1820 PolarHBondContact NZ-O 3.18Å; G1818-D1820 PolarHBondContact O-N 2.75Å
1821	D	63.4	Low	72.3	Confident	70 Å²	70	68.4 Å²	68.4	37%	0.374	35%	0.345	S	S	.	.			trans	-94.5	113.9	178.8	-175.8	-3.8	0	0	0	113	K1823 L1824 Q1825	D1821-K1823 PolarHBondContact O-N 2.87Å; D1821-K1823 WeakPolarHBondContact OD1-CB 3.49Å; D1821-K1823 PolarHBondContact OD1-N 2.93Å; D1821-L1824 HydrophobicContact CB-CB 4.21Å; D1821-L1824 HydrophobicContact CB-CD1 4.01Å; D1821-L1824 HydrophobicContact CB-CG 4.44Å; D1821-L1824 PolarHBondContact O-N 3.04Å; D1821-L1824 VanDerWaalsContact O-N 3.1Å; D1821-Q1825 PolarHBondContact O-N 3.49Å
1822	E	73.1	Confident	72.4	Confident	154 Å²	154	71.3 Å²	71.3	72%	0.72	36%	0.358	S	S	*	.	H	α-helix	trans	-60	-27.7	179.4	-167.1	176.4	-144.2	0	0	113.1	K1826	E1822-K1826 VanDerWaalsContact O-CB 3.3Å; E1822-K1826 WeakPolarHBondContact O-CB 3.45Å; E1822-K1826 PolarHBondContact O-N 3.31Å
1823	K	76.3	Confident	72.9	Confident	170 Å²	170	72.6 Å²	72.6	74%	0.739	37%	0.368	S	S	*	.	H	α-helix	trans	-69.4	-43.2	174.5	-67.2	176	-178.1	168.8	0	111.6	D1821 K1826 L1827	D1821-K1823 PolarHBondContact O-N 2.87Å; D1821-K1823 WeakPolarHBondContact OD1-CB 3.49Å; D1821-K1823 PolarHBondContact OD1-N 2.93Å; K1823-K1826 PolarHBondContact O-N 2.81Å; K1823-L1827 WeakPolarHBondContact O-CB 3.29Å; K1823-L1827 PolarHBondContact O-N 2.98Å
1824	L	72	Confident	73.4	Confident	53 Å²	53	74.6 Å²	74.6	28%	0.277	38%	0.376	S	S	.	.	H	α-helix	trans	-68	-38.1	175.9	-81	162.8	0	0	0	111	F1814 D1821 L1827 A1828	F1814-L1824 HydrophobicContact CD1-CD2 3.63Å; F1814-L1824 HydrophobicContact CE1-CD2 3.88Å; F1814-L1824 HydrophobicContact CG-CD2 4.5Å; D1821-L1824 HydrophobicContact CB-CB 4.21Å; D1821-L1824 HydrophobicContact CB-CD1 4.01Å; D1821-L1824 HydrophobicContact CB-CG 4.44Å; D1821-L1824 PolarHBondContact O-N 3.04Å; D1821-L1824 VanDerWaalsContact O-N 3.1Å; L1824-L1827 PolarHBondContact O-N 2.89Å; L1824-A1828 WeakPolarHBondContact O-CB 3.33Å; L1824-A1828 PolarHBondContact O-N 3.26Å
1825	Q	73	Confident	73.8	Confident	92 Å²	92	74.2 Å²	74.2	43%	0.43	38%	0.375	S	S	.	.	H	α-helix	trans	-61.5	-44.4	172.7	-158.7	175.6	4.4	0	0	111.9	G1818 D1821 A1828 V1829	G1818-Q1825 WeakPolarHBondContact O-CB 3.1Å; D1821-Q1825 PolarHBondContact O-N 3.49Å; Q1825-A1828 WeakPolarHBondContact O-CB 3.28Å; Q1825-A1828 PolarHBondContact O-N 3.36Å; Q1825-V1829 WeakPolarHBondContact O-CG2 3.47Å; Q1825-V1829 PolarHBondContact O-N 2.97Å
1826	K	79.9	Confident	74.4	Confident	141 Å²	141	72.4 Å²	72.4	61%	0.613	37%	0.366	S	S	*	.	H	α-helix	trans	-65.5	-44	176.2	-169.9	172.9	-177.6	176.7	0	111.7	E1822 K1823 A1828 V1829 D1830	E1822-K1826 VanDerWaalsContact O-CB 3.3Å; E1822-K1826 WeakPolarHBondContact O-CB 3.45Å; E1822-K1826 PolarHBondContact O-N 3.31Å; K1823-K1826 PolarHBondContact O-N 2.81Å; K1826-A1828 PolarHBondContact O-N 3.06Å; K1826-V1829 PolarHBondContact O-N 2.91Å; K1826-V1829 VanDerWaalsContact O-N 3.11Å; K1826-D1830 VanDerWaalsContact O-CG 3.31Å; K1826-D1830 PolarHBondContact O-N 3.03Å
1827	L	81.7	Confident	75.1	Confident	78 Å²	78	76.4 Å²	76.4	41%	0.408	38%	0.376	S	S	.	.	H	α-helix	trans	-57.4	-38.7	172.7	-166.2	88	0	0	0	111.5	F1814 K1823 L1824 D1830 L1831	F1814-L1827 HydrophobicContact CD2-CD2 4.17Å; F1814-L1827 HydrophobicContact CE1-CD2 4.43Å; F1814-L1827 HydrophobicContact CE2-CD2 3.9Å; F1814-L1827 HydrophobicContact CZ-CD2 4.05Å; K1823-L1827 WeakPolarHBondContact O-CB 3.29Å; K1823-L1827 PolarHBondContact O-N 2.98Å; L1824-L1827 PolarHBondContact O-N 2.89Å; L1827-D1830 PolarHBondContact O-N 3.29Å; L1827-L1831 HydrophobicContact CD2-CD1 4.03Å; L1827-L1831 HydrophobicContact CG-CD1 3.98Å; L1827-L1831 HydrophobicContact CG-CG 4.46Å; L1827-L1831 VanDerWaalsContact O-CB 3.26Å; L1827-L1831 WeakPolarHBondContact O-CB 3.45Å; L1827-L1831 WeakPolarHBondContact O-CG 3.27Å; L1827-L1831 PolarHBondContact O-N 2.82Å
1828	A	78.8	Confident	76.1	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.008	37%	0.365	C	S	.	.	H	α-helix	trans	-66	-40.3	176.2	0	0	0	0	0	112.3	F1814 E1815 L1824 Q1825 K1826 K1832	F1814-A1828 HydrophobicContact CB-CB 3.73Å; E1815-A1828 HydrophobicContact CG-CB 3.9Å; L1824-A1828 WeakPolarHBondContact O-CB 3.33Å; L1824-A1828 PolarHBondContact O-N 3.26Å; Q1825-A1828 WeakPolarHBondContact O-CB 3.28Å; Q1825-A1828 PolarHBondContact O-N 3.36Å; K1826-A1828 PolarHBondContact O-N 3.06Å; A1828-K1832 VanDerWaalsContact O-CB 3.24Å; A1828-K1832 WeakPolarHBondContact O-CB 3.33Å; A1828-K1832 PolarHBondContact O-N 3.34Å
1829	V	81.7	Confident	77.2	Confident	84 Å²	84	74.7 Å²	74.7	51%	0.509	37%	0.365	S	S	.	.	H	α-helix	trans	-67	-40.4	174.4	172.9	0	0	0	0	111.7	Q1825 K1826 K1832 S1833	Q1825-V1829 WeakPolarHBondContact O-CG2 3.47Å; Q1825-V1829 PolarHBondContact O-N 2.97Å; K1826-V1829 PolarHBondContact O-N 2.91Å; K1826-V1829 VanDerWaalsContact O-N 3.11Å; V1829-K1832 PolarHBondContact O-N 3Å; V1829-S1833 WeakPolarHBondContact O-CB 3.37Å; V1829-S1833 PolarHBondContact O-N 2.96Å; V1829-S1833 PolarHBondContact O-OG 2.72Å
1830	D	83.6	Confident	78.4	Confident	84 Å²	84	70.1 Å²	70.1	45%	0.449	34%	0.343	S	S	.	.	H	α-helix	trans	-65.6	-46.3	175.7	-68.3	-24	0	0	0	110.4	K1826 L1827 S1833 V1834	K1826-D1830 VanDerWaalsContact O-CG 3.31Å; K1826-D1830 PolarHBondContact O-N 3.03Å; L1827-D1830 PolarHBondContact O-N 3.29Å; D1830-S1833 CarbonylContact O-C 3.59Å; D1830-S1833 WeakPolarHBondContact O-CA 3.44Å; D1830-S1833 WeakPolarHBondContact O-CB 3.48Å; D1830-S1833 PolarHBondContact O-N 3.35Å; D1830-S1833 VanDerWaalsContact O-N 3.1Å; D1830-V1834 WeakPolarHBondContact O-CG2 3.19Å; D1830-V1834 PolarHBondContact O-N 2.91Å
1831	L	84	Confident	80.1	Confident	38 Å²	38	67.7 Å²	67.7	20%	0.199	33%	0.33	C	S	.	.	H	α-helix	trans	-64	-39.7	174.4	-73.7	167.2	0	0	0	112.3	L1810 T1811 F1814 L1827 S1833 V1834 F1835	L1810-L1831 HydrophobicContact CD2-CD1 4.27Å; T1811-L1831 HydrophobicContact CG2-CB 3.94Å; F1814-L1831 HydrophobicContact CD2-CD1 3.43Å; F1814-L1831 VanDerWaalsContact CD2-CD1 3.43Å; F1814-L1831 HydrophobicContact CE2-CD1 3.46Å; F1814-L1831 VanDerWaalsContact CE2-CD1 3.46Å; L1827-L1831 HydrophobicContact CD2-CD1 4.03Å; L1827-L1831 HydrophobicContact CG-CD1 3.98Å; L1827-L1831 HydrophobicContact CG-CG 4.46Å; L1827-L1831 VanDerWaalsContact O-CB 3.26Å; L1827-L1831 WeakPolarHBondContact O-CB 3.45Å; L1827-L1831 WeakPolarHBondContact O-CG 3.27Å; L1827-L1831 PolarHBondContact O-N 2.82Å; L1831-S1833 PolarHBondContact O-N 2.84Å; L1831-V1834 PolarHBondContact O-N 2.72Å; L1831-V1834 VanDerWaalsContact O-N 3.14Å; L1831-F1835 HydrophobicContact CB-CD2 4.3Å; L1831-F1835 HydrophobicContact CB-CE2 4.41Å; L1831-F1835 HydrophobicContact CD2-CE2 4.04Å; L1831-F1835 WeakPolarHBondContact O-CB 3.24Å; L1831-F1835 WeakPolarHBondContact O-CD2 3.44Å; L1831-F1835 PolarHBondContact O-N 2.78Å
1832	K	82.1	Confident	80.9	Confident	60 Å²	60	64.6 Å²	64.6	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-60.7	-35.8	172.5	-169.8	167.1	-168.9	167	0	110.4	T1811 E1815 A1828 V1829 I1836 F1841 D1849	T1811-K1832 HydrophobicContact CG2-CB 4.38Å; E1815-K1832 IonicContact OE1-NZ 3.6Å; A1828-K1832 VanDerWaalsContact O-CB 3.24Å; A1828-K1832 WeakPolarHBondContact O-CB 3.33Å; A1828-K1832 PolarHBondContact O-N 3.34Å; V1829-K1832 PolarHBondContact O-N 3Å; K1832-I1836 WeakPolarHBondContact O-CB 3.44Å; K1832-I1836 PolarHBondContact O-N 2.71Å; K1832-F1841 HydrophobicContact CG-CE1 4.35Å; K1832-F1841 HydrophobicContact CG-CZ 4.16Å; K1832-D1849 IonicContact NZ-OD2 2.73Å; K1832-D1849 PolarHBondContact NZ-OD2 2.78Å
1833	S	82.9	Confident	81.1	Confident	45 Å²	45	57.3 Å²	57.3	32%	0.315	28%	0.28	S	S	.	.	H	α-helix	trans	-74.4	-24.9	175.5	-56.8	0	0	0	0	113.9	V1829 D1830 L1831 I1836 Y1837	V1829-S1833 WeakPolarHBondContact O-CB 3.37Å; V1829-S1833 PolarHBondContact O-N 2.96Å; V1829-S1833 PolarHBondContact O-OG 2.72Å; D1830-S1833 CarbonylContact O-C 3.59Å; D1830-S1833 WeakPolarHBondContact O-CA 3.44Å; D1830-S1833 WeakPolarHBondContact O-CB 3.48Å; D1830-S1833 PolarHBondContact O-N 3.35Å; D1830-S1833 VanDerWaalsContact O-N 3.1Å; L1831-S1833 PolarHBondContact O-N 2.84Å; S1833-I1836 WeakPolarHBondContact O-CG2 3.27Å; S1833-Y1837 VanDerWaalsContact O-CE2 3.27Å; S1833-Y1837 WeakPolarHBondContact O-CE2 3.47Å
1834	V	84.2	Confident	81	Confident	85 Å²	85	49.3 Å²	49.3	52%	0.515	25%	0.245	S	C	.	.	H	α-helix	trans	-80.5	-42.3	170.9	172.5	0	0	0	0	111.6	D1830 L1831 Y1837	D1830-V1834 WeakPolarHBondContact O-CG2 3.19Å; D1830-V1834 PolarHBondContact O-N 2.91Å; L1831-V1834 PolarHBondContact O-N 2.72Å; L1831-V1834 VanDerWaalsContact O-N 3.14Å; V1834-Y1837 WeakPolarHBondContact O-CD2 3.18Å
1835	F	84.6	Confident	81.1	Confident	39 Å²	39	47.9 Å²	47.9	17%	0.171	24%	0.236	C	C	.	.	H	α-helix	trans	-79.1	-15.9	-176.8	-73.9	-62.9	0	0	0	114	L1810 T1811 L1831 Y1837 F1838 F1841	L1810-F1835 HydrophobicContact CD2-CE2 4.18Å; T1811-F1835 HydrophobicContact CG2-CD2 4.05Å; L1831-F1835 HydrophobicContact CB-CD2 4.3Å; L1831-F1835 HydrophobicContact CB-CE2 4.41Å; L1831-F1835 HydrophobicContact CD2-CE2 4.04Å; L1831-F1835 WeakPolarHBondContact O-CB 3.24Å; L1831-F1835 WeakPolarHBondContact O-CD2 3.44Å; L1831-F1835 PolarHBondContact O-N 2.78Å; F1835-Y1837 PolarHBondContact O-N 3.44Å; F1835-Y1837 VanDerWaalsContact O-N 3.09Å; F1835-F1838 HydrophobicContact CD1-CD2 4.1Å; F1835-F1838 HydrophobicContact CD1-CE2 4.46Å; F1835-F1838 PolarHBondContact O-N 2.99Å; F1835-F1841 HydrophobicContact CB-CB 4.28Å; F1835-F1841 HydrophobicContact CB-CD1 3.51Å; F1835-F1841 HydrophobicContact CB-CD2 3.85Å; F1835-F1841 HydrophobicContact CB-CE1 3.64Å; F1835-F1841 HydrophobicContact CB-CE2 3.98Å; F1835-F1841 HydrophobicContact CB-CG 3.6Å; F1835-F1841 HydrophobicContact CB-CZ 3.87Å; F1835-F1841 HydrophobicContact CG-CD2 4.45Å; F1835-F1841 WeakPolarHBondContact O-CD1 2.93Å
1836	I	83.4	Confident	81.1	Confident	14 Å²	14	43.9 Å²	43.9	7%	0.072	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.9	176.5	-154.5	159.3	0	0	0	113.3	K1832 S1833 F1838 V1842 K1898 P1899 I1902	K1832-I1836 WeakPolarHBondContact O-CB 3.44Å; K1832-I1836 PolarHBondContact O-N 2.71Å; S1833-I1836 WeakPolarHBondContact O-CG2 3.27Å; I1836-F1838 PolarHBondContact O-N 3.32Å; I1836-V1842 HydrophobicContact CG1-CG2 3.95Å; I1836-V1842 VanDerWaalsContact O-CG2 3.27Å; I1836-V1842 WeakPolarHBondContact O-CG2 3.38Å; I1836-K1898 HydrophobicContact CD1-CG 4.31Å; I1836-P1899 HydrophobicContact CD1-CG 4.34Å; I1836-I1902 HydrophobicContact CD1-CD1 3.61Å; I1836-I1902 HydrophobicContact CG1-CD1 4.08Å; I1836-I1902 HydrophobicContact CG1-CG2 4.43Å; I1836-I1902 HydrophobicContact CG2-CD1 4.32Å
1837	Y	82.4	Confident	80.6	Confident	141 Å²	141	38.6 Å²	38.6	55%	0.553	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	11.1	175.4	-57.8	-75.9	0	0	0	114.6	S1833 V1834 F1835 E1906	S1833-Y1837 VanDerWaalsContact O-CE2 3.27Å; S1833-Y1837 WeakPolarHBondContact O-CE2 3.47Å; V1834-Y1837 WeakPolarHBondContact O-CD2 3.18Å; F1835-Y1837 PolarHBondContact O-N 3.44Å; F1835-Y1837 VanDerWaalsContact O-N 3.09Å; Y1837-E1906 WeakPolarHBondContact CA-OE1 3.39Å; Y1837-E1906 WeakPolarHBondContact CD1-OE1 3.43Å
1838	F	84.9	Confident	80	Confident	69 Å²	69	35.2 Å²	35.2	30%	0.303	18%	0.178	S	C	.	.			trans	-124.5	107.9	177.4	-66.9	-78.5	0	0	0	110.5	F1778 I1803 F1835 I1836 P1840 F1841 V1842	F1778-F1838 HydrophobicContact CZ-CD1 4.49Å; I1803-F1838 HydrophobicContact CG2-CB 3.7Å; I1803-F1838 HydrophobicContact CG2-CD1 3.88Å; I1803-F1838 HydrophobicContact CG2-CG 3.81Å; F1835-F1838 HydrophobicContact CD1-CD2 4.1Å; F1835-F1838 HydrophobicContact CD1-CE2 4.46Å; F1835-F1838 PolarHBondContact O-N 2.99Å; I1836-F1838 PolarHBondContact O-N 3.32Å; F1838-P1840 VanDerWaalsContact C-N 3.33Å; F1838-P1840 VanDerWaalsContact O-N 3.13Å; F1838-F1841 HydrophobicContact CB-CB 4.33Å; F1838-F1841 WeakPolarHBondContact O-CB 3.29Å; F1838-F1841 PolarHBondContact O-N 2.81Å; F1838-V1842 PolarHBondContact O-N 3.34Å
1839	P	83.2	Confident	79.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-54.6	-34.7	-176.6	-27.4	34.4	0	0	0	116.6	S1774 M1775 F1841 V1842 M1843 E1903 F1910	S1774-P1839 WeakPolarHBondContact OG-CG 3.14Å; M1775-P1839 HydrophobicContact CB-CB 4Å; M1775-P1839 HydrophobicContact CG-CB 4.23Å; M1775-P1839 HydrophobicContact SD-CB 4.34Å; P1839-F1841 VanDerWaalsContact C-N 3.32Å; P1839-F1841 PolarHBondContact O-N 2.89Å; P1839-V1842 PolarHBondContact O-N 3.09Å; P1839-M1843 WeakPolarHBondContact O-CB 3.11Å; P1839-M1843 PolarHBondContact O-N 2.88Å; P1839-E1903 VanDerWaalsContact CA-OE1 3.25Å; P1839-E1903 WeakPolarHBondContact CA-OE1 3.49Å; P1839-E1903 WeakPolarHBondContact CG-OE2 2.87Å; P1839-F1910 HydrophobicContact CG-CE2 4.13Å
1840	P	82.8	Confident	78.8	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-32.9	173.4	-23.9	35.5	0	0	0	114.1	L1673 M1775 N1800 F1838 A1844	L1673-P1840 HydrophobicContact CD1-CB 4.16Å; L1673-P1840 VanDerWaalsContact CD1-O 3.26Å; L1673-P1840 WeakPolarHBondContact CD1-O 3.03Å; M1775-P1840 HydrophobicContact CE-CG 4.47Å; M1775-P1840 HydrophobicContact SD-CG 4.37Å; N1800-P1840 HydrophobicContact CB-CG 4Å; N1800-P1840 WeakPolarHBondContact O-CB 3.46Å; F1838-P1840 VanDerWaalsContact C-N 3.33Å; F1838-P1840 VanDerWaalsContact O-N 3.13Å; P1840-A1844 WeakPolarHBondContact O-CB 3.21Å; P1840-A1844 PolarHBondContact O-N 3.11Å
1841	F	85	Confident	77.7	Confident	3 Å²	3	30.1 Å²	30.1	1%	0.013	15%	0.146	C	C	.	.	H	α-helix	trans	-70	-50.2	175.9	165	-101.2	0	0	0	110.8	G1807 T1811 K1832 F1835 F1838 P1839 M1843 A1844 R1845	G1807-F1841 VanDerWaalsContact C-CE2 3.46Å; G1807-F1841 WeakPolarHBondContact O-CE2 3.43Å; T1811-F1841 HydrophobicContact CG2-CE2 3.99Å; T1811-F1841 HydrophobicContact CG2-CZ 4.01Å; T1811-F1841 WeakPolarHBondContact OG1-CE2 3.44Å; K1832-F1841 HydrophobicContact CG-CE1 4.35Å; K1832-F1841 HydrophobicContact CG-CZ 4.16Å; F1835-F1841 HydrophobicContact CB-CB 4.28Å; F1835-F1841 HydrophobicContact CB-CD1 3.51Å; F1835-F1841 HydrophobicContact CB-CD2 3.85Å; F1835-F1841 HydrophobicContact CB-CE1 3.64Å; F1835-F1841 HydrophobicContact CB-CE2 3.98Å; F1835-F1841 HydrophobicContact CB-CG 3.6Å; F1835-F1841 HydrophobicContact CB-CZ 3.87Å; F1835-F1841 HydrophobicContact CG-CD2 4.45Å; F1835-F1841 WeakPolarHBondContact O-CD1 2.93Å; F1838-F1841 HydrophobicContact CB-CB 4.33Å; F1838-F1841 WeakPolarHBondContact O-CB 3.29Å; F1838-F1841 PolarHBondContact O-N 2.81Å; P1839-F1841 VanDerWaalsContact C-N 3.32Å; P1839-F1841 PolarHBondContact O-N 2.89Å; F1841-M1843 VanDerWaalsContact C-N 3.31Å; F1841-M1843 PolarHBondContact O-N 2.96Å; F1841-A1844 PolarHBondContact O-N 2.97Å; F1841-R1845 HydrophobicContact CE2-CB 4.44Å; F1841-R1845 HydrophobicContact CZ-CB 4.35Å; F1841-R1845 HydrophobicContact CZ-CG 4.25Å; F1841-R1845 VanDerWaalsContact O-CB 3.28Å; F1841-R1845 WeakPolarHBondContact O-CB 3.33Å; F1841-R1845 PolarHBondContact O-N 3.27Å
1842	V	79.3	Confident	76.7	Confident	5 Å²	5	29.9 Å²	29.9	3%	0.03	15%	0.147	C	C	.	.	H	α-helix	trans	-59.1	-43.5	-179.2	170.6	0	0	0	0	111	H1767 I1836 F1838 P1839 R1845 A1846 P1899 E1903	H1767-V1842 WeakPolarHBondContact NE2-CG1 3.5Å; I1836-V1842 HydrophobicContact CG1-CG2 3.95Å; I1836-V1842 VanDerWaalsContact O-CG2 3.27Å; I1836-V1842 WeakPolarHBondContact O-CG2 3.38Å; F1838-V1842 PolarHBondContact O-N 3.34Å; P1839-V1842 PolarHBondContact O-N 3.09Å; V1842-R1845 PolarHBondContact O-N 3.19Å; V1842-A1846 VanDerWaalsContact O-CB 3.29Å; V1842-A1846 WeakPolarHBondContact O-CB 3.41Å; V1842-A1846 PolarHBondContact O-N 3.33Å; V1842-P1899 HydrophobicContact CG1-CB 3.76Å; V1842-E1903 HydrophobicContact CB-CG 4.5Å; V1842-E1903 VanDerWaalsContact CB-OE1 3.28Å; V1842-E1903 WeakPolarHBondContact CB-OE1 3.48Å; V1842-E1903 HydrophobicContact CG1-CG 3.87Å; V1842-E1903 WeakPolarHBondContact CG2-OE1 3.23Å
1843	M	76.4	Confident	75.7	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-61.9	-47	175.3	-171.3	179.9	67	0	0	112.3	L1673 F1676 M1775 P1839 F1841 R1845 W1847	L1673-M1843 HydrophobicContact CD1-CE 3.56Å; F1676-M1843 HydrophobicContact CB-CE 3.71Å; F1676-M1843 HydrophobicContact CB-SD 3.96Å; F1676-M1843 HydrophobicContact CD2-SD 4.35Å; F1676-M1843 HydrophobicContact CG-SD 4.42Å; M1775-M1843 HydrophobicContact CE-CE 4.09Å; M1775-M1843 HydrophobicContact SD-CE 4.47Å; P1839-M1843 WeakPolarHBondContact O-CB 3.11Å; P1839-M1843 PolarHBondContact O-N 2.88Å; F1841-M1843 VanDerWaalsContact C-N 3.31Å; F1841-M1843 PolarHBondContact O-N 2.96Å; M1843-R1845 PolarHBondContact O-N 2.92Å; M1843-W1847 PolarHBondContact O-N 3.37Å
1844	A	74.7	Confident	74.6	Confident	2 Å²	2	30.1 Å²	30.1	2%	0.017	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-46.2	177.4	0	0	0	0	0	111.8	L1673 P1840 F1841 W1847 T1848	L1673-A1844 HydrophobicContact CD1-CB 4.25Å; L1673-A1844 HydrophobicContact CD2-CB 4.03Å; P1840-A1844 WeakPolarHBondContact O-CB 3.21Å; P1840-A1844 PolarHBondContact O-N 3.11Å; F1841-A1844 PolarHBondContact O-N 2.97Å; A1844-W1847 PolarHBondContact O-N 2.86Å; A1844-T1848 PolarHBondContact O-N 3.46Å
1845	R	75	Confident	73.3	Confident	22 Å²	22	27.1 Å²	27.1	8%	0.083	13%	0.126	C	C	.	.	H	α-helix	trans	-68.5	-36	-176.2	-167.2	69	-142.7	-145.4	-1.6	112.9	E1815 F1841 V1842 M1843 W1847 T1848 D1849	E1815-R1845 IonicContact OE1-CZ 2.76Å; E1815-R1845 IonicContact OE1-NH1 2.63Å; E1815-R1845 PolarHBondContact OE1-NH1 3.26Å; E1815-R1845 IonicContact OE1-NH2 3.55Å; E1815-R1845 IonicContact OE2-CZ 2.72Å; E1815-R1845 IonicContact OE2-NH1 3.85Å; E1815-R1845 PolarHBondContact OE2-NH1 3.04Å; E1815-R1845 IonicContact OE2-NH2 3.19Å; E1815-R1845 PolarHBondContact OE2-NH2 3.29Å; F1841-R1845 HydrophobicContact CE2-CB 4.44Å; F1841-R1845 HydrophobicContact CZ-CB 4.35Å; F1841-R1845 HydrophobicContact CZ-CG 4.25Å; F1841-R1845 VanDerWaalsContact O-CB 3.28Å; F1841-R1845 WeakPolarHBondContact O-CB 3.33Å; F1841-R1845 PolarHBondContact O-N 3.27Å; V1842-R1845 PolarHBondContact O-N 3.19Å; M1843-R1845 PolarHBondContact O-N 2.92Å; R1845-W1847 VanDerWaalsContact C-N 3.34Å; R1845-W1847 PolarHBondContact O-N 3.37Å; R1845-T1848 WeakPolarHBondContact CA-OG1 3.3Å; R1845-T1848 PolarHBondContact O-N 3.02Å; R1845-T1848 PolarHBondContact O-OG1 3.01Å; R1845-D1849 IonicContact CZ-OD1 3.64Å; R1845-D1849 IonicContact CZ-OD2 2.71Å; R1845-D1849 IonicContact NE-OD1 3.72Å; R1845-D1849 PolarHBondContact NE-OD1 2.93Å; R1845-D1849 IonicContact NE-OD2 3.14Å; R1845-D1849 PolarHBondContact NE-OD2 2.69Å; R1845-D1849 IonicContact NH2-OD1 2.73Å; R1845-D1849 PolarHBondContact NH2-OD1 2.85Å; R1845-D1849 IonicContact NH2-OD2 2.89Å; R1845-D1849 VanDerWaalsContact O-CB 3.27Å; R1845-D1849 WeakPolarHBondContact O-CB 3.09Å; R1845-D1849 VanDerWaalsContact O-CG 3.22Å; R1845-D1849 PolarHBondContact O-N 2.83Å
1846	A	71.5	Confident	71.9	Confident	9 Å²	9	27.4 Å²	27.4	7%	0.074	13%	0.128	C	C	.	.	H	α-helix	trans	-65.5	-36.4	175.3	0	0	0	0	0	112.7	H1767 V1842 M1850 L1896	H1767-A1846 WeakPolarHBondContact CE1-CB 3.29Å; V1842-A1846 VanDerWaalsContact O-CB 3.29Å; V1842-A1846 WeakPolarHBondContact O-CB 3.41Å; V1842-A1846 PolarHBondContact O-N 3.33Å; A1846-M1850 VanDerWaalsContact O-CB 3.25Å; A1846-M1850 WeakPolarHBondContact O-CB 3.23Å; A1846-M1850 PolarHBondContact O-N 2.64Å; A1846-M1850 VanDerWaalsContact O-N 3.07Å; A1846-L1896 HydrophobicContact CB-CD2 3.54Å
1847	W	70.6	Confident	70.5	Confident	30 Å²	30	31.1 Å²	31.1	11%	0.114	14%	0.142	C	C	.	.	H	α-helix	trans	-71.3	-36.3	178.2	-78.3	57.9	0	0	0	112.4	A1669 F1672 F1676 L1732 Y1740 M1843 A1844 R1845	A1669-W1847 HydrophobicContact CB-CB 4.07Å; F1672-W1847 HydrophobicContact CB-CD2 4.41Å; F1672-W1847 HydrophobicContact CB-CE3 3.98Å; F1672-W1847 HydrophobicContact CB-CH2 4.19Å; F1672-W1847 HydrophobicContact CB-CZ3 3.88Å; F1672-W1847 HydrophobicContact CD1-CE3 4.29Å; F1672-W1847 AromaticContact CD1-CH2 3.33Å; F1672-W1847 HydrophobicContact CD1-CH2 3.33Å; F1672-W1847 HydrophobicContact CD1-CZ2 4.29Å; F1672-W1847 AromaticContact CD1-CZ3 3.34Å; F1672-W1847 HydrophobicContact CD1-CZ3 3.34Å; F1672-W1847 AromaticContact CD2-CE3 3.75Å; F1672-W1847 HydrophobicContact CD2-CE3 3.75Å; F1672-W1847 HydrophobicContact CD2-CH2 4.24Å; F1672-W1847 AromaticContact CD2-CZ3 3.36Å; F1672-W1847 HydrophobicContact CD2-CZ3 3.36Å; F1672-W1847 AromaticContact CE1-CH2 3.66Å; F1672-W1847 HydrophobicContact CE1-CH2 3.66Å; F1672-W1847 AromaticContact CE1-CZ3 3.61Å; F1672-W1847 HydrophobicContact CE1-CZ3 3.61Å; F1672-W1847 HydrophobicContact CE2-CE3 4.33Å; F1672-W1847 AromaticContact CE2-CZ3 3.65Å; F1672-W1847 HydrophobicContact CE2-CZ3 3.65Å; F1672-W1847 AromaticContact CG-CE3 3.75Å; F1672-W1847 HydrophobicContact CG-CE3 3.75Å; F1672-W1847 AromaticContact CG-CH2 3.67Å; F1672-W1847 HydrophobicContact CG-CH2 3.67Å; F1672-W1847 AromaticContact CG-CZ3 3.23Å; F1672-W1847 HydrophobicContact CG-CZ3 3.23Å; F1672-W1847 HydrophobicContact CZ-CH2 4.28Å; F1672-W1847 AromaticContact CZ-CZ3 3.78Å; F1672-W1847 HydrophobicContact CZ-CZ3 3.78Å; F1676-W1847 HydrophobicContact CE2-CH2 4.17Å; F1676-W1847 AromaticContact CE2-CZ2 3.92Å; F1676-W1847 HydrophobicContact CE2-CZ2 3.92Å; L1732-W1847 HydrophobicContact CD1-CH2 4.25Å; L1732-W1847 HydrophobicContact CD1-CZ3 4.15Å; Y1740-W1847 HydrophobicContact CE1-CE3 4.44Å; Y1740-W1847 PolarHBondContact OH-O 2.97Å; Y1740-W1847 VanDerWaalsContact OH-O 3.09Å; M1843-W1847 PolarHBondContact O-N 3.37Å; A1844-W1847 PolarHBondContact O-N 2.86Å; R1845-W1847 VanDerWaalsContact C-N 3.34Å; R1845-W1847 PolarHBondContact O-N 3.37Å
1848	T	68.9	Low	69	Low	7 Å²	7	27.8 Å²	27.8	4%	0.043	14%	0.14	C	C	.	.	H	α-helix	trans	-70.9	-50.7	172.3	56.1	0	0	0	0	111.4	A1669 A1844 R1845 M1850 K1851 V1852	A1669-T1848 HydrophobicContact CB-CG2 3.6Å; A1844-T1848 PolarHBondContact O-N 3.46Å; R1845-T1848 WeakPolarHBondContact CA-OG1 3.3Å; R1845-T1848 PolarHBondContact O-N 3.02Å; R1845-T1848 PolarHBondContact O-OG1 3.01Å; T1848-M1850 VanDerWaalsContact C-N 3.27Å; T1848-M1850 PolarHBondContact O-N 2.93Å; T1848-K1851 PolarHBondContact O-N 3.23Å; T1848-K1851 VanDerWaalsContact O-N 3.16Å; T1848-V1852 WeakPolarHBondContact O-CB 3.27Å; T1848-V1852 VanDerWaalsContact O-CG2 3.31Å; T1848-V1852 WeakPolarHBondContact O-CG2 3.33Å; T1848-V1852 PolarHBondContact O-N 3.45Å
1849	D	68.8	Low	67.2	Low	21 Å²	21	25.8 Å²	25.8	11%	0.112	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-37.7	-175.8	-72.4	-2	0	0	0	111	K1832 R1845 K1851 V1853	K1832-D1849 IonicContact NZ-OD2 2.73Å; K1832-D1849 PolarHBondContact NZ-OD2 2.78Å; R1845-D1849 IonicContact CZ-OD1 3.64Å; R1845-D1849 IonicContact CZ-OD2 2.71Å; R1845-D1849 IonicContact NE-OD1 3.72Å; R1845-D1849 PolarHBondContact NE-OD1 2.93Å; R1845-D1849 IonicContact NE-OD2 3.14Å; R1845-D1849 PolarHBondContact NE-OD2 2.69Å; R1845-D1849 IonicContact NH2-OD1 2.73Å; R1845-D1849 PolarHBondContact NH2-OD1 2.85Å; R1845-D1849 IonicContact NH2-OD2 2.89Å; R1845-D1849 VanDerWaalsContact O-CB 3.27Å; R1845-D1849 WeakPolarHBondContact O-CB 3.09Å; R1845-D1849 VanDerWaalsContact O-CG 3.22Å; R1845-D1849 PolarHBondContact O-N 2.83Å; D1849-K1851 PolarHBondContact O-N 2.73Å; D1849-V1853 VanDerWaalsContact O-CB 3.3Å; D1849-V1853 WeakPolarHBondContact O-CB 3.3Å; D1849-V1853 WeakPolarHBondContact O-CG2 3.47Å; D1849-V1853 PolarHBondContact O-N 3.26Å
1850	M	65.8	Low	65.5	Low	26 Å²	26	28.9 Å²	28.9	13%	0.128	15%	0.15	C	C	.	.	H	α-helix	trans	-60	-46	176	-176.7	178	-174.6	0	0	113.2	P1739 Y1740 A1846 T1848 F1854 L1890	P1739-M1850 WeakPolarHBondContact O-CE 3.41Å; Y1740-M1850 HydrophobicContact CD1-CE 4.29Å; Y1740-M1850 HydrophobicContact CD1-SD 3.83Å; Y1740-M1850 HydrophobicContact CE1-CG 4.44Å; Y1740-M1850 HydrophobicContact CE1-SD 3.89Å; A1846-M1850 VanDerWaalsContact O-CB 3.25Å; A1846-M1850 WeakPolarHBondContact O-CB 3.23Å; A1846-M1850 PolarHBondContact O-N 2.64Å; A1846-M1850 VanDerWaalsContact O-N 3.07Å; T1848-M1850 VanDerWaalsContact C-N 3.27Å; T1848-M1850 PolarHBondContact O-N 2.93Å; M1850-F1854 PolarHBondContact O-N 3.45Å; M1850-F1854 VanDerWaalsContact O-N 3.1Å; M1850-L1890 HydrophobicContact CE-CD2 4.13Å; M1850-L1890 HydrophobicContact CG-CD2 3.9Å; M1850-L1890 HydrophobicContact SD-CD2 4.47Å
1851	K	60.5	Low	63.6	Low	14 Å²	14	31.3 Å²	31.3	6%	0.061	18%	0.175	C	C	.	.	H	α-helix	trans	-81.2	-35	-176.9	-171.3	160.2	174	172.5	0	112.4	E1665 E1737 P1739 Y1740 T1848 D1849 V1853 F1854 N1855	E1665-K1851 HydrophobicContact CG-CD 3.94Å; E1665-K1851 HydrophobicContact CG-CG 4.31Å; E1737-K1851 IonicContact OE1-NZ 3.56Å; E1737-K1851 IonicContact OE2-NZ 2.89Å; E1737-K1851 PolarHBondContact OE2-NZ 3.37Å; P1739-K1851 HydrophobicContact CB-CD 4.39Å; P1739-K1851 HydrophobicContact CB-CG 4.18Å; P1739-K1851 HydrophobicContact CG-CD 3.69Å; P1739-K1851 HydrophobicContact CG-CG 3.96Å; Y1740-K1851 HydrophobicContact CE2-CD 3.99Å; T1848-K1851 PolarHBondContact O-N 3.23Å; T1848-K1851 VanDerWaalsContact O-N 3.16Å; D1849-K1851 PolarHBondContact O-N 2.73Å; K1851-V1853 VanDerWaalsContact C-N 3.34Å; K1851-V1853 PolarHBondContact O-N 2.64Å; K1851-F1854 PolarHBondContact O-N 3.31Å; K1851-N1855 WeakPolarHBondContact O-CB 3.38Å; K1851-N1855 VanDerWaalsContact O-CG 3.23Å; K1851-N1855 PolarHBondContact O-N 2.96Å; K1851-N1855 PolarHBondContact O-OD1 2.87Å
1852	V	62.9	Low	61.6	Low	34 Å²	34	38.8 Å²	38.8	21%	0.206	21%	0.207	C	C	.	.	H	α-helix	trans	-57.7	-47.3	170.4	171	0	0	0	0	110.7	I1662 T1848 N1855 I1856	I1662-V1852 HydrophobicContact CG1-CG2 4.22Å; T1848-V1852 WeakPolarHBondContact O-CB 3.27Å; T1848-V1852 VanDerWaalsContact O-CG2 3.31Å; T1848-V1852 WeakPolarHBondContact O-CG2 3.33Å; T1848-V1852 PolarHBondContact O-N 3.45Å; V1852-N1855 PolarHBondContact O-N 3.23Å; V1852-I1856 HydrophobicContact CG1-CD1 3.84Å; V1852-I1856 WeakPolarHBondContact O-CD1 3.41Å; V1852-I1856 VanDerWaalsContact O-CG1 3.26Å; V1852-I1856 WeakPolarHBondContact O-CG1 3.29Å; V1852-I1856 PolarHBondContact O-N 3.06Å
1853	V	61.8	Low	59.7	Low	28 Å²	28	47.3 Å²	47.3	17%	0.17	25%	0.247	C	C	.	.	H	α-helix	trans	-64.8	-42.5	177.4	170.6	0	0	0	0	111.9	D1849 K1851 N1855 I1856 Y1857 L1895	D1849-V1853 VanDerWaalsContact O-CB 3.3Å; D1849-V1853 WeakPolarHBondContact O-CB 3.3Å; D1849-V1853 WeakPolarHBondContact O-CG2 3.47Å; D1849-V1853 PolarHBondContact O-N 3.26Å; K1851-V1853 VanDerWaalsContact C-N 3.34Å; K1851-V1853 PolarHBondContact O-N 2.64Å; V1853-N1855 VanDerWaalsContact C-N 3.34Å; V1853-N1855 PolarHBondContact O-N 3.2Å; V1853-I1856 PolarHBondContact O-N 3.34Å; V1853-Y1857 HydrophobicContact CG1-CD2 3.75Å; V1853-Y1857 HydrophobicContact CG1-CE2 3.55Å; V1853-Y1857 VanDerWaalsContact O-CD2 3.23Å; V1853-Y1857 WeakPolarHBondContact O-CD2 3.13Å; V1853-Y1857 PolarHBondContact O-N 3.09Å; V1853-Y1857 VanDerWaalsContact O-N 3.1Å; V1853-L1895 HydrophobicContact CG2-CD1 3.87Å; V1853-L1895 HydrophobicContact CG2-CD2 4.22Å
1854	F	59.5	Low	57.9	Low	82 Å²	82	53.7 Å²	53.7	36%	0.36	28%	0.281	S	S	.	.	H	α-helix	trans	-59.7	-44.2	174	179.8	-89.6	0	0	0	112.1	K1738 P1739 M1850 K1851 Y1857 S1858	K1738-F1854 HydrophobicContact CB-CE1 4.44Å; K1738-F1854 HydrophobicContact CB-CZ 4.05Å; P1739-F1854 HydrophobicContact CB-CB 3.99Å; P1739-F1854 HydrophobicContact CB-CD1 3.72Å; P1739-F1854 HydrophobicContact CB-CD2 4.15Å; P1739-F1854 HydrophobicContact CB-CE1 4.23Å; P1739-F1854 HydrophobicContact CB-CG 3.68Å; P1739-F1854 HydrophobicContact CG-CD1 4.23Å; P1739-F1854 HydrophobicContact CG-CE1 4.49Å; M1850-F1854 PolarHBondContact O-N 3.45Å; M1850-F1854 VanDerWaalsContact O-N 3.1Å; K1851-F1854 PolarHBondContact O-N 3.31Å; F1854-Y1857 PolarHBondContact O-N 2.85Å; F1854-S1858 WeakPolarHBondContact O-CB 3.35Å; F1854-S1858 PolarHBondContact O-N 3.3Å; F1854-S1858 PolarHBondContact O-OG 3.33Å
1855	N	56.7	Low	55.9	Low	22 Å²	22	58.3 Å²	58.3	12%	0.118	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-45.4	179.2	-73.8	-4.2	0	0	0	111.3	E1665 K1851 V1852 V1853 Y1857 S1858 A1859	E1665-N1855 PolarHBondContact OE1-ND2 3.18Å; E1665-N1855 PolarHBondContact OE2-ND2 3.35Å; K1851-N1855 WeakPolarHBondContact O-CB 3.38Å; K1851-N1855 VanDerWaalsContact O-CG 3.23Å; K1851-N1855 PolarHBondContact O-N 2.96Å; K1851-N1855 PolarHBondContact O-OD1 2.87Å; V1852-N1855 PolarHBondContact O-N 3.23Å; V1853-N1855 VanDerWaalsContact C-N 3.34Å; V1853-N1855 PolarHBondContact O-N 3.2Å; N1855-Y1857 PolarHBondContact O-N 2.98Å; N1855-S1858 WeakPolarHBondContact CA-OG 3.18Å; N1855-S1858 PolarHBondContact O-N 2.77Å; N1855-S1858 PolarHBondContact O-OG 3.06Å; N1855-A1859 WeakPolarHBondContact O-CB 3.3Å; N1855-A1859 PolarHBondContact O-N 3.18Å
1856	I	55.3	Low	53.9	Low	45 Å²	45	65.7 Å²	65.7	23%	0.231	35%	0.346	C	S	.	.	H	α-helix	trans	-55.4	-49	175.3	-68.7	162.1	0	0	0	110.6	M1655 V1852 V1853 S1858 A1859 E1860	M1655-I1856 HydrophobicContact CE-CD1 3.67Å; M1655-I1856 HydrophobicContact CE-CG1 3.79Å; M1655-I1856 HydrophobicContact SD-CD1 4.43Å; M1655-I1856 HydrophobicContact SD-CG1 4.35Å; V1852-I1856 HydrophobicContact CG1-CD1 3.84Å; V1852-I1856 WeakPolarHBondContact O-CD1 3.41Å; V1852-I1856 VanDerWaalsContact O-CG1 3.26Å; V1852-I1856 WeakPolarHBondContact O-CG1 3.29Å; V1852-I1856 PolarHBondContact O-N 3.06Å; V1853-I1856 PolarHBondContact O-N 3.34Å; I1856-S1858 PolarHBondContact O-N 3.18Å; I1856-A1859 PolarHBondContact O-N 2.84Å; I1856-E1860 PolarHBondContact O-N 3.42Å
1857	Y	53.5	Low	52	Low	91 Å²	91	73.5 Å²	73.5	36%	0.357	37%	0.373	S	S	.	.	H	α-helix	trans	-69.1	-32.7	177.9	-73.9	-56.2	0	0	0	114.1	V1853 F1854 N1855 A1859 Y1888	V1853-Y1857 HydrophobicContact CG1-CD2 3.75Å; V1853-Y1857 HydrophobicContact CG1-CE2 3.55Å; V1853-Y1857 VanDerWaalsContact O-CD2 3.23Å; V1853-Y1857 WeakPolarHBondContact O-CD2 3.13Å; V1853-Y1857 PolarHBondContact O-N 3.09Å; V1853-Y1857 VanDerWaalsContact O-N 3.1Å; F1854-Y1857 PolarHBondContact O-N 2.85Å; N1855-Y1857 PolarHBondContact O-N 2.98Å; Y1857-A1859 VanDerWaalsContact C-N 3.29Å; Y1857-Y1888 AromaticContact CE2-CD1 3.99Å; Y1857-Y1888 HydrophobicContact CE2-CD1 3.99Å; Y1857-Y1888 HydrophobicContact CE2-CD2 4.02Å; Y1857-Y1888 AromaticContact CE2-CG 3.64Å; Y1857-Y1888 HydrophobicContact CE2-CG 3.64Å; Y1857-Y1888 AromaticContact CZ-CD2 3.67Å; Y1857-Y1888 AromaticContact CZ-CG 3.82Å; Y1857-Y1888 WeakPolarHBondContact OH-CD2 3.3Å; Y1857-Y1888 WeakPolarHBondContact OH-CE2 3.48Å
1858	S	51.2	Low	50	Low	72 Å²	72	78.3 Å²	78.3	50%	0.503	41%	0.406	S	S	.	.	H	α-helix	trans	-69.1	-29.2	173.9	77.6	0	0	0	0	112.5	F1854 N1855 I1856	F1854-S1858 WeakPolarHBondContact O-CB 3.35Å; F1854-S1858 PolarHBondContact O-N 3.3Å; F1854-S1858 PolarHBondContact O-OG 3.33Å; N1855-S1858 WeakPolarHBondContact CA-OG 3.18Å; N1855-S1858 PolarHBondContact O-N 2.77Å; N1855-S1858 PolarHBondContact O-OG 3.06Å; I1856-S1858 PolarHBondContact O-N 3.18Å
1859	A	47.7	Very low	48.2	Very low	26 Å²	26	83.9 Å²	83.9	22%	0.215	43%	0.434	C	S	.	.	H	α-helix	trans	-77.8	-27.1	178.3	0	0	0	0	0	113.2	N1855 I1856 Y1857 G1861	N1855-A1859 WeakPolarHBondContact O-CB 3.3Å; N1855-A1859 PolarHBondContact O-N 3.18Å; I1856-A1859 PolarHBondContact O-N 2.84Å; Y1857-A1859 VanDerWaalsContact C-N 3.29Å; A1859-G1861 PolarHBondContact O-N 3.31Å
1860	E	48.1	Very low	46.3	Very low	66 Å²	66	88 Å²	88	31%	0.308	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-2.4	172.6	-75.3	-168.3	170.6	0	0	114.1	I1856 K1862	I1856-E1860 PolarHBondContact O-N 3.42Å; E1860-K1862 PolarHBondContact O-N 3.05Å; E1860-K1862 WeakPolarHBondContact OE2-CE 3.32Å; E1860-K1862 IonicContact OE2-NZ 3.74Å; E1860-K1862 PolarHBondContact OE2-NZ 2.7Å
1861	G	42.6	Very low	44.5	Very low	51 Å²	51	92.8 Å²	92.8	53%	0.526	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	12.9	170	0	0	0	0	0	115.1	A1859 E1863	A1859-G1861 PolarHBondContact O-N 3.31Å; G1861-E1863 PolarHBondContact O-N 2.84Å
1862	K	43.6	Very low	43	Very low	159 Å²	159	97.9 Å²	97.9	69%	0.691	52%	0.517	S	S	*	.			trans	-74.5	55.8	176.5	-70.6	172.3	-175.1	151.2	0	112.1	E1860 L1864	E1860-K1862 PolarHBondContact O-N 3.05Å; E1860-K1862 WeakPolarHBondContact OE2-CE 3.32Å; E1860-K1862 IonicContact OE2-NZ 3.74Å; E1860-K1862 PolarHBondContact OE2-NZ 2.7Å; K1862-L1864 PolarHBondContact O-N 3.42Å
1863	E	38.8	Very low	41.4	Very low	184 Å²	184	104.6 Å²	104.6	86%	0.86	54%	0.544	S	S	*	.			trans	-65.9	101.8	157.7	-76.5	-161.7	153.7	0	0	109.1	G1861 S1865	G1861-E1863 PolarHBondContact O-N 2.84Å; E1863-S1865 PolarHBondContact O-N 2.64Å
1864	L	37.8	Very low	40	Very low	137 Å²	137	112.6 Å²	112.6	72%	0.717	58%	0.58	S	S	*	*			trans	35	59.3	148	-102	82.7	0	0	0	116.6	K1862 K1866	K1862-L1864 PolarHBondContact O-N 3.42Å; L1864-K1866 PolarHBondContact O-N 3.44Å
1865	S	33.9	Very low	38.9	Very low	99 Å²	99	113.8 Å²	113.8	69%	0.692	61%	0.605	S	S	*	*			trans	-68.5	98.1	163.2	78.9	0	0	0	0	108.4	E1863 R1867	E1863-S1865 PolarHBondContact O-N 2.64Å; S1865-R1867 PolarHBondContact O-N 2.96Å
1866	K	32.7	Very low	37.6	Very low	177 Å²	177	117.8 Å²	117.8	77%	0.77	63%	0.63	S	S	*	*			trans	-62.1	83.5	171.8	-73.4	-177.3	174.9	-178.7	0	110.1	L1864 T1868	L1864-K1866 PolarHBondContact O-N 3.44Å; K1866-T1868 PolarHBondContact O-N 2.94Å
1867	R	30	Very low	36.3	Very low	173 Å²	173	124.8 Å²	124.8	65%	0.653	66%	0.658	S	S	*	*			trans	-82.1	97.5	170.2	-103.8	-174.8	172	150.8	-3.1	109	E345 S1865 I1869	E345-R1867 IonicContact OE2-CZ 2.86Å; E345-R1867 IonicContact OE2-NE 3.61Å; E345-R1867 IonicContact OE2-NH2 2.66Å; E345-R1867 PolarHBondContact OE2-NH2 3.04Å; S1865-R1867 PolarHBondContact O-N 2.96Å; R1867-I1869 PolarHBondContact O-N 3.34Å
1868	T	29.3	Very low	35.2	Very low	130 Å²	130	126.8 Å²	126.8	80%	0.798	67%	0.674	S	S	*	*			trans	-67.9	91.8	170.6	-45.7	0	0	0	0	109.6	K1866 T1870	K1866-T1868 PolarHBondContact O-N 2.94Å; T1868-T1870 PolarHBondContact O-N 3.06Å
1869	I	31.4	Very low	34.2	Very low	125 Å²	125	129.2 Å²	129.2	64%	0.641	69%	0.69	S	S	*	*			trans	-81	106.3	176.2	-56.9	179.7	0	0	0	108.8	R1867 I1871	R1867-I1869 PolarHBondContact O-N 3.34Å; I1869-I1871 HydrophobicContact CG2-CD1 4.48Å; I1869-I1871 HydrophobicContact CG2-CG1 3.8Å; I1869-I1871 PolarHBondContact O-N 3.48Å
1870	T	28.1	Very low	33.3	Very low	106 Å²	106	132.7 Å²	132.7	65%	0.65	71%	0.709	S	S	*	*			trans	-79.5	95.1	173.5	-39.4	0	0	0	0	109.2	T1868 T1872	T1868-T1870 PolarHBondContact O-N 3.06Å; T1870-T1872 PolarHBondContact O-N 3.2Å
1871	I	29.7	Very low	32.5	Very low	128 Å²	128	135.7 Å²	135.7	66%	0.656	74%	0.736	S	S	*	*			trans	-84.4	109.9	173.4	-54.4	-179.1	0	0	0	108.5	I1869 F1873	I1869-I1871 HydrophobicContact CG2-CD1 4.48Å; I1869-I1871 HydrophobicContact CG2-CG1 3.8Å; I1869-I1871 PolarHBondContact O-N 3.48Å; I1871-F1873 HydrophobicContact CG2-CD2 4.03Å; I1871-F1873 HydrophobicContact CG2-CE2 4.25Å; I1871-F1873 PolarHBondContact O-N 2.77Å
1872	T	27.6	Very low	32	Very low	120 Å²	120	140 Å²	140	74%	0.736	75%	0.746	S	S	*	*			trans	-82.9	101.2	171.9	48.1	0	0	0	0	110.6	T1870	T1870-T1872 PolarHBondContact O-N 3.2Å
1873	F	30.1	Very low	31.5	Very low	175 Å²	175	138 Å²	138	77%	0.768	74%	0.743	S	S	*	*			trans	-86.2	151.4	152.3	-94.6	-92.7	0	0	0	109.5	I1871 A1875	I1871-F1873 HydrophobicContact CG2-CD2 4.03Å; I1871-F1873 HydrophobicContact CG2-CE2 4.25Å; I1871-F1873 PolarHBondContact O-N 2.77Å; F1873-A1875 PolarHBondContact O-N 3.42Å
1874	Q	33	Very low	31.3	Very low	197 Å²	197	137.9 Å²	137.9	92%	0.921	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	133.2	177.2	-74.6	171.9	-48.2	0	0	110.6
1875	A	35.1	Very low	31.3	Very low	107 Å²	107	135.5 Å²	135.5	88%	0.884	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.5	-11.3	169.1	0	0	0	0	0	121.7	F1873	F1873-A1875 PolarHBondContact O-N 3.42Å
1876	V	30.7	Very low	31.6	Very low	106 Å²	106	141.8 Å²	141.8	64%	0.642	74%	0.737	S	S	*	*			trans	-139.8	123	173.4	-164.1	0	0	0	0	114.1	I1878	V1876-I1878 HydrophobicContact CG1-CD1 4.2Å; V1876-I1878 HydrophobicContact CG1-CG1 3.73Å
1877	K	27.5	Very low	32.3	Very low	192 Å²	192	139.5 Å²	139.5	84%	0.835	73%	0.725	S	S	*	*			trans	-89.2	106.2	167	-100.4	-179.2	173.9	176.5	0	110.1
1878	I	31	Very low	33.2	Very low	132 Å²	132	135.3 Å²	135.3	68%	0.677	71%	0.71	S	S	*	*			trans	-117.2	113.9	164.6	-50	-175.5	0	0	0	108.6	V1876 V1880	V1876-I1878 HydrophobicContact CG1-CD1 4.2Å; V1876-I1878 HydrophobicContact CG1-CG1 3.73Å; I1878-V1880 HydrophobicContact CB-CG2 4.42Å; I1878-V1880 HydrophobicContact CG2-CG2 3.63Å; I1878-V1880 PolarHBondContact O-N 3.01Å; I1878-V1880 VanDerWaalsContact O-N 3.09Å
1879	S	29.2	Very low	34.3	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	70%	0.695	S	S	*	*			trans	-80.1	77.5	174.1	44.1	0	0	0	0	111.3
1880	V	29.9	Very low	35.4	Very low	99 Å²	99	129.5 Å²	129.5	60%	0.6	68%	0.675	S	S	*	*			trans	-81.7	117.4	170.7	-168.3	0	0	0	0	109.5	I1878 L1882	I1878-V1880 HydrophobicContact CB-CG2 4.42Å; I1878-V1880 HydrophobicContact CG2-CG2 3.63Å; I1878-V1880 PolarHBondContact O-N 3.01Å; I1878-V1880 VanDerWaalsContact O-N 3.09Å; V1880-L1882 VanDerWaalsContact C-N 3.34Å; V1880-L1882 HydrophobicContact CG1-CD1 4.13Å; V1880-L1882 HydrophobicContact CG1-CG 3.91Å; V1880-L1882 PolarHBondContact O-N 3.16Å
1881	C	31.4	Very low	36.8	Very low	129 Å²	129	126.8 Å²	126.8	87%	0.872	66%	0.656	S	S	*	*			trans	-73.9	89.3	168.2	-67.5	0	0	0	0	109.1
1882	L	30.8	Very low	38.4	Very low	142 Å²	142	126.6 Å²	126.6	74%	0.743	65%	0.647	S	S	*	*			trans	-95.5	104.5	168.5	-83.7	158.7	0	0	0	109	V1880 K1884	V1880-L1882 VanDerWaalsContact C-N 3.34Å; V1880-L1882 HydrophobicContact CG1-CD1 4.13Å; V1880-L1882 HydrophobicContact CG1-CG 3.91Å; V1880-L1882 PolarHBondContact O-N 3.16Å; L1882-K1884 PolarHBondContact O-N 2.91Å
1883	D	34.8	Very low	40.3	Very low	116 Å²	116	128.1 Å²	128.1	62%	0.62	64%	0.64	S	S	*	*			trans	-57	110.7	163.2	-77.4	-44.9	0	0	0	108.2	D1885	D1883-D1885 PolarHBondContact O-N 3.36Å
1884	K	32.7	Very low	41.8	Very low	183 Å²	183	125.7 Å²	125.7	80%	0.796	63%	0.634	S	S	*	*			trans	-86.8	78.3	163.6	-83.1	-165.8	171.6	-175.1	0	108.3	L1882 Y1886	L1882-K1884 PolarHBondContact O-N 2.91Å; K1884-Y1886 PolarHBondContact O-N 2.93Å
1885	D	38.8	Very low	43.2	Very low	86 Å²	86	118.1 Å²	118.1	46%	0.46	60%	0.6	S	S	.	*			trans	-56.1	120.8	171	-62.6	-67.9	0	0	0	110.7	D1883 Y1887	D1883-D1885 PolarHBondContact O-N 3.36Å; D1885-Y1887 HydrophobicContact CB-CD2 3.31Å; D1885-Y1887 HydrophobicContact CB-CE2 3.27Å; D1885-Y1887 HydrophobicContact CB-CG 4.03Å; D1885-Y1887 PolarHBondContact O-N 3.33Å; D1885-Y1887 VanDerWaalsContact O-N 3.16Å; D1885-Y1887 VanDerWaalsContact OD1-CE2 3.28Å; D1885-Y1887 WeakPolarHBondContact OD1-CE2 3.38Å; D1885-Y1887 PolarHBondContact OD1-OH 2.84Å; D1885-Y1887 WeakPolarHBondContact OD2-CE2 3.35Å
1886	Y	39.5	Very low	44.6	Very low	231 Å²	231	113.4 Å²	113.4	91%	0.906	56%	0.56	S	S	*	*			trans	-84	63.1	159.1	-80.2	-87.8	0	0	0	109.3	K1884	K1884-Y1886 PolarHBondContact O-N 2.93Å
1887	Y	48.1	Very low	46.4	Very low	129 Å²	129	108.6 Å²	108.6	51%	0.506	53%	0.532	S	S	.	.			trans	-71.8	128.3	164.1	-67.8	-54.8	0	0	0	109	L1760 D1885 D1889	L1760-Y1887 HydrophobicContact CD1-CD2 4.44Å; L1760-Y1887 HydrophobicContact CD2-CD1 4.18Å; L1760-Y1887 HydrophobicContact CD2-CD2 3.69Å; L1760-Y1887 HydrophobicContact CD2-CE1 4.34Å; L1760-Y1887 HydrophobicContact CD2-CE2 3.86Å; L1760-Y1887 HydrophobicContact CD2-CG 3.91Å; D1885-Y1887 HydrophobicContact CB-CD2 3.31Å; D1885-Y1887 HydrophobicContact CB-CE2 3.27Å; D1885-Y1887 HydrophobicContact CB-CG 4.03Å; D1885-Y1887 PolarHBondContact O-N 3.33Å; D1885-Y1887 VanDerWaalsContact O-N 3.16Å; D1885-Y1887 VanDerWaalsContact OD1-CE2 3.28Å; D1885-Y1887 WeakPolarHBondContact OD1-CE2 3.38Å; D1885-Y1887 PolarHBondContact OD1-OH 2.84Å; D1885-Y1887 WeakPolarHBondContact OD2-CE2 3.35Å; Y1887-D1889 PolarHBondContact O-N 3.4Å
1888	Y	48.1	Very low	48.7	Very low	86 Å²	86	103.8 Å²	103.8	34%	0.337	51%	0.511	S	S	.	.			trans	-74	123.1	169.9	-156.1	-107.4	0	0	0	108.8	Y1857 L1890 R1892	Y1857-Y1888 AromaticContact CE2-CD1 3.99Å; Y1857-Y1888 HydrophobicContact CE2-CD1 3.99Å; Y1857-Y1888 HydrophobicContact CE2-CD2 4.02Å; Y1857-Y1888 AromaticContact CE2-CG 3.64Å; Y1857-Y1888 HydrophobicContact CE2-CG 3.64Å; Y1857-Y1888 AromaticContact CZ-CD2 3.67Å; Y1857-Y1888 AromaticContact CZ-CG 3.82Å; Y1857-Y1888 WeakPolarHBondContact OH-CD2 3.3Å; Y1857-Y1888 WeakPolarHBondContact OH-CE2 3.48Å; Y1888-L1890 PolarHBondContact O-N 3.02Å; Y1888-R1892 PolarHBondContact OH-NH1 3.49Å
1889	D	54.3	Low	50.7	Low	89 Å²	89	98.6 Å²	98.6	48%	0.476	49%	0.486	S	S	.	.			trans	-68.2	105	179.5	-172.4	-1.9	0	0	0	109.8	Y1887 L1891 R1892	Y1887-D1889 PolarHBondContact O-N 3.4Å; D1889-L1891 PolarHBondContact O-N 3.48Å; D1889-L1891 VanDerWaalsContact O-N 3.1Å; D1889-L1891 PolarHBondContact OD1-N 3.34Å; D1889-L1891 VanDerWaalsContact OD1-N 3.08Å; D1889-R1892 VanDerWaalsContact O-CB 3.29Å; D1889-R1892 WeakPolarHBondContact O-CB 3.49Å; D1889-R1892 PolarHBondContact O-N 2.84Å
1890	L	53.6	Low	52.9	Low	44 Å²	44	93.6 Å²	93.6	23%	0.23	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.1	-179.2	-80.3	103.5	0	0	0	112.9	A1763 M1850 Y1888 R1892 L1896	A1763-L1890 HydrophobicContact CB-CB 3.92Å; M1850-L1890 HydrophobicContact CE-CD2 4.13Å; M1850-L1890 HydrophobicContact CG-CD2 3.9Å; M1850-L1890 HydrophobicContact SD-CD2 4.47Å; Y1888-L1890 PolarHBondContact O-N 3.02Å; L1890-R1892 VanDerWaalsContact C-N 3.27Å; L1890-R1892 PolarHBondContact O-N 2.83Å; L1890-L1896 HydrophobicContact CB-CD1 4.29Å; L1890-L1896 HydrophobicContact CD2-CD1 4.13Å; L1890-L1896 WeakPolarHBondContact O-CB 3.46Å
1891	L	57.3	Low	55.4	Low	49 Å²	49	91.7 Å²	91.7	26%	0.257	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	5.2	176.6	-86.4	152.3	0	0	0	114	Q1759 D1889 W1893	Q1759-L1891 HydrophobicContact CG-CD1 3.97Å; Q1759-L1891 VanDerWaalsContact NE2-CD1 3.3Å; D1889-L1891 PolarHBondContact O-N 3.48Å; D1889-L1891 VanDerWaalsContact O-N 3.1Å; D1889-L1891 PolarHBondContact OD1-N 3.34Å; D1889-L1891 VanDerWaalsContact OD1-N 3.08Å; L1891-W1893 PolarHBondContact O-N 2.94Å
1892	R	62.6	Low	57.8	Low	124 Å²	124	87.2 Å²	87.2	47%	0.468	41%	0.405	S	S	.	.			trans	-49.7	137.6	170.6	-174.3	175.4	177.8	151.2	12.8	110.7	Y1888 D1889 L1890 D1894 L1895 G1897	Y1888-R1892 PolarHBondContact OH-NH1 3.49Å; D1889-R1892 VanDerWaalsContact O-CB 3.29Å; D1889-R1892 WeakPolarHBondContact O-CB 3.49Å; D1889-R1892 PolarHBondContact O-N 2.84Å; L1890-R1892 VanDerWaalsContact C-N 3.27Å; L1890-R1892 PolarHBondContact O-N 2.83Å; R1892-D1894 IonicContact CZ-OD2 3.6Å; R1892-D1894 IonicContact NE-OD2 2.77Å; R1892-D1894 PolarHBondContact NE-OD2 2.84Å; R1892-D1894 IonicContact NH2-OD2 2.63Å; R1892-D1894 PolarHBondContact O-N 3.47Å; R1892-D1894 VanDerWaalsContact O-N 3.14Å; R1892-L1895 PolarHBondContact O-N 2.99Å; R1892-G1897 PolarHBondContact O-N 2.84Å
1893	W	68.1	Low	60.2	Low	152 Å²	152	80.4 Å²	80.4	58%	0.576	37%	0.37	S	S	*	.	I	π-helix	trans	-58.6	-33.4	-169.4	-160.6	-138.1	0	0	0	113.4	L1891 L1895 G1897 K1898 V1901	L1891-W1893 PolarHBondContact O-N 2.94Å; W1893-L1895 VanDerWaalsContact C-N 3.31Å; W1893-L1895 PolarHBondContact O-N 3.19Å; W1893-G1897 VanDerWaalsContact CZ3-O 3.24Å; W1893-G1897 WeakPolarHBondContact CZ3-O 3.4Å; W1893-K1898 HydrophobicContact CD2-CB 4.37Å; W1893-K1898 HydrophobicContact CE3-CB 4.35Å; W1893-K1898 HydrophobicContact CH2-CB 4.43Å; W1893-K1898 HydrophobicContact CZ2-CB 4.49Å; W1893-K1898 HydrophobicContact CZ3-CB 4.38Å; W1893-K1898 VanDerWaalsContact O-CB 3.25Å; W1893-K1898 WeakPolarHBondContact O-CB 3.31Å; W1893-K1898 PolarHBondContact O-N 3.12Å; W1893-V1901 HydrophobicContact CH2-CB 3.76Å; W1893-V1901 HydrophobicContact CH2-CG1 4.08Å; W1893-V1901 HydrophobicContact CH2-CG2 3.77Å; W1893-V1901 HydrophobicContact CZ3-CB 3.99Å; W1893-V1901 HydrophobicContact CZ3-CG2 3.58Å
1894	D	61.1	Low	62.4	Low	123 Å²	123	77.4 Å²	77.4	66%	0.658	36%	0.356	S	S	*	.	I	π-helix	trans	-73.6	-15.7	179	-45.6	-55.2	0	0	0	114.3	R1892	R1892-D1894 IonicContact CZ-OD2 3.6Å; R1892-D1894 IonicContact NE-OD2 2.77Å; R1892-D1894 PolarHBondContact NE-OD2 2.84Å; R1892-D1894 IonicContact NH2-OD2 2.63Å; R1892-D1894 PolarHBondContact O-N 3.47Å; R1892-D1894 VanDerWaalsContact O-N 3.14Å
1895	L	62.2	Low	65	Low	38 Å²	38	73 Å²	73	20%	0.199	34%	0.34	C	S	.	.	I	π-helix	trans	-109.3	-95.2	-171.9	-154.3	83.7	0	0	0	112.3	V1853 R1892 W1893	V1853-L1895 HydrophobicContact CG2-CD1 3.87Å; V1853-L1895 HydrophobicContact CG2-CD2 4.22Å; R1892-L1895 PolarHBondContact O-N 2.99Å; W1893-L1895 VanDerWaalsContact C-N 3.31Å; W1893-L1895 PolarHBondContact O-N 3.19Å
1896	L	65	Low	67.2	Low	9 Å²	9	69.5 Å²	69.5	5%	0.047	32%	0.321	C	S	.	.	I	π-helix	trans	-94.4	-18.2	176.9	-64.1	169.5	0	0	0	113.1	A1763 A1846 L1890 P1899 V1900	A1763-L1896 HydrophobicContact CB-CD1 4.19Å; A1846-L1896 HydrophobicContact CB-CD2 3.54Å; L1890-L1896 HydrophobicContact CB-CD1 4.29Å; L1890-L1896 HydrophobicContact CD2-CD1 4.13Å; L1890-L1896 WeakPolarHBondContact O-CB 3.46Å; L1896-P1899 WeakPolarHBondContact O-CD 3.2Å; L1896-V1900 WeakPolarHBondContact O-CG2 3.34Å; L1896-V1900 PolarHBondContact O-N 3.06Å; L1896-V1900 VanDerWaalsContact O-N 3.11Å
1897	G	69.5	Low	69.3	Low	4 Å²	4	58.7 Å²	58.7	4%	0.041	28%	0.28	C	S	.	.	I	π-helix	trans	-57.3	-56.1	-175.8	0	0	0	0	0	113	R1892 W1893 V1900 V1901	R1892-G1897 PolarHBondContact O-N 2.84Å; W1893-G1897 VanDerWaalsContact CZ3-O 3.24Å; W1893-G1897 WeakPolarHBondContact CZ3-O 3.4Å; G1897-V1900 PolarHBondContact O-N 3.02Å; G1897-V1901 PolarHBondContact O-N 3.48Å
1898	K	75.9	Confident	71.2	Confident	91 Å²	91	57.8 Å²	57.8	40%	0.396	28%	0.282	S	S	.	.	H	α-helix	trans	-57.2	-49.1	-179.5	171.6	-179.1	178.1	-173.7	0	112.8	I1836 W1893 V1900 V1901 I1902	I1836-K1898 HydrophobicContact CD1-CG 4.31Å; W1893-K1898 HydrophobicContact CD2-CB 4.37Å; W1893-K1898 HydrophobicContact CE3-CB 4.35Å; W1893-K1898 HydrophobicContact CH2-CB 4.43Å; W1893-K1898 HydrophobicContact CZ2-CB 4.49Å; W1893-K1898 HydrophobicContact CZ3-CB 4.38Å; W1893-K1898 VanDerWaalsContact O-CB 3.25Å; W1893-K1898 WeakPolarHBondContact O-CB 3.31Å; W1893-K1898 PolarHBondContact O-N 3.12Å; K1898-V1900 PolarHBondContact O-N 2.91Å; K1898-V1901 PolarHBondContact O-N 3.46Å; K1898-I1902 HydrophobicContact CD-CD1 4.48Å; K1898-I1902 HydrophobicContact CG-CD1 3.7Å; K1898-I1902 WeakPolarHBondContact O-CG1 3.38Å; K1898-I1902 PolarHBondContact O-N 2.98Å; K1898-I1902 VanDerWaalsContact O-N 3.13Å
1899	P	73	Confident	73.2	Confident	23 Å²	23	57.5 Å²	57.5	15%	0.149	29%	0.286	C	S	.	.	H	α-helix	trans	-55.1	-46.8	172.7	-27.8	33.4	0	0	0	115	I1836 V1842 L1896 V1901 I1902 E1903	I1836-P1899 HydrophobicContact CD1-CG 4.34Å; V1842-P1899 HydrophobicContact CG1-CB 3.76Å; L1896-P1899 WeakPolarHBondContact O-CD 3.2Å; P1899-V1901 VanDerWaalsContact C-N 3.29Å; P1899-V1901 PolarHBondContact O-N 3.29Å; P1899-I1902 PolarHBondContact O-N 3.16Å; P1899-E1903 WeakPolarHBondContact O-CB 3.43Å; P1899-E1903 WeakPolarHBondContact O-CG 3.42Å; P1899-E1903 PolarHBondContact O-N 3.5Å
1900	V	74.2	Confident	74.8	Confident	18 Å²	18	54.7 Å²	54.7	11%	0.109	27%	0.269	C	S	.	.	H	α-helix	trans	-56.3	-43.2	-179.1	171.7	0	0	0	0	112	H1767 T1770 L1896 G1897 K1898 T1904	H1767-V1900 HydrophobicContact CB-CG2 4.21Å; T1770-V1900 HydrophobicContact CG2-CG1 4.17Å; L1896-V1900 WeakPolarHBondContact O-CG2 3.34Å; L1896-V1900 PolarHBondContact O-N 3.06Å; L1896-V1900 VanDerWaalsContact O-N 3.11Å; G1897-V1900 PolarHBondContact O-N 3.02Å; K1898-V1900 PolarHBondContact O-N 2.91Å; V1900-T1904 PolarHBondContact O-N 2.65Å; V1900-T1904 VanDerWaalsContact O-N 3.14Å; V1900-T1904 PolarHBondContact O-OG1 3.03Å
1901	V	81.8	Confident	76.4	Confident	60 Å²	60	54.3 Å²	54.3	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-73.6	-38.3	-177.8	173.9	0	0	0	0	111.5	W1893 G1897 K1898 P1899 T1904 I1905	W1893-V1901 HydrophobicContact CH2-CB 3.76Å; W1893-V1901 HydrophobicContact CH2-CG1 4.08Å; W1893-V1901 HydrophobicContact CH2-CG2 3.77Å; W1893-V1901 HydrophobicContact CZ3-CB 3.99Å; W1893-V1901 HydrophobicContact CZ3-CG2 3.58Å; G1897-V1901 PolarHBondContact O-N 3.48Å; K1898-V1901 PolarHBondContact O-N 3.46Å; P1899-V1901 VanDerWaalsContact C-N 3.29Å; P1899-V1901 PolarHBondContact O-N 3.29Å; V1901-T1904 WeakPolarHBondContact CA-OG1 3.46Å; V1901-T1904 PolarHBondContact O-N 3.45Å; V1901-T1904 PolarHBondContact O-OG1 3.09Å; V1901-T1904 VanDerWaalsContact O-OG1 3.1Å; V1901-I1905 HydrophobicContact CG1-CD1 3.99Å; V1901-I1905 WeakPolarHBondContact O-CG1 3.21Å; V1901-I1905 PolarHBondContact O-N 3.29Å; V1901-I1905 VanDerWaalsContact O-N 3.14Å
1902	I	82.1	Confident	77.8	Confident	34 Å²	34	56.7 Å²	56.7	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-64.1	-48.8	175.8	-71.1	169.6	0	0	0	110.1	I1836 K1898 P1899 T1904 I1905 E1906	I1836-I1902 HydrophobicContact CD1-CD1 3.61Å; I1836-I1902 HydrophobicContact CG1-CD1 4.08Å; I1836-I1902 HydrophobicContact CG1-CG2 4.43Å; I1836-I1902 HydrophobicContact CG2-CD1 4.32Å; K1898-I1902 HydrophobicContact CD-CD1 4.48Å; K1898-I1902 HydrophobicContact CG-CD1 3.7Å; K1898-I1902 WeakPolarHBondContact O-CG1 3.38Å; K1898-I1902 PolarHBondContact O-N 2.98Å; K1898-I1902 VanDerWaalsContact O-N 3.13Å; P1899-I1902 PolarHBondContact O-N 3.16Å; I1902-T1904 VanDerWaalsContact C-N 3.32Å; I1902-T1904 PolarHBondContact O-N 2.92Å; I1902-I1905 PolarHBondContact O-N 2.91Å; I1902-I1905 VanDerWaalsContact O-N 3.13Å; I1902-E1906 HydrophobicContact CG2-CG 4.39Å; I1902-E1906 WeakPolarHBondContact CG2-OE1 3.43Å; I1902-E1906 WeakPolarHBondContact O-CB 3.41Å; I1902-E1906 PolarHBondContact O-N 3.28Å
1903	E	81.7	Confident	79	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.9	-37.3	177.4	-74.2	-67.2	163	0	0	113.6	S1774 P1839 V1842 P1899 E1906 A1907	S1774-E1903 WeakPolarHBondContact CB-OE2 3.45Å; S1774-E1903 PolarHBondContact OG-OE2 3.44Å; P1839-E1903 VanDerWaalsContact CA-OE1 3.25Å; P1839-E1903 WeakPolarHBondContact CA-OE1 3.49Å; P1839-E1903 WeakPolarHBondContact CG-OE2 2.87Å; V1842-E1903 HydrophobicContact CB-CG 4.5Å; V1842-E1903 VanDerWaalsContact CB-OE1 3.28Å; V1842-E1903 WeakPolarHBondContact CB-OE1 3.48Å; V1842-E1903 HydrophobicContact CG1-CG 3.87Å; V1842-E1903 WeakPolarHBondContact CG2-OE1 3.23Å; P1899-E1903 WeakPolarHBondContact O-CB 3.43Å; P1899-E1903 WeakPolarHBondContact O-CG 3.42Å; P1899-E1903 PolarHBondContact O-N 3.5Å; E1903-E1906 PolarHBondContact O-N 2.83Å; E1903-A1907 WeakPolarHBondContact O-CB 3.44Å; E1903-A1907 PolarHBondContact O-N 2.66Å
1904	T	81.3	Confident	79.9	Confident	53 Å²	53	46.9 Å²	46.9	33%	0.325	25%	0.246	S	C	.	.	H	α-helix	trans	-71.2	-35.4	176.8	33.3	0	0	0	0	112.6	T1770 V1900 V1901 I1902 I1908	T1770-T1904 HydrophobicContact CG2-CG2 3.51Å; V1900-T1904 PolarHBondContact O-N 2.65Å; V1900-T1904 VanDerWaalsContact O-N 3.14Å; V1900-T1904 PolarHBondContact O-OG1 3.03Å; V1901-T1904 WeakPolarHBondContact CA-OG1 3.46Å; V1901-T1904 PolarHBondContact O-N 3.45Å; V1901-T1904 PolarHBondContact O-OG1 3.09Å; V1901-T1904 VanDerWaalsContact O-OG1 3.1Å; I1902-T1904 VanDerWaalsContact C-N 3.32Å; I1902-T1904 PolarHBondContact O-N 2.92Å; T1904-I1908 WeakPolarHBondContact O-CG1 3.35Å
1905	I	86.7	Confident	81	Confident	91 Å²	91	42.4 Å²	42.4	47%	0.467	22%	0.222	S	C	.	.	H	α-helix	trans	-68.1	-43.2	171.9	-67	167.1	0	0	0	110.4	V1901 I1902 I1908 I1909	V1901-I1905 HydrophobicContact CG1-CD1 3.99Å; V1901-I1905 WeakPolarHBondContact O-CG1 3.21Å; V1901-I1905 PolarHBondContact O-N 3.29Å; V1901-I1905 VanDerWaalsContact O-N 3.14Å; I1902-I1905 PolarHBondContact O-N 2.91Å; I1902-I1905 VanDerWaalsContact O-N 3.13Å; I1905-I1908 WeakPolarHBondContact O-CB 3.37Å; I1905-I1908 PolarHBondContact O-N 3.4Å; I1905-I1909 HydrophobicContact CG2-CD1 3.74Å; I1905-I1909 HydrophobicContact CG2-CG1 4.37Å; I1905-I1909 WeakPolarHBondContact O-CG1 3.3Å; I1905-I1909 PolarHBondContact O-N 3.21Å
1906	E	85.1	Confident	82.1	Confident	11 Å²	11	44.3 Å²	44.3	5%	0.051	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-40.3	178.3	-81.6	-179.4	-150.8	0	0	113.4	Y1837 I1902 E1903 I1908 I1909 F1910	Y1837-E1906 WeakPolarHBondContact CA-OE1 3.39Å; Y1837-E1906 WeakPolarHBondContact CD1-OE1 3.43Å; I1902-E1906 HydrophobicContact CG2-CG 4.39Å; I1902-E1906 WeakPolarHBondContact CG2-OE1 3.43Å; I1902-E1906 WeakPolarHBondContact O-CB 3.41Å; I1902-E1906 PolarHBondContact O-N 3.28Å; E1903-E1906 PolarHBondContact O-N 2.83Å; E1906-I1908 PolarHBondContact O-N 2.78Å; E1906-I1909 CarbonylContact O-C 3.51Å; E1906-I1909 PolarHBondContact O-N 2.73Å; E1906-I1909 VanDerWaalsContact O-N 3.09Å; E1906-F1910 HydrophobicContact CB-CD2 4.16Å; E1906-F1910 HydrophobicContact CB-CE2 3.78Å; E1906-F1910 HydrophobicContact CB-CZ 4.38Å; E1906-F1910 HydrophobicContact CG-CE2 4.34Å; E1906-F1910 HydrophobicContact CG-CZ 4.48Å; E1906-F1910 WeakPolarHBondContact O-CB 3.18Å; E1906-F1910 VanDerWaalsContact O-CD2 3.24Å; E1906-F1910 WeakPolarHBondContact O-CD2 3.39Å; E1906-F1910 WeakPolarHBondContact O-CG 3.45Å; E1906-F1910 PolarHBondContact O-N 2.81Å
1907	A	84.3	Confident	82.8	Confident	5 Å²	5	47.1 Å²	47.1	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-53.9	-43.8	172.4	0	0	0	0	0	112.4	V1773 E1903 F1911	V1773-A1907 HydrophobicContact CB-CB 4.43Å; V1773-A1907 HydrophobicContact CG1-CB 3.57Å; V1773-A1907 WeakPolarHBondContact O-CB 3.44Å; E1903-A1907 WeakPolarHBondContact O-CB 3.44Å; E1903-A1907 PolarHBondContact O-N 2.66Å; A1907-F1911 VanDerWaalsContact O-CB 3.26Å; A1907-F1911 WeakPolarHBondContact O-CB 3.4Å; A1907-F1911 PolarHBondContact O-N 2.75Å
1908	I	87.6	Confident	83.2	Confident	109 Å²	109	48.3 Å²	48.3	56%	0.559	25%	0.251	S	S	*	.	H	α-helix	trans	-66.9	-45.5	176.6	-62.2	166.4	0	0	0	109.9	T1904 I1905 E1906 F1911 L1912	T1904-I1908 WeakPolarHBondContact O-CG1 3.35Å; I1905-I1908 WeakPolarHBondContact O-CB 3.37Å; I1905-I1908 PolarHBondContact O-N 3.4Å; E1906-I1908 PolarHBondContact O-N 2.78Å; I1908-F1911 PolarHBondContact O-N 2.76Å; I1908-L1912 HydrophobicContact CG2-CD1 3.84Å; I1908-L1912 HydrophobicContact CG2-CG 4.33Å; I1908-L1912 WeakPolarHBondContact O-CB 3.41Å; I1908-L1912 VanDerWaalsContact O-CG 3.22Å; I1908-L1912 WeakPolarHBondContact O-CG 3.26Å; I1908-L1912 PolarHBondContact O-N 3.16Å
1909	I	89.3	Confident	83.3	Confident	80 Å²	80	47.2 Å²	47.2	41%	0.41	25%	0.245	S	C	.	.	H	α-helix	trans	-62.5	-48.6	178.9	-68.4	171.1	0	0	0	111.7	I1905 E1906 F1911 L1912 L1913	I1905-I1909 HydrophobicContact CG2-CD1 3.74Å; I1905-I1909 HydrophobicContact CG2-CG1 4.37Å; I1905-I1909 WeakPolarHBondContact O-CG1 3.3Å; I1905-I1909 PolarHBondContact O-N 3.21Å; E1906-I1909 CarbonylContact O-C 3.51Å; E1906-I1909 PolarHBondContact O-N 2.73Å; E1906-I1909 VanDerWaalsContact O-N 3.09Å; I1909-F1911 PolarHBondContact O-N 3.36Å; I1909-L1912 PolarHBondContact O-N 2.62Å; I1909-L1913 HydrophobicContact CG2-CD1 3.82Å; I1909-L1913 HydrophobicContact CG2-CG 4.27Å; I1909-L1913 WeakPolarHBondContact O-CB 3.21Å; I1909-L1913 VanDerWaalsContact O-CG 3.3Å; I1909-L1913 WeakPolarHBondContact O-CG 3.43Å; I1909-L1913 PolarHBondContact O-N 2.77Å
1910	F	88.5	Confident	83	Confident	30 Å²	30	52 Å²	52	13%	0.132	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-38.6	178.6	-65.3	-41.4	0	0	0	111.8	P1777 F1778 P1839 E1906 L1913 L1914	P1777-F1910 HydrophobicContact CB-CB 3.84Å; F1778-F1910 HydrophobicContact CB-CD2 4.05Å; F1778-F1910 HydrophobicContact CB-CE2 4.3Å; F1778-F1910 HydrophobicContact CB-CG 4.47Å; F1778-F1910 HydrophobicContact CD2-CD1 4.47Å; F1778-F1910 HydrophobicContact CD2-CD2 4.42Å; F1778-F1910 HydrophobicContact CD2-CE1 4.12Å; F1778-F1910 HydrophobicContact CD2-CE2 4.06Å; F1778-F1910 AromaticContact CD2-CZ 3.92Å; F1778-F1910 HydrophobicContact CD2-CZ 3.92Å; P1839-F1910 HydrophobicContact CG-CE2 4.13Å; E1906-F1910 HydrophobicContact CB-CD2 4.16Å; E1906-F1910 HydrophobicContact CB-CE2 3.78Å; E1906-F1910 HydrophobicContact CB-CZ 4.38Å; E1906-F1910 HydrophobicContact CG-CE2 4.34Å; E1906-F1910 HydrophobicContact CG-CZ 4.48Å; E1906-F1910 WeakPolarHBondContact O-CB 3.18Å; E1906-F1910 VanDerWaalsContact O-CD2 3.24Å; E1906-F1910 WeakPolarHBondContact O-CD2 3.39Å; E1906-F1910 WeakPolarHBondContact O-CG 3.45Å; E1906-F1910 PolarHBondContact O-N 2.81Å; F1910-L1913 HydrophobicContact CD1-CD1 4.49Å; F1910-L1913 PolarHBondContact O-N 3.48Å; F1910-L1914 VanDerWaalsContact O-CB 3.27Å; F1910-L1914 WeakPolarHBondContact O-CB 3.47Å; F1910-L1914 PolarHBondContact O-N 3.3Å
1911	F	86.8	Confident	82.1	Confident	37 Å²	37	57.9 Å²	57.9	16%	0.162	28%	0.282	C	S	.	.	H	α-helix	trans	-68	-40.7	174.7	-164	-95.4	0	0	0	112	W1710 I1711 F1714 P1777 A1907 I1908 I1909 L1914 L1915	W1710-F1911 HydrophobicContact CB-CE2 4.05Å; W1710-F1911 HydrophobicContact CB-CZ 3.97Å; I1711-F1911 HydrophobicContact CG1-CE1 4.1Å; I1711-F1911 HydrophobicContact CG1-CZ 3.64Å; F1714-F1911 HydrophobicContact CB-CE2 4.35Å; P1777-F1911 HydrophobicContact CB-CB 4.29Å; P1777-F1911 HydrophobicContact CB-CD2 4.46Å; P1777-F1911 HydrophobicContact CG-CB 4.35Å; P1777-F1911 HydrophobicContact CG-CD2 4.21Å; A1907-F1911 VanDerWaalsContact O-CB 3.26Å; A1907-F1911 WeakPolarHBondContact O-CB 3.4Å; A1907-F1911 PolarHBondContact O-N 2.75Å; I1908-F1911 PolarHBondContact O-N 2.76Å; I1909-F1911 PolarHBondContact O-N 3.36Å; F1911-L1914 HydrophobicContact CD2-CD2 4.47Å; F1911-L1914 WeakPolarHBondContact O-CB 3.23Å; F1911-L1914 PolarHBondContact O-N 2.74Å; F1911-L1915 HydrophobicContact CD1-CD1 4.08Å; F1911-L1915 HydrophobicContact CD1-CG 4.42Å; F1911-L1915 HydrophobicContact CE1-CD1 3.88Å; F1911-L1915 HydrophobicContact CE1-CG 4.26Å; F1911-L1915 WeakPolarHBondContact O-CG 3.29Å; F1911-L1915 PolarHBondContact O-N 3.17Å
1912	L	87.9	Confident	80.6	Confident	98 Å²	98	60.5 Å²	60.5	51%	0.513	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-44	172.7	-74.4	173.3	0	0	0	111.9	I1908 I1909 L1914 L1915 V1916	I1908-L1912 HydrophobicContact CG2-CD1 3.84Å; I1908-L1912 HydrophobicContact CG2-CG 4.33Å; I1908-L1912 WeakPolarHBondContact O-CB 3.41Å; I1908-L1912 VanDerWaalsContact O-CG 3.22Å; I1908-L1912 WeakPolarHBondContact O-CG 3.26Å; I1908-L1912 PolarHBondContact O-N 3.16Å; I1909-L1912 PolarHBondContact O-N 2.62Å; L1912-L1914 PolarHBondContact O-N 3.04Å; L1912-L1915 CarbonylContact O-C 3.57Å; L1912-L1915 WeakPolarHBondContact O-CB 3.39Å; L1912-L1915 PolarHBondContact O-N 2.86Å; L1912-V1916 WeakPolarHBondContact O-CG2 3.38Å; L1912-V1916 PolarHBondContact O-N 2.8Å
1913	L	87.1	Confident	79.1	Confident	71 Å²	71	68 Å²	68	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-62.9	-40.9	175.7	-75.5	171.4	0	0	0	111.7	L1781 I1909 F1910 L1915 V1916 F1917	L1781-L1913 HydrophobicContact CD1-CB 3.54Å; L1781-L1913 HydrophobicContact CD1-CD1 4.43Å; I1909-L1913 HydrophobicContact CG2-CD1 3.82Å; I1909-L1913 HydrophobicContact CG2-CG 4.27Å; I1909-L1913 WeakPolarHBondContact O-CB 3.21Å; I1909-L1913 VanDerWaalsContact O-CG 3.3Å; I1909-L1913 WeakPolarHBondContact O-CG 3.43Å; I1909-L1913 PolarHBondContact O-N 2.77Å; F1910-L1913 HydrophobicContact CD1-CD1 4.49Å; F1910-L1913 PolarHBondContact O-N 3.48Å; L1913-L1915 VanDerWaalsContact C-N 3.31Å; L1913-L1915 PolarHBondContact O-N 3.46Å; L1913-V1916 CarbonylContact O-C 3.43Å; L1913-V1916 PolarHBondContact O-N 3.36Å; L1913-V1916 VanDerWaalsContact O-N 3.14Å; L1913-F1917 WeakPolarHBondContact O-CD2 3.16Å; L1913-F1917 PolarHBondContact O-N 3.39Å
1914	L	86.6	Confident	77.6	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-57.4	-45.3	173.8	-178.8	69.1	0	0	0	110.9	W1710 Y1780 L1781 L1784 F1910 F1911 L1912 F1917 E1918	W1710-L1914 HydrophobicContact CB-CD2 4.45Å; W1710-L1914 HydrophobicContact CD2-CD2 3.68Å; W1710-L1914 HydrophobicContact CD2-CG 4.15Å; W1710-L1914 HydrophobicContact CE3-CD2 3.79Å; W1710-L1914 HydrophobicContact CG-CD2 4.01Å; W1710-L1914 HydrophobicContact CG-CG 4.45Å; W1710-L1914 HydrophobicContact CH2-CD1 4.07Å; W1710-L1914 HydrophobicContact CZ2-CD1 3.8Å; W1710-L1914 HydrophobicContact CZ2-CD2 4.41Å; W1710-L1914 HydrophobicContact CZ2-CG 4.25Å; W1710-L1914 HydrophobicContact CZ3-CD2 4.22Å; Y1780-L1914 HydrophobicContact CD2-CD2 4.02Å; Y1780-L1914 HydrophobicContact CG-CD2 4.37Å; L1781-L1914 HydrophobicContact CB-CD1 4.43Å; L1784-L1914 HydrophobicContact CD1-CD1 4.06Å; L1784-L1914 HydrophobicContact CD2-CD1 4.47Å; L1784-L1914 HydrophobicContact CG-CD1 4.27Å; F1910-L1914 VanDerWaalsContact O-CB 3.27Å; F1910-L1914 WeakPolarHBondContact O-CB 3.47Å; F1910-L1914 PolarHBondContact O-N 3.3Å; F1911-L1914 HydrophobicContact CD2-CD2 4.47Å; F1911-L1914 WeakPolarHBondContact O-CB 3.23Å; F1911-L1914 PolarHBondContact O-N 2.74Å; L1912-L1914 PolarHBondContact O-N 3.04Å; L1914-F1917 PolarHBondContact O-N 3.22Å; L1914-E1918 WeakPolarHBondContact O-CB 3.47Å; L1914-E1918 PolarHBondContact O-N 3.31Å
1915	L	85.5	Confident	76.1	Confident	29 Å²	29	76.3 Å²	76.3	15%	0.152	35%	0.348	C	S	.	.	H	α-helix	trans	-64	-44	172.8	-65	177.8	0	0	0	111.8	W1707 F1911 L1912 L1913 F1917 E1918 Y1919	W1707-L1915 HydrophobicContact CB-CD1 4.4Å; W1707-L1915 HydrophobicContact CB-CD2 3.74Å; F1911-L1915 HydrophobicContact CD1-CD1 4.08Å; F1911-L1915 HydrophobicContact CD1-CG 4.42Å; F1911-L1915 HydrophobicContact CE1-CD1 3.88Å; F1911-L1915 HydrophobicContact CE1-CG 4.26Å; F1911-L1915 WeakPolarHBondContact O-CG 3.29Å; F1911-L1915 PolarHBondContact O-N 3.17Å; L1912-L1915 CarbonylContact O-C 3.57Å; L1912-L1915 WeakPolarHBondContact O-CB 3.39Å; L1912-L1915 PolarHBondContact O-N 2.86Å; L1913-L1915 VanDerWaalsContact C-N 3.31Å; L1913-L1915 PolarHBondContact O-N 3.46Å; L1915-F1917 VanDerWaalsContact C-N 3.34Å; L1915-F1917 PolarHBondContact O-N 2.88Å; L1915-E1918 CarbonylContact O-C 3.55Å; L1915-E1918 PolarHBondContact O-N 3.02Å; L1915-Y1919 HydrophobicContact CB-CD2 4.46Å; L1915-Y1919 WeakPolarHBondContact O-CB 3.15Å; L1915-Y1919 VanDerWaalsContact O-CD2 3.23Å; L1915-Y1919 WeakPolarHBondContact O-CD2 3.47Å; L1915-Y1919 PolarHBondContact O-N 3.27Å
1916	V	84.1	Confident	74.4	Confident	78 Å²	78	77.7 Å²	77.7	47%	0.473	36%	0.356	S	S	.	.	H	α-helix	trans	-60.5	-41.2	177.2	170.7	0	0	0	0	111.5	L1912 L1913 Y1919 R1920	L1912-V1916 WeakPolarHBondContact O-CG2 3.38Å; L1912-V1916 PolarHBondContact O-N 2.8Å; L1913-V1916 CarbonylContact O-C 3.43Å; L1913-V1916 PolarHBondContact O-N 3.36Å; L1913-V1916 VanDerWaalsContact O-N 3.14Å; V1916-Y1919 CarbonylContact O-C 3.59Å; V1916-Y1919 PolarHBondContact O-N 3.27Å; V1916-R1920 WeakPolarHBondContact O-CA 3.32Å; V1916-R1920 WeakPolarHBondContact O-CB 3.38Å; V1916-R1920 PolarHBondContact O-N 3.42Å
1917	F	80.5	Confident	72.6	Confident	67 Å²	67	86.8 Å²	86.8	29%	0.294	39%	0.389	S	S	.	.	H	α-helix	trans	-64.7	-42.9	174.1	-81.5	-66.8	0	0	0	112	L1781 L1784 L1913 L1914 L1915 Y1919 R1920	L1781-F1917 HydrophobicContact CD1-CD2 4.3Å; L1781-F1917 HydrophobicContact CD1-CE2 4.38Å; L1781-F1917 HydrophobicContact CD2-CE2 4.25Å; L1781-F1917 HydrophobicContact CG-CD2 4.29Å; L1781-F1917 HydrophobicContact CG-CE2 4.45Å; L1784-F1917 HydrophobicContact CD1-CB 3.77Å; L1784-F1917 HydrophobicContact CD1-CG 4.37Å; L1913-F1917 WeakPolarHBondContact O-CD2 3.16Å; L1913-F1917 PolarHBondContact O-N 3.39Å; L1914-F1917 PolarHBondContact O-N 3.22Å; L1915-F1917 VanDerWaalsContact C-N 3.34Å; L1915-F1917 PolarHBondContact O-N 2.88Å; F1917-Y1919 VanDerWaalsContact C-N 3.28Å; F1917-Y1919 PolarHBondContact O-N 3.35Å; F1917-R1920 WeakPolarHBondContact O-CB 3.22Å; F1917-R1920 PolarHBondContact O-N 3.42Å
1918	E	78	Confident	70.9	Confident	29 Å²	29	91.9 Å²	91.9	14%	0.136	41%	0.411	C	S	.	.	H	α-helix	trans	-65.8	-29.5	175.4	-159.1	77.7	-140.9	0	0	112.6	K1696 F1700 R1706 W1710 L1914 L1915	K1696-E1918 VanDerWaalsContact CE-OE1 3.25Å; K1696-E1918 WeakPolarHBondContact CE-OE1 3.14Å; K1696-E1918 IonicContact NZ-OE1 2.74Å; K1696-E1918 PolarHBondContact NZ-OE1 3.27Å; K1696-E1918 IonicContact NZ-OE2 3.7Å; K1696-E1918 PolarHBondContact NZ-OE2 3.44Å; F1700-E1918 WeakPolarHBondContact CE2-OE1 3.46Å; R1706-E1918 HydrophobicContact CB-CG 4.18Å; R1706-E1918 HydrophobicContact CG-CG 4.43Å; R1706-E1918 PolarHBondContact NH1-O 3.43Å; W1710-E1918 WeakPolarHBondContact CZ2-OE2 3.33Å; W1710-E1918 PolarHBondContact NE1-OE2 2.77Å; L1914-E1918 WeakPolarHBondContact O-CB 3.47Å; L1914-E1918 PolarHBondContact O-N 3.31Å; L1915-E1918 CarbonylContact O-C 3.55Å; L1915-E1918 PolarHBondContact O-N 3.02Å
1919	Y	77.6	Confident	68.8	Low	69 Å²	69	96.9 Å²	96.9	27%	0.271	42%	0.422	S	S	.	.	H	α-helix	trans	-93.9	-0.7	174.8	-77.6	-71.7	0	0	0	114	R1706 L1915 V1916 F1917 Y1921 K1922 W1923	R1706-Y1919 HydrophobicContact CB-CE2 4.31Å; L1915-Y1919 HydrophobicContact CB-CD2 4.46Å; L1915-Y1919 WeakPolarHBondContact O-CB 3.15Å; L1915-Y1919 VanDerWaalsContact O-CD2 3.23Å; L1915-Y1919 WeakPolarHBondContact O-CD2 3.47Å; L1915-Y1919 PolarHBondContact O-N 3.27Å; V1916-Y1919 CarbonylContact O-C 3.59Å; V1916-Y1919 PolarHBondContact O-N 3.27Å; F1917-Y1919 VanDerWaalsContact C-N 3.28Å; F1917-Y1919 PolarHBondContact O-N 3.35Å; Y1919-Y1921 PolarHBondContact O-N 3.39Å; Y1919-Y1921 VanDerWaalsContact O-N 3.12Å; Y1919-K1922 HydrophobicContact CD1-CD 4.29Å; Y1919-K1922 WeakPolarHBondContact O-CA 3.28Å; Y1919-K1922 VanDerWaalsContact O-CB 3.25Å; Y1919-K1922 WeakPolarHBondContact O-CB 3.47Å; Y1919-K1922 PolarHBondContact O-N 2.88Å; Y1919-W1923 PolarHBondContact O-N 2.93Å
1920	R	66.4	Low	66.5	Low	124 Å²	124	99.2 Å²	99.2	47%	0.468	44%	0.435	S	S	.	.	H	α-helix	trans	-56.2	-35	-174.6	-175.5	176.5	177.4	-176.8	0.2	113.2	V1916 F1917 K1922 W1923 F1924	V1916-R1920 WeakPolarHBondContact O-CA 3.32Å; V1916-R1920 WeakPolarHBondContact O-CB 3.38Å; V1916-R1920 PolarHBondContact O-N 3.42Å; F1917-R1920 WeakPolarHBondContact O-CB 3.22Å; F1917-R1920 PolarHBondContact O-N 3.42Å; R1920-K1922 VanDerWaalsContact C-N 3.28Å; R1920-K1922 PolarHBondContact O-N 3.21Å; R1920-W1923 PolarHBondContact O-N 3.25Å; R1920-F1924 PolarHBondContact O-N 2.9Å
1921	Y	54.8	Low	64.1	Low	140 Å²	140	103.6 Å²	103.6	55%	0.549	47%	0.467	S	S	.	.	H	α-helix	trans	-58.5	-37.7	173.5	-77.9	-84.4	0	0	0	112.9	Y1919 E1925	Y1919-Y1921 PolarHBondContact O-N 3.39Å; Y1919-Y1921 VanDerWaalsContact O-N 3.12Å; Y1921-E1925 PolarHBondContact O-N 3.41Å
1922	K	51.4	Low	61.5	Low	116 Å²	116	107.6 Å²	107.6	50%	0.504	50%	0.498	S	S	.	.	H	α-helix	trans	-72.5	-36.3	178.8	-150.3	-178.1	-175.5	-169.1	0	111.6	Y1919 R1920 E1925 L1926	Y1919-K1922 HydrophobicContact CD1-CD 4.29Å; Y1919-K1922 WeakPolarHBondContact O-CA 3.28Å; Y1919-K1922 VanDerWaalsContact O-CB 3.25Å; Y1919-K1922 WeakPolarHBondContact O-CB 3.47Å; Y1919-K1922 PolarHBondContact O-N 2.88Å; R1920-K1922 VanDerWaalsContact C-N 3.28Å; R1920-K1922 PolarHBondContact O-N 3.21Å; K1922-E1925 PolarHBondContact O-N 3.22Å; K1922-L1926 VanDerWaalsContact O-CD1 3.3Å; K1922-L1926 WeakPolarHBondContact O-CD1 3.34Å; K1922-L1926 PolarHBondContact O-N 3.48Å; K1922-L1926 VanDerWaalsContact O-N 3.15Å
1923	W	49.7	Very low	59	Low	192 Å²	192	112.6 Å²	112.6	73%	0.727	52%	0.516	S	S	*	.	H	α-helix	trans	-66.9	-38.7	173.9	-95.3	76.4	0	0	0	112.8	Y1919 R1920 E1925 L1926 R1927	Y1919-W1923 PolarHBondContact O-N 2.93Å; R1920-W1923 PolarHBondContact O-N 3.25Å; W1923-E1925 VanDerWaalsContact C-N 3.33Å; W1923-L1926 PolarHBondContact O-N 2.77Å; W1923-R1927 PolarHBondContact O-N 2.76Å
1924	F	50.7	Low	56.6	Low	131 Å²	131	115.8 Å²	115.8	58%	0.575	54%	0.538	S	S	*	.	H	α-helix	trans	-69.4	-29.9	176	-126.2	-81.8	0	0	0	112.7	R1920 K1928	R1920-F1924 PolarHBondContact O-N 2.9Å; F1924-K1928 PolarHBondContact O-N 2.97Å
1925	E	49.9	Very low	54.1	Low	95 Å²	95	123.3 Å²	123.3	44%	0.444	57%	0.574	S	S	.	*	H	α-helix	trans	-65.2	-45	168.7	-87.5	-176.6	151.6	0	0	112.4	Y1921 K1922 W1923 R1927 K1928	Y1921-E1925 PolarHBondContact O-N 3.41Å; K1922-E1925 PolarHBondContact O-N 3.22Å; W1923-E1925 VanDerWaalsContact C-N 3.33Å; E1925-R1927 VanDerWaalsContact C-N 3.27Å; E1925-R1927 PolarHBondContact O-N 3.39Å; E1925-K1928 PolarHBondContact O-N 3.18Å; E1925-K1928 VanDerWaalsContact O-N 3.12Å
1926	L	50.5	Low	51.7	Low	121 Å²	121	131.5 Å²	131.5	63%	0.634	61%	0.608	S	S	*	*	H	α-helix	trans	-58.2	-40.5	175.9	-95.9	95.9	0	0	0	111.9	K1922 W1923 K1928 R1929	K1922-L1926 VanDerWaalsContact O-CD1 3.3Å; K1922-L1926 WeakPolarHBondContact O-CD1 3.34Å; K1922-L1926 PolarHBondContact O-N 3.48Å; K1922-L1926 VanDerWaalsContact O-N 3.15Å; W1923-L1926 PolarHBondContact O-N 2.77Å; L1926-K1928 PolarHBondContact O-N 2.96Å; L1926-R1929 PolarHBondContact O-N 2.96Å
1927	R	48.3	Very low	49.6	Very low	202 Å²	202	132.8 Å²	132.8	76%	0.762	61%	0.609	S	S	*	*	H	α-helix	trans	-70.6	-16.5	179.9	-152.3	173.7	-171.3	170.1	3.4	113.9	W1923 E1925	W1923-R1927 PolarHBondContact O-N 2.76Å; E1925-R1927 VanDerWaalsContact C-N 3.27Å; E1925-R1927 PolarHBondContact O-N 3.39Å
1928	K	47	Very low	47.6	Very low	112 Å²	112	134.4 Å²	134.4	49%	0.487	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	1	173.8	-86.7	-167.8	177.2	-172.6	0	114.5	F1924 E1925 L1926 L1930 A2043 S2044	F1924-K1928 PolarHBondContact O-N 2.97Å; E1925-K1928 PolarHBondContact O-N 3.18Å; E1925-K1928 VanDerWaalsContact O-N 3.12Å; L1926-K1928 PolarHBondContact O-N 2.96Å; K1928-L1930 PolarHBondContact O-N 3.1Å; K1928-A2043 PolarHBondContact NZ-O 3.47Å; K1928-S2044 PolarHBondContact NZ-O 3.3Å
1929	R	45	Very low	45.9	Very low	214 Å²	214	140.4 Å²	140.4	81%	0.808	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-0.4	175.7	-73.8	-171.2	169.9	-164	-4.5	114.9	L1926	L1926-R1929 PolarHBondContact O-N 2.96Å
1930	L	39.8	Very low	44.4	Very low	128 Å²	128	142 Å²	142	67%	0.67	67%	0.667	S	S	*	*	S	Bend	trans	-70.2	131.6	163.9	-78.4	150.4	0	0	0	109.1	K1928 C1932	K1928-L1930 PolarHBondContact O-N 3.1Å; L1930-C1932 PolarHBondContact O-N 2.98Å
1931	P	37.9	Very low	43.4	Very low	123 Å²	123	142.3 Å²	142.3	80%	0.799	68%	0.683	S	S	*	*			trans	-70.1	95.8	-179.3	28.7	-34	0	0	0	110.2
1932	C	32.3	Very low	43.4	Very low	121 Å²	121	142.3 Å²	142.3	82%	0.818	69%	0.693	S	S	*	*			trans	-69.2	134	166	-67.8	0	0	0	0	109.3	L1930	L1930-C1932 PolarHBondContact O-N 2.98Å
1933	F	34.9	Very low	43.6	Very low	202 Å²	202	140.2 Å²	140.2	89%	0.886	69%	0.692	S	S	*	*			trans	-38.8	136.5	-179.5	-98	-108.5	0	0	0	113.9	E1935	F1933-E1935 VanDerWaalsContact C-N 3.27Å; F1933-E1935 PolarHBondContact O-N 3.48Å
1934	T	36.7	Very low	44.4	Very low	138 Å²	138	132.4 Å²	132.4	85%	0.847	66%	0.664	S	S	*	*			trans	-62.9	85	163	32.5	0	0	0	0	110.2	K1936	T1934-K1936 PolarHBondContact O-N 2.92Å
1935	E	35.4	Very low	45.6	Very low	159 Å²	159	133 Å²	133	74%	0.743	67%	0.669	S	S	*	*			trans	-58.5	115.9	163.4	-167.8	172.2	-125.7	0	0	107.4	F1933 Q1937 R1970	F1933-E1935 VanDerWaalsContact C-N 3.27Å; F1933-E1935 PolarHBondContact O-N 3.48Å; E1935-Q1937 PolarHBondContact O-N 3.18Å; E1935-Q1937 VanDerWaalsContact O-N 3.16Å; E1935-R1970 IonicContact OE2-NH1 2.79Å
1936	K	34.4	Very low	46.7	Very low	200 Å²	200	130.7 Å²	130.7	87%	0.87	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-52.8	123.6	178.3	-82.9	-174.7	173.3	-176.3	0	108.5	T1934	T1934-K1936 PolarHBondContact O-N 2.92Å
1937	Q	39.5	Very low	48	Very low	106 Å²	106	125.9 Å²	125.9	50%	0.495	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-61.3	136.7	172.8	-58.2	-162.1	-60.8	0	0	108.2	E1935 D1939 D2009	E1935-Q1937 PolarHBondContact O-N 3.18Å; E1935-Q1937 VanDerWaalsContact O-N 3.16Å; Q1937-D1939 PolarHBondContact O-N 2.7Å; Q1937-D2009 PolarHBondContact NE2-OD1 2.82Å; Q1937-D2009 PolarHBondContact NE2-OD2 3.05Å
1938	P	40.3	Very low	49.3	Very low	100 Å²	100	117.9 Å²	117.9	65%	0.649	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.3	162.6	28.3	-31.5	0	0	0	107.6	K1940	P1938-K1940 VanDerWaalsContact C-N 3.35Å; P1938-K1940 PolarHBondContact O-N 2.79Å
1939	D	41.1	Very low	50.7	Low	156 Å²	156	114.7 Å²	114.7	83%	0.834	61%	0.607	S	S	*	*			trans	-63.3	96.7	170.3	-76.2	-44.8	0	0	0	108.7	Q1937 T1941	Q1937-D1939 PolarHBondContact O-N 2.7Å; D1939-T1941 PolarHBondContact O-N 3.4Å
1940	K	45.8	Very low	52.3	Low	101 Å²	101	105 Å²	105	44%	0.439	57%	0.57	S	S	.	*			trans	-74.2	107.5	170.2	-71.9	-174.4	-173.9	171.9	0	108	P1938 D1942 D2008	P1938-K1940 VanDerWaalsContact C-N 3.35Å; P1938-K1940 PolarHBondContact O-N 2.79Å; K1940-D1942 PolarHBondContact O-N 2.91Å; K1940-D2008 IonicContact NZ-OD2 3.8Å; K1940-D2008 PolarHBondContact NZ-OD2 2.9Å
1941	T	46.8	Very low	54.2	Low	132 Å²	132	101.3 Å²	101.3	81%	0.81	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	7.2	-175	47.3	0	0	0	0	115.6	D1939	D1939-T1941 PolarHBondContact O-N 3.4Å
1942	D	54	Low	56.1	Low	139 Å²	139	103 Å²	103	74%	0.743	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	31.2	-173.8	-85.1	-32	0	0	0	113.3	K1940	K1940-D1942 PolarHBondContact O-N 2.91Å
1943	C	55.5	Low	58.3	Low	72 Å²	72	101.2 Å²	101.2	49%	0.486	52%	0.516	S	S	.	.			trans	-89.1	122.9	171.9	-62.6	0	0	0	0	111
1944	D	66.9	Low	60.3	Low	28 Å²	28	91.6 Å²	91.6	15%	0.15	47%	0.474	C	S	.	.			trans	-57	140.6	174.9	-177.2	17.5	0	0	0	111.5	N1946 V1947 A1948 T2189 C2190 K2200	D1944-N1946 PolarHBondContact O-N 2.97Å; D1944-N1946 VanDerWaalsContact O-N 3.16Å; D1944-V1947 HydrophobicContact CB-CG2 4.18Å; D1944-V1947 WeakPolarHBondContact O-CA 3.3Å; D1944-V1947 WeakPolarHBondContact O-CB 3.38Å; D1944-V1947 PolarHBondContact O-N 3.41Å; D1944-A1948 PolarHBondContact O-N 2.77Å; D1944-A1948 VanDerWaalsContact O-N 3.09Å; D1944-T2189 WeakPolarHBondContact CB-O 3.47Å; D1944-C2190 HydrophobicContact CB-CB 4.33Å; D1944-K2200 IonicContact OD1-NZ 2.77Å; D1944-K2200 PolarHBondContact OD1-NZ 3.27Å; D1944-K2200 IonicContact OD2-NZ 3.9Å; D1944-K2200 PolarHBondContact OD2-NZ 2.43Å
1945	E	74.6	Confident	62.2	Low	145 Å²	145	89.5 Å²	89.5	68%	0.678	46%	0.457	S	S	*	.	H	α-helix	trans	-58.7	-34.6	-171.6	-165.7	173.2	-152.3	0	0	112	A1948 A1949	E1945-A1948 PolarHBondContact O-N 3Å; E1945-A1949 VanDerWaalsContact O-CB 3.3Å; E1945-A1949 WeakPolarHBondContact O-CB 3.3Å; E1945-A1949 PolarHBondContact O-N 2.62Å
1946	N	74.8	Confident	63.9	Low	46 Å²	46	85.7 Å²	85.7	25%	0.246	45%	0.448	C	S	.	.	H	α-helix	trans	-64.7	-37.1	174.5	-66.6	-9.3	0	0	0	112.5	D1944 A1949 E1950 L2191 D2192 K2200	D1944-N1946 PolarHBondContact O-N 2.97Å; D1944-N1946 VanDerWaalsContact O-N 3.16Å; N1946-A1949 PolarHBondContact O-N 3.46Å; N1946-E1950 VanDerWaalsContact O-CB 3.31Å; N1946-E1950 WeakPolarHBondContact O-CB 3.21Å; N1946-E1950 PolarHBondContact O-N 3.43Å; N1946-L2191 VanDerWaalsContact CB-O 3.22Å; N1946-L2191 WeakPolarHBondContact CB-O 3.22Å; N1946-D2192 PolarHBondContact ND2-OD2 3.3Å; N1946-K2200 PolarHBondContact ND2-NZ 3.19Å
1947	V	76.8	Confident	65.3	Low	19 Å²	19	77.8 Å²	77.8	12%	0.115	42%	0.423	C	S	.	.	H	α-helix	trans	-70.1	-40.5	176.6	-179.1	0	0	0	0	110	D1944 E1950 K1951 F2188 L2191	D1944-V1947 HydrophobicContact CB-CG2 4.18Å; D1944-V1947 WeakPolarHBondContact O-CA 3.3Å; D1944-V1947 WeakPolarHBondContact O-CB 3.38Å; D1944-V1947 PolarHBondContact O-N 3.41Å; V1947-E1950 PolarHBondContact O-N 2.75Å; V1947-K1951 WeakPolarHBondContact O-CB 3.42Å; V1947-K1951 PolarHBondContact O-N 2.98Å; V1947-F2188 HydrophobicContact CG1-CB 3.77Å; V1947-F2188 HydrophobicContact CG2-CB 4.22Å; V1947-L2191 HydrophobicContact CG2-CB 3.88Å
1948	A	75.4	Confident	66.2	Low	34 Å²	34	78 Å²	78	28%	0.281	43%	0.431	S	S	.	.	H	α-helix	trans	-68.6	-34.2	174.9	0	0	0	0	0	112.8	D1944 E1945 R1952	D1944-A1948 PolarHBondContact O-N 2.77Å; D1944-A1948 VanDerWaalsContact O-N 3.09Å; E1945-A1948 PolarHBondContact O-N 3Å; A1948-R1952 WeakPolarHBondContact O-CG 3.36Å; A1948-R1952 PolarHBondContact O-N 3.22Å; A1948-R1952 VanDerWaalsContact O-N 3.14Å; A1948-R1952 PolarHBondContact O-NE 3.38Å; A1948-R1952 VanDerWaalsContact O-NE 3.09Å
1949	A	77.2	Confident	67.2	Low	45 Å²	45	76.2 Å²	76.2	37%	0.372	42%	0.416	S	S	.	.	H	α-helix	trans	-69.3	-44.3	173.2	0	0	0	0	0	111.5	E1945 N1946 R1952 R1953	E1945-A1949 VanDerWaalsContact O-CB 3.3Å; E1945-A1949 WeakPolarHBondContact O-CB 3.3Å; E1945-A1949 PolarHBondContact O-N 2.62Å; N1946-A1949 PolarHBondContact O-N 3.46Å; A1949-R1952 WeakPolarHBondContact O-CB 3.5Å; A1949-R1952 PolarHBondContact O-N 3.14Å; A1949-R1953 PolarHBondContact O-N 3.41Å
1950	E	78.2	Confident	68	Low	10 Å²	10	77.5 Å²	77.5	5%	0.047	41%	0.414	C	S	.	.	H	α-helix	trans	-62.4	-46	175	177.7	68.9	155.5	0	0	111.5	N1946 V1947 R1952 R1953 V1954 R2179 L2191	N1946-E1950 VanDerWaalsContact O-CB 3.31Å; N1946-E1950 WeakPolarHBondContact O-CB 3.21Å; N1946-E1950 PolarHBondContact O-N 3.43Å; V1947-E1950 PolarHBondContact O-N 2.75Å; E1950-R1952 VanDerWaalsContact C-N 3.27Å; E1950-R1952 PolarHBondContact O-N 3.19Å; E1950-R1953 VanDerWaalsContact CD-NH2 3.29Å; E1950-R1953 PolarHBondContact O-N 3.32Å; E1950-R1953 VanDerWaalsContact O-N 3.08Å; E1950-R1953 IonicContact OE1-NH2 2.7Å; E1950-R1953 PolarHBondContact OE1-NH2 3.25Å; E1950-R1953 IonicContact OE2-CZ 3.65Å; E1950-R1953 IonicContact OE2-NE 3.15Å; E1950-R1953 PolarHBondContact OE2-NE 3.16Å; E1950-R1953 IonicContact OE2-NH2 3.79Å; E1950-R1953 PolarHBondContact OE2-NH2 2.95Å; E1950-V1954 HydrophobicContact CG-CG2 4.3Å; E1950-V1954 VanDerWaalsContact O-CG2 3.28Å; E1950-V1954 WeakPolarHBondContact O-CG2 3.11Å; E1950-V1954 PolarHBondContact O-N 3.07Å; E1950-R2179 IonicContact OE1-CZ 2.7Å; E1950-R2179 IonicContact OE1-NH2 2.74Å; E1950-R2179 PolarHBondContact OE1-NH2 2.78Å; E1950-L2191 HydrophobicContact CB-CD2 4.08Å; E1950-L2191 HydrophobicContact CG-CD1 4.33Å; E1950-L2191 HydrophobicContact CG-CD2 4.01Å
1951	K	79.3	Confident	69.1	Low	51 Å²	51	79.1 Å²	79.1	22%	0.222	43%	0.428	C	S	.	.	H	α-helix	trans	-55.9	-42.7	174.5	-175.8	172.5	175	-174.5	0	111.2	V1947 L1955 D2009 C2011	V1947-K1951 WeakPolarHBondContact O-CB 3.42Å; V1947-K1951 PolarHBondContact O-N 2.98Å; K1951-L1955 HydrophobicContact CG-CD1 4.01Å; K1951-L1955 WeakPolarHBondContact O-CB 3.41Å; K1951-L1955 WeakPolarHBondContact O-CD1 3.17Å; K1951-L1955 WeakPolarHBondContact O-CG 3.42Å; K1951-L1955 PolarHBondContact O-N 2.92Å; K1951-L1955 VanDerWaalsContact O-N 3.09Å; K1951-D2009 WeakPolarHBondContact CE-OD2 2.98Å; K1951-D2009 IonicContact NZ-OD2 2.73Å; K1951-D2009 PolarHBondContact NZ-OD2 2.99Å; K1951-C2011 HydrophobicContact CB-CB 4.32Å; K1951-C2011 HydrophobicContact CG-CB 4.17Å
1952	R	77.2	Confident	70.1	Confident	158 Å²	158	72.9 Å²	72.9	60%	0.596	39%	0.39	S	S	*	.	H	α-helix	trans	-63.8	-44.7	173.2	-78.7	178.3	-78.6	167	-7.1	112.7	A1948 A1949 E1950 L1955 S1956	A1948-R1952 WeakPolarHBondContact O-CG 3.36Å; A1948-R1952 PolarHBondContact O-N 3.22Å; A1948-R1952 VanDerWaalsContact O-N 3.14Å; A1948-R1952 PolarHBondContact O-NE 3.38Å; A1948-R1952 VanDerWaalsContact O-NE 3.09Å; A1949-R1952 WeakPolarHBondContact O-CB 3.5Å; A1949-R1952 PolarHBondContact O-N 3.14Å; E1950-R1952 VanDerWaalsContact C-N 3.27Å; E1950-R1952 PolarHBondContact O-N 3.19Å; R1952-L1955 PolarHBondContact O-N 3.25Å; R1952-S1956 WeakPolarHBondContact O-CB 3.37Å; R1952-S1956 PolarHBondContact O-N 2.84Å; R1952-S1956 PolarHBondContact O-OG 2.95Å
1953	R	78.9	Confident	70.9	Confident	85 Å²	85	66.7 Å²	66.7	32%	0.321	36%	0.357	S	S	.	.	H	α-helix	trans	-61.1	-43.5	178	-172.6	177.6	72.6	132.4	2.4	112.6	A1949 E1950 S1956 G1957	A1949-R1953 PolarHBondContact O-N 3.41Å; E1950-R1953 VanDerWaalsContact CD-NH2 3.29Å; E1950-R1953 PolarHBondContact O-N 3.32Å; E1950-R1953 VanDerWaalsContact O-N 3.08Å; E1950-R1953 IonicContact OE1-NH2 2.7Å; E1950-R1953 PolarHBondContact OE1-NH2 3.25Å; E1950-R1953 IonicContact OE2-CZ 3.65Å; E1950-R1953 IonicContact OE2-NE 3.15Å; E1950-R1953 PolarHBondContact OE2-NE 3.16Å; E1950-R1953 IonicContact OE2-NH2 3.79Å; E1950-R1953 PolarHBondContact OE2-NH2 2.95Å; R1953-S1956 PolarHBondContact O-OG 3.31Å; R1953-S1956 VanDerWaalsContact O-OG 3.1Å; R1953-G1957 PolarHBondContact O-N 3.07Å
1954	V	77.5	Confident	72.1	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.3	-43	178	175	0	0	0	0	110.8	E1950 K1965 I1967 E2013	E1950-V1954 HydrophobicContact CG-CG2 4.3Å; E1950-V1954 VanDerWaalsContact O-CG2 3.28Å; E1950-V1954 WeakPolarHBondContact O-CG2 3.11Å; E1950-V1954 PolarHBondContact O-N 3.07Å; V1954-K1965 HydrophobicContact CG1-CG 4.14Å; V1954-K1965 WeakPolarHBondContact O-CE 3.43Å; V1954-K1965 PolarHBondContact O-NZ 2.96Å; V1954-I1967 HydrophobicContact CG1-CG1 4.02Å; V1954-E2013 HydrophobicContact CG2-CB 3.93Å
1955	L	76.3	Confident	72.8	Confident	94 Å²	94	63.7 Å²	63.7	49%	0.492	34%	0.335	S	S	.	.	H	α-helix	trans	-68.8	-35.4	178.1	-72.1	168.3	0	0	0	113	K1951 R1952 I1967	K1951-L1955 HydrophobicContact CG-CD1 4.01Å; K1951-L1955 WeakPolarHBondContact O-CB 3.41Å; K1951-L1955 WeakPolarHBondContact O-CD1 3.17Å; K1951-L1955 WeakPolarHBondContact O-CG 3.42Å; K1951-L1955 PolarHBondContact O-N 2.92Å; K1951-L1955 VanDerWaalsContact O-N 3.09Å; R1952-L1955 PolarHBondContact O-N 3.25Å; L1955-I1967 HydrophobicContact CD2-CG2 3.77Å
1956	S	71.7	Confident	73.1	Confident	79 Å²	79	56.8 Å²	56.8	55%	0.552	30%	0.303	S	S	*	.	H	α-helix	trans	-75.7	-22.4	179.2	64.5	0	0	0	0	114.2	R1952 R1953	R1952-S1956 WeakPolarHBondContact O-CB 3.37Å; R1952-S1956 PolarHBondContact O-N 2.84Å; R1952-S1956 PolarHBondContact O-OG 2.95Å; R1953-S1956 PolarHBondContact O-OG 3.31Å; R1953-S1956 VanDerWaalsContact O-OG 3.1Å
1957	G	63.9	Low	73.4	Confident	34 Å²	34	56.1 Å²	56.1	35%	0.351	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.5	33.1	165.2	0	0	0	0	0	116.3	R1953 N1959	R1953-G1957 PolarHBondContact O-N 3.07Å; G1957-N1959 VanDerWaalsContact C-N 3.33Å; G1957-N1959 PolarHBondContact O-N 3Å
1958	V	58.5	Low	73.6	Confident	111 Å²	111	57.7 Å²	57.7	67%	0.673	31%	0.306	S	S	*	.			trans	-62.2	-32.2	-174.5	-176.9	0	0	0	0	113.9
1959	N	60	Low	73.8	Confident	61 Å²	61	56 Å²	56	33%	0.326	29%	0.293	S	S	.	.			trans	-95.1	128.6	-175.6	-75.4	-37	0	0	0	113.5	G1957	G1957-N1959 VanDerWaalsContact C-N 3.33Å; G1957-N1959 PolarHBondContact O-N 3Å
1960	K	58.1	Low	73.8	Confident	184 Å²	184	58 Å²	58	80%	0.8	29%	0.291	S	S	*	.	S	Bend	trans	-96.6	7.2	177.9	-66.7	-173.4	179.1	179.8	0	115.1	S2052	K1960-S2052 PolarHBondContact O-OG 2.75Å
1961	N	68.8	Low	73.8	Confident	135 Å²	135	59.6 Å²	59.6	72%	0.722	30%	0.298	S	S	*	.			trans	-140.7	59.8	-178	-92.6	-11.7	0	0	0	110.3	P2016	N1961-P2016 WeakPolarHBondContact O-CD 3.29Å; N1961-P2016 WeakPolarHBondContact O-CG 3.27Å
1962	S	67.9	Low	73.2	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.007	30%	0.301	C	S	.	.			trans	-104	132.5	175.3	40	0	0	0	0	112.1	E2013 N2051	S1962-E2013 VanDerWaalsContact CB-CG 3.5Å; S1962-E2013 WeakPolarHBondContact CB-OE1 3.26Å; S1962-E2013 PolarHBondContact OG-OE1 3.48Å; S1962-N2051 WeakPolarHBondContact O-CA 3.29Å
1963	A	72.3	Confident	72.2	Confident	8 Å²	8	53.2 Å²	53.2	7%	0.066	29%	0.288	C	S	.	.	S	Bend	trans	-72.9	-35.1	-176.9	0	0	0	0	0	111.8	V2014	A1963-V2014 PolarHBondContact N-O 2.71Å
1964	L	78.9	Confident	70.8	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	130	174	179.1	68.4	0	0	0	110.3	V1966 F2012 E2013 V2014 I2037 F2048 L2139	L1964-V1966 HydrophobicContact CD1-CG2 4.29Å; L1964-V1966 HydrophobicContact CD2-CG2 4.15Å; L1964-V1966 HydrophobicContact CG-CG2 4Å; L1964-F2012 HydrophobicContact CD2-CE2 4.22Å; L1964-F2012 HydrophobicContact CD2-CZ 4.46Å; L1964-E2013 WeakPolarHBondContact O-CA 3.18Å; L1964-V2014 HydrophobicContact CB-CB 4.3Å; L1964-V2014 HydrophobicContact CB-CG2 4.43Å; L1964-V2014 PolarHBondContact N-O 2.82Å; L1964-V2014 PolarHBondContact O-N 2.89Å; L1964-I2037 HydrophobicContact CD1-CG2 4.15Å; L1964-I2037 HydrophobicContact CD2-CD1 4.17Å; L1964-I2037 HydrophobicContact CD2-CG2 4.35Å; L1964-F2048 HydrophobicContact CD1-CD2 4.49Å; L1964-L2139 HydrophobicContact CB-CD1 4.12Å; L1964-L2139 HydrophobicContact CB-CD2 4.2Å; L1964-L2139 HydrophobicContact CD1-CD2 4.15Å; L1964-L2139 HydrophobicContact CD2-CD1 4.48Å; L1964-L2139 HydrophobicContact CD2-CD2 4.33Å; L1964-L2139 HydrophobicContact CG-CD2 4.45Å
1965	K	82.3	Confident	69.1	Low	33 Å²	33	64.5 Å²	64.5	14%	0.143	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	122.7	174.7	-172.1	173.4	-174.6	171.1	0	110.6	V1954 I1967 F2048 F2049	V1954-K1965 HydrophobicContact CG1-CG 4.14Å; V1954-K1965 WeakPolarHBondContact O-CE 3.43Å; V1954-K1965 PolarHBondContact O-NZ 2.96Å; K1965-I1967 HydrophobicContact CD-CD1 4.48Å; K1965-I1967 HydrophobicContact CG-CD1 4.49Å; K1965-I1967 HydrophobicContact CG-CG1 4.34Å; K1965-F2048 CarbonylContact O-C 3.54Å; K1965-F2048 WeakPolarHBondContact O-CA 3.4Å; K1965-F2049 PolarHBondContact N-O 3.43Å; K1965-F2049 PolarHBondContact O-N 2.77Å
1966	V	81	Confident	67.3	Low	0 Å²	0	67 Å²	67	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.2	-175.7	-177.9	0	0	0	0	110.1	L1964 L1969 C2011 F2012 F2048	L1964-V1966 HydrophobicContact CD1-CG2 4.29Å; L1964-V1966 HydrophobicContact CD2-CG2 4.15Å; L1964-V1966 HydrophobicContact CG-CG2 4Å; V1966-L1969 HydrophobicContact CG1-CB 3.72Å; V1966-L1969 HydrophobicContact CG1-CD1 4.41Å; V1966-L1969 HydrophobicContact CG1-CD2 3.94Å; V1966-L1969 HydrophobicContact CG1-CG 4.24Å; V1966-C2011 WeakPolarHBondContact O-CA 3.5Å; V1966-F2012 HydrophobicContact CB-CD1 3.96Å; V1966-F2012 HydrophobicContact CB-CE1 3.89Å; V1966-F2012 HydrophobicContact CB-CZ 4.37Å; V1966-F2012 HydrophobicContact CG1-CD1 4.3Å; V1966-F2012 HydrophobicContact CG1-CE1 4.04Å; V1966-F2012 HydrophobicContact CG2-CD1 4.26Å; V1966-F2012 HydrophobicContact CG2-CE1 3.78Å; V1966-F2012 HydrophobicContact CG2-CE2 4.24Å; V1966-F2012 HydrophobicContact CG2-CZ 3.77Å; V1966-F2012 PolarHBondContact N-O 2.99Å; V1966-F2012 PolarHBondContact O-N 3.25Å; V1966-F2012 VanDerWaalsContact O-N 3.16Å; V1966-F2048 HydrophobicContact CG2-CB 4.15Å
1967	I	81.4	Confident	65.3	Low	31 Å²	31	66.5 Å²	66.5	16%	0.159	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.2	-172.4	-46.2	-176.2	0	0	0	111.1	V1954 L1955 K1965 L1969 G2046 S2047 F2049	V1954-I1967 HydrophobicContact CG1-CG1 4.02Å; L1955-I1967 HydrophobicContact CD2-CG2 3.77Å; K1965-I1967 HydrophobicContact CD-CD1 4.48Å; K1965-I1967 HydrophobicContact CG-CD1 4.49Å; K1965-I1967 HydrophobicContact CG-CG1 4.34Å; I1967-L1969 PolarHBondContact O-N 3.24Å; I1967-L1969 VanDerWaalsContact O-N 3.13Å; I1967-G2046 CarbonylContact O-C 3.45Å; I1967-G2046 WeakPolarHBondContact O-CA 3.33Å; I1967-S2047 PolarHBondContact N-O 3.38Å; I1967-S2047 PolarHBondContact O-N 3.22Å; I1967-F2049 HydrophobicContact CD1-CD2 4.48Å; I1967-F2049 HydrophobicContact CD1-CE2 4.1Å
1968	N	81.5	Confident	63.6	Low	52 Å²	52	72.2 Å²	72.2	28%	0.278	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.5	39.9	174	-61.5	-1.5	0	0	0	113.7	R1970 D2009 V2010 C2011 G2046	N1968-R1970 PolarHBondContact O-N 2.92Å; N1968-D2009 VanDerWaalsContact CA-OD1 3.28Å; N1968-D2009 WeakPolarHBondContact CA-OD1 3.09Å; N1968-D2009 VanDerWaalsContact CB-OD1 3.23Å; N1968-D2009 WeakPolarHBondContact CB-OD1 3.2Å; N1968-V2010 PolarHBondContact N-O 2.89Å; N1968-C2011 PolarHBondContact N-SG 3.36Å; N1968-C2011 PolarHBondContact OD1-SG 2.86Å; N1968-G2046 WeakPolarHBondContact O-CA 3.39Å; N1968-G2046 PolarHBondContact O-N 3.2Å
1969	L	78.6	Confident	62.4	Low	0 Å²	0	74.4 Å²	74.4	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	120	-169.5	-159.2	79.5	0	0	0	110.5	V1966 I1967 D2009 V2010 T2033 M2036 A2043 F2048	V1966-L1969 HydrophobicContact CG1-CB 3.72Å; V1966-L1969 HydrophobicContact CG1-CD1 4.41Å; V1966-L1969 HydrophobicContact CG1-CD2 3.94Å; V1966-L1969 HydrophobicContact CG1-CG 4.24Å; I1967-L1969 PolarHBondContact O-N 3.24Å; I1967-L1969 VanDerWaalsContact O-N 3.13Å; L1969-D2009 PolarHBondContact O-N 2.98Å; L1969-V2010 HydrophobicContact CB-CB 4.4Å; L1969-V2010 WeakPolarHBondContact CB-O 3.11Å; L1969-V2010 PolarHBondContact N-O 3.5Å; L1969-V2010 PolarHBondContact O-N 3.09Å; L1969-T2033 HydrophobicContact CD2-CG2 4.13Å; L1969-M2036 HydrophobicContact CD2-CB 4.22Å; L1969-M2036 HydrophobicContact CD2-CE 3.72Å; L1969-M2036 HydrophobicContact CD2-SD 4.39Å; L1969-M2036 HydrophobicContact CG-CE 4.13Å; L1969-M2036 HydrophobicContact CG-SD 4.42Å; L1969-A2043 HydrophobicContact CD1-CB 4.12Å; L1969-F2048 HydrophobicContact CD1-CD1 4.23Å
1970	R	77.8	Confident	60.9	Low	85 Å²	85	78.1 Å²	78.1	32%	0.321	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.7	-172.8	-162.2	176.7	-162.6	-162.7	5.8	112.1	E1935 N1968 V2007 D2008 S2044 S2045	E1935-R1970 IonicContact OE2-NH1 2.79Å; N1968-R1970 PolarHBondContact O-N 2.92Å; R1970-V2007 CarbonylContact C-O 3.56Å; R1970-V2007 WeakPolarHBondContact CA-O 3.45Å; R1970-D2008 IonicContact CZ-OD1 3.26Å; R1970-D2008 VanDerWaalsContact CZ-OD1 3.29Å; R1970-D2008 IonicContact NE-OD1 2.77Å; R1970-D2008 PolarHBondContact NE-OD1 2.96Å; R1970-D2008 IonicContact NH2-OD1 2.9Å; R1970-D2008 PolarHBondContact NH2-OD1 3.48Å; R1970-S2044 WeakPolarHBondContact O-CA 3.37Å; R1970-S2044 WeakPolarHBondContact O-CB 3.43Å; R1970-S2044 PolarHBondContact O-N 3.23Å; R1970-S2045 WeakPolarHBondContact CB-OG 3.28Å; R1970-S2045 PolarHBondContact N-O 3.49Å; R1970-S2045 PolarHBondContact O-N 3.36Å
1971	K	77.5	Confident	59.4	Low	45 Å²	45	79.9 Å²	79.9	20%	0.196	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	100.7	170.9	-170.9	65.5	179.8	177.7	0	111.2	V2006 V2007 T2032 M2036 I2041 S2042	K1971-V2006 PolarHBondContact O-N 3.42Å; K1971-V2007 HydrophobicContact CB-CB 4.15Å; K1971-V2007 HydrophobicContact CB-CG2 4.45Å; K1971-V2007 PolarHBondContact N-O 2.76Å; K1971-V2007 PolarHBondContact O-N 3.36Å; K1971-T2032 HydrophobicContact CG-CG2 4.45Å; K1971-M2036 HydrophobicContact CB-CE 4.14Å; K1971-M2036 HydrophobicContact CB-SD 3.81Å; K1971-M2036 HydrophobicContact CD-SD 4.36Å; K1971-M2036 HydrophobicContact CG-SD 4.36Å; K1971-I2041 HydrophobicContact CD-CG2 4.12Å; K1971-S2042 WeakPolarHBondContact CD-O 3.24Å; K1971-S2042 PolarHBondContact NZ-O 2.84Å
1972	A	67.2	Low	57.4	Low	35 Å²	35	78.2 Å²	78.2	29%	0.289	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	130.8	166	0	0	0	0	0	110.4	S2044	A1972-S2044 PolarHBondContact N-OG 2.89Å
1973	A	55.6	Low	55.5	Low	39 Å²	39	83.1 Å²	83.1	32%	0.322	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143.2	170.4	0	0	0	0	0	110	V2004 V2006	A1973-V2004 PolarHBondContact N-O 3.35Å; A1973-V2004 PolarHBondContact O-N 3.48Å; A1973-V2006 HydrophobicContact CB-CG2 3.59Å
1974	M	50.8	Low	53.4	Low	148 Å²	148	88.9 Å²	88.9	73%	0.729	47%	0.47	S	S	*	.			trans	-75.2	125.4	165.6	-69.6	-173.2	-175.2	0	0	108.2	N1976	M1974-N1976 PolarHBondContact O-N 2.72Å
1975	R	42	Very low	50.9	Low	175 Å²	175	96.3 Å²	96.3	66%	0.66	51%	0.508	S	S	*	.			trans	-82.7	103.1	172.5	-154.7	-179.7	-161.3	158.8	4.6	107	A1977 V2004	R1975-A1977 PolarHBondContact O-N 2.71Å; R1975-V2004 HydrophobicContact CB-CG2 4.47Å
1976	N	38.5	Very low	48.3	Very low	145 Å²	145	101.6 Å²	101.6	78%	0.775	54%	0.544	S	S	*	.			trans	-71.8	78.2	170.4	-74.3	5.5	0	0	0	109.1	M1974	M1974-N1976 PolarHBondContact O-N 2.72Å
1977	A	29.4	Very low	45.8	Very low	70 Å²	70	107.1 Å²	107.1	58%	0.579	59%	0.589	S	S	*	*			trans	-81.8	128.8	160.8	0	0	0	0	0	107.9	R1975	R1975-A1977 PolarHBondContact O-N 2.71Å
1978	L	27.8	Very low	43.3	Very low	154 Å²	154	109.7 Å²	109.7	81%	0.806	62%	0.616	S	S	*	*			trans	63.4	129.2	-162.6	-68.2	75.9	0	0	0	111.6
1979	I	33.1	Very low	40.7	Very low	156 Å²	156	113.9 Å²	113.9	80%	0.8	64%	0.637	S	S	*	*				-139.5	126.6	63	-77.1	151.8	0	0	0	111.2
1980	V	29	Very low	38.3	Very low	139 Å²	139	118.7 Å²	118.7	84%	0.842	67%	0.668	S	S	*	*			trans	-92.5	106.8	155.4	171.8	0	0	0	0	107.3
1981	R	26.7	Very low	35.9	Very low	222 Å²	222	118.8 Å²	118.8	84%	0.838	68%	0.678	S	S	*	*			trans	179	145	145.1	-107.2	171.8	171.2	159.4	-1.9	112.3
1982	S	26.4	Very low	33.6	Very low	100 Å²	100	125.6 Å²	125.6	70%	0.699	71%	0.708	S	S	*	*			trans	41.6	109.4	160.2	53.2	0	0	0	0	118.3
1983	S	27.2	Very low	31.8	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	74%	0.736	S	S	*	*				57.8	108.5	69.5	79.9	0	0	0	0	114.8
1984	L	28.2	Very low	30.7	Very low	128 Å²	128	136.7 Å²	136.7	67%	0.67	76%	0.756	S	S	*	*	S	Bend	trans	70.7	140.4	174.6	-76.2	83.6	0	0	0	117.9
1985	L	27.7	Very low	29.8	Very low	161 Å²	161	139.4 Å²	139.4	84%	0.843	76%	0.759	S	S	*	*			trans	56.3	78.4	167.3	-76.8	132.1	0	0	0	118.3
1986	T	26.9	Very low	29.3	Very low	145 Å²	145	141.3 Å²	141.3	89%	0.89	77%	0.773	S	S	*	*			trans	-168.7	76	145.2	12.9	0	0	0	0	110.7
1987	A	29	Very low	28.8	Very low	115 Å²	115	144.7 Å²	144.7	95%	0.95	78%	0.781	S	S	*	*			trans	-123.1	12.6	179	0	0	0	0	0	113.8
1988	A	28.7	Very low	28.8	Very low	86 Å²	86	144.9 Å²	144.9	71%	0.711	79%	0.789	S	S	*	*	S	Bend	trans	-120	144.7	174.1	0	0	0	0	0	109.5
1989	L	25.7	Very low	29	Very low	139 Å²	139	146 Å²	146	73%	0.728	79%	0.792	S	S	*	*			trans	74.9	78	-178.2	-57.5	164.9	0	0	0	117.5	T1991	L1989-T1991 PolarHBondContact O-N 2.89Å
1990	P	28.3	Very low	29.1	Very low	102 Å²	102	143.9 Å²	143.9	66%	0.662	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	43.8	163.1	36.4	-35.1	0	0	0	112.2	Y1785	Y1785-P1990 HydrophobicContact CD1-CG 4.41Å; Y1785-P1990 HydrophobicContact CE1-CG 3.84Å
1991	T	27.7	Very low	29.4	Very low	86 Å²	86	143.2 Å²	143.2	53%	0.528	79%	0.789	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.6	-6.3	-172.5	28.8	0	0	0	0	114.9	L1989	L1989-T1991 PolarHBondContact O-N 2.89Å
1992	F	29.4	Very low	30.2	Very low	188 Å²	188	143.2 Å²	143.2	83%	0.825	79%	0.789	S	S	*	*			trans	-122.3	38.6	-171.9	-112.1	-83.7	0	0	0	115.5
1993	Q	30.5	Very low	31.1	Very low	187 Å²	187	145.9 Å²	145.9	87%	0.874	79%	0.788	S	S	*	*			trans	-115.9	33.3	-179.7	-140.5	176.7	23.2	0	0	114.2
1994	V	31.4	Very low	32.6	Very low	121 Å²	121	143.8 Å²	143.8	73%	0.733	77%	0.771	S	S	*	*	S	Bend	trans	-114.7	-7.6	-174.4	-178.7	0	0	0	0	113.7
1995	Y	31.5	Very low	34.1	Very low	205 Å²	205	138.9 Å²	138.9	80%	0.804	75%	0.749	S	S	*	*			trans	-121	34.3	-167.7	-85.6	-84.9	0	0	0	116.7
1996	F	31.5	Very low	36.1	Very low	214 Å²	214	133.4 Å²	133.4	94%	0.939	72%	0.722	S	S	*	*			trans	-115	77.6	162.4	-88.9	-83.3	0	0	0	111.4
1997	K	28.1	Very low	38.3	Very low	217 Å²	217	126.5 Å²	126.5	94%	0.943	68%	0.68	S	S	*	*			trans	-82.7	104.6	158.8	-83.1	-177	171.8	-177.3	0	107.5
1998	G	30.4	Very low	40.5	Very low	74 Å²	74	122 Å²	122	76%	0.763	64%	0.64	S	S	*	*			trans	-171.5	-24.5	-179.8	0	0	0	0	0	117
1999	M	30.8	Very low	42.9	Very low	177 Å²	177	119.7 Å²	119.7	87%	0.872	62%	0.615	S	S	*	*	S	Bend	trans	-125.8	137.2	174.7	-76.6	-176.3	170.9	0	0	111.8	L2001	M1999-L2001 PolarHBondContact O-N 2.75Å
2000	A	36.6	Very low	45.5	Very low	111 Å²	111	113.1 Å²	113.1	92%	0.917	58%	0.581	S	S	*	*			trans	-75.5	68.9	-177.3	0	0	0	0	0	112.2	R2002	A2000-R2002 PolarHBondContact O-N 2.73Å
2001	L	35.3	Very low	48.1	Very low	125 Å²	125	108.6 Å²	108.6	65%	0.654	55%	0.551	S	S	*	*			trans	-67.7	112.3	173.6	-75.8	161.6	0	0	0	110.4	M1999 K2003	M1999-L2001 PolarHBondContact O-N 2.75Å; L2001-K2003 PolarHBondContact O-N 3.38Å
2002	R	42.5	Very low	50.9	Low	222 Å²	222	104.7 Å²	104.7	84%	0.838	53%	0.527	S	S	*	.			trans	-57	105.5	176.5	-121.1	177.7	176.7	-173.5	-4.5	109.8	A2000 V2004	A2000-R2002 PolarHBondContact O-N 2.73Å; R2002-V2004 PolarHBondContact O-N 2.71Å
2003	K	46.7	Very low	53.4	Low	156 Å²	156	95.8 Å²	95.8	68%	0.678	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-70.4	119	174.3	-67.5	173.7	-174.1	164.1	0	108.8	L2001	L2001-K2003 PolarHBondContact O-N 3.38Å
2004	V	57.1	Low	55.8	Low	60 Å²	60	87.5 Å²	87.5	36%	0.364	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.1	173.2	-178.6	0	0	0	0	108.3	A1973 R1975 R2002 V2006	A1973-V2004 PolarHBondContact N-O 3.35Å; A1973-V2004 PolarHBondContact O-N 3.48Å; R1975-V2004 HydrophobicContact CB-CG2 4.47Å; R2002-V2004 PolarHBondContact O-N 2.71Å; V2004-V2006 PolarHBondContact O-N 3.18Å
2005	A	61.2	Low	58	Low	25 Å²	25	84.3 Å²	84.3	21%	0.207	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	120.4	170.9	0	0	0	0	0	109	D2008	A2005-D2008 HydrophobicContact CB-CB 3.71Å; A2005-D2008 WeakPolarHBondContact CB-OD1 3.45Å
2006	V	69.8	Low	60	Low	47 Å²	47	78.9 Å²	78.9	29%	0.285	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-27.5	174.4	178.6	0	0	0	0	110.4	K1971 A1973 V2004 T2032 G2186	K1971-V2006 PolarHBondContact O-N 3.42Å; A1973-V2006 HydrophobicContact CB-CG2 3.59Å; V2004-V2006 PolarHBondContact O-N 3.18Å; V2006-T2032 HydrophobicContact CG1-CG2 4.15Å; V2006-G2186 WeakPolarHBondContact O-CA 3.11Å
2007	V	73.2	Confident	61.9	Low	0 Å²	0	71.8 Å²	71.8	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	130.7	166.1	-176.1	0	0	0	0	106.4	R1970 K1971 V2010 T2032 M2036 G2186	R1970-V2007 CarbonylContact C-O 3.56Å; R1970-V2007 WeakPolarHBondContact CA-O 3.45Å; K1971-V2007 HydrophobicContact CB-CB 4.15Å; K1971-V2007 HydrophobicContact CB-CG2 4.45Å; K1971-V2007 PolarHBondContact N-O 2.76Å; K1971-V2007 PolarHBondContact O-N 3.36Å; V2007-V2010 HydrophobicContact CG1-CB 4.16Å; V2007-V2010 HydrophobicContact CG1-CG2 3.53Å; V2007-T2032 HydrophobicContact CG2-CG2 4.13Å; V2007-M2036 HydrophobicContact CB-CE 3.86Å; V2007-M2036 HydrophobicContact CG1-CE 3.99Å; V2007-M2036 HydrophobicContact CG2-CE 3.68Å; V2007-G2186 CarbonylContact C-O 3.6Å; V2007-G2186 WeakPolarHBondContact CA-O 3.37Å
2008	D	75.1	Confident	64.1	Low	21 Å²	21	63.4 Å²	63.4	11%	0.112	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	102.2	-172	-153.7	40.6	0	0	0	109.9	K1940 R1970 A2005 G2186 S2187	K1940-D2008 IonicContact NZ-OD2 3.8Å; K1940-D2008 PolarHBondContact NZ-OD2 2.9Å; R1970-D2008 IonicContact CZ-OD1 3.26Å; R1970-D2008 VanDerWaalsContact CZ-OD1 3.29Å; R1970-D2008 IonicContact NE-OD1 2.77Å; R1970-D2008 PolarHBondContact NE-OD1 2.96Å; R1970-D2008 IonicContact NH2-OD1 2.9Å; R1970-D2008 PolarHBondContact NH2-OD1 3.48Å; A2005-D2008 HydrophobicContact CB-CB 3.71Å; A2005-D2008 WeakPolarHBondContact CB-OD1 3.45Å; D2008-G2186 PolarHBondContact N-O 3.33Å; D2008-S2187 WeakPolarHBondContact O-CB 3.47Å
2009	D	77.8	Confident	66.4	Low	37 Å²	37	61.1 Å²	61.1	20%	0.198	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59	48.8	170.2	-155.1	43	0	0	0	116.4	Q1937 K1951 N1968 L1969	Q1937-D2009 PolarHBondContact NE2-OD1 2.82Å; Q1937-D2009 PolarHBondContact NE2-OD2 3.05Å; K1951-D2009 WeakPolarHBondContact CE-OD2 2.98Å; K1951-D2009 IonicContact NZ-OD2 2.73Å; K1951-D2009 PolarHBondContact NZ-OD2 2.99Å; N1968-D2009 VanDerWaalsContact CA-OD1 3.28Å; N1968-D2009 WeakPolarHBondContact CA-OD1 3.09Å; N1968-D2009 VanDerWaalsContact CB-OD1 3.23Å; N1968-D2009 WeakPolarHBondContact CB-OD1 3.2Å; L1969-D2009 PolarHBondContact O-N 2.98Å
2010	V	80.7	Confident	68.8	Low	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	127.4	-179.7	172.5	0	0	0	0	111.8	N1968 L1969 V2007 F2012 L2183 G2186 F2188	N1968-V2010 PolarHBondContact N-O 2.89Å; L1969-V2010 HydrophobicContact CB-CB 4.4Å; L1969-V2010 WeakPolarHBondContact CB-O 3.11Å; L1969-V2010 PolarHBondContact N-O 3.5Å; L1969-V2010 PolarHBondContact O-N 3.09Å; V2007-V2010 HydrophobicContact CG1-CB 4.16Å; V2007-V2010 HydrophobicContact CG1-CG2 3.53Å; V2010-F2012 HydrophobicContact CG1-CD1 3.9Å; V2010-F2012 HydrophobicContact CG1-CE1 3.97Å; V2010-L2183 HydrophobicContact CG2-CD2 4.14Å; V2010-G2186 WeakPolarHBondContact CG2-O 3.13Å; V2010-F2188 HydrophobicContact CG1-CD2 4.05Å; V2010-F2188 HydrophobicContact CG1-CE2 3.62Å; V2010-F2188 HydrophobicContact CG1-CZ 4.15Å
2011	C	83.9	Confident	70.9	Confident	7 Å²	7	49 Å²	49	5%	0.047	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	130.3	177	-64.4	0	0	0	0	111.6	K1951 V1966 N1968 F2188	K1951-C2011 HydrophobicContact CB-CB 4.32Å; K1951-C2011 HydrophobicContact CG-CB 4.17Å; V1966-C2011 WeakPolarHBondContact O-CA 3.5Å; N1968-C2011 PolarHBondContact N-SG 3.36Å; N1968-C2011 PolarHBondContact OD1-SG 2.86Å; C2011-F2188 WeakPolarHBondContact O-CE2 3.37Å
2012	F	85.5	Confident	72.9	Confident	4 Å²	4	44.2 Å²	44.2	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	159.7	170.7	64	-78.6	0	0	0	111.7	L1964 V1966 V2010 V2014 F2020 L2022 I2037 F2188	L1964-F2012 HydrophobicContact CD2-CE2 4.22Å; L1964-F2012 HydrophobicContact CD2-CZ 4.46Å; V1966-F2012 HydrophobicContact CB-CD1 3.96Å; V1966-F2012 HydrophobicContact CB-CE1 3.89Å; V1966-F2012 HydrophobicContact CB-CZ 4.37Å; V1966-F2012 HydrophobicContact CG1-CD1 4.3Å; V1966-F2012 HydrophobicContact CG1-CE1 4.04Å; V1966-F2012 HydrophobicContact CG2-CD1 4.26Å; V1966-F2012 HydrophobicContact CG2-CE1 3.78Å; V1966-F2012 HydrophobicContact CG2-CE2 4.24Å; V1966-F2012 HydrophobicContact CG2-CZ 3.77Å; V1966-F2012 PolarHBondContact N-O 2.99Å; V1966-F2012 PolarHBondContact O-N 3.25Å; V1966-F2012 VanDerWaalsContact O-N 3.16Å; V2010-F2012 HydrophobicContact CG1-CD1 3.9Å; V2010-F2012 HydrophobicContact CG1-CE1 3.97Å; F2012-V2014 HydrophobicContact CD2-CG2 3.83Å; F2012-V2014 HydrophobicContact CE2-CG2 3.81Å; F2012-F2020 HydrophobicContact CB-CZ 4.23Å; F2012-F2020 AromaticContact CD2-CD1 3.87Å; F2012-F2020 HydrophobicContact CD2-CD1 3.87Å; F2012-F2020 AromaticContact CD2-CE1 3.6Å; F2012-F2020 HydrophobicContact CD2-CE1 3.6Å; F2012-F2020 HydrophobicContact CD2-CG 4.48Å; F2012-F2020 HydrophobicContact CD2-CZ 4.04Å; F2012-F2020 AromaticContact CE2-CD1 3.82Å; F2012-F2020 HydrophobicContact CE2-CD1 3.82Å; F2012-F2020 AromaticContact CE2-CE1 3.79Å; F2012-F2020 HydrophobicContact CE2-CE1 3.79Å; F2012-F2020 HydrophobicContact CG-CE1 4.03Å; F2012-F2020 HydrophobicContact CG-CZ 4.18Å; F2012-F2020 HydrophobicContact CZ-CE1 4.35Å; F2012-L2022 HydrophobicContact CZ-CD1 4.48Å; F2012-I2037 HydrophobicContact CZ-CD1 4.27Å; F2012-F2188 HydrophobicContact CB-CE2 4.07Å; F2012-F2188 HydrophobicContact CB-CZ 4.48Å; F2012-F2188 AromaticContact CD1-CE2 3.76Å; F2012-F2188 HydrophobicContact CD1-CE2 3.76Å; F2012-F2188 AromaticContact CD1-CZ 3.94Å; F2012-F2188 HydrophobicContact CD1-CZ 3.94Å; F2012-F2188 HydrophobicContact CE1-CZ 4.49Å; F2012-F2188 HydrophobicContact CG-CE2 4.23Å; F2012-F2188 HydrophobicContact CG-CZ 4.34Å
2013	E	82.9	Confident	74.5	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	138.5	173.3	179	170.7	-114.7	0	0	110.7	V1954 S1962 L1964 R2179	V1954-E2013 HydrophobicContact CG2-CB 3.93Å; S1962-E2013 VanDerWaalsContact CB-CG 3.5Å; S1962-E2013 WeakPolarHBondContact CB-OE1 3.26Å; S1962-E2013 PolarHBondContact OG-OE1 3.48Å; L1964-E2013 WeakPolarHBondContact O-CA 3.18Å; E2013-R2179 PolarHBondContact O-NH1 3.05Å; E2013-R2179 PolarHBondContact O-NH2 3.47Å
2014	V	81.1	Confident	75.7	Confident	14 Å²	14	28.1 Å²	28.1	9%	0.085	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.8	179.4	-172.7	0	0	0	0	109.5	A1963 L1964 F2012 E2018 F2020	A1963-V2014 PolarHBondContact N-O 2.71Å; L1964-V2014 HydrophobicContact CB-CB 4.3Å; L1964-V2014 HydrophobicContact CB-CG2 4.43Å; L1964-V2014 PolarHBondContact N-O 2.82Å; L1964-V2014 PolarHBondContact O-N 2.89Å; F2012-V2014 HydrophobicContact CD2-CG2 3.83Å; F2012-V2014 HydrophobicContact CE2-CG2 3.81Å; V2014-E2018 HydrophobicContact CG1-CB 4.41Å; V2014-F2020 HydrophobicContact CG1-CB 4.32Å; V2014-F2020 HydrophobicContact CG2-CB 3.95Å; V2014-F2020 HydrophobicContact CG2-CG 4.23Å
2015	L	77.5	Confident	76.2	Confident	54 Å²	54	28 Å²	28	28%	0.283	17%	0.174	S	C	.	.			trans	-87.4	156.3	-179.3	-61.6	173.2	0	0	0	112.3	G2017 E2018	L2015-G2017 PolarHBondContact O-N 3.3Å; L2015-E2018 HydrophobicContact CB-CB 3.99Å; L2015-E2018 PolarHBondContact N-OE2 2.98Å; L2015-E2018 VanDerWaalsContact O-CB 3.23Å; L2015-E2018 WeakPolarHBondContact O-CB 3.46Å; L2015-E2018 PolarHBondContact O-N 2.77Å
2016	P	73.4	Confident	76.3	Confident	90 Å²	90	30.7 Å²	30.7	58%	0.584	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	127.2	174.4	-22.2	33.6	0	0	0	111.5	N1961 E2018	N1961-P2016 WeakPolarHBondContact O-CD 3.29Å; N1961-P2016 WeakPolarHBondContact O-CG 3.27Å; P2016-E2018 PolarHBondContact O-N 2.92Å
2017	G	71.1	Confident	75.8	Confident	65 Å²	65	31.5 Å²	31.5	67%	0.67	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.2	-4	-174.7	0	0	0	0	0	114.7	L2015	L2015-G2017 PolarHBondContact O-N 3.3Å
2018	E	74.6	Confident	75.5	Confident	42 Å²	42	31.7 Å²	31.7	20%	0.196	20%	0.204	C	C	.	.			trans	-82.3	142.5	170.4	-166.6	-179.4	-157.7	0	0	110.4	V2014 L2015 P2016 T2178 R2179	V2014-E2018 HydrophobicContact CG1-CB 4.41Å; L2015-E2018 HydrophobicContact CB-CB 3.99Å; L2015-E2018 PolarHBondContact N-OE2 2.98Å; L2015-E2018 VanDerWaalsContact O-CB 3.23Å; L2015-E2018 WeakPolarHBondContact O-CB 3.46Å; L2015-E2018 PolarHBondContact O-N 2.77Å; P2016-E2018 PolarHBondContact O-N 2.92Å; E2018-T2178 WeakPolarHBondContact CG-OG1 3.24Å; E2018-R2179 IonicContact OE1-CZ 2.65Å; E2018-R2179 IonicContact OE1-NE 3.66Å; E2018-R2179 IonicContact OE1-NH1 3.39Å; E2018-R2179 PolarHBondContact OE1-NH1 2.94Å; E2018-R2179 IonicContact OE2-NH1 2.67Å; E2018-R2179 PolarHBondContact OE2-NH1 2.98Å
2019	C	77.3	Confident	75.4	Confident	26 Å²	26	30.9 Å²	30.9	18%	0.176	20%	0.201	C	C	.	.			trans	-116.8	122.3	173.6	-172.1	0	0	0	0	109.6	L2176 C2177 T2178 R2179	C2019-L2176 WeakPolarHBondContact CB-O 3.46Å; C2019-L2176 PolarHBondContact SG-O 3.25Å; C2019-C2177 CarbonylContact O-C 3.51Å; C2019-C2177 WeakPolarHBondContact O-CA 3.48Å; C2019-T2178 PolarHBondContact N-OG1 2.88Å; C2019-T2178 PolarHBondContact O-N 3.26Å; C2019-T2178 PolarHBondContact O-OG1 3.31Å; C2019-T2178 VanDerWaalsContact O-OG1 3.13Å; C2019-R2179 PolarHBondContact O-N 3.47Å
2020	F	82.1	Confident	75.3	Confident	29 Å²	29	30.7 Å²	30.7	13%	0.127	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.2	-170.5	-176.3	-99.8	0	0	0	111.5	F2012 V2014 L2022 R2179 F2188 L2191	F2012-F2020 HydrophobicContact CB-CZ 4.23Å; F2012-F2020 AromaticContact CD2-CD1 3.87Å; F2012-F2020 HydrophobicContact CD2-CD1 3.87Å; F2012-F2020 AromaticContact CD2-CE1 3.6Å; F2012-F2020 HydrophobicContact CD2-CE1 3.6Å; F2012-F2020 HydrophobicContact CD2-CG 4.48Å; F2012-F2020 HydrophobicContact CD2-CZ 4.04Å; F2012-F2020 AromaticContact CE2-CD1 3.82Å; F2012-F2020 HydrophobicContact CE2-CD1 3.82Å; F2012-F2020 AromaticContact CE2-CE1 3.79Å; F2012-F2020 HydrophobicContact CE2-CE1 3.79Å; F2012-F2020 HydrophobicContact CG-CE1 4.03Å; F2012-F2020 HydrophobicContact CG-CZ 4.18Å; F2012-F2020 HydrophobicContact CZ-CE1 4.35Å; V2014-F2020 HydrophobicContact CG1-CB 4.32Å; V2014-F2020 HydrophobicContact CG2-CB 3.95Å; V2014-F2020 HydrophobicContact CG2-CG 4.23Å; F2020-L2022 HydrophobicContact CD1-CD1 4.41Å; F2020-L2022 HydrophobicContact CD1-CG 4.22Å; F2020-L2022 HydrophobicContact CE1-CD1 4.26Å; F2020-L2022 HydrophobicContact CE1-CD2 4.08Å; F2020-L2022 HydrophobicContact CE1-CG 3.82Å; F2020-R2179 WeakPolarHBondContact CA-O 3.36Å; F2020-R2179 HydrophobicContact CD2-CB 4.16Å; F2020-F2188 HydrophobicContact CE1-CZ 4.14Å; F2020-F2188 HydrophobicContact CZ-CE1 4.42Å; F2020-F2188 AromaticContact CZ-CZ 3.91Å; F2020-F2188 HydrophobicContact CZ-CZ 3.91Å; F2020-L2191 HydrophobicContact CE2-CD1 3.93Å; F2020-L2191 HydrophobicContact CE2-CG 4.45Å; F2020-L2191 HydrophobicContact CZ-CD1 3.82Å
2021	G	79.8	Confident	74.9	Confident	3 Å²	3	31.9 Å²	31.9	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.5	-177.7	0	0	0	0	0	113.4	C2177 R2179 V2180 G2181	G2021-C2177 WeakPolarHBondContact CA-SG 3.45Å; G2021-R2179 PolarHBondContact N-O 3.36Å; G2021-V2180 WeakPolarHBondContact O-CA 3.35Å; G2021-G2181 PolarHBondContact O-N 2.87Å
2022	L	78.8	Confident	74.6	Confident	25 Å²	25	33.2 Å²	33.2	13%	0.131	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	99.7	177.3	-83.5	154.9	0	0	0	110.3	F2012 F2020 K2030 F2034 L2183 F2188	F2012-L2022 HydrophobicContact CZ-CD1 4.48Å; F2020-L2022 HydrophobicContact CD1-CD1 4.41Å; F2020-L2022 HydrophobicContact CD1-CG 4.22Å; F2020-L2022 HydrophobicContact CE1-CD1 4.26Å; F2020-L2022 HydrophobicContact CE1-CD2 4.08Å; F2020-L2022 HydrophobicContact CE1-CG 3.82Å; L2022-K2030 WeakPolarHBondContact O-CD 3.21Å; L2022-F2034 HydrophobicContact CD1-CD1 4.39Å; L2022-F2034 HydrophobicContact CD1-CE1 3.56Å; L2022-F2034 HydrophobicContact CD1-CZ 3.89Å; L2022-L2183 HydrophobicContact CD2-CD1 3.61Å; L2022-F2188 HydrophobicContact CD2-CE1 3.65Å; L2022-F2188 HydrophobicContact CD2-CZ 3.81Å
2023	L	74.5	Confident	74.3	Confident	35 Å²	35	33 Å²	33	18%	0.183	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	162.7	179.3	-84.6	157.4	0	0	0	111.3	C2173 V2180 G2181 I2182 L2183 L2280	L2023-C2173 HydrophobicContact CD1-CB 4.26Å; L2023-V2180 HydrophobicContact CD1-CG1 3.76Å; L2023-G2181 PolarHBondContact N-O 3.31Å; L2023-I2182 HydrophobicContact CB-CG1 4.28Å; L2023-L2183 PolarHBondContact O-N 3.48Å; L2023-L2280 HydrophobicContact CD1-CD2 3.54Å; L2023-L2280 HydrophobicContact CD1-CG 4.4Å
2024	G	72.6	Confident	74.2	Confident	5 Å²	5	34.2 Å²	34.2	5%	0.052	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151	153.2	-169.1	0	0	0	0	0	112.4	K2030 L2183	G2024-K2030 WeakPolarHBondContact O-CE 3.37Å; G2024-K2030 PolarHBondContact O-NZ 3.36Å; G2024-L2183 WeakPolarHBondContact CA-O 3.48Å
2025	H	66.8	Low	73.9	Confident	59 Å²	59	36.3 Å²	36.3	27%	0.273	23%	0.226	S	C	.	.			trans	-69.5	165	-179.1	71.7	-101.8	0	0	0	112.2	G2027 A2028 F2284 Q2291	H2025-G2027 PolarHBondContact O-N 3.29Å; H2025-A2028 WeakPolarHBondContact O-CB 3.47Å; H2025-A2028 PolarHBondContact O-N 3.47Å; H2025-F2284 HydrophobicContact CB-CZ 4.21Å; H2025-Q2291 PolarHBondContact ND1-OE1 3.47Å
2026	N	63.5	Low	74	Confident	81 Å²	81	33.8 Å²	33.8	43%	0.433	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	93.7	177.1	-81.1	-30.2	0	0	0	111.2	D1076	D1076-N2026 PolarHBondContact OD1-ND2 3.06Å
2027	G	60	Low	74.2	Confident	64 Å²	64	29.6 Å²	29.6	66%	0.66	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	134.8	-18.9	-173.2	0	0	0	0	0	114.1	H2025 G2029	H2025-G2027 PolarHBondContact O-N 3.29Å; G2027-G2029 PolarHBondContact O-N 3.21Å
2028	A	67.4	Low	74.5	Confident	3 Å²	3	26.9 Å²	26.9	3%	0.025	16%	0.156	C	C	.	.	S	Bend	trans	-68.2	-2.9	-170.5	0	0	0	0	0	116.8	H2025 L2183 G2186	H2025-A2028 WeakPolarHBondContact O-CB 3.47Å; H2025-A2028 PolarHBondContact O-N 3.47Å; A2028-L2183 HydrophobicContact CB-CB 4.23Å; A2028-L2183 WeakPolarHBondContact CB-O 3.49Å; A2028-G2186 WeakPolarHBondContact O-CA 3.43Å; A2028-G2186 PolarHBondContact O-N 3.17Å
2029	G	71.5	Confident	74.6	Confident	4 Å²	4	28.9 Å²	28.9	4%	0.041	16%	0.162	C	C	.	.	S	Bend	trans	109.1	-13	175.8	0	0	0	0	0	116.6	G2027 T2031 T2032 T2033	G2027-G2029 PolarHBondContact O-N 3.21Å; G2029-T2031 PolarHBondContact O-N 3.46Å; G2029-T2032 CarbonylContact O-C 3.59Å; G2029-T2032 WeakPolarHBondContact O-CA 3.22Å; G2029-T2032 WeakPolarHBondContact O-CB 3.02Å; G2029-T2032 PolarHBondContact O-N 3.42Å; G2029-T2033 PolarHBondContact O-N 2.92Å; G2029-T2033 PolarHBondContact O-OG1 3.25Å
2030	K	75.6	Confident	74.4	Confident	34 Å²	34	30.8 Å²	30.8	15%	0.148	17%	0.167	C	C	.	.	H	α-helix	trans	-39.4	-67.4	-176.4	-59.1	-178.5	-64.5	-179.2	0	114.6	L2022 G2024 T2032 T2033 F2034 E2144 L2183	L2022-K2030 WeakPolarHBondContact O-CD 3.21Å; G2024-K2030 WeakPolarHBondContact O-CE 3.37Å; G2024-K2030 PolarHBondContact O-NZ 3.36Å; K2030-T2032 PolarHBondContact O-N 3.21Å; K2030-T2033 WeakPolarHBondContact O-CB 3.27Å; K2030-T2033 PolarHBondContact O-N 2.66Å; K2030-F2034 PolarHBondContact O-N 3.12Å; K2030-E2144 IonicContact NZ-OE1 2.69Å; K2030-L2183 HydrophobicContact CG-CD1 4.15Å
2031	T	73.8	Confident	73.9	Confident	25 Å²	25	31.9 Å²	31.9	15%	0.153	17%	0.173	C	C	.	.	H	α-helix	trans	-61.9	-28.9	179.8	-47.1	0	0	0	0	112.5	G2029 K2035	G2029-T2031 PolarHBondContact O-N 3.46Å; T2031-K2035 HydrophobicContact CG2-CD 4.18Å; T2031-K2035 WeakPolarHBondContact O-CB 3.35Å; T2031-K2035 VanDerWaalsContact O-CG 3.23Å; T2031-K2035 WeakPolarHBondContact O-CG 3.04Å; T2031-K2035 PolarHBondContact O-N 3.16Å
2032	T	77	Confident	73.4	Confident	34 Å²	34	34.4 Å²	34.4	21%	0.209	19%	0.191	C	C	.	.	H	α-helix	trans	-68.5	-39.2	175.3	-48	0	0	0	0	110.6	K1971 V2006 V2007 G2029 K2030 K2035 M2036 I2041	K1971-T2032 HydrophobicContact CG-CG2 4.45Å; V2006-T2032 HydrophobicContact CG1-CG2 4.15Å; V2007-T2032 HydrophobicContact CG2-CG2 4.13Å; G2029-T2032 CarbonylContact O-C 3.59Å; G2029-T2032 WeakPolarHBondContact O-CA 3.22Å; G2029-T2032 WeakPolarHBondContact O-CB 3.02Å; G2029-T2032 PolarHBondContact O-N 3.42Å; K2030-T2032 PolarHBondContact O-N 3.21Å; T2032-K2035 PolarHBondContact O-N 3.09Å; T2032-M2036 WeakPolarHBondContact O-CG 2.89Å; T2032-M2036 PolarHBondContact O-N 2.95Å; T2032-I2041 HydrophobicContact CG2-CD1 4.48Å
2033	T	79	Confident	73	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-47.4	174.2	-53.8	0	0	0	0	111.4	L1969 G2029 K2030 K2035 M2036 I2037	L1969-T2033 HydrophobicContact CD2-CG2 4.13Å; G2029-T2033 PolarHBondContact O-N 2.92Å; G2029-T2033 PolarHBondContact O-OG1 3.25Å; K2030-T2033 WeakPolarHBondContact O-CB 3.27Å; K2030-T2033 PolarHBondContact O-N 2.66Å; T2033-K2035 VanDerWaalsContact C-N 3.35Å; T2033-K2035 PolarHBondContact O-N 3.08Å; T2033-M2036 WeakPolarHBondContact O-CB 3.4Å; T2033-M2036 PolarHBondContact O-N 3.34Å; T2033-I2037 HydrophobicContact CG2-CD1 4.07Å; T2033-I2037 WeakPolarHBondContact O-CG1 2.99Å; T2033-I2037 PolarHBondContact O-N 2.99Å
2034	F	80.5	Confident	73	Confident	26 Å²	26	34.9 Å²	34.9	11%	0.114	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-37.7	173.5	-71.1	-24	0	0	0	113.2	L2022 K2030 M2036 I2037 T2038 L2141 D2143	L2022-F2034 HydrophobicContact CD1-CD1 4.39Å; L2022-F2034 HydrophobicContact CD1-CE1 3.56Å; L2022-F2034 HydrophobicContact CD1-CZ 3.89Å; K2030-F2034 PolarHBondContact O-N 3.12Å; F2034-M2036 PolarHBondContact O-N 3.31Å; F2034-I2037 HydrophobicContact CD1-CD1 4.39Å; F2034-I2037 PolarHBondContact O-N 3.37Å; F2034-T2038 WeakPolarHBondContact O-CB 3.45Å; F2034-T2038 WeakPolarHBondContact O-CG2 3.12Å; F2034-T2038 PolarHBondContact O-N 2.79Å; F2034-T2038 PolarHBondContact O-OG1 2.89Å; F2034-L2141 HydrophobicContact CD1-CD2 4.36Å; F2034-L2141 HydrophobicContact CE1-CD2 4.18Å; F2034-D2143 HydrophobicContact CD2-CB 3.86Å; F2034-D2143 HydrophobicContact CE2-CB 4.21Å
2035	K	76.2	Confident	72.8	Confident	58 Å²	58	37.4 Å²	37.4	25%	0.252	22%	0.218	S	C	.	.	H	α-helix	trans	-65.8	-25.3	172.8	-74.9	168.4	-177.9	162.4	0	112.7	T2031 T2032 T2033 K2040 I2041	T2031-K2035 HydrophobicContact CG2-CD 4.18Å; T2031-K2035 WeakPolarHBondContact O-CB 3.35Å; T2031-K2035 VanDerWaalsContact O-CG 3.23Å; T2031-K2035 WeakPolarHBondContact O-CG 3.04Å; T2031-K2035 PolarHBondContact O-N 3.16Å; T2032-K2035 PolarHBondContact O-N 3.09Å; T2033-K2035 VanDerWaalsContact C-N 3.35Å; T2033-K2035 PolarHBondContact O-N 3.08Å; K2035-K2040 HydrophobicContact CB-CB 4.27Å; K2035-K2040 HydrophobicContact CG-CB 4.46Å; K2035-K2040 HydrophobicContact CG-CD 4.36Å; K2035-K2040 WeakPolarHBondContact O-CA 3.45Å; K2035-K2040 WeakPolarHBondContact O-CB 3.23Å; K2035-K2040 PolarHBondContact O-N 2.96Å; K2035-I2041 HydrophobicContact CB-CB 4.33Å; K2035-I2041 HydrophobicContact CB-CD1 3.79Å; K2035-I2041 HydrophobicContact CB-CG1 3.99Å; K2035-I2041 HydrophobicContact CD-CD1 4Å; K2035-I2041 HydrophobicContact CG-CD1 4.47Å; K2035-I2041 PolarHBondContact O-N 3.3Å
2036	M	78.5	Confident	73.1	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-77.6	-47	171.9	-72.6	-173.1	-68.1	0	0	112.5	L1969 K1971 V2007 T2032 T2033 F2034 T2038 R2039 I2041 A2043 F2048	L1969-M2036 HydrophobicContact CD2-CB 4.22Å; L1969-M2036 HydrophobicContact CD2-CE 3.72Å; L1969-M2036 HydrophobicContact CD2-SD 4.39Å; L1969-M2036 HydrophobicContact CG-CE 4.13Å; L1969-M2036 HydrophobicContact CG-SD 4.42Å; K1971-M2036 HydrophobicContact CB-CE 4.14Å; K1971-M2036 HydrophobicContact CB-SD 3.81Å; K1971-M2036 HydrophobicContact CD-SD 4.36Å; K1971-M2036 HydrophobicContact CG-SD 4.36Å; V2007-M2036 HydrophobicContact CB-CE 3.86Å; V2007-M2036 HydrophobicContact CG1-CE 3.99Å; V2007-M2036 HydrophobicContact CG2-CE 3.68Å; T2032-M2036 WeakPolarHBondContact O-CG 2.89Å; T2032-M2036 PolarHBondContact O-N 2.95Å; T2033-M2036 WeakPolarHBondContact O-CB 3.4Å; T2033-M2036 PolarHBondContact O-N 3.34Å; F2034-M2036 PolarHBondContact O-N 3.31Å; M2036-T2038 PolarHBondContact O-N 3.18Å; M2036-R2039 WeakPolarHBondContact O-CA 3.46Å; M2036-R2039 PolarHBondContact O-N 3.37Å; M2036-I2041 WeakPolarHBondContact CA-O 3.32Å; M2036-I2041 HydrophobicContact CG-CB 4.27Å; M2036-I2041 HydrophobicContact CG-CG2 4.19Å; M2036-A2043 HydrophobicContact SD-CB 4.03Å; M2036-F2048 WeakPolarHBondContact O-CE1 3.46Å; M2036-F2048 WeakPolarHBondContact O-CZ 3.08Å
2037	I	78.1	Confident	73.6	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-60.8	-44.9	178.1	-64.8	160.5	0	0	0	110.8	L1964 F2012 T2033 F2034 R2039 F2048 L2141	L1964-I2037 HydrophobicContact CD1-CG2 4.15Å; L1964-I2037 HydrophobicContact CD2-CD1 4.17Å; L1964-I2037 HydrophobicContact CD2-CG2 4.35Å; F2012-I2037 HydrophobicContact CZ-CD1 4.27Å; T2033-I2037 HydrophobicContact CG2-CD1 4.07Å; T2033-I2037 WeakPolarHBondContact O-CG1 2.99Å; T2033-I2037 PolarHBondContact O-N 2.99Å; F2034-I2037 HydrophobicContact CD1-CD1 4.39Å; F2034-I2037 PolarHBondContact O-N 3.37Å; I2037-R2039 PolarHBondContact O-N 3.19Å; I2037-R2039 VanDerWaalsContact O-N 3.13Å; I2037-F2048 HydrophobicContact CG2-CE2 4.47Å; I2037-F2048 WeakPolarHBondContact O-CE2 3.31Å; I2037-F2048 WeakPolarHBondContact O-CZ 3.31Å; I2037-L2141 HydrophobicContact CG2-CD1 3.91Å
2038	T	77.7	Confident	74.4	Confident	8 Å²	8	33.8 Å²	33.8	5%	0.049	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	2.8	174.9	59.3	0	0	0	0	114.1	H1697 F2034 M2036 K2040 Y2064 L2141	H1697-T2038 PolarHBondContact CE1-O 3.18Å; H1697-T2038 VanDerWaalsContact CE1-O 3.29Å; H1697-T2038 PolarHBondContact NE2-OG1 2.85Å; F2034-T2038 WeakPolarHBondContact O-CB 3.45Å; F2034-T2038 WeakPolarHBondContact O-CG2 3.12Å; F2034-T2038 PolarHBondContact O-N 2.79Å; F2034-T2038 PolarHBondContact O-OG1 2.89Å; M2036-T2038 PolarHBondContact O-N 3.18Å; T2038-K2040 VanDerWaalsContact C-N 3.26Å; T2038-K2040 PolarHBondContact O-N 2.85Å; T2038-Y2064 HydrophobicContact CG2-CD1 4.28Å; T2038-Y2064 HydrophobicContact CG2-CD2 4.15Å; T2038-Y2064 HydrophobicContact CG2-CE1 4.41Å; T2038-Y2064 HydrophobicContact CG2-CE2 4.31Å; T2038-Y2064 HydrophobicContact CG2-CG 4.15Å; T2038-L2141 HydrophobicContact CG2-CD1 3.78Å
2039	R	75	Confident	74.6	Confident	84 Å²	84	37 Å²	37	32%	0.317	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	23.7	-178.1	-61.3	-173.5	166.5	158.8	-1.5	116	M2036 I2037 F2048	M2036-R2039 WeakPolarHBondContact O-CA 3.46Å; M2036-R2039 PolarHBondContact O-N 3.37Å; I2037-R2039 PolarHBondContact O-N 3.19Å; I2037-R2039 VanDerWaalsContact O-N 3.13Å; R2039-F2048 HydrophobicContact CG-CZ 3.73Å
2040	K	73.9	Confident	74.1	Confident	66 Å²	66	38.9 Å²	38.9	29%	0.287	22%	0.218	S	C	.	.	S	Bend	trans	-73	-34	169	-175.6	163.6	170.8	172.4	0	112.4	D1694 K2035 T2038	D1694-K2040 IonicContact OD1-NZ 3.3Å; D1694-K2040 PolarHBondContact OD1-NZ 2.83Å; D1694-K2040 IonicContact OD2-NZ 3.78Å; D1694-K2040 PolarHBondContact OD2-NZ 3.47Å; K2035-K2040 HydrophobicContact CB-CB 4.27Å; K2035-K2040 HydrophobicContact CG-CB 4.46Å; K2035-K2040 HydrophobicContact CG-CD 4.36Å; K2035-K2040 WeakPolarHBondContact O-CA 3.45Å; K2035-K2040 WeakPolarHBondContact O-CB 3.23Å; K2035-K2040 PolarHBondContact O-N 2.96Å; T2038-K2040 VanDerWaalsContact C-N 3.26Å; T2038-K2040 PolarHBondContact O-N 2.85Å
2041	I	72.3	Confident	73.5	Confident	51 Å²	51	41.4 Å²	41.4	26%	0.262	23%	0.233	S	C	.	.	S	Bend	trans	-122.2	131.5	175.8	-64.9	176.4	0	0	0	108.1	K1971 T2032 K2035 M2036	K1971-I2041 HydrophobicContact CD-CG2 4.12Å; T2032-I2041 HydrophobicContact CG2-CD1 4.48Å; K2035-I2041 HydrophobicContact CB-CB 4.33Å; K2035-I2041 HydrophobicContact CB-CD1 3.79Å; K2035-I2041 HydrophobicContact CB-CG1 3.99Å; K2035-I2041 HydrophobicContact CD-CD1 4Å; K2035-I2041 HydrophobicContact CG-CD1 4.47Å; K2035-I2041 PolarHBondContact O-N 3.3Å; M2036-I2041 WeakPolarHBondContact CA-O 3.32Å; M2036-I2041 HydrophobicContact CG-CB 4.27Å; M2036-I2041 HydrophobicContact CG-CG2 4.19Å
2042	S	69	Low	72.6	Confident	57 Å²	57	42.4 Å²	42.4	40%	0.399	24%	0.241	S	C	.	.			trans	-75.5	136.7	174.1	47.9	0	0	0	0	111.7	K1971	K1971-S2042 WeakPolarHBondContact CD-O 3.24Å; K1971-S2042 PolarHBondContact NZ-O 2.84Å
2043	A	71	Confident	71.4	Confident	25 Å²	25	47.7 Å²	47.7	21%	0.207	27%	0.268	C	S	.	.			trans	-66.8	148.1	173	0	0	0	0	0	111.7	K1928 L1969 M2036	K1928-A2043 PolarHBondContact NZ-O 3.47Å; L1969-A2043 HydrophobicContact CD1-CB 4.12Å; M2036-A2043 HydrophobicContact SD-CB 4.03Å
2044	S	73	Confident	70	Confident	44 Å²	44	50.1 Å²	50.1	31%	0.308	29%	0.293	S	S	.	.	S	Bend	trans	-76.7	-45.6	172.9	-66.1	0	0	0	0	110.6	K1928 R1970 A1972	K1928-S2044 PolarHBondContact NZ-O 3.3Å; R1970-S2044 WeakPolarHBondContact O-CA 3.37Å; R1970-S2044 WeakPolarHBondContact O-CB 3.43Å; R1970-S2044 PolarHBondContact O-N 3.23Å; A1972-S2044 PolarHBondContact N-OG 2.89Å
2045	S	69.4	Low	68.2	Low	59 Å²	59	57.1 Å²	57.1	41%	0.413	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	171.1	167.6	61	0	0	0	0	110	R1970	R1970-S2045 WeakPolarHBondContact CB-OG 3.28Å; R1970-S2045 PolarHBondContact N-O 3.49Å; R1970-S2045 PolarHBondContact O-N 3.36Å
2046	G	73	Confident	66.7	Low	39 Å²	39	58 Å²	58	40%	0.402	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	88.2	170.1	-173.6	0	0	0	0	0	113.8	I1967 N1968	I1967-G2046 CarbonylContact O-C 3.45Å; I1967-G2046 WeakPolarHBondContact O-CA 3.33Å; N1968-G2046 WeakPolarHBondContact O-CA 3.39Å; N1968-G2046 PolarHBondContact O-N 3.2Å
2047	S	74	Confident	64.9	Low	52 Å²	52	63 Å²	63	36%	0.364	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	159.8	-175.6	55.2	0	0	0	0	111.2	I1967	I1967-S2047 PolarHBondContact N-O 3.38Å; I1967-S2047 PolarHBondContact O-N 3.22Å
2048	F	76	Confident	63.4	Low	36 Å²	36	70.4 Å²	70.4	16%	0.158	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	151.1	173.2	64.3	-87.8	0	0	0	110.6	L1964 K1965 V1966 L1969 M2036 I2037 R2039	L1964-F2048 HydrophobicContact CD1-CD2 4.49Å; K1965-F2048 CarbonylContact O-C 3.54Å; K1965-F2048 WeakPolarHBondContact O-CA 3.4Å; V1966-F2048 HydrophobicContact CG2-CB 4.15Å; L1969-F2048 HydrophobicContact CD1-CD1 4.23Å; M2036-F2048 WeakPolarHBondContact O-CE1 3.46Å; M2036-F2048 WeakPolarHBondContact O-CZ 3.08Å; I2037-F2048 HydrophobicContact CG2-CE2 4.47Å; I2037-F2048 WeakPolarHBondContact O-CE2 3.31Å; I2037-F2048 WeakPolarHBondContact O-CZ 3.31Å; R2039-F2048 HydrophobicContact CG-CZ 3.73Å
2049	F	71.8	Confident	62.1	Low	70 Å²	70	73.8 Å²	73.8	31%	0.307	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.9	-175.3	-54.5	-87.6	0	0	0	110	K1965 I1967	K1965-F2049 PolarHBondContact N-O 3.43Å; K1965-F2049 PolarHBondContact O-N 2.77Å; I1967-F2049 HydrophobicContact CD1-CD2 4.48Å; I1967-F2049 HydrophobicContact CD1-CE2 4.1Å
2050	E	60.9	Low	61.2	Low	45 Å²	45	71.6 Å²	71.6	21%	0.21	42%	0.421	C	S	.	.	S	Bend	trans	-108	110.5	172.2	-171.3	-176.5	175.3	0	0	105.1	S2060	E2050-S2060 VanDerWaalsContact CD-OG 3.27Å; E2050-S2060 WeakPolarHBondContact OE1-CB 3.45Å; E2050-S2060 PolarHBondContact OE1-OG 3.3Å
2051	N	62.7	Low	60.8	Low	86 Å²	86	70.6 Å²	70.6	46%	0.46	42%	0.421	S	S	.	.	S	Bend	trans	61.2	153.1	-159.5	-61.5	-24.1	0	0	0	115.7	S1962 D2053	S1962-N2051 WeakPolarHBondContact O-CA 3.29Å; N2051-D2053 PolarHBondContact O-N 2.86Å
2052	S	54.8	Low	61.1	Low	47 Å²	47	68.3 Å²	68.3	33%	0.329	41%	0.41	S	S	.	.	S	Bend	trans	-83.1	-2.8	-162.1	22.1	0	0	0	0	116.6	K1960 G2054	K1960-S2052 PolarHBondContact O-OG 2.75Å; S2052-G2054 PolarHBondContact O-N 3.46Å
2053	D	52.7	Low	61.6	Low	144 Å²	144	65.6 Å²	65.6	77%	0.77	39%	0.391	S	S	*	.	S	Bend	trans	-73	3.4	-171.2	-76.1	-10.1	0	0	0	115.5	N2051 K2055	N2051-D2053 PolarHBondContact O-N 2.86Å; D2053-K2055 PolarHBondContact O-N 2.87Å
2054	G	48.7	Very low	62.2	Low	51 Å²	51	64.8 Å²	64.8	53%	0.526	38%	0.382	S	S	.	.			trans	66.1	-13.5	174.6	0	0	0	0	0	116.1	S2052	S2052-G2054 PolarHBondContact O-N 3.46Å
2055	K	44.1	Very low	62.7	Low	173 Å²	173	62.7 Å²	62.7	75%	0.752	37%	0.368	S	S	*	.			trans	-83	114.1	175.9	-72.9	177.3	-179.3	171.7	0	109.7	D2053 V2057	D2053-K2055 PolarHBondContact O-N 2.87Å; K2055-V2057 HydrophobicContact CB-CB 4.48Å; K2055-V2057 HydrophobicContact CB-CG2 3.96Å; K2055-V2057 PolarHBondContact O-N 3.3Å
2056	A	44.6	Very low	63.1	Low	77 Å²	77	60.4 Å²	60.4	64%	0.636	35%	0.351	S	S	*	.			trans	-73.4	44.7	177.1	0	0	0	0	0	113.6
2057	V	40.1	Very low	63	Low	106 Å²	106	61.3 Å²	61.3	64%	0.642	35%	0.345	S	S	*	.			trans	-101.2	112.1	-168.6	176	0	0	0	0	109.6	K2055	K2055-V2057 HydrophobicContact CB-CB 4.48Å; K2055-V2057 HydrophobicContact CB-CG2 3.96Å; K2055-V2057 PolarHBondContact O-N 3.3Å
2058	H	46.3	Very low	62.7	Low	158 Å²	158	66.6 Å²	66.6	73%	0.731	36%	0.362	S	S	*	.			trans	48.1	100.2	172.3	-75.3	-80	0	0	0	116.9	S2060	H2058-S2060 PolarHBondContact O-N 2.78Å
2059	L	50.1	Low	62.4	Low	80 Å²	80	67.1 Å²	67.1	42%	0.419	37%	0.366	S	S	.	.			trans	-48.1	128	168	-86.5	85.6	0	0	0	110.9	I2062	L2059-I2062 HydrophobicContact CD2-CD1 3.74Å; L2059-I2062 HydrophobicContact CD2-CG1 4.44Å
2060	S	56.2	Low	62.7	Low	37 Å²	37	63.9 Å²	63.9	26%	0.259	35%	0.352	S	S	.	.			trans	-54.8	151.8	153.9	12	0	0	0	0	110	E2050 H2058 I2062	E2050-S2060 VanDerWaalsContact CD-OG 3.27Å; E2050-S2060 WeakPolarHBondContact OE1-CB 3.45Å; E2050-S2060 PolarHBondContact OE1-OG 3.3Å; H2058-S2060 PolarHBondContact O-N 2.78Å; S2060-I2062 PolarHBondContact O-N 2.84Å
2061	P	67	Low	63.7	Low	45 Å²	45	62.6 Å²	62.6	29%	0.292	35%	0.347	S	S	.	.			trans	-65.3	105.8	174.6	26.3	-32.8	0	0	0	110.1	S2137	P2061-S2137 WeakPolarHBondContact O-CB 3.3Å; P2061-S2137 PolarHBondContact O-OG 3.05Å
2062	I	77.5	Confident	64.7	Low	4 Å²	4	59.2 Å²	59.2	2%	0.021	33%	0.329	C	S	.	.			trans	-75.4	134.8	176.2	-63.4	175.3	0	0	0	108.8	V1701 L2059 S2060 Y2064 L2139 L2141	V1701-I2062 HydrophobicContact CG1-CB 3.86Å; V1701-I2062 HydrophobicContact CG1-CG2 4.14Å; V1701-I2062 PolarHBondContact O-N 2.61Å; L2059-I2062 HydrophobicContact CD2-CD1 3.74Å; L2059-I2062 HydrophobicContact CD2-CG1 4.44Å; S2060-I2062 PolarHBondContact O-N 2.84Å; I2062-Y2064 PolarHBondContact O-N 3.39Å; I2062-L2139 HydrophobicContact CD1-CD2 4.24Å; I2062-L2139 HydrophobicContact CG2-CG 4.5Å; I2062-L2141 HydrophobicContact CG2-CD1 4.12Å; I2062-L2141 HydrophobicContact CG2-CG 4.25Å
2063	G	80.1	Confident	65.8	Low	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	115.7	168.3	0	0	0	0	0	110	A2132 S2137 L2139 I2140 L2141	G2063-A2132 WeakPolarHBondContact CA-O 3.47Å; G2063-S2137 PolarHBondContact N-OG 3.45Å; G2063-L2139 PolarHBondContact N-O 3.08Å; G2063-I2140 CarbonylContact O-C 3.52Å; G2063-I2140 VanDerWaalsContact O-CA 3.31Å; G2063-I2140 WeakPolarHBondContact O-CA 3.19Å; G2063-L2141 PolarHBondContact O-N 3.4Å
2064	Y	84	Confident	67.2	Low	8 Å²	8	54.1 Å²	54.1	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	124.4	179.5	-180	-131.6	0	0	0	112.6	L1698 V1701 T2038 I2062 P2066 L2141 D2143	L1698-Y2064 VanDerWaalsContact CD1-O 3.31Å; L1698-Y2064 WeakPolarHBondContact CD1-O 3.15Å; V1701-Y2064 HydrophobicContact CG1-CG 4.45Å; T2038-Y2064 HydrophobicContact CG2-CD1 4.28Å; T2038-Y2064 HydrophobicContact CG2-CD2 4.15Å; T2038-Y2064 HydrophobicContact CG2-CE1 4.41Å; T2038-Y2064 HydrophobicContact CG2-CE2 4.31Å; T2038-Y2064 HydrophobicContact CG2-CG 4.15Å; I2062-Y2064 PolarHBondContact O-N 3.39Å; Y2064-P2066 HydrophobicContact CD1-CB 4.43Å; Y2064-P2066 HydrophobicContact CE1-CB 3.68Å; Y2064-P2066 HydrophobicContact CE1-CG 4.37Å; Y2064-L2141 WeakPolarHBondContact CA-O 3.47Å; Y2064-L2141 HydrophobicContact CD2-CB 3.9Å; Y2064-D2143 HydrophobicContact CE2-CB 4.24Å; Y2064-D2143 PolarHBondContact OH-OD2 3.3Å
2065	C	82.9	Confident	69	Low	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	104.4	167	-167.8	0	0	0	0	108.8	S2128 T2129 A2132 L2141 L2142 D2143	C2065-S2128 VanDerWaalsContact SG-CB 3.59Å; C2065-T2129 PolarHBondContact SG-OG1 2.03Å; C2065-A2132 HydrophobicContact CB-CB 4.16Å; C2065-L2141 PolarHBondContact N-O 3.37Å; C2065-L2142 HydrophobicContact CB-CD2 3.47Å; C2065-L2142 VanDerWaalsContact CB-CD2 3.47Å; C2065-D2143 WeakPolarHBondContact O-CB 3.06Å; C2065-D2143 PolarHBondContact O-N 2.8Å
2066	P	77.2	Confident	71.1	Confident	10 Å²	10	43.7 Å²	43.7	7%	0.065	24%	0.239	C	C	.	.			trans	-71.1	158	179.3	26.7	-33.3	0	0	0	112.9	Y2064 F2068 A2070 R2125	Y2064-P2066 HydrophobicContact CD1-CB 4.43Å; Y2064-P2066 HydrophobicContact CE1-CB 3.68Å; Y2064-P2066 HydrophobicContact CE1-CG 4.37Å; P2066-F2068 VanDerWaalsContact C-N 3.26Å; P2066-F2068 VanDerWaalsContact CG-O 3.32Å; P2066-F2068 WeakPolarHBondContact CG-O 3.28Å; P2066-F2068 PolarHBondContact O-N 2.66Å; P2066-A2070 HydrophobicContact CG-CB 3.9Å; P2066-R2125 VanDerWaalsContact O-CZ 3.25Å; P2066-R2125 PolarHBondContact O-NH1 2.94Å; P2066-R2125 PolarHBondContact O-NH2 2.79Å
2067	Q	72.1	Confident	73.1	Confident	58 Å²	58	40 Å²	40	27%	0.271	21%	0.209	S	C	.	.	S	Bend	trans	-55.2	-35.8	177.9	-168.1	178.3	31.8	0	0	114.3	D2143 E2144	Q2067-D2143 WeakPolarHBondContact CA-O 3.5Å; Q2067-D2143 PolarHBondContact N-OD2 3.28Å; Q2067-E2144 PolarHBondContact NE2-OE2 2.92Å
2068	F	67.5	Low	75.5	Confident	164 Å²	164	38 Å²	38	72%	0.719	19%	0.19	S	C	*	.	S	Bend	trans	-111.4	137.4	173.1	-64	-80.7	0	0	0	109.9	P2066 A2070	P2066-F2068 VanDerWaalsContact C-N 3.26Å; P2066-F2068 VanDerWaalsContact CG-O 3.32Å; P2066-F2068 WeakPolarHBondContact CG-O 3.28Å; P2066-F2068 PolarHBondContact O-N 2.66Å; F2068-A2070 PolarHBondContact O-N 2.03Å
2069	D	69.6	Low	77.6	Confident	47 Å²	47	32.1 Å²	32.1	25%	0.251	16%	0.163	S	C	.	.			trans	-66.6	101.8	-172.7	-59.4	-40.9	0	0	0	112.6	L2071 K2124 R2125 S2128	D2069-L2071 HydrophobicContact CB-CD1 4Å; D2069-L2071 HydrophobicContact CB-CG 4.19Å; D2069-L2071 PolarHBondContact O-N 3.05Å; D2069-K2124 HydrophobicContact CB-CB 4.11Å; D2069-K2124 WeakPolarHBondContact OD2-CB 3.43Å; D2069-R2125 IonicContact OD1-CZ 2.65Å; D2069-R2125 IonicContact OD1-NH1 3.13Å; D2069-R2125 PolarHBondContact OD1-NH1 3.4Å; D2069-R2125 PolarHBondContact OD2-N 2.87Å; D2069-S2128 PolarHBondContact OD1-OG 2.95Å
2070	A	77.8	Confident	79.5	Confident	2 Å²	2	28.5 Å²	28.5	2%	0.017	14%	0.144	C	C	.	.			trans	-77.7	54.8	-178.4	0	0	0	0	0	113.4	S1693 D1694 L1698 P2066 F2068	S1693-A2070 WeakPolarHBondContact O-CA 3.17Å; S1693-A2070 VanDerWaalsContact O-CB 3.24Å; S1693-A2070 WeakPolarHBondContact O-CB 3.18Å; D1694-A2070 HydrophobicContact CB-CB 4.03Å; L1698-A2070 HydrophobicContact CB-CB 4.46Å; L1698-A2070 HydrophobicContact CD2-CB 4.15Å; P2066-A2070 HydrophobicContact CG-CB 3.9Å; F2068-A2070 PolarHBondContact O-N 2.03Å
2071	L	82.8	Confident	81	Confident	18 Å²	18	26.7 Å²	26.7	9%	0.094	13%	0.132	C	C	.	.			trans	-109.5	139.4	-171.6	-59.4	172.5	0	0	0	112.1	D2069 S2073 T2080 V2116 K2124 L2127 I2131	D2069-L2071 HydrophobicContact CB-CD1 4Å; D2069-L2071 HydrophobicContact CB-CG 4.19Å; D2069-L2071 PolarHBondContact O-N 3.05Å; L2071-S2073 PolarHBondContact O-N 2.99Å; L2071-T2080 HydrophobicContact CD2-CG2 4.39Å; L2071-V2116 HydrophobicContact CB-CG1 4.02Å; L2071-V2116 HydrophobicContact CD1-CG1 3.98Å; L2071-K2124 HydrophobicContact CD1-CB 3.97Å; L2071-K2124 HydrophobicContact CD1-CG 4.32Å; L2071-L2127 HydrophobicContact CD1-CB 4.27Å; L2071-L2127 HydrophobicContact CD1-CD2 4.17Å; L2071-L2127 HydrophobicContact CD1-CG 4.36Å; L2071-L2127 HydrophobicContact CD2-CD2 4.39Å; L2071-L2127 HydrophobicContact CD2-CG 4.29Å; L2071-I2131 HydrophobicContact CD2-CD1 3.43Å; L2071-I2131 VanDerWaalsContact CD2-CD1 3.43Å
2072	D	81.9	Confident	82.1	Confident	15 Å²	15	27.1 Å²	27.1	8%	0.08	13%	0.131	C	C	.	.			trans	-72.9	114.5	170.5	-167.2	-39.2	0	0	0	110	N1278 R2074 L2075	N1278-D2072 PolarHBondContact ND2-OD2 3.28Å; N1278-D2072 PolarHBondContact OD1-OD2 3.27Å; D2072-R2074 PolarHBondContact O-N 3.4Å; D2072-R2074 VanDerWaalsContact O-N 3.11Å; D2072-R2074 WeakPolarHBondContact OD1-CB 3.38Å; D2072-R2074 IonicContact OD1-CZ 3.55Å; D2072-R2074 PolarHBondContact OD1-N 3.37Å; D2072-R2074 IonicContact OD1-NE 3.66Å; D2072-R2074 PolarHBondContact OD1-NE 3.11Å; D2072-R2074 IonicContact OD1-NH2 3.8Å; D2072-R2074 PolarHBondContact OD1-NH2 3.25Å; D2072-R2074 IonicContact OD2-CZ 3.3Å; D2072-R2074 IonicContact OD2-NE 3.45Å; D2072-R2074 IonicContact OD2-NH2 2.77Å; D2072-R2074 PolarHBondContact OD2-NH2 2.87Å; D2072-L2075 HydrophobicContact CB-CD1 3.98Å; D2072-L2075 HydrophobicContact CB-CG 4.13Å; D2072-L2075 PolarHBondContact O-N 2.98Å
2073	S	78.1	Confident	82.6	Confident	49 Å²	49	27.4 Å²	27.4	34%	0.343	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-18.2	-174.8	74	0	0	0	0	114.6	L2071 K2117	L2071-S2073 PolarHBondContact O-N 2.99Å; S2073-K2117 WeakPolarHBondContact O-CB 3.03Å; S2073-K2117 PolarHBondContact O-N 3.5Å
2074	R	82.6	Confident	83	Confident	34 Å²	34	27.7 Å²	27.7	13%	0.128	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-25.7	-177.7	-64.2	167.7	-70.2	-137.2	-4.3	113.8	N1278 R1281 E1689 D2072	N1278-R2074 PolarHBondContact ND2-NH2 2.94Å; N1278-R2074 VanDerWaalsContact ND2-NH2 3.19Å; R1281-R2074 WeakPolarHBondContact CD-O 3.5Å; R1281-R2074 PolarHBondContact NH1-O 2.97Å; E1689-R2074 VanDerWaalsContact CD-NH2 3.33Å; E1689-R2074 IonicContact OE1-CZ 3.33Å; E1689-R2074 IonicContact OE1-NH1 2.89Å; E1689-R2074 PolarHBondContact OE1-NH1 3.23Å; E1689-R2074 IonicContact OE1-NH2 2.78Å; E1689-R2074 IonicContact OE2-CZ 2.97Å; E1689-R2074 IonicContact OE2-NH1 3.82Å; E1689-R2074 PolarHBondContact OE2-NH1 3.06Å; E1689-R2074 IonicContact OE2-NH2 2.71Å; E1689-R2074 PolarHBondContact OE2-NH2 3.3Å; D2072-R2074 PolarHBondContact O-N 3.4Å; D2072-R2074 VanDerWaalsContact O-N 3.11Å; D2072-R2074 WeakPolarHBondContact OD1-CB 3.38Å; D2072-R2074 IonicContact OD1-CZ 3.55Å; D2072-R2074 PolarHBondContact OD1-N 3.37Å; D2072-R2074 IonicContact OD1-NE 3.66Å; D2072-R2074 PolarHBondContact OD1-NE 3.11Å; D2072-R2074 IonicContact OD1-NH2 3.8Å; D2072-R2074 PolarHBondContact OD1-NH2 3.25Å; D2072-R2074 IonicContact OD2-CZ 3.3Å; D2072-R2074 IonicContact OD2-NE 3.45Å; D2072-R2074 IonicContact OD2-NH2 2.77Å; D2072-R2074 PolarHBondContact OD2-NH2 2.87Å
2075	L	85.9	Confident	83.1	Confident	4 Å²	4	27.3 Å²	27.3	2%	0.021	13%	0.132	C	C	.	.	S	Bend	trans	-77.9	163.6	-178.5	-60.7	178.1	0	0	0	111.1	K1274 L1277 D2072 E2079 L2083 Q2115 V2116	K1274-L2075 HydrophobicContact CG-CD1 4.22Å; L1277-L2075 HydrophobicContact CB-CD2 3.89Å; L1277-L2075 HydrophobicContact CD1-CD2 4.27Å; D2072-L2075 HydrophobicContact CB-CD1 3.98Å; D2072-L2075 HydrophobicContact CB-CG 4.13Å; D2072-L2075 PolarHBondContact O-N 2.98Å; L2075-E2079 WeakPolarHBondContact CA-OE2 3.34Å; L2075-E2079 HydrophobicContact CB-CB 4.37Å; L2075-E2079 HydrophobicContact CD2-CB 4.47Å; L2075-L2083 HydrophobicContact CD1-CD2 4.37Å; L2075-Q2115 WeakPolarHBondContact O-CA 3.11Å; L2075-V2116 WeakPolarHBondContact O-CG2 3.45Å; L2075-V2116 PolarHBondContact O-N 3.46Å
2076	T	88.3	Confident	83.1	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.006	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-92	169.1	165.8	78.5	0	0	0	0	110.9	R2078 E2079 T2080 A2112 D2113 K2114	T2076-R2078 VanDerWaalsContact C-N 3.31Å; T2076-R2078 PolarHBondContact O-N 2.81Å; T2076-R2078 PolarHBondContact OG1-N 2.81Å; T2076-E2079 PolarHBondContact N-OE2 3.44Å; T2076-E2079 PolarHBondContact O-N 2.99Å; T2076-E2079 PolarHBondContact OG1-N 3.43Å; T2076-T2080 WeakPolarHBondContact O-CB 3.11Å; T2076-T2080 PolarHBondContact O-N 3.28Å; T2076-T2080 PolarHBondContact O-OG1 3.04Å; T2076-A2112 WeakPolarHBondContact CB-O 3.35Å; T2076-A2112 PolarHBondContact OG1-O 3.33Å; T2076-D2113 WeakPolarHBondContact CG2-O 3.38Å; T2076-K2114 WeakPolarHBondContact CA-O 3.44Å; T2076-K2114 WeakPolarHBondContact CB-O 3.29Å
2077	A	86.6	Confident	83.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.5	-44.4	171.1	0	0	0	0	0	111.9	E2079 T2080 L2081 L2103 F2108 A2112 Y2119 L2127	A2077-E2079 PolarHBondContact O-N 2.96Å; A2077-T2080 PolarHBondContact O-N 3.32Å; A2077-L2081 WeakPolarHBondContact O-CG 3.06Å; A2077-L2081 PolarHBondContact O-N 3.06Å; A2077-L2103 HydrophobicContact CB-CD2 4.1Å; A2077-F2108 HydrophobicContact CB-CG 4.42Å; A2077-A2112 PolarHBondContact N-O 3.22Å; A2077-Y2119 HydrophobicContact CB-CE2 4.12Å; A2077-Y2119 VanDerWaalsContact CB-OH 3.29Å; A2077-Y2119 WeakPolarHBondContact CB-OH 3.49Å; A2077-L2127 HydrophobicContact CB-CD1 4.03Å; A2077-L2127 HydrophobicContact CB-CD2 4.08Å
2078	R	90.3	Very high	83.8	Confident	65 Å²	65	24.9 Å²	24.9	25%	0.245	12%	0.119	C	C	.	.	H	α-helix	trans	-57.3	-47	176.9	178.4	-179.1	-64.5	-70.8	-0.2	112.5	T2076 L2082 V2099 E2100 L2103 A2112 D2113	T2076-R2078 VanDerWaalsContact C-N 3.31Å; T2076-R2078 PolarHBondContact O-N 2.81Å; T2076-R2078 PolarHBondContact OG1-N 2.81Å; R2078-L2082 HydrophobicContact CG-CD1 4.2Å; R2078-L2082 WeakPolarHBondContact O-CB 3.4Å; R2078-L2082 WeakPolarHBondContact O-CG 3.47Å; R2078-L2082 PolarHBondContact O-N 2.83Å; R2078-V2099 HydrophobicContact CG-CG1 4.46Å; R2078-E2100 IonicContact CZ-OE2 2.68Å; R2078-E2100 VanDerWaalsContact CZ-OE2 3.22Å; R2078-E2100 IonicContact NH1-OE2 3.59Å; R2078-E2100 PolarHBondContact NH1-OE2 2.99Å; R2078-E2100 IonicContact NH2-OE1 3.06Å; R2078-E2100 IonicContact NH2-OE2 3.11Å; R2078-E2100 PolarHBondContact NH2-OE2 3.47Å; R2078-L2103 HydrophobicContact CB-CD1 3.93Å; R2078-L2103 HydrophobicContact CG-CD1 4.09Å; R2078-A2112 WeakPolarHBondContact CB-O 3.37Å; R2078-A2112 PolarHBondContact N-O 3.41Å; R2078-A2112 VanDerWaalsContact N-O 3.16Å; R2078-D2113 VanDerWaalsContact CD-OD1 3.28Å; R2078-D2113 WeakPolarHBondContact CD-OD1 3.27Å; R2078-D2113 IonicContact NE-OD1 3.52Å; R2078-D2113 PolarHBondContact NE-OD1 3.22Å; R2078-D2113 IonicContact NE-OD2 3.66Å
2079	E	90.3	Very high	84.2	Confident	33 Å²	33	17.5 Å²	17.5	15%	0.154	9%	0.088	C	C	.	.	H	α-helix	trans	-69.1	-37.4	179.5	-69.3	166.8	160.7	0	0	112.4	L1277 R1281 L2075 T2076 A2077 L2082 L2083	L1277-E2079 HydrophobicContact CD1-CB 4.28Å; L1277-E2079 HydrophobicContact CD1-CG 4.08Å; R1281-E2079 IonicContact CZ-OE1 3.73Å; R1281-E2079 VanDerWaalsContact CZ-OE1 3.26Å; R1281-E2079 IonicContact CZ-OE2 2.83Å; R1281-E2079 IonicContact NE-OE1 2.7Å; R1281-E2079 IonicContact NE-OE2 3.49Å; R1281-E2079 IonicContact NH1-OE1 3.14Å; R1281-E2079 IonicContact NH1-OE2 3.54Å; R1281-E2079 PolarHBondContact NH1-OE2 2.8Å; R1281-E2079 IonicContact NH2-OE1 2.68Å; R1281-E2079 PolarHBondContact NH2-OE1 3.25Å; R1281-E2079 IonicContact NH2-OE2 3.9Å; R1281-E2079 PolarHBondContact NH2-OE2 2.69Å; R1281-E2079 VanDerWaalsContact NH2-OE2 3.09Å; L2075-E2079 WeakPolarHBondContact CA-OE2 3.34Å; L2075-E2079 HydrophobicContact CB-CB 4.37Å; L2075-E2079 HydrophobicContact CD2-CB 4.47Å; T2076-E2079 PolarHBondContact N-OE2 3.44Å; T2076-E2079 PolarHBondContact O-N 2.99Å; T2076-E2079 PolarHBondContact OG1-N 3.43Å; A2077-E2079 PolarHBondContact O-N 2.96Å; E2079-L2082 PolarHBondContact O-N 2.85Å; E2079-L2083 WeakPolarHBondContact O-CB 2.93Å; E2079-L2083 PolarHBondContact O-N 2.73Å
2080	T	90.5	Very high	84.6	Confident	4 Å²	4	16 Å²	16	3%	0.025	8%	0.079	C	C	.	.	H	α-helix	trans	-64.8	-44.9	178.2	-53.9	0	0	0	0	110.6	L2071 T2076 A2077 L2083 Y2084 L2127 I2131	L2071-T2080 HydrophobicContact CD2-CG2 4.39Å; T2076-T2080 WeakPolarHBondContact O-CB 3.11Å; T2076-T2080 PolarHBondContact O-N 3.28Å; T2076-T2080 PolarHBondContact O-OG1 3.04Å; A2077-T2080 PolarHBondContact O-N 3.32Å; T2080-L2083 WeakPolarHBondContact O-CB 3.33Å; T2080-L2083 PolarHBondContact O-N 3.23Å; T2080-Y2084 HydrophobicContact CG2-CD2 3.96Å; T2080-Y2084 HydrophobicContact CG2-CE2 3.88Å; T2080-Y2084 VanDerWaalsContact O-CD2 3.29Å; T2080-Y2084 WeakPolarHBondContact O-CD2 3.48Å; T2080-Y2084 PolarHBondContact O-N 3.05Å; T2080-L2127 HydrophobicContact CG2-CD2 4.49Å; T2080-I2131 HydrophobicContact CG2-CD1 3.65Å; T2080-I2131 HydrophobicContact CG2-CG1 4.4Å
2081	L	89.1	Confident	84.5	Confident	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66.4	-38.4	175.1	-64.8	169.6	0	0	0	112	A2077 L2083 Y2084 T2085 V2099 L2103 L2127 A2130 I2131 L2134	A2077-L2081 WeakPolarHBondContact O-CG 3.06Å; A2077-L2081 PolarHBondContact O-N 3.06Å; L2081-L2083 VanDerWaalsContact C-N 3.29Å; L2081-L2083 PolarHBondContact O-N 2.99Å; L2081-Y2084 PolarHBondContact O-N 3.48Å; L2081-T2085 WeakPolarHBondContact O-CG2 3.4Å; L2081-T2085 PolarHBondContact O-N 2.8Å; L2081-T2085 PolarHBondContact O-OG1 2.83Å; L2081-V2099 HydrophobicContact CB-CB 4.45Å; L2081-V2099 HydrophobicContact CB-CG1 3.87Å; L2081-V2099 HydrophobicContact CB-CG2 3.9Å; L2081-V2099 HydrophobicContact CD1-CG1 4.39Å; L2081-L2103 HydrophobicContact CD1-CD2 3.77Å; L2081-L2103 HydrophobicContact CD1-CG 3.96Å; L2081-L2127 HydrophobicContact CD1-CD1 4.5Å; L2081-L2127 HydrophobicContact CD2-CD1 4.21Å; L2081-L2127 HydrophobicContact CG-CD1 4.13Å; L2081-A2130 HydrophobicContact CD2-CB 4.24Å; L2081-I2131 HydrophobicContact CD2-CG1 4.41Å; L2081-L2134 HydrophobicContact CD2-CD1 4.17Å
2082	L	88.8	Confident	84	Confident	53 Å²	53	23.3 Å²	23.3	28%	0.277	11%	0.112	S	C	.	.	H	α-helix	trans	-63.2	-31.5	172.4	-80.9	168.4	0	0	0	113.5	R2078 E2079 T2085 R2095 V2099	R2078-L2082 HydrophobicContact CG-CD1 4.2Å; R2078-L2082 WeakPolarHBondContact O-CB 3.4Å; R2078-L2082 WeakPolarHBondContact O-CG 3.47Å; R2078-L2082 PolarHBondContact O-N 2.83Å; E2079-L2082 PolarHBondContact O-N 2.85Å; L2082-T2085 WeakPolarHBondContact CA-OG1 3.07Å; L2082-T2085 PolarHBondContact O-OG1 3.38Å; L2082-T2085 VanDerWaalsContact O-OG1 3.14Å; L2082-R2095 HydrophobicContact CD2-CB 4.34Å; L2082-V2099 HydrophobicContact CD2-CG2 4.01Å; L2082-V2099 HydrophobicContact CG-CG1 4.29Å; L2082-V2099 HydrophobicContact CG-CG2 4.07Å
2083	L	88.5	Confident	83.7	Confident	11 Å²	11	31.9 Å²	31.9	6%	0.058	15%	0.149	C	C	.	.	H	α-helix	trans	-67.9	-55.4	172.8	172.9	61.9	0	0	0	110.6	A1270 K1274 L2075 E2079 T2080 L2081 T2085 G2086 I2087	A1270-L2083 HydrophobicContact CB-CD1 4.24Å; A1270-L2083 WeakPolarHBondContact O-CD1 3.44Å; K1274-L2083 HydrophobicContact CB-CD1 4.07Å; K1274-L2083 HydrophobicContact CB-CD2 4.16Å; K1274-L2083 HydrophobicContact CD-CD2 3.9Å; K1274-L2083 HydrophobicContact CG-CD2 3.95Å; L2075-L2083 HydrophobicContact CD1-CD2 4.37Å; E2079-L2083 WeakPolarHBondContact O-CB 2.93Å; E2079-L2083 PolarHBondContact O-N 2.73Å; T2080-L2083 WeakPolarHBondContact O-CB 3.33Å; T2080-L2083 PolarHBondContact O-N 3.23Å; L2081-L2083 VanDerWaalsContact C-N 3.29Å; L2081-L2083 PolarHBondContact O-N 2.99Å; L2083-T2085 PolarHBondContact O-N 3.32Å; L2083-G2086 WeakPolarHBondContact O-CA 2.9Å; L2083-G2086 PolarHBondContact O-N 2.93Å; L2083-I2087 HydrophobicContact CD1-CD1 4.02Å; L2083-I2087 HydrophobicContact CD1-CG1 4.27Å; L2083-I2087 HydrophobicContact CG-CD1 4Å; L2083-I2087 WeakPolarHBondContact O-CG1 3.21Å; L2083-I2087 PolarHBondContact O-N 3.32Å
2084	Y	87.7	Confident	83.7	Confident	6 Å²	6	33.2 Å²	33.2	2%	0.024	15%	0.149	C	C	.	.	H	α-helix	trans	-68.9	-30.9	-175	-76.5	-76.4	0	0	0	113.8	L1698 H1699 T2080 L2081 G2086 I2087 R2088 I2131	L1698-Y2084 HydrophobicContact CD2-CE1 4.48Å; L1698-Y2084 WeakPolarHBondContact CD2-OH 3.33Å; L1698-Y2084 HydrophobicContact CG-CE1 4.13Å; H1699-Y2084 AromaticContact CE1-CE1 3.96Å; H1699-Y2084 AromaticContact CE1-CZ 3.58Å; H1699-Y2084 PolarHBondContact CE1-OH 2.73Å; H1699-Y2084 AromaticContact ND1-CE1 3.5Å; H1699-Y2084 AromaticContact ND1-CZ 3.63Å; H1699-Y2084 PolarHBondContact ND1-OH 2.94Å; T2080-Y2084 HydrophobicContact CG2-CD2 3.96Å; T2080-Y2084 HydrophobicContact CG2-CE2 3.88Å; T2080-Y2084 VanDerWaalsContact O-CD2 3.29Å; T2080-Y2084 WeakPolarHBondContact O-CD2 3.48Å; T2080-Y2084 PolarHBondContact O-N 3.05Å; L2081-Y2084 PolarHBondContact O-N 3.48Å; Y2084-G2086 PolarHBondContact O-N 3.3Å; Y2084-I2087 HydrophobicContact CD1-CD1 4.01Å; Y2084-I2087 HydrophobicContact CE1-CD1 4.11Å; Y2084-I2087 PolarHBondContact O-N 3.2Å; Y2084-R2088 WeakPolarHBondContact O-CG 3.39Å; Y2084-R2088 PolarHBondContact O-N 3.23Å; Y2084-I2131 HydrophobicContact CD1-CG2 3.71Å; Y2084-I2131 HydrophobicContact CD2-CB 4.37Å; Y2084-I2131 HydrophobicContact CD2-CD1 3.85Å; Y2084-I2131 HydrophobicContact CD2-CG1 3.75Å; Y2084-I2131 HydrophobicContact CD2-CG2 3.66Å; Y2084-I2131 HydrophobicContact CE1-CG2 3.94Å; Y2084-I2131 HydrophobicContact CE2-CD1 3.73Å; Y2084-I2131 HydrophobicContact CE2-CG1 4.14Å; Y2084-I2131 HydrophobicContact CE2-CG2 3.9Å; Y2084-I2131 HydrophobicContact CG-CG1 4.35Å; Y2084-I2131 HydrophobicContact CG-CG2 3.58Å
2085	T	86	Confident	83.7	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-29.5	169.1	49.1	0	0	0	0	112.3	L2081 L2082 L2083 I2090 I2098 V2099 L2134	L2081-T2085 WeakPolarHBondContact O-CG2 3.4Å; L2081-T2085 PolarHBondContact O-N 2.8Å; L2081-T2085 PolarHBondContact O-OG1 2.83Å; L2082-T2085 WeakPolarHBondContact CA-OG1 3.07Å; L2082-T2085 PolarHBondContact O-OG1 3.38Å; L2082-T2085 VanDerWaalsContact O-OG1 3.14Å; L2083-T2085 PolarHBondContact O-N 3.32Å; T2085-I2090 HydrophobicContact CG2-CD1 3.98Å; T2085-I2090 WeakPolarHBondContact O-CB 3.33Å; T2085-I2090 PolarHBondContact O-N 3.28Å; T2085-I2090 VanDerWaalsContact O-N 3.12Å; T2085-I2098 HydrophobicContact CG2-CG2 4.38Å; T2085-V2099 HydrophobicContact CG2-CG2 3.86Å; T2085-L2134 HydrophobicContact CG2-CD1 4Å; T2085-L2134 HydrophobicContact CG2-CD2 3.77Å; T2085-L2134 HydrophobicContact CG2-CG 4.02Å
2086	G	83.8	Confident	83.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-78.3	-34	172.5	0	0	0	0	0	114.7	S1266 L2083 Y2084 C2089 R2095	S1266-G2086 PolarHBondContact OG-O 2.79Å; L2083-G2086 WeakPolarHBondContact O-CA 2.9Å; L2083-G2086 PolarHBondContact O-N 2.93Å; Y2084-G2086 PolarHBondContact O-N 3.3Å; G2086-C2089 PolarHBondContact O-N 3.45Å; G2086-R2095 VanDerWaalsContact CA-NH1 3.29Å
2087	I	82.6	Confident	83.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.5	-41.3	174.6	-64	178.5	0	0	0	110.8	Q1267 H1699 M1704 L2083 Y2084 C2089	Q1267-I2087 PolarHBondContact NE2-O 2.77Å; H1699-I2087 HydrophobicContact CB-CD1 4.46Å; H1699-I2087 VanDerWaalsContact ND1-CD1 3.27Å; H1699-I2087 WeakPolarHBondContact ND1-CD1 3.48Å; M1704-I2087 HydrophobicContact CB-CG2 3.95Å; M1704-I2087 HydrophobicContact CE-CD1 3.74Å; M1704-I2087 HydrophobicContact CE-CG1 3.72Å; M1704-I2087 HydrophobicContact CE-CG2 4.44Å; L2083-I2087 HydrophobicContact CD1-CD1 4.02Å; L2083-I2087 HydrophobicContact CD1-CG1 4.27Å; L2083-I2087 HydrophobicContact CG-CD1 4Å; L2083-I2087 WeakPolarHBondContact O-CG1 3.21Å; L2083-I2087 PolarHBondContact O-N 3.32Å; Y2084-I2087 HydrophobicContact CD1-CD1 4.01Å; Y2084-I2087 HydrophobicContact CE1-CD1 4.11Å; Y2084-I2087 PolarHBondContact O-N 3.2Å; I2087-C2089 PolarHBondContact O-N 2.8Å
2088	R	80.8	Confident	83	Confident	17 Å²	17	43.8 Å²	43.8	6%	0.064	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	10.8	176.3	-64.5	-179.6	178	-128.8	5.6	114.3	Y2084 I2090 I2131 A2132 L2134 S2137	Y2084-R2088 WeakPolarHBondContact O-CG 3.39Å; Y2084-R2088 PolarHBondContact O-N 3.23Å; R2088-I2090 PolarHBondContact O-N 2.84Å; R2088-I2131 PolarHBondContact NH2-O 3.26Å; R2088-A2132 PolarHBondContact NH2-O 2.7Å; R2088-L2134 WeakPolarHBondContact CD-O 3.35Å; R2088-L2134 PolarHBondContact NE-O 2.76Å; R2088-L2134 PolarHBondContact NH1-O 2.72Å; R2088-S2137 PolarHBondContact NH1-OG 3.45Å
2089	C	77.2	Confident	82.8	Confident	9 Å²	9	40.8 Å²	40.8	6%	0.061	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	38.1	173.5	-56.6	0	0	0	0	115.8	V1256 E1257 T1263 G2086 I2087	V1256-C2089 HydrophobicContact CG1-CB 4.39Å; E1257-C2089 PolarHBondContact N-O 3.2Å; T1263-C2089 VanDerWaalsContact CB-SG 3.58Å; T1263-C2089 HydrophobicContact CG2-CB 3.69Å; G2086-C2089 PolarHBondContact O-N 3.45Å; I2087-C2089 PolarHBondContact O-N 2.8Å
2090	I	78	Confident	82.6	Confident	14 Å²	14	41.7 Å²	41.7	7%	0.072	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-76.1	134.3	172.8	-62.1	174	0	0	0	109.2	T2085 R2088 E2092 R2095 I2098	T2085-I2090 HydrophobicContact CG2-CD1 3.98Å; T2085-I2090 WeakPolarHBondContact O-CB 3.33Å; T2085-I2090 PolarHBondContact O-N 3.28Å; T2085-I2090 VanDerWaalsContact O-N 3.12Å; R2088-I2090 PolarHBondContact O-N 2.84Å; I2090-E2092 PolarHBondContact O-N 3.18Å; I2090-R2095 HydrophobicContact CB-CG 4.43Å; I2090-R2095 HydrophobicContact CG2-CG 4.26Å; I2090-R2095 VanDerWaalsContact O-CZ 3.27Å; I2090-R2095 PolarHBondContact O-NE 2.93Å; I2090-R2095 PolarHBondContact O-NH2 2.77Å; I2090-I2098 HydrophobicContact CG2-CD1 3.66Å
2091	K	74.1	Confident	82.2	Confident	65 Å²	65	43.8 Å²	43.8	28%	0.283	22%	0.221	S	C	.	.			trans	-49.4	132.3	180	-73.5	177.5	179.4	-179	0	112.2	E1255 E1257 K2093 H2094 R2095	E1255-K2091 HydrophobicContact CB-CD 4.42Å; E1255-K2091 IonicContact OE2-NZ 2.95Å; E1255-K2091 PolarHBondContact OE2-NZ 3.37Å; E1257-K2091 HydrophobicContact CG-CG 3.89Å; K2091-K2093 PolarHBondContact O-N 2.74Å; K2091-K2093 VanDerWaalsContact O-N 3.12Å; K2091-H2094 PolarHBondContact O-N 3.15Å; K2091-R2095 PolarHBondContact O-N 2.83Å
2092	E	73.3	Confident	81.9	Confident	110 Å²	110	44.4 Å²	44.4	51%	0.514	22%	0.224	S	C	.	.	H	α-helix	trans	-61.1	-28.5	-169.4	-165.9	163.8	-155.8	0	0	113.5	K1269 I2090 H2094	K1269-E2092 IonicContact NZ-OE1 2.69Å; K1269-E2092 PolarHBondContact NZ-OE1 3.34Å; K1269-E2092 IonicContact NZ-OE2 3.47Å; K1269-E2092 PolarHBondContact NZ-OE2 3.2Å; I2090-E2092 PolarHBondContact O-N 3.18Å; E2092-H2094 PolarHBondContact O-N 2.89Å
2093	K	76.2	Confident	81.7	Confident	195 Å²	195	41.9 Å²	41.9	85%	0.848	21%	0.211	S	C	*	.	H	α-helix	trans	-58.6	-42.2	173.1	-63.7	-176.2	-178.9	-179.6	0	112.8	K2091	K2091-K2093 PolarHBondContact O-N 2.74Å; K2091-K2093 VanDerWaalsContact O-N 3.12Å
2094	H	78.3	Confident	81.4	Confident	76 Å²	76	45.2 Å²	45.2	35%	0.352	23%	0.226	S	C	.	.	H	α-helix	trans	-88.4	-20.4	-172.2	-61.1	115.1	0	0	0	113.9	K2091 E2092 K2096 G2097 I2098	K2091-H2094 PolarHBondContact O-N 3.15Å; E2092-H2094 PolarHBondContact O-N 2.89Å; H2094-K2096 VanDerWaalsContact C-N 3.33Å; H2094-K2096 PolarHBondContact O-N 3.46Å; H2094-G2097 PolarHBondContact O-N 3.35Å; H2094-G2097 VanDerWaalsContact O-N 3.11Å; H2094-I2098 HydrophobicContact CB-CD1 3.89Å; H2094-I2098 PolarHBondContact O-N 3.31Å
2095	R	81.8	Confident	80.9	Confident	19 Å²	19	48.2 Å²	48.2	7%	0.072	24%	0.237	C	C	.	.	H	α-helix	trans	-53	-44.6	-175.4	-68.2	-170.4	-166.1	163.8	12.2	114.1	S1266 L2082 G2086 I2090 K2091 V2099	S1266-R2095 PolarHBondContact OG-NH2 3.02Å; L2082-R2095 HydrophobicContact CD2-CB 4.34Å; G2086-R2095 VanDerWaalsContact CA-NH1 3.29Å; I2090-R2095 HydrophobicContact CB-CG 4.43Å; I2090-R2095 HydrophobicContact CG2-CG 4.26Å; I2090-R2095 VanDerWaalsContact O-CZ 3.27Å; I2090-R2095 PolarHBondContact O-NE 2.93Å; I2090-R2095 PolarHBondContact O-NH2 2.77Å; K2091-R2095 PolarHBondContact O-N 2.83Å; R2095-V2099 VanDerWaalsContact O-CB 3.31Å; R2095-V2099 WeakPolarHBondContact O-CB 3.46Å; R2095-V2099 WeakPolarHBondContact O-CG2 3.49Å; R2095-V2099 PolarHBondContact O-N 3.09Å
2096	K	81.4	Confident	80.5	Confident	169 Å²	169	48.2 Å²	48.2	74%	0.735	24%	0.237	S	C	*	.	H	α-helix	trans	-64.7	-42.2	-178.5	-71.9	-175.4	-179.5	177.8	0	111.6	H2094 E2100	H2094-K2096 VanDerWaalsContact C-N 3.33Å; H2094-K2096 PolarHBondContact O-N 3.46Å; K2096-E2100 WeakPolarHBondContact O-CB 3.39Å; K2096-E2100 PolarHBondContact O-N 2.99Å
2097	G	81.1	Confident	80.1	Confident	50 Å²	50	51.8 Å²	51.8	52%	0.515	26%	0.256	S	S	.	.	H	α-helix	trans	-64.2	-49.2	176.6	0	0	0	0	0	111.9	H2094 V2099 E2100 A2101	H2094-G2097 PolarHBondContact O-N 3.35Å; H2094-G2097 VanDerWaalsContact O-N 3.11Å; G2097-V2099 PolarHBondContact O-N 2.92Å; G2097-E2100 PolarHBondContact O-N 3.38Å; G2097-A2101 WeakPolarHBondContact O-CB 3.29Å; G2097-A2101 PolarHBondContact O-N 3.39Å
2098	I	82.8	Confident	79.8	Confident	24 Å²	24	51.8 Å²	51.8	12%	0.123	26%	0.256	C	S	.	.	H	α-helix	trans	-61	-44.3	177.4	-67.1	164	0	0	0	111.1	T2085 I2090 H2094 A2101 Y2102	T2085-I2098 HydrophobicContact CG2-CG2 4.38Å; I2090-I2098 HydrophobicContact CG2-CD1 3.66Å; H2094-I2098 HydrophobicContact CB-CD1 3.89Å; H2094-I2098 PolarHBondContact O-N 3.31Å; I2098-A2101 PolarHBondContact O-N 2.94Å; I2098-Y2102 HydrophobicContact CG2-CD2 3.99Å; I2098-Y2102 HydrophobicContact CG2-CE2 3.98Å; I2098-Y2102 VanDerWaalsContact O-CD2 3.25Å; I2098-Y2102 WeakPolarHBondContact O-CD2 3.4Å; I2098-Y2102 PolarHBondContact O-N 3.17Å
2099	V	86.8	Confident	79.4	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-41.8	177.5	169.9	0	0	0	0	111.6	R2078 L2081 L2082 T2085 R2095 G2097 Y2102 L2103	R2078-V2099 HydrophobicContact CG-CG1 4.46Å; L2081-V2099 HydrophobicContact CB-CB 4.45Å; L2081-V2099 HydrophobicContact CB-CG1 3.87Å; L2081-V2099 HydrophobicContact CB-CG2 3.9Å; L2081-V2099 HydrophobicContact CD1-CG1 4.39Å; L2082-V2099 HydrophobicContact CD2-CG2 4.01Å; L2082-V2099 HydrophobicContact CG-CG1 4.29Å; L2082-V2099 HydrophobicContact CG-CG2 4.07Å; T2085-V2099 HydrophobicContact CG2-CG2 3.86Å; R2095-V2099 VanDerWaalsContact O-CB 3.31Å; R2095-V2099 WeakPolarHBondContact O-CB 3.46Å; R2095-V2099 WeakPolarHBondContact O-CG2 3.49Å; R2095-V2099 PolarHBondContact O-N 3.09Å; G2097-V2099 PolarHBondContact O-N 2.92Å; V2099-Y2102 PolarHBondContact O-N 2.68Å; V2099-L2103 HydrophobicContact CG1-CD1 3.85Å; V2099-L2103 HydrophobicContact CG1-CG 4.21Å; V2099-L2103 WeakPolarHBondContact O-CB 3.43Å; V2099-L2103 VanDerWaalsContact O-CG 3.24Å; V2099-L2103 WeakPolarHBondContact O-CG 3.44Å; V2099-L2103 PolarHBondContact O-N 3.3Å
2100	E	86	Confident	79	Confident	52 Å²	52	59.7 Å²	59.7	24%	0.243	31%	0.305	C	S	.	.	H	α-helix	trans	-67.1	-38.6	176.7	-162.3	63.9	-162	0	0	111.8	R2078 K2096 G2097 Y2102 L2103 Q2104 K2109	R2078-E2100 IonicContact CZ-OE2 2.68Å; R2078-E2100 VanDerWaalsContact CZ-OE2 3.22Å; R2078-E2100 IonicContact NH1-OE2 3.59Å; R2078-E2100 PolarHBondContact NH1-OE2 2.99Å; R2078-E2100 IonicContact NH2-OE1 3.06Å; R2078-E2100 IonicContact NH2-OE2 3.11Å; R2078-E2100 PolarHBondContact NH2-OE2 3.47Å; K2096-E2100 WeakPolarHBondContact O-CB 3.39Å; K2096-E2100 PolarHBondContact O-N 2.99Å; G2097-E2100 PolarHBondContact O-N 3.38Å; E2100-Y2102 PolarHBondContact O-N 2.93Å; E2100-L2103 PolarHBondContact O-N 3.04Å; E2100-Q2104 VanDerWaalsContact O-CB 3.31Å; E2100-Q2104 WeakPolarHBondContact O-CB 3.41Å; E2100-Q2104 PolarHBondContact O-N 2.62Å; E2100-K2109 WeakPolarHBondContact OE1-CE 3.41Å; E2100-K2109 IonicContact OE1-NZ 3.89Å
2101	A	81.5	Confident	78.7	Confident	49 Å²	49	63 Å²	63	41%	0.405	32%	0.318	S	S	.	.	H	α-helix	trans	-60.4	-42	172.7	0	0	0	0	0	111.9	G2097 I2098 Q2104 R2105	G2097-A2101 WeakPolarHBondContact O-CB 3.29Å; G2097-A2101 PolarHBondContact O-N 3.39Å; I2098-A2101 PolarHBondContact O-N 2.94Å; A2101-Q2104 PolarHBondContact O-N 2.88Å; A2101-R2105 WeakPolarHBondContact O-CB 3.35Å; A2101-R2105 PolarHBondContact O-N 3.13Å
2102	Y	83.7	Confident	78.9	Confident	13 Å²	13	60 Å²	60	5%	0.051	31%	0.305	C	S	.	.	H	α-helix	trans	-70.6	-38.7	174.9	-85.9	-116.5	0	0	0	112.5	I2098 V2099 E2100 Q2104 R2105 F2106 L2133 L2134 G2135	I2098-Y2102 HydrophobicContact CG2-CD2 3.99Å; I2098-Y2102 HydrophobicContact CG2-CE2 3.98Å; I2098-Y2102 VanDerWaalsContact O-CD2 3.25Å; I2098-Y2102 WeakPolarHBondContact O-CD2 3.4Å; I2098-Y2102 PolarHBondContact O-N 3.17Å; V2099-Y2102 PolarHBondContact O-N 2.68Å; E2100-Y2102 PolarHBondContact O-N 2.93Å; Y2102-Q2104 VanDerWaalsContact C-N 3.27Å; Y2102-Q2104 PolarHBondContact O-N 2.84Å; Y2102-R2105 PolarHBondContact O-N 3.17Å; Y2102-F2106 HydrophobicContact CD1-CD2 4.15Å; Y2102-F2106 AromaticContact CD1-CE2 3.73Å; Y2102-F2106 HydrophobicContact CD1-CE2 3.73Å; Y2102-F2106 HydrophobicContact CE1-CE2 4.17Å; Y2102-F2106 WeakPolarHBondContact O-CB 3.45Å; Y2102-F2106 WeakPolarHBondContact O-CD2 3.25Å; Y2102-F2106 PolarHBondContact O-N 3.01Å; Y2102-L2133 PolarHBondContact OH-O 3.36Å; Y2102-L2134 HydrophobicContact CD1-CD1 3.74Å; Y2102-L2134 HydrophobicContact CD2-CD1 4.37Å; Y2102-L2134 HydrophobicContact CE1-CB 4.45Å; Y2102-L2134 HydrophobicContact CE1-CD1 3.75Å; Y2102-L2134 HydrophobicContact CE2-CD1 4.38Å; Y2102-L2134 HydrophobicContact CG-CD1 4.06Å; Y2102-G2135 PolarHBondContact OH-N 2.92Å
2103	L	84.8	Confident	79.3	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64	-33.7	174.9	-73.1	170.4	0	0	0	112.3	A2077 R2078 L2081 V2099 E2100 F2108 K2109 A2112	A2077-L2103 HydrophobicContact CB-CD2 4.1Å; R2078-L2103 HydrophobicContact CB-CD1 3.93Å; R2078-L2103 HydrophobicContact CG-CD1 4.09Å; L2081-L2103 HydrophobicContact CD1-CD2 3.77Å; L2081-L2103 HydrophobicContact CD1-CG 3.96Å; V2099-L2103 HydrophobicContact CG1-CD1 3.85Å; V2099-L2103 HydrophobicContact CG1-CG 4.21Å; V2099-L2103 WeakPolarHBondContact O-CB 3.43Å; V2099-L2103 VanDerWaalsContact O-CG 3.24Å; V2099-L2103 WeakPolarHBondContact O-CG 3.44Å; V2099-L2103 PolarHBondContact O-N 3.3Å; E2100-L2103 PolarHBondContact O-N 3.04Å; L2103-F2108 HydrophobicContact CB-CB 4.46Å; L2103-F2108 HydrophobicContact CD2-CB 3.59Å; L2103-F2108 HydrophobicContact CD2-CD2 4.11Å; L2103-F2108 HydrophobicContact CD2-CG 4.24Å; L2103-F2108 PolarHBondContact O-N 3.33Å; L2103-K2109 PolarHBondContact O-N 3.2Å; L2103-A2112 HydrophobicContact CD1-CB 4.13Å; L2103-A2112 HydrophobicContact CD2-CB 3.89Å
2104	Q	81	Confident	79.4	Confident	81 Å²	81	54.8 Å²	54.8	38%	0.379	29%	0.285	S	S	.	.	H	α-helix	trans	-78.2	-42.1	175	-173	158.8	-29	0	0	111.6	E2100 A2101 Y2102 D2107	E2100-Q2104 VanDerWaalsContact O-CB 3.31Å; E2100-Q2104 WeakPolarHBondContact O-CB 3.41Å; E2100-Q2104 PolarHBondContact O-N 2.62Å; A2101-Q2104 PolarHBondContact O-N 2.88Å; Y2102-Q2104 VanDerWaalsContact C-N 3.27Å; Y2102-Q2104 PolarHBondContact O-N 2.84Å; Q2104-D2107 PolarHBondContact O-N 3.09Å
2105	R	77.6	Confident	79.5	Confident	68 Å²	68	54.7 Å²	54.7	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-45	178.7	-168.3	167.8	-176	165.1	-10.9	112	A2101 Y2102 D2107 F2156 V2160 E2163	A2101-R2105 WeakPolarHBondContact O-CB 3.35Å; A2101-R2105 PolarHBondContact O-N 3.13Å; Y2102-R2105 PolarHBondContact O-N 3.17Å; R2105-D2107 VanDerWaalsContact C-N 3.31Å; R2105-D2107 PolarHBondContact O-N 3.17Å; R2105-F2156 WeakPolarHBondContact O-CE2 3.45Å; R2105-F2156 WeakPolarHBondContact O-CZ 3.48Å; R2105-V2160 HydrophobicContact CG-CG2 4.31Å; R2105-E2163 IonicContact CZ-OE2 3.1Å; R2105-E2163 IonicContact NE-OE2 3.98Å; R2105-E2163 PolarHBondContact NE-OE2 2.98Å; R2105-E2163 VanDerWaalsContact NH2-CB 3.28Å; R2105-E2163 IonicContact NH2-OE2 2.66Å; R2105-E2163 PolarHBondContact NH2-OE2 2.98Å
2106	F	77.5	Confident	79.5	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	6.2	-180	-76.4	-90.6	0	0	0	115.7	Y2102 F2108 R2126 A2130 L2133 F2156 L2157 V2160	Y2102-F2106 HydrophobicContact CD1-CD2 4.15Å; Y2102-F2106 AromaticContact CD1-CE2 3.73Å; Y2102-F2106 HydrophobicContact CD1-CE2 3.73Å; Y2102-F2106 HydrophobicContact CE1-CE2 4.17Å; Y2102-F2106 WeakPolarHBondContact O-CB 3.45Å; Y2102-F2106 WeakPolarHBondContact O-CD2 3.25Å; Y2102-F2106 PolarHBondContact O-N 3.01Å; F2106-F2108 VanDerWaalsContact C-N 3.35Å; F2106-F2108 HydrophobicContact CB-CD2 3.51Å; F2106-F2108 HydrophobicContact CB-CE2 3.31Å; F2106-F2108 HydrophobicContact CB-CG 4.36Å; F2106-F2108 HydrophobicContact CB-CZ 4.04Å; F2106-F2108 AromaticContact CG-CE2 3.99Å; F2106-F2108 HydrophobicContact CG-CE2 3.99Å; F2106-F2108 PolarHBondContact O-N 3.35Å; F2106-R2126 PolarHBondContact O-NH1 3.31Å; F2106-A2130 HydrophobicContact CD1-CB 4.01Å; F2106-A2130 HydrophobicContact CD2-CB 3.78Å; F2106-A2130 HydrophobicContact CE1-CB 3.88Å; F2106-A2130 HydrophobicContact CE2-CB 3.65Å; F2106-A2130 HydrophobicContact CG-CB 3.97Å; F2106-A2130 HydrophobicContact CZ-CB 3.7Å; F2106-L2133 HydrophobicContact CZ-CD1 3.86Å; F2106-F2156 HydrophobicContact CD1-CE1 4.26Å; F2106-L2157 HydrophobicContact CD1-CD1 4.38Å; F2106-L2157 HydrophobicContact CE1-CD1 3.94Å; F2106-V2160 HydrophobicContact CE1-CG1 3.95Å; F2106-V2160 HydrophobicContact CE2-CG1 3.98Å; F2106-V2160 HydrophobicContact CZ-CG1 3.53Å
2107	D	76.5	Confident	79	Confident	75 Å²	75	52.9 Å²	52.9	40%	0.401	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	47.7	-172.6	-169.2	35.1	0	0	0	114.1	Q2104 R2105	Q2104-D2107 PolarHBondContact O-N 3.09Å; R2105-D2107 VanDerWaalsContact C-N 3.31Å; R2105-D2107 PolarHBondContact O-N 3.17Å
2108	F	75.1	Confident	78.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.282	C	S	.	.			trans	-91.1	-10.1	171.9	-68.2	-53.1	0	0	0	113.2	A2077 L2103 F2106 A2110 Y2111 A2112 Y2119 Y2123 R2126 L2127 A2130	A2077-F2108 HydrophobicContact CB-CG 4.42Å; L2103-F2108 HydrophobicContact CB-CB 4.46Å; L2103-F2108 HydrophobicContact CD2-CB 3.59Å; L2103-F2108 HydrophobicContact CD2-CD2 4.11Å; L2103-F2108 HydrophobicContact CD2-CG 4.24Å; L2103-F2108 PolarHBondContact O-N 3.33Å; F2106-F2108 VanDerWaalsContact C-N 3.35Å; F2106-F2108 HydrophobicContact CB-CD2 3.51Å; F2106-F2108 HydrophobicContact CB-CE2 3.31Å; F2106-F2108 HydrophobicContact CB-CG 4.36Å; F2106-F2108 HydrophobicContact CB-CZ 4.04Å; F2106-F2108 AromaticContact CG-CE2 3.99Å; F2106-F2108 HydrophobicContact CG-CE2 3.99Å; F2106-F2108 PolarHBondContact O-N 3.35Å; F2108-A2110 VanDerWaalsContact C-N 3.26Å; F2108-A2110 PolarHBondContact O-N 3.04Å; F2108-Y2111 CarbonylContact O-C 3.53Å; F2108-Y2111 WeakPolarHBondContact O-CA 3.26Å; F2108-Y2111 PolarHBondContact O-N 3.18Å; F2108-A2112 WeakPolarHBondContact O-CA 3.47Å; F2108-A2112 WeakPolarHBondContact O-CB 3.33Å; F2108-A2112 PolarHBondContact O-N 3.2Å; F2108-Y2119 HydrophobicContact CD1-CE2 4.35Å; F2108-Y2119 HydrophobicContact CE1-CE2 4.3Å; F2108-Y2123 HydrophobicContact CD1-CD1 4.03Å; F2108-Y2123 HydrophobicContact CD1-CE1 4.36Å; F2108-Y2123 AromaticContact CE1-CD1 3.92Å; F2108-Y2123 HydrophobicContact CE1-CD1 3.92Å; F2108-R2126 HydrophobicContact CE1-CB 4.06Å; F2108-R2126 HydrophobicContact CZ-CB 3.73Å; F2108-L2127 HydrophobicContact CE1-CB 4.41Å; F2108-L2127 HydrophobicContact CE2-CB 4.49Å; F2108-L2127 HydrophobicContact CE2-CD1 4.11Å; F2108-L2127 HydrophobicContact CZ-CB 3.84Å; F2108-L2127 HydrophobicContact CZ-CD1 4.26Å; F2108-A2130 HydrophobicContact CE2-CB 4.29Å
2109	K	72.5	Confident	77.8	Confident	108 Å²	108	54.6 Å²	54.6	47%	0.47	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-35.8	-164.1	-148.3	168.8	-168.7	167.9	0	114.3	E2100 L2103	E2100-K2109 WeakPolarHBondContact OE1-CE 3.41Å; E2100-K2109 IonicContact OE1-NZ 3.89Å; L2103-K2109 PolarHBondContact O-N 3.2Å
2110	A	68.3	Low	76.9	Confident	83 Å²	83	56.8 Å²	56.8	69%	0.686	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-19.9	176.6	0	0	0	0	0	115	F2108	F2108-A2110 VanDerWaalsContact C-N 3.26Å; F2108-A2110 PolarHBondContact O-N 3.04Å
2111	Y	73.2	Confident	76	Confident	85 Å²	85	56.3 Å²	56.3	33%	0.333	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-2.7	-176.8	-61.1	-82.5	0	0	0	113.3	F2108 D2113 K2114 Y2119 Y2123	F2108-Y2111 CarbonylContact O-C 3.53Å; F2108-Y2111 WeakPolarHBondContact O-CA 3.26Å; F2108-Y2111 PolarHBondContact O-N 3.18Å; Y2111-D2113 PolarHBondContact O-N 3.17Å; Y2111-K2114 HydrophobicContact CD1-CD 4.14Å; Y2111-K2114 WeakPolarHBondContact O-CB 3.43Å; Y2111-K2114 PolarHBondContact O-N 3.24Å; Y2111-Y2119 PolarHBondContact O-OH 3.35Å; Y2111-Y2123 HydrophobicContact CD2-CE1 4.23Å
2112	A	77.4	Confident	75.5	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.008	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-29.1	-166.4	0	0	0	0	0	115	T2076 A2077 R2078 L2103 F2108	T2076-A2112 WeakPolarHBondContact CB-O 3.35Å; T2076-A2112 PolarHBondContact OG1-O 3.33Å; A2077-A2112 PolarHBondContact N-O 3.22Å; R2078-A2112 WeakPolarHBondContact CB-O 3.37Å; R2078-A2112 PolarHBondContact N-O 3.41Å; R2078-A2112 VanDerWaalsContact N-O 3.16Å; L2103-A2112 HydrophobicContact CD1-CB 4.13Å; L2103-A2112 HydrophobicContact CD2-CB 3.89Å; F2108-A2112 WeakPolarHBondContact O-CA 3.47Å; F2108-A2112 WeakPolarHBondContact O-CB 3.33Å; F2108-A2112 PolarHBondContact O-N 3.2Å
2113	D	82	Confident	75.3	Confident	105 Å²	105	55.6 Å²	55.6	56%	0.561	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	7.1	-178.3	-54.8	-45.3	0	0	0	113.8	T2076 R2078 Y2111	T2076-D2113 WeakPolarHBondContact CG2-O 3.38Å; R2078-D2113 VanDerWaalsContact CD-OD1 3.28Å; R2078-D2113 WeakPolarHBondContact CD-OD1 3.27Å; R2078-D2113 IonicContact NE-OD1 3.52Å; R2078-D2113 PolarHBondContact NE-OD1 3.22Å; R2078-D2113 IonicContact NE-OD2 3.66Å; Y2111-D2113 PolarHBondContact O-N 3.17Å
2114	K	77.7	Confident	75	Confident	90 Å²	90	58.3 Å²	58.3	39%	0.391	30%	0.303	S	S	.	.	S	Bend	trans	-83	148.9	165.5	-78.1	-176.8	170.5	-176.9	0	109.9	D925 T2076 Y2111 Y2119	D925-K2114 IonicContact OD1-NZ 3.73Å; D925-K2114 PolarHBondContact OD1-NZ 3.1Å; T2076-K2114 WeakPolarHBondContact CA-O 3.44Å; T2076-K2114 WeakPolarHBondContact CB-O 3.29Å; Y2111-K2114 HydrophobicContact CD1-CD 4.14Å; Y2111-K2114 WeakPolarHBondContact O-CB 3.43Å; Y2111-K2114 PolarHBondContact O-N 3.24Å; K2114-Y2119 HydrophobicContact CB-CE1 4.28Å
2115	Q	80.3	Confident	75	Confident	75 Å²	75	54.8 Å²	54.8	35%	0.35	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-71.9	139.6	-178.9	-67.4	-179.1	-12.7	0	0	111.5	L2075 K2117 T2118	L2075-Q2115 WeakPolarHBondContact O-CA 3.11Å; Q2115-K2117 PolarHBondContact O-N 3.14Å; Q2115-K2117 VanDerWaalsContact O-N 3.09Å; Q2115-T2118 WeakPolarHBondContact O-CB 3.47Å; Q2115-T2118 PolarHBondContact O-N 2.93Å; Q2115-T2118 PolarHBondContact O-OG1 2.98Å
2116	V	81.6	Confident	75.3	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.012	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-57.7	-27.2	-178.6	172.1	0	0	0	0	112.6	L2071 L2075 T2118 Y2119 K2124 L2127	L2071-V2116 HydrophobicContact CB-CG1 4.02Å; L2071-V2116 HydrophobicContact CD1-CG1 3.98Å; L2075-V2116 WeakPolarHBondContact O-CG2 3.45Å; L2075-V2116 PolarHBondContact O-N 3.46Å; V2116-T2118 PolarHBondContact O-N 3.41Å; V2116-T2118 VanDerWaalsContact O-N 3.16Å; V2116-Y2119 WeakPolarHBondContact O-CB 3.37Å; V2116-Y2119 PolarHBondContact O-N 3.11Å; V2116-K2124 HydrophobicContact CG1-CG 4.14Å; V2116-K2124 WeakPolarHBondContact O-CE 3.49Å; V2116-L2127 HydrophobicContact CG2-CD2 3.64Å
2117	K	71.3	Confident	75.7	Confident	147 Å²	147	52.2 Å²	52.2	64%	0.639	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-52.2	-36.1	170.9	-170.4	172.8	179.7	178.8	0	113.2	S2073 Q2115	S2073-K2117 WeakPolarHBondContact O-CB 3.03Å; S2073-K2117 PolarHBondContact O-N 3.5Å; Q2115-K2117 PolarHBondContact O-N 3.14Å; Q2115-K2117 VanDerWaalsContact O-N 3.09Å
2118	T	69.2	Low	76.2	Confident	99 Å²	99	48.8 Å²	48.8	61%	0.607	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-82.8	-9.2	-178.7	66.3	0	0	0	0	114.1	Q2115 V2116	Q2115-T2118 WeakPolarHBondContact O-CB 3.47Å; Q2115-T2118 PolarHBondContact O-N 2.93Å; Q2115-T2118 PolarHBondContact O-OG1 2.98Å; V2116-T2118 PolarHBondContact O-N 3.41Å; V2116-T2118 VanDerWaalsContact O-N 3.16Å
2119	Y	70.5	Confident	76.6	Confident	12 Å²	12	48.8 Å²	48.8	5%	0.047	26%	0.258	C	S	.	.	S	Bend	trans	-73.8	141.7	178.8	-74.7	16.9	0	0	0	111	A2077 F2108 Y2111 K2114 V2116 K2124 L2127	A2077-Y2119 HydrophobicContact CB-CE2 4.12Å; A2077-Y2119 VanDerWaalsContact CB-OH 3.29Å; A2077-Y2119 WeakPolarHBondContact CB-OH 3.49Å; F2108-Y2119 HydrophobicContact CD1-CE2 4.35Å; F2108-Y2119 HydrophobicContact CE1-CE2 4.3Å; Y2111-Y2119 PolarHBondContact O-OH 3.35Å; K2114-Y2119 HydrophobicContact CB-CE1 4.28Å; V2116-Y2119 WeakPolarHBondContact O-CB 3.37Å; V2116-Y2119 PolarHBondContact O-N 3.11Å; Y2119-K2124 WeakPolarHBondContact O-CE 3.21Å; Y2119-K2124 PolarHBondContact O-NZ 3.44Å; Y2119-L2127 HydrophobicContact CE2-CD2 4.48Å
2120	S	66.3	Low	77.3	Confident	46 Å²	46	43.6 Å²	43.6	32%	0.322	24%	0.235	S	C	.	.			trans	-65.6	164.6	166.9	66.8	0	0	0	0	110.9	G2122 Y2123 K2124	S2120-G2122 VanDerWaalsContact C-N 3.31Å; S2120-G2122 PolarHBondContact O-N 3.39Å; S2120-Y2123 PolarHBondContact O-N 2.7Å; S2120-K2124 PolarHBondContact O-N 2.78Å
2121	G	68.9	Low	78.1	Confident	43 Å²	43	39.7 Å²	39.7	44%	0.443	20%	0.203	S	C	.	.	H	α-helix	trans	-51.6	-48.7	177.9	0	0	0	0	0	112.3	Y2123 K2124 R2125	G2121-Y2123 PolarHBondContact O-N 2.97Å; G2121-K2124 WeakPolarHBondContact O-CB 3.24Å; G2121-K2124 PolarHBondContact O-N 3.07Å; G2121-K2124 VanDerWaalsContact O-N 3.13Å; G2121-R2125 PolarHBondContact O-N 2.9Å
2122	G	71	Confident	78.6	Confident	2 Å²	2	35.7 Å²	35.7	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-61.8	-37.6	179.2	0	0	0	0	0	115	S2120 R2125 R2126	S2120-G2122 VanDerWaalsContact C-N 3.31Å; S2120-G2122 PolarHBondContact O-N 3.39Å; G2122-R2125 WeakPolarHBondContact O-CB 3.49Å; G2122-R2125 PolarHBondContact O-N 2.86Å; G2122-R2126 WeakPolarHBondContact O-CG 3.27Å; G2122-R2126 PolarHBondContact O-N 2.83Å
2123	Y	77.8	Confident	78.8	Confident	45 Å²	45	36 Å²	36	18%	0.176	19%	0.189	C	C	.	.	H	α-helix	trans	-71.4	-30.8	175.3	-90.5	-82.5	0	0	0	112.8	F2108 Y2111 S2120 G2121 L2127	F2108-Y2123 HydrophobicContact CD1-CD1 4.03Å; F2108-Y2123 HydrophobicContact CD1-CE1 4.36Å; F2108-Y2123 AromaticContact CE1-CD1 3.92Å; F2108-Y2123 HydrophobicContact CE1-CD1 3.92Å; Y2111-Y2123 HydrophobicContact CD2-CE1 4.23Å; S2120-Y2123 PolarHBondContact O-N 2.7Å; G2121-Y2123 PolarHBondContact O-N 2.97Å; Y2123-L2127 PolarHBondContact O-N 2.9Å
2124	K	80	Confident	78.7	Confident	57 Å²	57	31 Å²	31	25%	0.248	16%	0.162	C	C	.	.	H	α-helix	trans	-67.2	-46.6	170.8	-70.3	170.5	175.4	146.5	0	110.7	D2069 L2071 V2116 Y2119 S2120 G2121 R2126 L2127 S2128	D2069-K2124 HydrophobicContact CB-CB 4.11Å; D2069-K2124 WeakPolarHBondContact OD2-CB 3.43Å; L2071-K2124 HydrophobicContact CD1-CB 3.97Å; L2071-K2124 HydrophobicContact CD1-CG 4.32Å; V2116-K2124 HydrophobicContact CG1-CG 4.14Å; V2116-K2124 WeakPolarHBondContact O-CE 3.49Å; Y2119-K2124 WeakPolarHBondContact O-CE 3.21Å; Y2119-K2124 PolarHBondContact O-NZ 3.44Å; S2120-K2124 PolarHBondContact O-N 2.78Å; G2121-K2124 WeakPolarHBondContact O-CB 3.24Å; G2121-K2124 PolarHBondContact O-N 3.07Å; G2121-K2124 VanDerWaalsContact O-N 3.13Å; K2124-R2126 PolarHBondContact O-N 2.67Å; K2124-L2127 WeakPolarHBondContact O-CA 3.04Å; K2124-L2127 WeakPolarHBondContact O-CB 3.16Å; K2124-L2127 PolarHBondContact O-N 3.04Å; K2124-S2128 PolarHBondContact O-N 3.03Å; K2124-S2128 PolarHBondContact O-OG 3.21Å
2125	R	81.3	Confident	78.3	Confident	6 Å²	6	27.2 Å²	27.2	2%	0.023	15%	0.148	C	C	.	.	H	α-helix	trans	-54.6	-50.1	174.9	-151.3	84.3	-162.8	115.8	-2	112.4	P2066 D2069 G2121 G2122 L2127 S2128 T2129 D2143 E2144 P2145 M2149	P2066-R2125 VanDerWaalsContact O-CZ 3.25Å; P2066-R2125 PolarHBondContact O-NH1 2.94Å; P2066-R2125 PolarHBondContact O-NH2 2.79Å; D2069-R2125 IonicContact OD1-CZ 2.65Å; D2069-R2125 IonicContact OD1-NH1 3.13Å; D2069-R2125 PolarHBondContact OD1-NH1 3.4Å; D2069-R2125 PolarHBondContact OD2-N 2.87Å; G2121-R2125 PolarHBondContact O-N 2.9Å; G2122-R2125 WeakPolarHBondContact O-CB 3.49Å; G2122-R2125 PolarHBondContact O-N 2.86Å; R2125-L2127 PolarHBondContact O-N 3.31Å; R2125-S2128 PolarHBondContact O-N 3.32Å; R2125-T2129 PolarHBondContact O-N 3.45Å; R2125-T2129 PolarHBondContact O-OG1 3.1Å; R2125-D2143 PolarHBondContact NH2-O 3.01Å; R2125-E2144 PolarHBondContact NE-O 2.93Å; R2125-E2144 PolarHBondContact NH2-O 3.5Å; R2125-P2145 WeakPolarHBondContact CG-O 3.21Å; R2125-M2149 HydrophobicContact CB-CG 3.95Å; R2125-M2149 HydrophobicContact CB-SD 3.65Å; R2125-M2149 HydrophobicContact CG-CG 4.15Å; R2125-M2149 HydrophobicContact CG-SD 3.63Å
2126	R	83.1	Confident	77.7	Confident	16 Å²	16	29.9 Å²	29.9	6%	0.06	16%	0.159	C	C	.	.	H	α-helix	trans	-53.1	-42	173.1	-72.6	-176.8	-174.7	-152.9	7.6	111.7	F2106 F2108 G2122 K2124 T2129 A2130 M2149 S2153 L2157	F2106-R2126 PolarHBondContact O-NH1 3.31Å; F2108-R2126 HydrophobicContact CE1-CB 4.06Å; F2108-R2126 HydrophobicContact CZ-CB 3.73Å; G2122-R2126 WeakPolarHBondContact O-CG 3.27Å; G2122-R2126 PolarHBondContact O-N 2.83Å; K2124-R2126 PolarHBondContact O-N 2.67Å; R2126-T2129 PolarHBondContact O-N 3.41Å; R2126-A2130 WeakPolarHBondContact O-CB 3.43Å; R2126-A2130 PolarHBondContact O-N 3.24Å; R2126-M2149 HydrophobicContact CG-CE 3.6Å; R2126-S2153 PolarHBondContact NH2-OG 2.85Å; R2126-L2157 HydrophobicContact CG-CD1 4.37Å
2127	L	86.5	Confident	77.3	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-72.5	-39.9	-177.8	-177.5	59.6	0	0	0	111.8	L2071 A2077 T2080 L2081 F2108 V2116 Y2119 Y2123 K2124 R2125 T2129 A2130 I2131	L2071-L2127 HydrophobicContact CD1-CB 4.27Å; L2071-L2127 HydrophobicContact CD1-CD2 4.17Å; L2071-L2127 HydrophobicContact CD1-CG 4.36Å; L2071-L2127 HydrophobicContact CD2-CD2 4.39Å; L2071-L2127 HydrophobicContact CD2-CG 4.29Å; A2077-L2127 HydrophobicContact CB-CD1 4.03Å; A2077-L2127 HydrophobicContact CB-CD2 4.08Å; T2080-L2127 HydrophobicContact CG2-CD2 4.49Å; L2081-L2127 HydrophobicContact CD1-CD1 4.5Å; L2081-L2127 HydrophobicContact CD2-CD1 4.21Å; L2081-L2127 HydrophobicContact CG-CD1 4.13Å; F2108-L2127 HydrophobicContact CE1-CB 4.41Å; F2108-L2127 HydrophobicContact CE2-CB 4.49Å; F2108-L2127 HydrophobicContact CE2-CD1 4.11Å; F2108-L2127 HydrophobicContact CZ-CB 3.84Å; F2108-L2127 HydrophobicContact CZ-CD1 4.26Å; V2116-L2127 HydrophobicContact CG2-CD2 3.64Å; Y2119-L2127 HydrophobicContact CE2-CD2 4.48Å; Y2123-L2127 PolarHBondContact O-N 2.9Å; K2124-L2127 WeakPolarHBondContact O-CA 3.04Å; K2124-L2127 WeakPolarHBondContact O-CB 3.16Å; K2124-L2127 PolarHBondContact O-N 3.04Å; R2125-L2127 PolarHBondContact O-N 3.31Å; L2127-T2129 VanDerWaalsContact C-N 3.34Å; L2127-T2129 PolarHBondContact O-N 2.98Å; L2127-A2130 PolarHBondContact O-N 3.46Å; L2127-I2131 HydrophobicContact CG-CD1 4.32Å; L2127-I2131 WeakPolarHBondContact O-CD1 2.97Å; L2127-I2131 VanDerWaalsContact O-CG1 3.28Å; L2127-I2131 WeakPolarHBondContact O-CG1 3.38Å; L2127-I2131 PolarHBondContact O-N 3.02Å
2128	S	86.4	Confident	77.3	Confident	2 Å²	2	27 Å²	27	1%	0.014	16%	0.155	C	C	.	.	H	α-helix	trans	-59.3	-43.5	171.8	-68.6	0	0	0	0	112	C2065 D2069 K2124 R2125 I2131 A2132	C2065-S2128 VanDerWaalsContact SG-CB 3.59Å; D2069-S2128 PolarHBondContact OD1-OG 2.95Å; K2124-S2128 PolarHBondContact O-N 3.03Å; K2124-S2128 PolarHBondContact O-OG 3.21Å; R2125-S2128 PolarHBondContact O-N 3.32Å; S2128-I2131 PolarHBondContact O-N 2.94Å; S2128-A2132 PolarHBondContact O-N 3.19Å; S2128-A2132 VanDerWaalsContact O-N 3.1Å
2129	T	83.7	Confident	77.7	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.5	-36.1	176.4	-53.3	0	0	0	0	112.2	C2065 R2125 R2126 L2127 I2131 A2132 L2133 L2142 L2157 I2161	C2065-T2129 PolarHBondContact SG-OG1 2.03Å; R2125-T2129 PolarHBondContact O-N 3.45Å; R2125-T2129 PolarHBondContact O-OG1 3.1Å; R2126-T2129 PolarHBondContact O-N 3.41Å; L2127-T2129 VanDerWaalsContact C-N 3.34Å; L2127-T2129 PolarHBondContact O-N 2.98Å; T2129-I2131 VanDerWaalsContact C-N 3.32Å; T2129-I2131 PolarHBondContact O-N 3Å; T2129-A2132 WeakPolarHBondContact O-CB 3.32Å; T2129-A2132 PolarHBondContact O-N 2.96Å; T2129-L2133 HydrophobicContact CG2-CD1 3.96Å; T2129-L2133 PolarHBondContact O-N 3.21Å; T2129-L2142 HydrophobicContact CG2-CD2 4.27Å; T2129-L2157 HydrophobicContact CG2-CD1 3.9Å; T2129-L2157 HydrophobicContact CG2-CD2 4.12Å; T2129-L2157 HydrophobicContact CG2-CG 4.19Å; T2129-I2161 HydrophobicContact CG2-CD1 4.35Å
2130	A	86.2	Confident	78.3	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-36.8	172.4	0	0	0	0	0	112.8	L2081 F2106 F2108 R2126 L2127 L2134	L2081-A2130 HydrophobicContact CD2-CB 4.24Å; F2106-A2130 HydrophobicContact CD1-CB 4.01Å; F2106-A2130 HydrophobicContact CD2-CB 3.78Å; F2106-A2130 HydrophobicContact CE1-CB 3.88Å; F2106-A2130 HydrophobicContact CE2-CB 3.65Å; F2106-A2130 HydrophobicContact CG-CB 3.97Å; F2106-A2130 HydrophobicContact CZ-CB 3.7Å; F2108-A2130 HydrophobicContact CE2-CB 4.29Å; R2126-A2130 WeakPolarHBondContact O-CB 3.43Å; R2126-A2130 PolarHBondContact O-N 3.24Å; L2127-A2130 PolarHBondContact O-N 3.46Å; A2130-L2134 WeakPolarHBondContact O-CB 3.4Å; A2130-L2134 PolarHBondContact O-N 3.04Å
2131	I	86.2	Confident	79.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.6	-36.9	174	-66.6	157.8	0	0	0	111.5	L1698 L2071 T2080 L2081 Y2084 R2088 L2127 S2128 T2129 L2134	L1698-I2131 HydrophobicContact CD2-CG2 4.41Å; L2071-I2131 HydrophobicContact CD2-CD1 3.43Å; L2071-I2131 VanDerWaalsContact CD2-CD1 3.43Å; T2080-I2131 HydrophobicContact CG2-CD1 3.65Å; T2080-I2131 HydrophobicContact CG2-CG1 4.4Å; L2081-I2131 HydrophobicContact CD2-CG1 4.41Å; Y2084-I2131 HydrophobicContact CD1-CG2 3.71Å; Y2084-I2131 HydrophobicContact CD2-CB 4.37Å; Y2084-I2131 HydrophobicContact CD2-CD1 3.85Å; Y2084-I2131 HydrophobicContact CD2-CG1 3.75Å; Y2084-I2131 HydrophobicContact CD2-CG2 3.66Å; Y2084-I2131 HydrophobicContact CE1-CG2 3.94Å; Y2084-I2131 HydrophobicContact CE2-CD1 3.73Å; Y2084-I2131 HydrophobicContact CE2-CG1 4.14Å; Y2084-I2131 HydrophobicContact CE2-CG2 3.9Å; Y2084-I2131 HydrophobicContact CG-CG1 4.35Å; Y2084-I2131 HydrophobicContact CG-CG2 3.58Å; R2088-I2131 PolarHBondContact NH2-O 3.26Å; L2127-I2131 HydrophobicContact CG-CD1 4.32Å; L2127-I2131 WeakPolarHBondContact O-CD1 2.97Å; L2127-I2131 VanDerWaalsContact O-CG1 3.28Å; L2127-I2131 WeakPolarHBondContact O-CG1 3.38Å; L2127-I2131 PolarHBondContact O-N 3.02Å; S2128-I2131 PolarHBondContact O-N 2.94Å; T2129-I2131 VanDerWaalsContact C-N 3.32Å; T2129-I2131 PolarHBondContact O-N 3Å; I2131-L2134 WeakPolarHBondContact O-CB 3.32Å
2132	A	83.2	Confident	79.7	Confident	1 Å²	1	23 Å²	23	1%	0.008	12%	0.117	C	C	.	.	H	α-helix	trans	-64.5	-42.7	175.8	0	0	0	0	0	111.8	G2063 C2065 R2088 S2128 T2129 L2134 L2142	G2063-A2132 WeakPolarHBondContact CA-O 3.47Å; C2065-A2132 HydrophobicContact CB-CB 4.16Å; R2088-A2132 PolarHBondContact NH2-O 2.7Å; S2128-A2132 PolarHBondContact O-N 3.19Å; S2128-A2132 VanDerWaalsContact O-N 3.1Å; T2129-A2132 WeakPolarHBondContact O-CB 3.32Å; T2129-A2132 PolarHBondContact O-N 2.96Å; A2132-L2134 VanDerWaalsContact C-N 3.34Å; A2132-L2134 PolarHBondContact O-N 3.28Å; A2132-L2142 HydrophobicContact CB-CD2 4.21Å
2133	L	80.9	Confident	80	Confident	9 Å²	9	23.2 Å²	23.2	5%	0.047	12%	0.117	C	C	.	.	S	Bend	trans	-79.3	-7.4	-178.4	-72.3	164.1	0	0	0	115.1	Y2102 F2106 T2129 G2135 I2140 V2160 I2161 R2164	Y2102-L2133 PolarHBondContact OH-O 3.36Å; F2106-L2133 HydrophobicContact CZ-CD1 3.86Å; T2129-L2133 HydrophobicContact CG2-CD1 3.96Å; T2129-L2133 PolarHBondContact O-N 3.21Å; L2133-G2135 PolarHBondContact O-N 3.36Å; L2133-I2140 HydrophobicContact CD2-CD1 3.94Å; L2133-V2160 HydrophobicContact CD1-CG1 4.35Å; L2133-I2161 HydrophobicContact CD1-CG1 4.16Å; L2133-R2164 HydrophobicContact CD2-CG 4.28Å
2134	L	81	Confident	79.7	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	-66.2	95	-168.8	-163.6	71.4	0	0	0	113.9	L2081 T2085 R2088 Y2102 A2130 I2131 A2132	L2081-L2134 HydrophobicContact CD2-CD1 4.17Å; T2085-L2134 HydrophobicContact CG2-CD1 4Å; T2085-L2134 HydrophobicContact CG2-CD2 3.77Å; T2085-L2134 HydrophobicContact CG2-CG 4.02Å; R2088-L2134 WeakPolarHBondContact CD-O 3.35Å; R2088-L2134 PolarHBondContact NE-O 2.76Å; R2088-L2134 PolarHBondContact NH1-O 2.72Å; Y2102-L2134 HydrophobicContact CD1-CD1 3.74Å; Y2102-L2134 HydrophobicContact CD2-CD1 4.37Å; Y2102-L2134 HydrophobicContact CE1-CB 4.45Å; Y2102-L2134 HydrophobicContact CE1-CD1 3.75Å; Y2102-L2134 HydrophobicContact CE2-CD1 4.38Å; Y2102-L2134 HydrophobicContact CG-CD1 4.06Å; A2130-L2134 WeakPolarHBondContact O-CB 3.4Å; A2130-L2134 PolarHBondContact O-N 3.04Å; I2131-L2134 WeakPolarHBondContact O-CB 3.32Å; A2132-L2134 VanDerWaalsContact C-N 3.34Å; A2132-L2134 PolarHBondContact O-N 3.28Å
2135	G	68.4	Low	79.3	Confident	9 Å²	9	22.2 Å²	22.2	9%	0.093	12%	0.116	C	C	.	.	S	Bend	trans	93.7	-167.8	-178.1	0	0	0	0	0	113.3	Y2102 L2133 S2137 R2164	Y2102-G2135 PolarHBondContact OH-N 2.92Å; L2133-G2135 PolarHBondContact O-N 3.36Å; G2135-S2137 PolarHBondContact O-N 2.85Å; G2135-R2164 PolarHBondContact O-NH2 3.33Å
2136	K	68.4	Low	78.8	Confident	132 Å²	132	22.3 Å²	22.3	57%	0.574	12%	0.118	S	C	*	.			trans	-90.9	85	-179.5	-74.3	178.3	-179.1	169.7	0	112.1	D1254	D1254-K2136 HydrophobicContact CB-CD 4.27Å; D1254-K2136 HydrophobicContact CB-CG 4.43Å
2137	S	72.3	Confident	77.8	Confident	19 Å²	19	23.7 Å²	23.7	13%	0.133	13%	0.133	C	C	.	.			trans	-83.6	132.7	164.9	-74.4	0	0	0	0	110.7	P2061 G2063 R2088 G2135 L2139	P2061-S2137 WeakPolarHBondContact O-CB 3.3Å; P2061-S2137 PolarHBondContact O-OG 3.05Å; G2063-S2137 PolarHBondContact N-OG 3.45Å; R2088-S2137 PolarHBondContact NH1-OG 3.45Å; G2135-S2137 PolarHBondContact O-N 2.85Å; S2137-L2139 VanDerWaalsContact C-N 3.33Å
2138	P	71.5	Confident	76.4	Confident	68 Å²	68	25.3 Å²	25.3	44%	0.442	15%	0.149	S	C	.	.	S	Bend	trans	-74	-24.1	176.2	30	-34.4	0	0	0	113
2139	L	78.7	Confident	75.6	Confident	14 Å²	14	25.2 Å²	25.2	7%	0.073	15%	0.149	C	C	.	.			trans	-129.5	132.8	176.4	-178.6	63.7	0	0	0	109.8	L1964 I2062 G2063 S2137 L2141	L1964-L2139 HydrophobicContact CB-CD1 4.12Å; L1964-L2139 HydrophobicContact CB-CD2 4.2Å; L1964-L2139 HydrophobicContact CD1-CD2 4.15Å; L1964-L2139 HydrophobicContact CD2-CD1 4.48Å; L1964-L2139 HydrophobicContact CD2-CD2 4.33Å; L1964-L2139 HydrophobicContact CG-CD2 4.45Å; I2062-L2139 HydrophobicContact CD1-CD2 4.24Å; I2062-L2139 HydrophobicContact CG2-CG 4.5Å; G2063-L2139 PolarHBondContact N-O 3.08Å; S2137-L2139 VanDerWaalsContact C-N 3.33Å; L2139-L2141 HydrophobicContact CD1-CD2 4.38Å; L2139-L2141 HydrophobicContact CG-CD2 4.44Å; L2139-L2141 HydrophobicContact CG-CG 4.39Å
2140	I	82.5	Confident	74.6	Confident	54 Å²	54	25.4 Å²	25.4	28%	0.277	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.7	176.2	-59.9	161.4	0	0	0	108.4	G2063 L2133 L2142	G2063-I2140 CarbonylContact O-C 3.52Å; G2063-I2140 VanDerWaalsContact O-CA 3.31Å; G2063-I2140 WeakPolarHBondContact O-CA 3.19Å; L2133-I2140 HydrophobicContact CD2-CD1 3.94Å; I2140-L2142 HydrophobicContact CG2-CD2 4.04Å; I2140-L2142 HydrophobicContact CG2-CG 4.08Å
2141	L	84.3	Confident	73.4	Confident	11 Å²	11	26 Å²	26	6%	0.058	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.8	-179.2	-63.3	176.3	0	0	0	109.2	F2034 I2037 T2038 I2062 G2063 Y2064 C2065 L2139	F2034-L2141 HydrophobicContact CD1-CD2 4.36Å; F2034-L2141 HydrophobicContact CE1-CD2 4.18Å; I2037-L2141 HydrophobicContact CG2-CD1 3.91Å; T2038-L2141 HydrophobicContact CG2-CD1 3.78Å; I2062-L2141 HydrophobicContact CG2-CD1 4.12Å; I2062-L2141 HydrophobicContact CG2-CG 4.25Å; G2063-L2141 PolarHBondContact O-N 3.4Å; Y2064-L2141 WeakPolarHBondContact CA-O 3.47Å; Y2064-L2141 HydrophobicContact CD2-CB 3.9Å; C2065-L2141 PolarHBondContact N-O 3.37Å; L2139-L2141 HydrophobicContact CD1-CD2 4.38Å; L2139-L2141 HydrophobicContact CG-CD2 4.44Å; L2139-L2141 HydrophobicContact CG-CG 4.39Å
2142	L	81.5	Confident	72.3	Confident	39 Å²	39	31 Å²	31	20%	0.204	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	110.2	-178.3	-60.9	-179.5	0	0	0	109.7	C2065 T2129 A2132 I2140 P2145 I2161	C2065-L2142 HydrophobicContact CB-CD2 3.47Å; C2065-L2142 VanDerWaalsContact CB-CD2 3.47Å; T2129-L2142 HydrophobicContact CG2-CD2 4.27Å; A2132-L2142 HydrophobicContact CB-CD2 4.21Å; I2140-L2142 HydrophobicContact CG2-CD2 4.04Å; I2140-L2142 HydrophobicContact CG2-CG 4.08Å; L2142-P2145 HydrophobicContact CB-CB 4.01Å; L2142-P2145 HydrophobicContact CB-CG 3.9Å; L2142-P2145 HydrophobicContact CD1-CB 4.21Å; L2142-P2145 HydrophobicContact CD1-CG 4.24Å; L2142-P2145 HydrophobicContact CG-CB 4.49Å; L2142-I2161 HydrophobicContact CD1-CD1 3.82Å; L2142-I2161 HydrophobicContact CD1-CG1 4.45Å
2143	D	76	Confident	71.5	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.027	18%	0.179	C	C	.	.	S	Bend	trans	-98.2	89.5	-176.7	-166.5	14.8	0	0	0	108.5	F2034 Y2064 C2065 Q2067 R2125	F2034-D2143 HydrophobicContact CD2-CB 3.86Å; F2034-D2143 HydrophobicContact CE2-CB 4.21Å; Y2064-D2143 HydrophobicContact CE2-CB 4.24Å; Y2064-D2143 PolarHBondContact OH-OD2 3.3Å; C2065-D2143 WeakPolarHBondContact O-CB 3.06Å; C2065-D2143 PolarHBondContact O-N 2.8Å; Q2067-D2143 WeakPolarHBondContact CA-O 3.5Å; Q2067-D2143 PolarHBondContact N-OD2 3.28Å; R2125-D2143 PolarHBondContact NH2-O 3.01Å
2144	E	72.2	Confident	70.9	Confident	65 Å²	65	32.5 Å²	32.5	30%	0.304	18%	0.183	S	C	.	.	S	Bend	trans	56.4	63.8	-172.9	-60.8	177.8	168.1	0	0	112.8	K2030 Q2067 R2125 T2146 A2147	K2030-E2144 IonicContact NZ-OE1 2.69Å; Q2067-E2144 PolarHBondContact NE2-OE2 2.92Å; R2125-E2144 PolarHBondContact NE-O 2.93Å; R2125-E2144 PolarHBondContact NH2-O 3.5Å; E2144-T2146 PolarHBondContact O-N 3.22Å; E2144-T2146 VanDerWaalsContact O-N 3.08Å; E2144-A2147 HydrophobicContact CB-CB 4.09Å; E2144-A2147 PolarHBondContact O-N 3.4Å
2145	P	70.7	Confident	70.1	Confident	16 Å²	16	34.2 Å²	34.2	10%	0.104	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.2	-171.5	26.9	-35.1	0	0	0	115	R2125 L2142 L2157	R2125-P2145 WeakPolarHBondContact CG-O 3.21Å; L2142-P2145 HydrophobicContact CB-CB 4.01Å; L2142-P2145 HydrophobicContact CB-CG 3.9Å; L2142-P2145 HydrophobicContact CD1-CB 4.21Å; L2142-P2145 HydrophobicContact CD1-CG 4.24Å; L2142-P2145 HydrophobicContact CG-CB 4.49Å; P2145-L2157 HydrophobicContact CB-CD2 4.26Å; P2145-L2157 VanDerWaalsContact O-CD2 3.31Å; P2145-L2157 WeakPolarHBondContact O-CD2 3.32Å
2146	T	70.7	Confident	70.2	Confident	9 Å²	9	36.1 Å²	36.1	6%	0.055	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-2.6	-170.9	42.9	0	0	0	0	113.9	E2144 G2148 M2149 R2154 L2157 W2158 E2172	E2144-T2146 PolarHBondContact O-N 3.22Å; E2144-T2146 VanDerWaalsContact O-N 3.08Å; T2146-G2148 PolarHBondContact O-N 2.86Å; T2146-M2149 WeakPolarHBondContact O-CB 3.12Å; T2146-M2149 PolarHBondContact O-N 3.34Å; T2146-M2149 VanDerWaalsContact O-N 3.09Å; T2146-R2154 HydrophobicContact CG2-CB 4.12Å; T2146-R2154 HydrophobicContact CG2-CG 3.84Å; T2146-L2157 HydrophobicContact CG2-CD2 4.21Å; T2146-W2158 HydrophobicContact CG2-CZ2 4.25Å; T2146-E2172 VanDerWaalsContact CB-OE1 3.22Å; T2146-E2172 WeakPolarHBondContact CB-OE1 3.36Å; T2146-E2172 PolarHBondContact OG1-OE1 2.87Å
2147	A	63.7	Low	70.3	Confident	45 Å²	45	29.9 Å²	29.9	37%	0.372	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	128.5	178.8	0	0	0	0	0	111.4	E2144 M2149	E2144-A2147 HydrophobicContact CB-CB 4.09Å; E2144-A2147 PolarHBondContact O-N 3.4Å; A2147-M2149 VanDerWaalsContact C-N 3.28Å; A2147-M2149 PolarHBondContact O-N 3.45Å
2148	G	57	Low	70.2	Confident	34 Å²	34	29.2 Å²	29.2	35%	0.351	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	17.7	-178.1	0	0	0	0	0	114.9	N948 T2146	N948-G2148 PolarHBondContact ND2-O 3.47Å; T2146-G2148 PolarHBondContact O-N 2.86Å
2149	M	68.1	Low	70	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.			trans	-102.6	138.5	170.4	-66.4	176.7	65.7	0	0	110.7	R2125 R2126 T2146 A2147 S2153 R2154 L2157	R2125-M2149 HydrophobicContact CB-CG 3.95Å; R2125-M2149 HydrophobicContact CB-SD 3.65Å; R2125-M2149 HydrophobicContact CG-CG 4.15Å; R2125-M2149 HydrophobicContact CG-SD 3.63Å; R2126-M2149 HydrophobicContact CG-CE 3.6Å; T2146-M2149 WeakPolarHBondContact O-CB 3.12Å; T2146-M2149 PolarHBondContact O-N 3.34Å; T2146-M2149 VanDerWaalsContact O-N 3.09Å; A2147-M2149 VanDerWaalsContact C-N 3.28Å; A2147-M2149 PolarHBondContact O-N 3.45Å; M2149-S2153 WeakPolarHBondContact CE-O 3.47Å; M2149-R2154 HydrophobicContact CB-CG 3.54Å; M2149-R2154 WeakPolarHBondContact O-CD 3.24Å; M2149-R2154 WeakPolarHBondContact O-CG 3.37Å; M2149-R2154 PolarHBondContact O-NE 2.99Å; M2149-L2157 HydrophobicContact CE-CB 4.01Å; M2149-L2157 HydrophobicContact CE-CD1 4.5Å; M2149-L2157 HydrophobicContact CE-CD2 4.08Å; M2149-L2157 HydrophobicContact CE-CG 4.43Å; M2149-L2157 HydrophobicContact SD-CD2 3.97Å
2150	D	63.1	Low	69.7	Low	3 Å²	3	28.5 Å²	28.5	2%	0.016	16%	0.156	C	C	.	.			trans	-65.1	159.6	172.1	52.7	-85.7	0	0	0	112.4	P947 N948 E2152 S2153 R2154	P947-D2150 HydrophobicContact CB-CB 4.23Å; N948-D2150 HydrophobicContact CB-CB 4.3Å; N948-D2150 WeakPolarHBondContact CB-OD1 3.35Å; N948-D2150 PolarHBondContact N-OD1 3.04Å; N948-D2150 VanDerWaalsContact N-OD1 3.13Å; N948-D2150 PolarHBondContact ND2-N 2.96Å; D2150-E2152 VanDerWaalsContact C-N 3.32Å; D2150-E2152 PolarHBondContact O-N 2.89Å; D2150-S2153 PolarHBondContact O-N 2.76Å; D2150-S2153 VanDerWaalsContact O-N 3.15Å; D2150-S2153 WeakPolarHBondContact OD1-CB 3.21Å; D2150-S2153 PolarHBondContact OD1-OG 2.66Å; D2150-S2153 WeakPolarHBondContact OD2-CB 3.49Å; D2150-S2153 PolarHBondContact OD2-N 3.17Å; D2150-S2153 PolarHBondContact OD2-OG 3.06Å; D2150-R2154 WeakPolarHBondContact O-CG 2.98Å; D2150-R2154 PolarHBondContact O-N 3Å
2151	P	61	Low	69.2	Low	14 Å²	14	26.1 Å²	26.1	9%	0.091	14%	0.143	C	C	.	.	H	α-helix	trans	-53.7	-43.5	-177	-24.8	31.6	0	0	0	114.1	H1101 F1103 R2154 R2155	H1101-P2151 WeakPolarHBondContact O-CD 3.47Å; H1101-P2151 WeakPolarHBondContact O-CG 3.42Å; F1103-P2151 HydrophobicContact CD2-CG 4.48Å; P2151-R2154 PolarHBondContact O-N 2.97Å; P2151-R2155 WeakPolarHBondContact O-CB 3.22Å; P2151-R2155 VanDerWaalsContact O-CG 3.26Å; P2151-R2155 WeakPolarHBondContact O-CG 3.33Å; P2151-R2155 PolarHBondContact O-N 3.35Å
2152	E	64.1	Low	68.3	Low	105 Å²	105	26.2 Å²	26.2	49%	0.491	14%	0.144	S	C	.	.	H	α-helix	trans	-62.2	-47.8	178.3	-173.3	-177.4	-178.7	0	0	111	D2150 R2154 F2156	D2150-E2152 VanDerWaalsContact C-N 3.32Å; D2150-E2152 PolarHBondContact O-N 2.89Å; E2152-R2154 PolarHBondContact O-N 2.87Å; E2152-F2156 VanDerWaalsContact O-CB 3.25Å; E2152-F2156 WeakPolarHBondContact O-CB 3.43Å; E2152-F2156 PolarHBondContact O-N 2.65Å
2153	S	66.7	Low	67.5	Low	7 Å²	7	30.8 Å²	30.8	5%	0.049	16%	0.164	C	C	.	.	H	α-helix	trans	-62.9	-36.9	174.9	-67.6	0	0	0	0	113.8	R2126 M2149 D2150 L2157	R2126-S2153 PolarHBondContact NH2-OG 2.85Å; M2149-S2153 WeakPolarHBondContact CE-O 3.47Å; D2150-S2153 PolarHBondContact O-N 2.76Å; D2150-S2153 VanDerWaalsContact O-N 3.15Å; D2150-S2153 WeakPolarHBondContact OD1-CB 3.21Å; D2150-S2153 PolarHBondContact OD1-OG 2.66Å; D2150-S2153 WeakPolarHBondContact OD2-CB 3.49Å; D2150-S2153 PolarHBondContact OD2-N 3.17Å; D2150-S2153 PolarHBondContact OD2-OG 3.06Å; S2153-L2157 WeakPolarHBondContact O-CB 3.28Å; S2153-L2157 PolarHBondContact O-N 2.81Å
2154	R	67.7	Low	66.8	Low	34 Å²	34	34.3 Å²	34.3	13%	0.128	18%	0.177	C	C	.	.	H	α-helix	trans	-67	-50.7	177.6	-73.9	-172	-72.5	143.1	1.9	111	T2146 M2149 D2150 P2151 E2152 F2156 L2157 W2158	T2146-R2154 HydrophobicContact CG2-CB 4.12Å; T2146-R2154 HydrophobicContact CG2-CG 3.84Å; M2149-R2154 HydrophobicContact CB-CG 3.54Å; M2149-R2154 WeakPolarHBondContact O-CD 3.24Å; M2149-R2154 WeakPolarHBondContact O-CG 3.37Å; M2149-R2154 PolarHBondContact O-NE 2.99Å; D2150-R2154 WeakPolarHBondContact O-CG 2.98Å; D2150-R2154 PolarHBondContact O-N 3Å; P2151-R2154 PolarHBondContact O-N 2.97Å; E2152-R2154 PolarHBondContact O-N 2.87Å; R2154-F2156 PolarHBondContact O-N 2.84Å; R2154-L2157 WeakPolarHBondContact O-CB 3.28Å; R2154-L2157 PolarHBondContact O-N 3.03Å; R2154-W2158 HydrophobicContact CB-CH2 3.81Å; R2154-W2158 HydrophobicContact CB-CZ2 3.68Å; R2154-W2158 HydrophobicContact CB-CZ3 4.31Å; R2154-W2158 HydrophobicContact CG-CZ2 4.42Å; R2154-W2158 VanDerWaalsContact O-CD2 3.28Å; R2154-W2158 VanDerWaalsContact O-CG 3.27Å; R2154-W2158 PolarHBondContact O-N 3.02Å
2155	R	63.4	Low	65.9	Low	36 Å²	36	33.8 Å²	33.8	14%	0.136	18%	0.176	C	C	.	.	H	α-helix	trans	-53.2	-55.6	174.6	-70.5	174.1	-173	-125.3	14.1	111.2	E1222 Q1226 P2151 L2157 W2158 D2159 M2170	E1222-R2155 IonicContact OE1-CZ 3.81Å; E1222-R2155 IonicContact OE1-NE 2.78Å; E1222-R2155 PolarHBondContact OE1-NE 3.01Å; E1222-R2155 IonicContact OE1-NH2 3.18Å; E1222-R2155 PolarHBondContact OE1-NH2 3.09Å; Q1226-R2155 VanDerWaalsContact CD-CZ 3.44Å; Q1226-R2155 VanDerWaalsContact NE2-CZ 3.3Å; Q1226-R2155 VanDerWaalsContact NE2-NH1 3.13Å; Q1226-R2155 VanDerWaalsContact OE1-CZ 3.28Å; P2151-R2155 WeakPolarHBondContact O-CB 3.22Å; P2151-R2155 VanDerWaalsContact O-CG 3.26Å; P2151-R2155 WeakPolarHBondContact O-CG 3.33Å; P2151-R2155 PolarHBondContact O-N 3.35Å; R2155-L2157 PolarHBondContact O-N 2.77Å; R2155-L2157 VanDerWaalsContact O-N 3.15Å; R2155-W2158 VanDerWaalsContact CA-CE3 3.45Å; R2155-W2158 HydrophobicContact CB-CE3 4.28Å; R2155-W2158 HydrophobicContact CB-CZ3 4.43Å; R2155-W2158 HydrophobicContact CG-CE3 3.96Å; R2155-W2158 HydrophobicContact CG-CZ3 3.67Å; R2155-W2158 WeakPolarHBondContact O-CB 3.26Å; R2155-W2158 PolarHBondContact O-N 2.68Å; R2155-D2159 PolarHBondContact O-N 3Å; R2155-M2170 HydrophobicContact CG-CE 3.94Å; R2155-M2170 HydrophobicContact CG-SD 3.6Å; R2155-M2170 VanDerWaalsContact CG-SD 3.6Å; R2155-M2170 VanDerWaalsContact NE-CE 3.28Å; R2155-M2170 PolarHBondContact NE-SD 2.73Å; R2155-M2170 PolarHBondContact NH1-SD 2.81Å
2156	F	70.8	Confident	64.6	Low	49 Å²	49	39.9 Å²	39.9	22%	0.215	20%	0.201	C	C	.	.	H	α-helix	trans	-51.1	-41	175.2	169	-91.8	0	0	0	113.1	R2105 F2106 E2152 R2154 V2160	R2105-F2156 WeakPolarHBondContact O-CE2 3.45Å; R2105-F2156 WeakPolarHBondContact O-CZ 3.48Å; F2106-F2156 HydrophobicContact CD1-CE1 4.26Å; E2152-F2156 VanDerWaalsContact O-CB 3.25Å; E2152-F2156 WeakPolarHBondContact O-CB 3.43Å; E2152-F2156 PolarHBondContact O-N 2.65Å; R2154-F2156 PolarHBondContact O-N 2.84Å; F2156-V2160 HydrophobicContact CE1-CG2 4.21Å; F2156-V2160 HydrophobicContact CE2-CG2 3.96Å; F2156-V2160 HydrophobicContact CZ-CG2 3.56Å; F2156-V2160 WeakPolarHBondContact O-CG2 3.4Å; F2156-V2160 PolarHBondContact O-N 3.15Å
2157	L	71.1	Confident	62.7	Low	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-70.5	-41.5	177.9	-165.1	78.5	0	0	0	112.5	F2106 R2126 T2129 P2145 T2146 M2149 S2153 R2154 R2155 D2159 V2160 I2161	F2106-L2157 HydrophobicContact CD1-CD1 4.38Å; F2106-L2157 HydrophobicContact CE1-CD1 3.94Å; R2126-L2157 HydrophobicContact CG-CD1 4.37Å; T2129-L2157 HydrophobicContact CG2-CD1 3.9Å; T2129-L2157 HydrophobicContact CG2-CD2 4.12Å; T2129-L2157 HydrophobicContact CG2-CG 4.19Å; P2145-L2157 HydrophobicContact CB-CD2 4.26Å; P2145-L2157 VanDerWaalsContact O-CD2 3.31Å; P2145-L2157 WeakPolarHBondContact O-CD2 3.32Å; T2146-L2157 HydrophobicContact CG2-CD2 4.21Å; M2149-L2157 HydrophobicContact CE-CB 4.01Å; M2149-L2157 HydrophobicContact CE-CD1 4.5Å; M2149-L2157 HydrophobicContact CE-CD2 4.08Å; M2149-L2157 HydrophobicContact CE-CG 4.43Å; M2149-L2157 HydrophobicContact SD-CD2 3.97Å; S2153-L2157 WeakPolarHBondContact O-CB 3.28Å; S2153-L2157 PolarHBondContact O-N 2.81Å; R2154-L2157 WeakPolarHBondContact O-CB 3.28Å; R2154-L2157 PolarHBondContact O-N 3.03Å; R2155-L2157 PolarHBondContact O-N 2.77Å; R2155-L2157 VanDerWaalsContact O-N 3.15Å; L2157-D2159 VanDerWaalsContact C-N 3.34Å; L2157-V2160 PolarHBondContact O-N 3.15Å; L2157-I2161 HydrophobicContact CD2-CD1 4.42Å; L2157-I2161 HydrophobicContact CG-CD1 4.19Å; L2157-I2161 VanDerWaalsContact O-CG1 3.31Å; L2157-I2161 WeakPolarHBondContact O-CG1 3.43Å; L2157-I2161 PolarHBondContact O-N 3.05Å; L2157-I2161 VanDerWaalsContact O-N 3.09Å
2158	W	68.9	Low	61.2	Low	5 Å²	5	42.4 Å²	42.4	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-43.3	175.3	-58.5	-36	0	0	0	111.3	T2146 R2154 R2155 V2160 I2161 L2162 M2170 E2171 E2172 I2175 L2176	T2146-W2158 HydrophobicContact CG2-CZ2 4.25Å; R2154-W2158 HydrophobicContact CB-CH2 3.81Å; R2154-W2158 HydrophobicContact CB-CZ2 3.68Å; R2154-W2158 HydrophobicContact CB-CZ3 4.31Å; R2154-W2158 HydrophobicContact CG-CZ2 4.42Å; R2154-W2158 VanDerWaalsContact O-CD2 3.28Å; R2154-W2158 VanDerWaalsContact O-CG 3.27Å; R2154-W2158 PolarHBondContact O-N 3.02Å; R2155-W2158 VanDerWaalsContact CA-CE3 3.45Å; R2155-W2158 HydrophobicContact CB-CE3 4.28Å; R2155-W2158 HydrophobicContact CB-CZ3 4.43Å; R2155-W2158 HydrophobicContact CG-CE3 3.96Å; R2155-W2158 HydrophobicContact CG-CZ3 3.67Å; R2155-W2158 WeakPolarHBondContact O-CB 3.26Å; R2155-W2158 PolarHBondContact O-N 2.68Å; W2158-V2160 VanDerWaalsContact C-N 3.29Å; W2158-V2160 PolarHBondContact O-N 2.89Å; W2158-I2161 CarbonylContact O-C 3.23Å; W2158-I2161 PolarHBondContact O-N 3.45Å; W2158-L2162 WeakPolarHBondContact O-CB 3.02Å; W2158-L2162 VanDerWaalsContact O-CG 3.28Å; W2158-L2162 WeakPolarHBondContact O-CG 3.18Å; W2158-L2162 PolarHBondContact O-N 3.26Å; W2158-M2170 HydrophobicContact CE3-CG 3.91Å; W2158-M2170 HydrophobicContact CE3-SD 4.39Å; W2158-M2170 HydrophobicContact CH2-CE 4.29Å; W2158-M2170 HydrophobicContact CZ3-CE 3.61Å; W2158-M2170 HydrophobicContact CZ3-CG 3.72Å; W2158-M2170 HydrophobicContact CZ3-SD 3.93Å; W2158-E2171 WeakPolarHBondContact CH2-O 3.32Å; W2158-E2171 WeakPolarHBondContact CZ2-O 3.23Å; W2158-E2171 WeakPolarHBondContact CZ3-O 2.83Å; W2158-E2172 HydrophobicContact CH2-CB 4.44Å; W2158-E2172 HydrophobicContact CZ2-CB 3.85Å; W2158-E2172 HydrophobicContact CZ2-CG 3.64Å; W2158-E2172 WeakPolarHBondContact CZ2-OE1 3.24Å; W2158-I2175 HydrophobicContact CB-CD1 4.05Å; W2158-I2175 HydrophobicContact CD2-CD1 3.38Å; W2158-I2175 HydrophobicContact CE3-CD1 3.31Å; W2158-I2175 HydrophobicContact CG-CD1 3.72Å; W2158-I2175 HydrophobicContact CZ3-CD1 3.97Å; W2158-L2176 HydrophobicContact CB-CD2 4.47Å
2159	D	67.6	Low	60.2	Low	58 Å²	58	44.5 Å²	44.5	31%	0.31	23%	0.225	S	C	.	.	H	α-helix	trans	-56	-45.3	177.9	-57.4	-21.6	0	0	0	110.8	R2155 L2157 I2161 L2162 E2163 H2169	R2155-D2159 PolarHBondContact O-N 3Å; L2157-D2159 VanDerWaalsContact C-N 3.34Å; D2159-I2161 PolarHBondContact O-N 3.4Å; D2159-L2162 PolarHBondContact O-N 2.71Å; D2159-E2163 WeakPolarHBondContact O-CG 2.89Å; D2159-E2163 PolarHBondContact O-N 3.04Å; D2159-H2169 IonicContact OD1-CE1 3.01Å; D2159-H2169 PolarHBondContact OD1-CE1 3.47Å; D2159-H2169 VanDerWaalsContact OD1-CE1 3.29Å; D2159-H2169 IonicContact OD1-CG 3.35Å; D2159-H2169 IonicContact OD1-ND1 3.01Å; D2159-H2169 PolarHBondContact OD1-ND1 2.99Å
2160	V	72.6	Confident	59	Low	10 Å²	10	45.8 Å²	45.8	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-67.6	-32.6	177.1	175	0	0	0	0	113.1	R2105 F2106 L2133 F2156 L2157 W2158	R2105-V2160 HydrophobicContact CG-CG2 4.31Å; F2106-V2160 HydrophobicContact CE1-CG1 3.95Å; F2106-V2160 HydrophobicContact CE2-CG1 3.98Å; F2106-V2160 HydrophobicContact CZ-CG1 3.53Å; L2133-V2160 HydrophobicContact CD1-CG1 4.35Å; F2156-V2160 HydrophobicContact CE1-CG2 4.21Å; F2156-V2160 HydrophobicContact CE2-CG2 3.96Å; F2156-V2160 HydrophobicContact CZ-CG2 3.56Å; F2156-V2160 WeakPolarHBondContact O-CG2 3.4Å; F2156-V2160 PolarHBondContact O-N 3.15Å; L2157-V2160 PolarHBondContact O-N 3.15Å; W2158-V2160 VanDerWaalsContact C-N 3.29Å; W2158-V2160 PolarHBondContact O-N 2.89Å
2161	I	71.6	Confident	58.2	Low	4 Å²	4	49.6 Å²	49.6	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-71.4	-43.9	174.6	-67.2	162.5	0	0	0	110.3	T2129 L2133 L2142 L2157 W2158 D2159 R2164 I2165 L2176	T2129-I2161 HydrophobicContact CG2-CD1 4.35Å; L2133-I2161 HydrophobicContact CD1-CG1 4.16Å; L2142-I2161 HydrophobicContact CD1-CD1 3.82Å; L2142-I2161 HydrophobicContact CD1-CG1 4.45Å; L2157-I2161 HydrophobicContact CD2-CD1 4.42Å; L2157-I2161 HydrophobicContact CG-CD1 4.19Å; L2157-I2161 VanDerWaalsContact O-CG1 3.31Å; L2157-I2161 WeakPolarHBondContact O-CG1 3.43Å; L2157-I2161 PolarHBondContact O-N 3.05Å; L2157-I2161 VanDerWaalsContact O-N 3.09Å; W2158-I2161 CarbonylContact O-C 3.23Å; W2158-I2161 PolarHBondContact O-N 3.45Å; D2159-I2161 PolarHBondContact O-N 3.4Å; I2161-R2164 VanDerWaalsContact O-CB 3.32Å; I2161-R2164 WeakPolarHBondContact O-CB 3.22Å; I2161-R2164 PolarHBondContact O-N 3.4Å; I2161-I2165 HydrophobicContact CG2-CD1 3.88Å; I2161-I2165 PolarHBondContact O-N 3.3Å; I2161-L2176 HydrophobicContact CB-CD2 4.34Å; I2161-L2176 HydrophobicContact CG2-CD2 3.9Å
2162	L	66.2	Low	57.8	Low	13 Å²	13	52.6 Å²	52.6	7%	0.068	26%	0.261	C	S	.	.	H	α-helix	trans	-64.8	-42.8	179.8	-75	164.9	0	0	0	112.6	W2158 D2159 R2164 I2165 F2166 G2168 H2169 I2175 L2176	W2158-L2162 WeakPolarHBondContact O-CB 3.02Å; W2158-L2162 VanDerWaalsContact O-CG 3.28Å; W2158-L2162 WeakPolarHBondContact O-CG 3.18Å; W2158-L2162 PolarHBondContact O-N 3.26Å; D2159-L2162 PolarHBondContact O-N 2.71Å; L2162-R2164 PolarHBondContact O-N 3.45Å; L2162-I2165 PolarHBondContact O-N 3.05Å; L2162-F2166 CarbonylContact O-C 3.55Å; L2162-F2166 VanDerWaalsContact O-C 3.28Å; L2162-F2166 PolarHBondContact O-N 3.23Å; L2162-G2168 WeakPolarHBondContact CD1-O 3.43Å; L2162-G2168 WeakPolarHBondContact CD2-O 3.34Å; L2162-H2169 HydrophobicContact CD1-CB 4.29Å; L2162-I2175 HydrophobicContact CD1-CG2 3.72Å; L2162-I2175 HydrophobicContact CD2-CG2 3.92Å; L2162-I2175 HydrophobicContact CG-CG2 4.17Å; L2162-L2176 HydrophobicContact CD2-CD2 4.17Å; L2162-L2176 HydrophobicContact CG-CD2 4.07Å
2163	E	65.4	Low	57.4	Low	134 Å²	134	49.4 Å²	49.4	63%	0.626	25%	0.25	S	S	*	.	H	α-helix	trans	-54	-23.3	171.4	-79	-171.3	136.6	0	0	113	R2105 D2159	R2105-E2163 IonicContact CZ-OE2 3.1Å; R2105-E2163 IonicContact NE-OE2 3.98Å; R2105-E2163 PolarHBondContact NE-OE2 2.98Å; R2105-E2163 VanDerWaalsContact NH2-CB 3.28Å; R2105-E2163 IonicContact NH2-OE2 2.66Å; R2105-E2163 PolarHBondContact NH2-OE2 2.98Å; D2159-E2163 WeakPolarHBondContact O-CG 2.89Å; D2159-E2163 PolarHBondContact O-N 3.04Å
2164	R	60	Low	56.9	Low	80 Å²	80	51.5 Å²	51.5	30%	0.302	26%	0.26	S	S	.	.	H	α-helix	trans	-92	-18.2	178.5	-151.9	72.4	164.5	160.1	-0.1	113.4	L2133 G2135 I2161 L2162	L2133-R2164 HydrophobicContact CD2-CG 4.28Å; G2135-R2164 PolarHBondContact O-NH2 3.33Å; I2161-R2164 VanDerWaalsContact O-CB 3.32Å; I2161-R2164 WeakPolarHBondContact O-CB 3.22Å; I2161-R2164 PolarHBondContact O-N 3.4Å; L2162-R2164 PolarHBondContact O-N 3.45Å
2165	I	54.8	Low	56.2	Low	54 Å²	54	51.1 Å²	51.1	28%	0.277	26%	0.26	S	S	.	.	H	α-helix	trans	-119.3	-38.8	-168	-64.7	179.7	0	0	0	113.5	I2161 L2162	I2161-I2165 HydrophobicContact CG2-CD1 3.88Å; I2161-I2165 PolarHBondContact O-N 3.3Å; L2162-I2165 PolarHBondContact O-N 3.05Å
2166	F	43.3	Very low	56.2	Low	143 Å²	143	50.6 Å²	50.6	63%	0.627	26%	0.26	S	S	*	.			trans	164.6	149.3	164.3	-100.2	-152.4	0	0	0	107.3	L2162	L2162-F2166 CarbonylContact O-C 3.55Å; L2162-F2166 VanDerWaalsContact O-C 3.28Å; L2162-F2166 PolarHBondContact O-N 3.23Å
2167	A	30.4	Very low	56.2	Low	91 Å²	91	48.6 Å²	48.6	75%	0.752	25%	0.252	S	S	*	.	S	Bend	trans	-71.8	132.3	-173.1	0	0	0	0	0	114.8
2168	G	31.4	Very low	56.3	Low	16 Å²	16	51.5 Å²	51.5	17%	0.165	27%	0.269	C	S	.	.			trans	149.2	141	170.1	0	0	0	0	0	115.1	L2162	L2162-G2168 WeakPolarHBondContact CD1-O 3.43Å; L2162-G2168 WeakPolarHBondContact CD2-O 3.34Å
2169	H	36.4	Very low	56.8	Low	79 Å²	79	52.5 Å²	52.5	37%	0.366	27%	0.273	S	S	.	.			trans	-136.7	160.9	-167	-34.5	-121.6	0	0	0	110	D2159 L2162	D2159-H2169 IonicContact OD1-CE1 3.01Å; D2159-H2169 PolarHBondContact OD1-CE1 3.47Å; D2159-H2169 VanDerWaalsContact OD1-CE1 3.29Å; D2159-H2169 IonicContact OD1-CG 3.35Å; D2159-H2169 IonicContact OD1-ND1 3.01Å; D2159-H2169 PolarHBondContact OD1-ND1 2.99Å; L2162-H2169 HydrophobicContact CD1-CB 4.29Å
2170	M	42.3	Very low	57.4	Low	26 Å²	26	49.7 Å²	49.7	13%	0.128	26%	0.258	C	S	.	.			cis	-151.3	149.4	-1.6	160.5	-162.4	157.5	0	0	107.2	R1177 R2155 W2158 I2175	R1177-M2170 VanDerWaalsContact CZ-C 3.4Å; R1177-M2170 PolarHBondContact NE-O 3.3Å; R1177-M2170 PolarHBondContact NH1-O 3.1Å; R1177-M2170 PolarHBondContact NH2-O 3.48Å; R1177-M2170 PolarHBondContact NH2-SD 3.16Å; R2155-M2170 HydrophobicContact CG-CE 3.94Å; R2155-M2170 HydrophobicContact CG-SD 3.6Å; R2155-M2170 VanDerWaalsContact CG-SD 3.6Å; R2155-M2170 VanDerWaalsContact NE-CE 3.28Å; R2155-M2170 PolarHBondContact NE-SD 2.73Å; R2155-M2170 PolarHBondContact NH1-SD 2.81Å; W2158-M2170 HydrophobicContact CE3-CG 3.91Å; W2158-M2170 HydrophobicContact CE3-SD 4.39Å; W2158-M2170 HydrophobicContact CH2-CE 4.29Å; W2158-M2170 HydrophobicContact CZ3-CE 3.61Å; W2158-M2170 HydrophobicContact CZ3-CG 3.72Å; W2158-M2170 HydrophobicContact CZ3-SD 3.93Å; M2170-I2175 VanDerWaalsContact C-CG1 3.45Å; M2170-I2175 VanDerWaalsContact CA-CG1 3.45Å; M2170-I2175 HydrophobicContact CB-CD1 3.96Å; M2170-I2175 HydrophobicContact CB-CG1 4.35Å; M2170-I2175 HydrophobicContact CG-CD1 3.77Å; M2170-I2175 HydrophobicContact CG-CG1 4.43Å
2171	E	46	Very low	57.7	Low	84 Å²	84	49.2 Å²	49.2	39%	0.393	26%	0.255	S	S	.	.	S	Bend		-132.1	-70.9	98.5	-141.6	65.2	-96	0	0	118.3	R1177 W2158 E2174 I2175	R1177-E2171 IonicContact CZ-OE1 3.18Å; R1177-E2171 IonicContact CZ-OE2 3.3Å; R1177-E2171 VanDerWaalsContact CZ-OE2 3.3Å; R1177-E2171 IonicContact NH1-OE1 3.88Å; R1177-E2171 IonicContact NH1-OE2 2.72Å; R1177-E2171 PolarHBondContact NH1-OE2 3.44Å; R1177-E2171 IonicContact NH2-OE1 3.63Å; R1177-E2171 PolarHBondContact NH2-OE1 3.08Å; R1177-E2171 IonicContact NH2-OE2 2.73Å; R1177-E2171 PolarHBondContact NH2-OE2 2.85Å; W2158-E2171 WeakPolarHBondContact CH2-O 3.32Å; W2158-E2171 WeakPolarHBondContact CZ2-O 3.23Å; W2158-E2171 WeakPolarHBondContact CZ3-O 2.83Å; E2171-E2174 HydrophobicContact CB-CB 4.27Å; E2171-I2175 VanDerWaalsContact C-CD1 3.47Å; E2171-I2175 WeakPolarHBondContact O-CD1 3.11Å
2172	E	53.9	Low	58	Low	76 Å²	76	49.1 Å²	49.1	36%	0.355	26%	0.255	S	S	.	.	S	Bend	trans	-144.3	-94.8	159.8	-168.4	170.4	-107.3	0	0	114.1	T2146 W2158 E2174 I2175 L2176	T2146-E2172 VanDerWaalsContact CB-OE1 3.22Å; T2146-E2172 WeakPolarHBondContact CB-OE1 3.36Å; T2146-E2172 PolarHBondContact OG1-OE1 2.87Å; W2158-E2172 HydrophobicContact CH2-CB 4.44Å; W2158-E2172 HydrophobicContact CZ2-CB 3.85Å; W2158-E2172 HydrophobicContact CZ2-CG 3.64Å; W2158-E2172 WeakPolarHBondContact CZ2-OE1 3.24Å; E2172-E2174 PolarHBondContact O-N 3.23Å; E2172-I2175 WeakPolarHBondContact O-CA 3.46Å; E2172-I2175 WeakPolarHBondContact O-CB 3.39Å; E2172-I2175 WeakPolarHBondContact O-CG1 3.41Å; E2172-I2175 PolarHBondContact O-N 3.06Å; E2172-L2176 PolarHBondContact O-N 3.23Å; E2172-L2176 VanDerWaalsContact O-N 3.13Å
2173	C	54.6	Low	58.5	Low	39 Å²	39	48.6 Å²	48.6	26%	0.264	25%	0.252	S	S	.	.	H	α-helix	trans	-62.4	-29	165.9	-89	0	0	0	0	111.1	L2023 I2175 L2176 C2177	L2023-C2173 HydrophobicContact CD1-CB 4.26Å; C2173-I2175 PolarHBondContact O-N 3.21Å; C2173-L2176 PolarHBondContact O-N 3Å; C2173-C2177 WeakPolarHBondContact O-CB 3.37Å; C2173-C2177 PolarHBondContact O-N 3.44Å; C2173-C2177 VanDerWaalsContact O-N 3.16Å
2174	E	57.2	Low	58.7	Low	51 Å²	51	42.3 Å²	42.3	24%	0.238	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-17.4	167.5	-66.3	-161.7	-176.9	0	0	113.5	E2171 E2172 I2194 K2198 L2280	E2171-E2174 HydrophobicContact CB-CB 4.27Å; E2172-E2174 PolarHBondContact O-N 3.23Å; E2174-I2194 HydrophobicContact CB-CD1 4.49Å; E2174-I2194 HydrophobicContact CG-CG2 3.97Å; E2174-I2194 WeakPolarHBondContact O-CD1 3.2Å; E2174-K2198 WeakPolarHBondContact OE1-CE 3.46Å; E2174-K2198 IonicContact OE1-NZ 2.77Å; E2174-K2198 PolarHBondContact OE1-NZ 3.05Å; E2174-K2198 IonicContact OE2-NZ 3.16Å; E2174-K2198 PolarHBondContact OE2-NZ 3.3Å; E2174-L2280 HydrophobicContact CG-CB 4Å; E2174-L2280 HydrophobicContact CG-CD2 4.07Å; E2174-L2280 WeakPolarHBondContact OE1-CB 3.37Å; E2174-L2280 PolarHBondContact OE1-N 3.35Å
2175	I	53.5	Low	59.2	Low	26 Å²	26	43 Å²	43	13%	0.133	23%	0.229	C	C	.	.	H	α-helix	trans	-82.7	-65.5	168.5	-48.5	177.6	0	0	0	110.2	W2158 L2162 M2170 E2171 E2172 C2173	W2158-I2175 HydrophobicContact CB-CD1 4.05Å; W2158-I2175 HydrophobicContact CD2-CD1 3.38Å; W2158-I2175 HydrophobicContact CE3-CD1 3.31Å; W2158-I2175 HydrophobicContact CG-CD1 3.72Å; W2158-I2175 HydrophobicContact CZ3-CD1 3.97Å; L2162-I2175 HydrophobicContact CD1-CG2 3.72Å; L2162-I2175 HydrophobicContact CD2-CG2 3.92Å; L2162-I2175 HydrophobicContact CG-CG2 4.17Å; M2170-I2175 VanDerWaalsContact C-CG1 3.45Å; M2170-I2175 VanDerWaalsContact CA-CG1 3.45Å; M2170-I2175 HydrophobicContact CB-CD1 3.96Å; M2170-I2175 HydrophobicContact CB-CG1 4.35Å; M2170-I2175 HydrophobicContact CG-CD1 3.77Å; M2170-I2175 HydrophobicContact CG-CG1 4.43Å; E2171-I2175 VanDerWaalsContact C-CD1 3.47Å; E2171-I2175 WeakPolarHBondContact O-CD1 3.11Å; E2172-I2175 WeakPolarHBondContact O-CA 3.46Å; E2172-I2175 WeakPolarHBondContact O-CB 3.39Å; E2172-I2175 WeakPolarHBondContact O-CG1 3.41Å; E2172-I2175 PolarHBondContact O-N 3.06Å; C2173-I2175 PolarHBondContact O-N 3.21Å
2176	L	63.1	Low	59.9	Low	25 Å²	25	40.5 Å²	40.5	13%	0.131	22%	0.217	C	C	.	.	H	α-helix	trans	-80	-37.8	-148.9	-68.1	176.4	0	0	0	107.1	C2019 W2158 I2161 L2162 E2172 C2173	C2019-L2176 WeakPolarHBondContact CB-O 3.46Å; C2019-L2176 PolarHBondContact SG-O 3.25Å; W2158-L2176 HydrophobicContact CB-CD2 4.47Å; I2161-L2176 HydrophobicContact CB-CD2 4.34Å; I2161-L2176 HydrophobicContact CG2-CD2 3.9Å; L2162-L2176 HydrophobicContact CD2-CD2 4.17Å; L2162-L2176 HydrophobicContact CG-CD2 4.07Å; E2172-L2176 PolarHBondContact O-N 3.23Å; E2172-L2176 VanDerWaalsContact O-N 3.13Å; C2173-L2176 PolarHBondContact O-N 3Å
2177	C	71	Confident	61.5	Low	7 Å²	7	34.9 Å²	34.9	5%	0.047	20%	0.196	C	C	.	.			trans	-92.8	109.6	-165.9	-53.3	0	0	0	0	111.1	C2019 G2021 C2173 R2179 V2180 I2194	C2019-C2177 CarbonylContact O-C 3.51Å; C2019-C2177 WeakPolarHBondContact O-CA 3.48Å; G2021-C2177 WeakPolarHBondContact CA-SG 3.45Å; C2173-C2177 WeakPolarHBondContact O-CB 3.37Å; C2173-C2177 PolarHBondContact O-N 3.44Å; C2173-C2177 VanDerWaalsContact O-N 3.16Å; C2177-R2179 PolarHBondContact O-N 3.47Å; C2177-V2180 HydrophobicContact CB-CG2 3.89Å; C2177-I2194 WeakPolarHBondContact O-CD1 3.42Å
2178	T	72.5	Confident	63.7	Low	60 Å²	60	31.2 Å²	31.2	37%	0.368	16%	0.163	S	C	.	.	S	Bend	trans	-62.9	-26.4	170.5	47.7	0	0	0	0	112.3	E2018 C2019	E2018-T2178 WeakPolarHBondContact CG-OG1 3.24Å; C2019-T2178 PolarHBondContact N-OG1 2.88Å; C2019-T2178 PolarHBondContact O-N 3.26Å; C2019-T2178 PolarHBondContact O-OG1 3.31Å; C2019-T2178 VanDerWaalsContact O-OG1 3.13Å
2179	R	79	Confident	65.9	Low	26 Å²	26	32.5 Å²	32.5	10%	0.098	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	140.7	180	-151	172.3	87.2	-126.7	2	110.1	E1950 E2013 E2018 C2019 F2020 G2021 C2177	E1950-R2179 IonicContact OE1-CZ 2.7Å; E1950-R2179 IonicContact OE1-NH2 2.74Å; E1950-R2179 PolarHBondContact OE1-NH2 2.78Å; E2013-R2179 PolarHBondContact O-NH1 3.05Å; E2013-R2179 PolarHBondContact O-NH2 3.47Å; E2018-R2179 IonicContact OE1-CZ 2.65Å; E2018-R2179 IonicContact OE1-NE 3.66Å; E2018-R2179 IonicContact OE1-NH1 3.39Å; E2018-R2179 PolarHBondContact OE1-NH1 2.94Å; E2018-R2179 IonicContact OE2-NH1 2.67Å; E2018-R2179 PolarHBondContact OE2-NH1 2.98Å; C2019-R2179 PolarHBondContact O-N 3.47Å; F2020-R2179 WeakPolarHBondContact CA-O 3.36Å; F2020-R2179 HydrophobicContact CD2-CB 4.16Å; G2021-R2179 PolarHBondContact N-O 3.36Å; C2177-R2179 PolarHBondContact O-N 3.47Å
2180	V	79.4	Confident	67.9	Low	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.4	-174	170.4	0	0	0	0	110.3	G2021 L2023 C2177 I2182 L2191 D2192 I2194 L2197	G2021-V2180 WeakPolarHBondContact O-CA 3.35Å; L2023-V2180 HydrophobicContact CD1-CG1 3.76Å; C2177-V2180 HydrophobicContact CB-CG2 3.89Å; V2180-I2182 HydrophobicContact CG1-CG1 4.42Å; V2180-L2191 WeakPolarHBondContact O-CA 3.37Å; V2180-D2192 PolarHBondContact N-O 3.34Å; V2180-D2192 PolarHBondContact O-N 3.01Å; V2180-D2192 VanDerWaalsContact O-O 3.1Å; V2180-I2194 HydrophobicContact CG2-CG1 4.03Å; V2180-L2197 HydrophobicContact CB-CD1 3.86Å; V2180-L2197 HydrophobicContact CG1-CD1 3.75Å
2181	G	79.8	Confident	69.7	Low	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.2	168.8	0	0	0	0	0	111.7	G2021 L2023 C2190	G2021-G2181 PolarHBondContact O-N 2.87Å; L2023-G2181 PolarHBondContact N-O 3.31Å; G2181-C2190 WeakPolarHBondContact CA-O 3.41Å
2182	I	79	Confident	71.2	Confident	2 Å²	2	26 Å²	26	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.5	178.3	-55.5	-175.5	0	0	0	109.7	L2023 V2180 T2189 C2190 L2197 F2284 L2287	L2023-I2182 HydrophobicContact CB-CG1 4.28Å; V2180-I2182 HydrophobicContact CG1-CG1 4.42Å; I2182-T2189 PolarHBondContact O-N 3.48Å; I2182-T2189 PolarHBondContact O-OG1 3.44Å; I2182-T2189 VanDerWaalsContact O-OG1 3.07Å; I2182-C2190 PolarHBondContact N-O 3.4Å; I2182-L2197 HydrophobicContact CD1-CD1 4.41Å; I2182-F2284 HydrophobicContact CG2-CD2 4.37Å; I2182-L2287 HydrophobicContact CD1-CD1 3.93Å
2183	L	75	Confident	72.3	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.7	177.8	-91.9	152.2	0	0	0	112.1	V2010 L2022 L2023 G2024 A2028 K2030 S2187 F2188	V2010-L2183 HydrophobicContact CG2-CD2 4.14Å; L2022-L2183 HydrophobicContact CD2-CD1 3.61Å; L2023-L2183 PolarHBondContact O-N 3.48Å; G2024-L2183 WeakPolarHBondContact CA-O 3.48Å; A2028-L2183 HydrophobicContact CB-CB 4.23Å; A2028-L2183 WeakPolarHBondContact CB-O 3.49Å; K2030-L2183 HydrophobicContact CG-CD1 4.15Å; L2183-S2187 WeakPolarHBondContact CA-O 3.44Å; L2183-F2188 HydrophobicContact CG-CD1 4.25Å; L2183-F2188 HydrophobicContact CG-CE1 4.35Å
2184	A	70.4	Confident	73.1	Confident	2 Å²	2	23.7 Å²	23.7	2%	0.017	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	131.6	177.3	0	0	0	0	0	109.7	G2186 S2187 T2189	A2184-G2186 PolarHBondContact O-N 3.2Å; A2184-S2187 PolarHBondContact N-O 3.06Å; A2184-S2187 PolarHBondContact O-N 3.48Å; A2184-S2187 PolarHBondContact O-OG 2.84Å; A2184-S2187 VanDerWaalsContact O-OG 3.09Å; A2184-T2189 HydrophobicContact CB-CG2 3.54Å; A2184-T2189 WeakPolarHBondContact CB-OG1 3.29Å
2185	H	69.6	Low	73.6	Confident	94 Å²	94	22.6 Å²	22.6	44%	0.435	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	29.9	-179.4	-51.3	-86.3	0	0	0	114.5	D2295	H2185-D2295 IonicContact CE1-OD1 2.59Å
2186	G	69.8	Low	74.5	Confident	2 Å²	2	22 Å²	22	2%	0.021	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	-6.4	-178	0	0	0	0	0	116.1	V2006 V2007 D2008 V2010 A2028 A2184	V2006-G2186 WeakPolarHBondContact O-CA 3.11Å; V2007-G2186 CarbonylContact C-O 3.6Å; V2007-G2186 WeakPolarHBondContact CA-O 3.37Å; D2008-G2186 PolarHBondContact N-O 3.33Å; V2010-G2186 WeakPolarHBondContact CG2-O 3.13Å; A2028-G2186 WeakPolarHBondContact O-CA 3.43Å; A2028-G2186 PolarHBondContact O-N 3.17Å; A2184-G2186 PolarHBondContact O-N 3.2Å
2187	S	77	Confident	74.9	Confident	26 Å²	26	20.9 Å²	20.9	18%	0.182	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	158.6	178.8	40.6	0	0	0	0	112	D2008 L2183 A2184 T2189	D2008-S2187 WeakPolarHBondContact O-CB 3.47Å; L2183-S2187 WeakPolarHBondContact CA-O 3.44Å; A2184-S2187 PolarHBondContact N-O 3.06Å; A2184-S2187 PolarHBondContact O-N 3.48Å; A2184-S2187 PolarHBondContact O-OG 2.84Å; A2184-S2187 VanDerWaalsContact O-OG 3.09Å; S2187-T2189 PolarHBondContact O-N 3.32Å
2188	F	77.4	Confident	75	Confident	13 Å²	13	21.3 Å²	21.3	6%	0.057	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	126.8	168.9	-80.3	-52.5	0	0	0	110.3	V1947 V2010 C2011 F2012 F2020 L2022 L2183 L2191	V1947-F2188 HydrophobicContact CG1-CB 3.77Å; V1947-F2188 HydrophobicContact CG2-CB 4.22Å; V2010-F2188 HydrophobicContact CG1-CD2 4.05Å; V2010-F2188 HydrophobicContact CG1-CE2 3.62Å; V2010-F2188 HydrophobicContact CG1-CZ 4.15Å; C2011-F2188 WeakPolarHBondContact O-CE2 3.37Å; F2012-F2188 HydrophobicContact CB-CE2 4.07Å; F2012-F2188 HydrophobicContact CB-CZ 4.48Å; F2012-F2188 AromaticContact CD1-CE2 3.76Å; F2012-F2188 HydrophobicContact CD1-CE2 3.76Å; F2012-F2188 AromaticContact CD1-CZ 3.94Å; F2012-F2188 HydrophobicContact CD1-CZ 3.94Å; F2012-F2188 HydrophobicContact CE1-CZ 4.49Å; F2012-F2188 HydrophobicContact CG-CE2 4.23Å; F2012-F2188 HydrophobicContact CG-CZ 4.34Å; F2020-F2188 HydrophobicContact CE1-CZ 4.14Å; F2020-F2188 HydrophobicContact CZ-CE1 4.42Å; F2020-F2188 AromaticContact CZ-CZ 3.91Å; F2020-F2188 HydrophobicContact CZ-CZ 3.91Å; L2022-F2188 HydrophobicContact CD2-CE1 3.65Å; L2022-F2188 HydrophobicContact CD2-CZ 3.81Å; L2183-F2188 HydrophobicContact CG-CD1 4.25Å; L2183-F2188 HydrophobicContact CG-CE1 4.35Å; F2188-L2191 HydrophobicContact CD2-CD1 4.38Å; F2188-L2191 HydrophobicContact CE2-CD1 4.12Å; F2188-L2191 HydrophobicContact CZ-CD1 4.2Å
2189	T	76.6	Confident	74.9	Confident	43 Å²	43	23 Å²	23	26%	0.264	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-43.2	170.7	18	0	0	0	0	112	D1944 I2182 A2184 S2187	D1944-T2189 WeakPolarHBondContact CB-O 3.47Å; I2182-T2189 PolarHBondContact O-N 3.48Å; I2182-T2189 PolarHBondContact O-OG1 3.44Å; I2182-T2189 VanDerWaalsContact O-OG1 3.07Å; A2184-T2189 HydrophobicContact CB-CG2 3.54Å; A2184-T2189 WeakPolarHBondContact CB-OG1 3.29Å; S2187-T2189 PolarHBondContact O-N 3.32Å
2190	C	78.4	Confident	74.5	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	149.6	179.9	45.2	0	0	0	0	110.7	D1944 G2181 I2182 L2197 F2201	D1944-C2190 HydrophobicContact CB-CB 4.33Å; G2181-C2190 WeakPolarHBondContact CA-O 3.41Å; I2182-C2190 PolarHBondContact N-O 3.4Å; C2190-L2197 HydrophobicContact CB-CD2 4.11Å; C2190-F2201 HydrophobicContact CB-CE2 3.54Å; C2190-F2201 HydrophobicContact CB-CZ 3.6Å
2191	L	80.5	Confident	74	Confident	9 Å²	9	28.8 Å²	28.8	5%	0.047	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	118.8	-176.1	-179	145.3	0	0	0	109.5	N1946 V1947 E1950 F2020 V2180 F2188	N1946-L2191 VanDerWaalsContact CB-O 3.22Å; N1946-L2191 WeakPolarHBondContact CB-O 3.22Å; V1947-L2191 HydrophobicContact CG2-CB 3.88Å; E1950-L2191 HydrophobicContact CB-CD2 4.08Å; E1950-L2191 HydrophobicContact CG-CD1 4.33Å; E1950-L2191 HydrophobicContact CG-CD2 4.01Å; F2020-L2191 HydrophobicContact CE2-CD1 3.93Å; F2020-L2191 HydrophobicContact CE2-CG 4.45Å; F2020-L2191 HydrophobicContact CZ-CD1 3.82Å; V2180-L2191 WeakPolarHBondContact O-CA 3.37Å; F2188-L2191 HydrophobicContact CD2-CD1 4.38Å; F2188-L2191 HydrophobicContact CE2-CD1 4.12Å; F2188-L2191 HydrophobicContact CZ-CD1 4.2Å
2192	D	77.9	Confident	73.2	Confident	43 Å²	43	29.3 Å²	29.3	23%	0.23	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	-178.1	179.8	-149.6	-39.2	0	0	0	110.3	N1946 V2180 L2197	N1946-D2192 PolarHBondContact ND2-OD2 3.3Å; V2180-D2192 PolarHBondContact N-O 3.34Å; V2180-D2192 PolarHBondContact O-N 3.01Å; V2180-D2192 VanDerWaalsContact O-O 3.1Å; D2192-L2197 HydrophobicContact CB-CD2 4.03Å; D2192-L2197 HydrophobicContact CB-CG 4Å
2193	T	75.9	Confident	72.6	Confident	59 Å²	59	34.1 Å²	34.1	36%	0.362	18%	0.18	S	C	.	.			trans	-61.9	157.6	159.3	62	0	0	0	0	111.3	Q2195 G2196 L2197	T2193-Q2195 VanDerWaalsContact C-N 3.33Å; T2193-Q2195 PolarHBondContact O-N 3.45Å; T2193-G2196 WeakPolarHBondContact O-CA 3.47Å; T2193-G2196 PolarHBondContact O-N 3.13Å; T2193-G2196 VanDerWaalsContact O-N 3.12Å; T2193-G2196 PolarHBondContact OG1-N 3.28Å; T2193-G2196 VanDerWaalsContact OG1-N 3.08Å; T2193-L2197 PolarHBondContact O-N 2.97Å
2194	I	71.4	Confident	72.5	Confident	7 Å²	7	34.6 Å²	34.6	4%	0.036	19%	0.185	C	C	.	.	H	α-helix	trans	-55	-46.9	179.1	-65.1	147.1	0	0	0	111.6	E2174 C2177 V2180 L2197 K2198	E2174-I2194 HydrophobicContact CB-CD1 4.49Å; E2174-I2194 HydrophobicContact CG-CG2 3.97Å; E2174-I2194 WeakPolarHBondContact O-CD1 3.2Å; C2177-I2194 WeakPolarHBondContact O-CD1 3.42Å; V2180-I2194 HydrophobicContact CG2-CG1 4.03Å; I2194-L2197 PolarHBondContact O-N 3.06Å; I2194-K2198 HydrophobicContact CG2-CD 4.24Å; I2194-K2198 WeakPolarHBondContact O-CG 3.37Å; I2194-K2198 PolarHBondContact O-N 3.02Å
2195	Q	68.3	Low	72.7	Confident	28 Å²	28	36 Å²	36	13%	0.131	19%	0.19	C	C	.	.	H	α-helix	trans	-75.4	-26.7	179.4	-70.3	-64.6	-6.9	0	0	112.9	T1143 T2193 K2198 N2199	T1143-Q2195 HydrophobicContact CG2-CG 3.98Å; T1143-Q2195 VanDerWaalsContact CG2-NE2 3.26Å; T2193-Q2195 VanDerWaalsContact C-N 3.33Å; T2193-Q2195 PolarHBondContact O-N 3.45Å; Q2195-K2198 PolarHBondContact O-N 3.11Å; Q2195-N2199 VanDerWaalsContact O-CB 3.26Å; Q2195-N2199 WeakPolarHBondContact O-CB 3.3Å; Q2195-N2199 PolarHBondContact O-N 3.03Å; Q2195-N2199 PolarHBondContact O-ND2 3.05Å
2196	G	72.7	Confident	72.9	Confident	15 Å²	15	32.3 Å²	32.3	16%	0.155	17%	0.173	C	C	.	.	H	α-helix	trans	-58.2	-49.9	165.4	0	0	0	0	0	111.4	T2193 N2199 K2200	T2193-G2196 WeakPolarHBondContact O-CA 3.47Å; T2193-G2196 PolarHBondContact O-N 3.13Å; T2193-G2196 VanDerWaalsContact O-N 3.12Å; T2193-G2196 PolarHBondContact OG1-N 3.28Å; T2193-G2196 VanDerWaalsContact OG1-N 3.08Å; G2196-N2199 PolarHBondContact O-N 3.29Å; G2196-K2200 WeakPolarHBondContact O-CB 3.45Å; G2196-K2200 PolarHBondContact O-N 3.44Å
2197	L	72.6	Confident	73.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-45.1	176	-66.8	174.6	0	0	0	112.6	V2180 I2182 C2190 D2192 T2193 I2194 N2199 K2200 F2201 L2280	V2180-L2197 HydrophobicContact CB-CD1 3.86Å; V2180-L2197 HydrophobicContact CG1-CD1 3.75Å; I2182-L2197 HydrophobicContact CD1-CD1 4.41Å; C2190-L2197 HydrophobicContact CB-CD2 4.11Å; D2192-L2197 HydrophobicContact CB-CD2 4.03Å; D2192-L2197 HydrophobicContact CB-CG 4Å; T2193-L2197 PolarHBondContact O-N 2.97Å; I2194-L2197 PolarHBondContact O-N 3.06Å; L2197-N2199 PolarHBondContact O-N 3.23Å; L2197-K2200 PolarHBondContact O-N 3.07Å; L2197-F2201 HydrophobicContact CD2-CD2 3.93Å; L2197-F2201 HydrophobicContact CD2-CE2 3.89Å; L2197-F2201 PolarHBondContact O-N 3.43Å; L2197-L2280 HydrophobicContact CB-CD1 4.17Å; L2197-L2280 HydrophobicContact CD1-CD1 4.03Å
2198	K	72.6	Confident	73.3	Confident	16 Å²	16	31.9 Å²	31.9	7%	0.07	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-38.3	177.1	-74.4	179.4	175.9	179.8	0	112.5	E2174 I2194 Q2195 G2202	E2174-K2198 WeakPolarHBondContact OE1-CE 3.46Å; E2174-K2198 IonicContact OE1-NZ 2.77Å; E2174-K2198 PolarHBondContact OE1-NZ 3.05Å; E2174-K2198 IonicContact OE2-NZ 3.16Å; E2174-K2198 PolarHBondContact OE2-NZ 3.3Å; I2194-K2198 HydrophobicContact CG2-CD 4.24Å; I2194-K2198 WeakPolarHBondContact O-CG 3.37Å; I2194-K2198 PolarHBondContact O-N 3.02Å; Q2195-K2198 PolarHBondContact O-N 3.11Å; K2198-G2202 WeakPolarHBondContact O-CA 3.29Å; K2198-G2202 PolarHBondContact O-N 3.36Å
2199	N	70.2	Confident	73.4	Confident	97 Å²	97	31.3 Å²	31.3	52%	0.519	17%	0.168	S	C	.	.	H	α-helix	trans	-78.2	-33	178.6	-69.5	-19.2	0	0	0	113.1	Q2195 G2196 L2197	Q2195-N2199 VanDerWaalsContact O-CB 3.26Å; Q2195-N2199 WeakPolarHBondContact O-CB 3.3Å; Q2195-N2199 PolarHBondContact O-N 3.03Å; Q2195-N2199 PolarHBondContact O-ND2 3.05Å; G2196-N2199 PolarHBondContact O-N 3.29Å; L2197-N2199 PolarHBondContact O-N 3.23Å
2200	K	69.6	Low	73.2	Confident	92 Å²	92	30.1 Å²	30.1	40%	0.4	16%	0.159	S	C	.	.	H	α-helix	trans	-85.1	-35.9	-175.6	-161.8	179.9	-165.8	-175.3	0	113.2	D1944 N1946 G2196 L2197	D1944-K2200 IonicContact OD1-NZ 2.77Å; D1944-K2200 PolarHBondContact OD1-NZ 3.27Å; D1944-K2200 IonicContact OD2-NZ 3.9Å; D1944-K2200 PolarHBondContact OD2-NZ 2.43Å; N1946-K2200 PolarHBondContact ND2-NZ 3.19Å; G2196-K2200 WeakPolarHBondContact O-CB 3.45Å; G2196-K2200 PolarHBondContact O-N 3.44Å; L2197-K2200 PolarHBondContact O-N 3.07Å
2201	F	70	Confident	73.1	Confident	54 Å²	54	30.1 Å²	30.1	24%	0.237	16%	0.159	C	C	.	.	H	α-helix	trans	-117.4	-13.9	-177.2	-60.6	-78.5	0	0	0	114.1	C2190 L2197 V2283 L2287	C2190-F2201 HydrophobicContact CB-CE2 3.54Å; C2190-F2201 HydrophobicContact CB-CZ 3.6Å; L2197-F2201 HydrophobicContact CD2-CD2 3.93Å; L2197-F2201 HydrophobicContact CD2-CE2 3.89Å; L2197-F2201 PolarHBondContact O-N 3.43Å; F2201-V2283 HydrophobicContact CB-CG1 3.61Å; F2201-L2287 HydrophobicContact CD1-CD2 4.34Å
2202	G	62.7	Low	72.5	Confident	12 Å²	12	32.8 Å²	32.8	12%	0.124	17%	0.173	C	C	.	.	S	Bend	trans	-82.4	136.8	172.8	0	0	0	0	0	111.5	K2198 G2204 T2278	K2198-G2202 WeakPolarHBondContact O-CA 3.29Å; K2198-G2202 PolarHBondContact O-N 3.36Å; G2202-G2204 PolarHBondContact O-N 3.26Å; G2202-G2204 VanDerWaalsContact O-N 3.16Å; G2202-T2278 WeakPolarHBondContact CA-OG1 3.48Å
2203	H	66.9	Low	71.7	Confident	103 Å²	103	33.3 Å²	33.3	48%	0.477	19%	0.188	S	C	.	.			trans	-83.4	22.4	-176	-67.4	-37.4	0	0	0	114.4	Q2246 L2247	H2203-Q2246 HydrophobicContact CB-CB 4.44Å; H2203-Q2246 HydrophobicContact CB-CG 4.45Å; H2203-Q2246 PolarHBondContact CD2-OE1 3.04Å; H2203-L2247 CarbonylContact O-C 3.57Å
2204	G	72.7	Confident	71	Confident	11 Å²	11	33.7 Å²	33.7	11%	0.113	20%	0.204	C	C	.	.	S	Bend	trans	102.4	-122.4	176.8	0	0	0	0	0	113.7	G2202 L2247 T2278	G2202-G2204 PolarHBondContact O-N 3.26Å; G2202-G2204 VanDerWaalsContact O-N 3.16Å; G2204-L2247 WeakPolarHBondContact CA-O 3.36Å; G2204-T2278 PolarHBondContact O-N 2.85Å; G2204-T2278 VanDerWaalsContact O-N 3.14Å; G2204-T2278 PolarHBondContact O-OG1 2.63Å
2205	Y	74	Confident	70.8	Confident	30 Å²	30	35.8 Å²	35.8	12%	0.118	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	159.8	179.1	-64.6	-80.8	0	0	0	111	Y1214 Q2246 L2247 V2254 N2276	Y1214-Y2205 WeakPolarHBondContact O-CE1 3.2Å; Y2205-Q2246 WeakPolarHBondContact O-CA 3.25Å; Y2205-L2247 PolarHBondContact N-O 3.1Å; Y2205-L2247 PolarHBondContact O-N 3.18Å; Y2205-V2254 HydrophobicContact CD1-CG2 4.18Å; Y2205-V2254 HydrophobicContact CD2-CG2 4Å; Y2205-V2254 HydrophobicContact CE1-CG2 3.94Å; Y2205-V2254 HydrophobicContact CE2-CG2 3.75Å; Y2205-V2254 HydrophobicContact CG-CG2 4.21Å; Y2205-N2276 CarbonylContact C-O 3.52Å; Y2205-N2276 WeakPolarHBondContact CA-O 3.37Å
2206	Q	75	Confident	70.7	Confident	17 Å²	17	38 Å²	38	8%	0.079	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.2	173.1	-91.1	-176.9	-21.5	0	0	110.9	F2245 Q2246 L2275 N2276 T2278	Q2206-F2245 CarbonylContact C-O 3.43Å; Q2206-F2245 VanDerWaalsContact CA-O 3.24Å; Q2206-F2245 WeakPolarHBondContact CA-O 3.46Å; Q2206-Q2246 HydrophobicContact CG-CG 3.65Å; Q2206-L2275 WeakPolarHBondContact O-CA 3.35Å; Q2206-N2276 PolarHBondContact N-O 3.21Å; Q2206-N2276 PolarHBondContact O-N 3.1Å; Q2206-T2278 HydrophobicContact CG-CG2 4.02Å
2207	V	79.3	Confident	70.5	Confident	5 Å²	5	49 Å²	49	3%	0.03	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	121	168.9	-172.9	0	0	0	0	107.7	V2209 K2244 F2245 L2247 A2257 V2261 S2274 L2275	V2207-V2209 HydrophobicContact CG1-CG2 4Å; V2207-K2244 CarbonylContact O-C 3.52Å; V2207-K2244 WeakPolarHBondContact O-CA 3.33Å; V2207-F2245 PolarHBondContact N-O 3.23Å; V2207-F2245 PolarHBondContact O-N 3.02Å; V2207-L2247 HydrophobicContact CG2-CD1 3.45Å; V2207-L2247 VanDerWaalsContact CG2-CD1 3.45Å; V2207-L2247 HydrophobicContact CG2-CG 4.18Å; V2207-A2257 HydrophobicContact CG2-CB 4.28Å; V2207-V2261 HydrophobicContact CG1-CG2 3.84Å; V2207-S2274 WeakPolarHBondContact CA-O 3.29Å; V2207-L2275 HydrophobicContact CG2-CD1 3.87Å; V2207-L2275 HydrophobicContact CG2-CG 4.25Å
2208	A	75.5	Confident	70.6	Confident	14 Å²	14	52.7 Å²	52.7	12%	0.116	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	127.3	171.2	0	0	0	0	0	109.4	L2242 A2243 K2244 C2273 S2274	A2208-L2242 HydrophobicContact CB-CD1 4.46Å; A2208-A2243 WeakPolarHBondContact CA-O 3.47Å; A2208-K2244 HydrophobicContact CB-CG 3.84Å; A2208-C2273 WeakPolarHBondContact O-CA 3.43Å; A2208-S2274 WeakPolarHBondContact CB-OG 3.28Å; A2208-S2274 PolarHBondContact N-O 3.28Å; A2208-S2274 PolarHBondContact O-N 3.38Å
2209	V	78.4	Confident	70.6	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	117.6	-179.5	-165.6	0	0	0	0	108.8	V2207 L2222 I2226 L2242 A2243 F2245 V2264 V2270	V2207-V2209 HydrophobicContact CG1-CG2 4Å; V2209-L2222 HydrophobicContact CB-CD2 4.28Å; V2209-L2222 HydrophobicContact CG1-CD1 4.47Å; V2209-L2222 HydrophobicContact CG1-CD2 3.89Å; V2209-I2226 HydrophobicContact CG2-CD1 3.84Å; V2209-L2242 WeakPolarHBondContact O-CA 3.4Å; V2209-A2243 PolarHBondContact N-O 3.03Å; V2209-A2243 PolarHBondContact O-N 2.9Å; V2209-F2245 HydrophobicContact CG2-CE2 4.28Å; V2209-V2264 HydrophobicContact CG1-CG1 3.95Å; V2209-V2270 HydrophobicContact CG1-CB 4.49Å; V2209-V2270 HydrophobicContact CG1-CG1 3.74Å; V2209-V2270 HydrophobicContact CG1-CG2 3.84Å
2210	K	73.2	Confident	71	Confident	19 Å²	19	51.5 Å²	51.5	8%	0.083	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.8	178.1	-164.5	179.9	175.4	-161.9	0	109.9	E1107 N2241 L2242 V2270 E2271 A2272	E1107-K2210 PolarHBondContact O-NZ 3.36Å; K2210-N2241 CarbonylContact C-O 3.56Å; K2210-N2241 WeakPolarHBondContact CA-O 3.11Å; K2210-L2242 HydrophobicContact CB-CD1 3.74Å; K2210-L2242 HydrophobicContact CG-CD1 4.11Å; K2210-V2270 CarbonylContact O-C 3.28Å; K2210-V2270 WeakPolarHBondContact O-CA 3.47Å; K2210-V2270 VanDerWaalsContact O-CG1 3.3Å; K2210-V2270 WeakPolarHBondContact O-CG1 3.23Å; K2210-E2271 HydrophobicContact CB-CB 4.38Å; K2210-E2271 HydrophobicContact CD-CG 4.14Å; K2210-E2271 WeakPolarHBondContact CD-OE2 3.42Å; K2210-E2271 VanDerWaalsContact CE-CD 3.45Å; K2210-E2271 WeakPolarHBondContact CE-OE1 3.42Å; K2210-E2271 WeakPolarHBondContact CE-OE2 3.23Å; K2210-E2271 HydrophobicContact CG-CB 4.38Å; K2210-E2271 HydrophobicContact CG-CG 4.48Å; K2210-E2271 VanDerWaalsContact NZ-CD 3.3Å; K2210-E2271 IonicContact NZ-OE1 3.08Å; K2210-E2271 PolarHBondContact NZ-OE1 3.08Å; K2210-E2271 IonicContact NZ-OE2 3.27Å; K2210-E2271 PolarHBondContact NZ-OE2 2.66Å; K2210-E2271 PolarHBondContact O-N 3.06Å; K2210-A2272 HydrophobicContact CB-CB 4.3Å; K2210-A2272 PolarHBondContact N-O 3.27Å; K2210-A2272 PolarHBondContact O-N 3.36Å
2211	L	75.2	Confident	71.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	145.8	175.3	-77.7	172.7	0	0	0	111.4	G2213 Q2218 L2219 L2222 N2241 F2268 V2270	L2211-G2213 PolarHBondContact O-N 3.06Å; L2211-Q2218 HydrophobicContact CD1-CB 4.44Å; L2211-L2219 HydrophobicContact CD1-CB 3.94Å; L2211-L2219 HydrophobicContact CD1-CD1 3.76Å; L2211-L2219 HydrophobicContact CD1-CG 4.49Å; L2211-L2219 HydrophobicContact CG-CD1 4.42Å; L2211-L2222 HydrophobicContact CD1-CD2 4.16Å; L2211-L2222 HydrophobicContact CD2-CD2 4.27Å; L2211-L2222 HydrophobicContact CG-CD2 4.04Å; L2211-N2241 PolarHBondContact N-O 3.41Å; L2211-F2268 HydrophobicContact CD2-CB 4.29Å; L2211-V2270 HydrophobicContact CD2-CG2 4.19Å
2212	L	68.3	Low	72	Confident	66 Å²	66	47.9 Å²	47.9	35%	0.346	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-58.7	133.4	174.6	-140.1	97.1	0	0	0	110.7	I1128 G2214 N2215 K2269 E2271	I1128-L2212 HydrophobicContact CD1-CD1 3.65Å; I1128-L2212 HydrophobicContact CD1-CG 4.28Å; L2212-G2214 PolarHBondContact O-N 3.46Å; L2212-N2215 PolarHBondContact O-N 3.03Å; L2212-K2269 WeakPolarHBondContact CB-O 3.27Å; L2212-K2269 PolarHBondContact N-O 3.14Å; L2212-E2271 HydrophobicContact CD1-CB 4.19Å
2213	G	60.6	Low	72.9	Confident	53 Å²	53	47.9 Å²	47.9	55%	0.546	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	131.5	-179.1	0	0	0	0	0	113.2	L2211	L2211-G2213 PolarHBondContact O-N 3.06Å
2214	G	61.4	Low	73.6	Confident	68 Å²	68	49.5 Å²	49.5	70%	0.701	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.4	-17	-176	0	0	0	0	0	115.5	L2212	L2212-G2214 PolarHBondContact O-N 3.46Å
2215	N	67.8	Low	74.1	Confident	51 Å²	51	49.7 Å²	49.7	27%	0.273	27%	0.273	S	S	.	.			trans	-96.3	18.4	179	-68.1	-47.3	0	0	0	114.5	L2212 R2217 Q2218	L2212-N2215 PolarHBondContact O-N 3.03Å; N2215-R2217 PolarHBondContact O-N 3.4Å; N2215-Q2218 WeakPolarHBondContact O-CB 3.38Å; N2215-Q2218 PolarHBondContact O-N 3.49Å
2216	E	65.3	Low	74.4	Confident	74 Å²	74	48.5 Å²	48.5	35%	0.346	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-51.6	-32	-172.8	-63.7	169.7	-173.2	0	0	114.1	Q2218 L2219 N2241	E2216-Q2218 PolarHBondContact O-N 3.15Å; E2216-Q2218 VanDerWaalsContact O-N 3.1Å; E2216-L2219 VanDerWaalsContact O-CB 3.31Å; E2216-L2219 WeakPolarHBondContact O-CB 3.11Å; E2216-L2219 PolarHBondContact O-N 3.03Å; E2216-N2241 HydrophobicContact CG-CB 4.44Å
2217	R	69.8	Low	74.6	Confident	245 Å²	245	51.7 Å²	51.7	93%	0.925	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-59.9	-19.5	176.5	-64.6	-176	-178.7	178.7	0.8	114.1	N2215	N2215-R2217 PolarHBondContact O-N 3.4Å
2218	Q	74.1	Confident	74.7	Confident	79 Å²	79	57.8 Å²	57.8	37%	0.369	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-85.3	-12.8	177.4	-62.7	-175.2	-14.1	0	0	113.4	L2211 N2215 E2216 S2221 L2222	L2211-Q2218 HydrophobicContact CD1-CB 4.44Å; N2215-Q2218 WeakPolarHBondContact O-CB 3.38Å; N2215-Q2218 PolarHBondContact O-N 3.49Å; E2216-Q2218 PolarHBondContact O-N 3.15Å; E2216-Q2218 VanDerWaalsContact O-N 3.1Å; Q2218-S2221 WeakPolarHBondContact O-CB 3.44Å; Q2218-S2221 PolarHBondContact O-N 2.79Å; Q2218-S2221 VanDerWaalsContact O-N 3.08Å; Q2218-L2222 PolarHBondContact O-N 2.97Å
2219	L	73.8	Confident	74.8	Confident	7 Å²	7	61 Å²	61	4%	0.037	32%	0.323	C	S	.	.	H	α-helix	trans	-56.7	-41.7	-176.2	-167.9	74.7	0	0	0	113.7	L2211 E2216 S2221 L2222 V2223 Q2238 H2239 A2243	L2211-L2219 HydrophobicContact CD1-CB 3.94Å; L2211-L2219 HydrophobicContact CD1-CD1 3.76Å; L2211-L2219 HydrophobicContact CD1-CG 4.49Å; L2211-L2219 HydrophobicContact CG-CD1 4.42Å; E2216-L2219 VanDerWaalsContact O-CB 3.31Å; E2216-L2219 WeakPolarHBondContact O-CB 3.11Å; E2216-L2219 PolarHBondContact O-N 3.03Å; L2219-S2221 VanDerWaalsContact C-N 3.31Å; L2219-S2221 PolarHBondContact O-N 3.36Å; L2219-L2222 HydrophobicContact CD1-CD2 4.12Å; L2219-L2222 WeakPolarHBondContact O-CB 3.5Å; L2219-L2222 PolarHBondContact O-N 3.33Å; L2219-V2223 WeakPolarHBondContact O-CG2 3.49Å; L2219-V2223 PolarHBondContact O-N 2.84Å; L2219-Q2238 HydrophobicContact CD2-CG 3.82Å; L2219-H2239 WeakPolarHBondContact CD2-O 3.29Å; L2219-A2243 HydrophobicContact CD1-CB 4.16Å
2220	P	78.4	Confident	74.7	Confident	80 Å²	80	61.7 Å²	61.7	52%	0.519	33%	0.327	S	S	.	.	H	α-helix	trans	-65.6	-33.2	176.7	-20.4	34	0	0	0	113.2	K2224	P2220-K2224 PolarHBondContact O-N 3.16Å; P2220-K2224 VanDerWaalsContact O-N 3.16Å
2221	S	80.1	Confident	74.3	Confident	70 Å²	70	66.4 Å²	66.4	49%	0.49	36%	0.359	S	S	.	.	H	α-helix	trans	-71.3	-39.1	176.1	-52.4	0	0	0	0	111.7	Q2218 L2219 F2225	Q2218-S2221 WeakPolarHBondContact O-CB 3.44Å; Q2218-S2221 PolarHBondContact O-N 2.79Å; Q2218-S2221 VanDerWaalsContact O-N 3.08Å; L2219-S2221 VanDerWaalsContact C-N 3.31Å; L2219-S2221 PolarHBondContact O-N 3.36Å; S2221-F2225 WeakPolarHBondContact O-CB 3.38Å; S2221-F2225 PolarHBondContact O-N 3.42Å
2222	L	80.6	Confident	74.2	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-61.8	-46.3	172.6	179.7	78	0	0	0	111.4	V2209 L2211 Q2218 L2219 F2225 I2226 V2264 F2268	V2209-L2222 HydrophobicContact CB-CD2 4.28Å; V2209-L2222 HydrophobicContact CG1-CD1 4.47Å; V2209-L2222 HydrophobicContact CG1-CD2 3.89Å; L2211-L2222 HydrophobicContact CD1-CD2 4.16Å; L2211-L2222 HydrophobicContact CD2-CD2 4.27Å; L2211-L2222 HydrophobicContact CG-CD2 4.04Å; Q2218-L2222 PolarHBondContact O-N 2.97Å; L2219-L2222 HydrophobicContact CD1-CD2 4.12Å; L2219-L2222 WeakPolarHBondContact O-CB 3.5Å; L2219-L2222 PolarHBondContact O-N 3.33Å; L2222-F2225 PolarHBondContact O-N 3Å; L2222-I2226 HydrophobicContact CD1-CD1 4.09Å; L2222-I2226 HydrophobicContact CG-CD1 3.91Å; L2222-I2226 WeakPolarHBondContact O-CG1 3.46Å; L2222-I2226 PolarHBondContact O-N 3.49Å; L2222-V2264 HydrophobicContact CD1-CG1 3.72Å; L2222-V2264 HydrophobicContact CD1-CG2 4.23Å; L2222-F2268 HydrophobicContact CD1-CB 4.11Å; L2222-F2268 HydrophobicContact CD1-CD1 4.46Å; L2222-F2268 HydrophobicContact CD1-CD2 3.62Å; L2222-F2268 HydrophobicContact CD1-CE2 4.12Å; L2222-F2268 HydrophobicContact CD1-CG 3.81Å
2223	V	81.1	Confident	74.5	Confident	13 Å²	13	70 Å²	70	8%	0.079	38%	0.375	C	S	.	.	H	α-helix	trans	-59	-50.7	178.8	169.1	0	0	0	0	110.8	L2219 F2225 I2226 E2227 L2235 A2243 F2245	L2219-V2223 WeakPolarHBondContact O-CG2 3.49Å; L2219-V2223 PolarHBondContact O-N 2.84Å; V2223-F2225 PolarHBondContact O-N 3.2Å; V2223-I2226 PolarHBondContact O-N 3.26Å; V2223-E2227 WeakPolarHBondContact O-CG 3.29Å; V2223-E2227 PolarHBondContact O-N 2.98Å; V2223-L2235 HydrophobicContact CG1-CD1 4.41Å; V2223-L2235 HydrophobicContact CG1-CD2 4.1Å; V2223-L2235 HydrophobicContact CG2-CD1 4.29Å; V2223-A2243 HydrophobicContact CG2-CB 4.11Å; V2223-F2245 HydrophobicContact CB-CZ 4.41Å; V2223-F2245 HydrophobicContact CG1-CE1 4.27Å; V2223-F2245 HydrophobicContact CG2-CZ 4.04Å
2224	K	81.2	Confident	75.2	Confident	137 Å²	137	74.7 Å²	74.7	60%	0.596	38%	0.38	S	S	*	.	H	α-helix	trans	-56.5	-46.1	174.6	-94.8	-169.1	167.7	-166.7	0	113.1	P2220 I2226 E2227 E2228	P2220-K2224 PolarHBondContact O-N 3.16Å; P2220-K2224 VanDerWaalsContact O-N 3.16Å; K2224-I2226 VanDerWaalsContact C-N 3.28Å; K2224-I2226 PolarHBondContact O-N 3.47Å; K2224-E2227 PolarHBondContact O-N 3.5Å; K2224-E2228 WeakPolarHBondContact O-CG 3.44Å; K2224-E2228 PolarHBondContact O-N 3.19Å
2225	F	83.3	Confident	75.9	Confident	15 Å²	15	74.3 Å²	74.3	7%	0.066	36%	0.361	C	S	.	.	H	α-helix	trans	-59.3	-40.6	-179.5	-179	-100.8	0	0	0	112.2	S2221 L2222 V2223 E2228 H2229 E2263 V2264 F2268	S2221-F2225 WeakPolarHBondContact O-CB 3.38Å; S2221-F2225 PolarHBondContact O-N 3.42Å; L2222-F2225 PolarHBondContact O-N 3Å; V2223-F2225 PolarHBondContact O-N 3.2Å; F2225-E2228 PolarHBondContact O-N 3.24Å; F2225-H2229 AromaticContact CD2-CE1 3.69Å; F2225-H2229 AromaticContact CD2-ND1 3.8Å; F2225-H2229 AromaticContact CE2-CE1 3.07Å; F2225-H2229 WeakPolarHBondContact CE2-CE1 3.23Å; F2225-H2229 AromaticContact CE2-ND1 3.49Å; F2225-H2229 WeakPolarHBondContact CE2-ND1 3.42Å; F2225-H2229 AromaticContact CE2-NE2 3.55Å; F2225-H2229 AromaticContact CZ-CD2 3.9Å; F2225-H2229 AromaticContact CZ-CE1 3.52Å; F2225-H2229 AromaticContact CZ-CG 3.99Å; F2225-H2229 AromaticContact CZ-ND1 3.71Å; F2225-H2229 AromaticContact CZ-NE2 3.62Å; F2225-H2229 PolarHBondContact O-N 2.94Å; F2225-H2229 VanDerWaalsContact O-N 3.12Å; F2225-H2229 PolarHBondContact O-ND1 2.93Å; F2225-E2263 HydrophobicContact CE1-CB 4.35Å; F2225-E2263 HydrophobicContact CZ-CB 4.28Å; F2225-V2264 HydrophobicContact CD1-CG2 3.72Å; F2225-V2264 HydrophobicContact CE1-CG2 3.76Å; F2225-F2268 HydrophobicContact CB-CE2 4.16Å; F2225-F2268 HydrophobicContact CB-CZ 4.33Å; F2225-F2268 AromaticContact CD1-CE2 3.98Å; F2225-F2268 HydrophobicContact CD1-CE2 3.98Å; F2225-F2268 HydrophobicContact CG-CE2 4Å
2226	I	79.3	Confident	75.9	Confident	4 Å²	4	73.8 Å²	73.8	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-71.5	-39.4	178.2	-67.4	169.8	0	0	0	111.5	V2209 L2222 V2223 K2224 E2228 H2229 L2230 F2245 V2264	V2209-I2226 HydrophobicContact CG2-CD1 3.84Å; L2222-I2226 HydrophobicContact CD1-CD1 4.09Å; L2222-I2226 HydrophobicContact CG-CD1 3.91Å; L2222-I2226 WeakPolarHBondContact O-CG1 3.46Å; L2222-I2226 PolarHBondContact O-N 3.49Å; V2223-I2226 PolarHBondContact O-N 3.26Å; K2224-I2226 VanDerWaalsContact C-N 3.28Å; K2224-I2226 PolarHBondContact O-N 3.47Å; I2226-E2228 VanDerWaalsContact C-N 3.33Å; I2226-H2229 PolarHBondContact O-N 2.93Å; I2226-L2230 HydrophobicContact CG2-CD1 4.3Å; I2226-L2230 WeakPolarHBondContact O-CB 3.48Å; I2226-L2230 PolarHBondContact O-N 2.98Å; I2226-F2245 HydrophobicContact CB-CE1 4.06Å; I2226-F2245 HydrophobicContact CB-CE2 4.32Å; I2226-F2245 HydrophobicContact CB-CZ 3.91Å; I2226-F2245 HydrophobicContact CD1-CD2 4.28Å; I2226-F2245 HydrophobicContact CD1-CE2 3.48Å; I2226-F2245 VanDerWaalsContact CD1-CE2 3.48Å; I2226-F2245 HydrophobicContact CD1-CZ 3.71Å; I2226-F2245 HydrophobicContact CG1-CE2 4.49Å; I2226-F2245 HydrophobicContact CG1-CZ 4.41Å; I2226-F2245 HydrophobicContact CG2-CD1 3.79Å; I2226-F2245 HydrophobicContact CG2-CD2 3.96Å; I2226-F2245 HydrophobicContact CG2-CE1 3.72Å; I2226-F2245 HydrophobicContact CG2-CE2 3.92Å; I2226-F2245 HydrophobicContact CG2-CG 3.91Å; I2226-F2245 HydrophobicContact CG2-CZ 3.8Å; I2226-V2264 HydrophobicContact CD1-CG2 4.2Å; I2226-V2264 HydrophobicContact CG1-CG2 3.87Å
2227	E	80.9	Confident	76	Confident	84 Å²	84	71.6 Å²	71.6	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-38.1	173.8	-72.3	176.6	160.5	0	0	112.1	V2223 K2224 L2230	V2223-E2227 WeakPolarHBondContact O-CG 3.29Å; V2223-E2227 PolarHBondContact O-N 2.98Å; K2224-E2227 PolarHBondContact O-N 3.5Å; E2227-L2230 CarbonylContact O-C 3.55Å
2228	E	79.8	Confident	76.1	Confident	134 Å²	134	64.7 Å²	64.7	63%	0.626	33%	0.332	S	S	*	.	H	α-helix	trans	-67.6	-41	175.8	-74.1	169.8	-173.7	0	0	112.9	K2224 F2225 I2226	K2224-E2228 WeakPolarHBondContact O-CG 3.44Å; K2224-E2228 PolarHBondContact O-N 3.19Å; F2225-E2228 PolarHBondContact O-N 3.24Å; I2226-E2228 VanDerWaalsContact C-N 3.33Å
2229	H	78.7	Confident	75.7	Confident	80 Å²	80	62.1 Å²	62.1	37%	0.37	32%	0.32	S	S	.	.	H	α-helix	trans	-85.2	-16.9	-177.3	-69.9	60.2	0	0	0	113.3	F2225 I2226 E2263	F2225-H2229 AromaticContact CD2-CE1 3.69Å; F2225-H2229 AromaticContact CD2-ND1 3.8Å; F2225-H2229 AromaticContact CE2-CE1 3.07Å; F2225-H2229 WeakPolarHBondContact CE2-CE1 3.23Å; F2225-H2229 AromaticContact CE2-ND1 3.49Å; F2225-H2229 WeakPolarHBondContact CE2-ND1 3.42Å; F2225-H2229 AromaticContact CE2-NE2 3.55Å; F2225-H2229 AromaticContact CZ-CD2 3.9Å; F2225-H2229 AromaticContact CZ-CE1 3.52Å; F2225-H2229 AromaticContact CZ-CG 3.99Å; F2225-H2229 AromaticContact CZ-ND1 3.71Å; F2225-H2229 AromaticContact CZ-NE2 3.62Å; F2225-H2229 PolarHBondContact O-N 2.94Å; F2225-H2229 VanDerWaalsContact O-N 3.12Å; F2225-H2229 PolarHBondContact O-ND1 2.93Å; I2226-H2229 PolarHBondContact O-N 2.93Å; H2229-E2263 IonicContact CD2-OE2 2.63Å; H2229-E2263 PolarHBondContact CD2-OE2 2.66Å; H2229-E2263 IonicContact NE2-OE2 3.73Å
2230	L	76.8	Confident	75.2	Confident	17 Å²	17	65.7 Å²	65.7	9%	0.089	34%	0.339	C	S	.	.	S	Bend	trans	-130.1	74.8	178.5	-67.1	165.7	0	0	0	110.6	I2226 E2227 K2232 C2233 L2247 K2256 A2257 C2260	I2226-L2230 HydrophobicContact CG2-CD1 4.3Å; I2226-L2230 WeakPolarHBondContact O-CB 3.48Å; I2226-L2230 PolarHBondContact O-N 2.98Å; E2227-L2230 CarbonylContact O-C 3.55Å; L2230-K2232 PolarHBondContact O-N 2.88Å; L2230-C2233 HydrophobicContact CB-CB 4.09Å; L2230-C2233 WeakPolarHBondContact O-CB 3.37Å; L2230-C2233 PolarHBondContact O-N 3.18Å; L2230-C2233 PolarHBondContact O-SG 3.1Å; L2230-C2233 VanDerWaalsContact O-SG 3.34Å; L2230-L2247 HydrophobicContact CB-CD2 4.4Å; L2230-L2247 HydrophobicContact CD1-CD2 4.18Å; L2230-K2256 HydrophobicContact CD2-CB 4.36Å; L2230-A2257 HydrophobicContact CD1-CB 4.45Å; L2230-C2260 HydrophobicContact CD1-CB 3.98Å; L2230-C2260 HydrophobicContact CG-CB 4.23Å
2231	P	63.9	Low	74.8	Confident	117 Å²	117	62.9 Å²	62.9	76%	0.76	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	14.6	-165.4	28.5	-38	0	0	0	116.7
2232	K	72.4	Confident	74.5	Confident	125 Å²	125	60.6 Å²	60.6	54%	0.543	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	7.1	169.8	-63.5	-175.1	-177.8	168.3	0	112.9	L2230 P2248 E2250	L2230-K2232 PolarHBondContact O-N 2.88Å; K2232-P2248 HydrophobicContact CB-CG 3.93Å; K2232-P2248 HydrophobicContact CD-CG 4.35Å; K2232-P2248 WeakPolarHBondContact O-CD 3.29Å; K2232-E2250 IonicContact NZ-OE1 2.75Å; K2232-E2250 PolarHBondContact NZ-OE1 2.89Å; K2232-E2250 IonicContact NZ-OE2 2.7Å; K2232-E2250 PolarHBondContact NZ-OE2 3.45Å
2233	C	75.3	Confident	74.4	Confident	18 Å²	18	60.6 Å²	60.6	12%	0.122	30%	0.302	C	S	.	.			trans	-73.2	145.2	177.8	79.5	0	0	0	0	110.4	L2230 F2245 Q2246 L2247	L2230-C2233 HydrophobicContact CB-CB 4.09Å; L2230-C2233 WeakPolarHBondContact O-CB 3.37Å; L2230-C2233 PolarHBondContact O-N 3.18Å; L2230-C2233 PolarHBondContact O-SG 3.1Å; L2230-C2233 VanDerWaalsContact O-SG 3.34Å; C2233-F2245 HydrophobicContact CB-CB 4.37Å; C2233-Q2246 CarbonylContact C-O 3.57Å; C2233-Q2246 VanDerWaalsContact CA-O 3.3Å; C2233-Q2246 WeakPolarHBondContact CA-O 3.18Å; C2233-L2247 HydrophobicContact CB-CD2 3.64Å
2234	K	74.4	Confident	74.2	Confident	150 Å²	150	61.6 Å²	61.6	65%	0.652	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.5	169.6	-84.9	-176.3	173.4	177.6	0	108.9	A2236 F2245 Q2246	K2234-A2236 PolarHBondContact O-N 3.05Å; K2234-A2236 VanDerWaalsContact O-N 3.07Å; K2234-F2245 CarbonylContact O-C 3.56Å; K2234-F2245 WeakPolarHBondContact O-CA 3.47Å; K2234-Q2246 PolarHBondContact N-O 3.1Å; K2234-Q2246 PolarHBondContact O-N 3.32Å
2235	L	77.4	Confident	74.1	Confident	60 Å²	60	55.1 Å²	55.1	31%	0.314	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	112	165.2	-174.2	70	0	0	0	108.5	V2223 Q2238 A2243 F2245	V2223-L2235 HydrophobicContact CG1-CD1 4.41Å; V2223-L2235 HydrophobicContact CG1-CD2 4.1Å; V2223-L2235 HydrophobicContact CG2-CD1 4.29Å; L2235-Q2238 HydrophobicContact CD2-CB 4.28Å; L2235-A2243 HydrophobicContact CD1-CB 4.26Å; L2235-F2245 HydrophobicContact CB-CD1 4.46Å; L2235-F2245 HydrophobicContact CD1-CD1 4.03Å; L2235-F2245 HydrophobicContact CD1-CE1 3.65Å; L2235-F2245 HydrophobicContact CD1-CZ 3.92Å
2236	A	67.4	Low	73.9	Confident	41 Å²	41	56 Å²	56	34%	0.339	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-42.6	-174.1	0	0	0	0	0	111.6	K2234 K2244 Q2246	K2234-A2236 PolarHBondContact O-N 3.05Å; K2234-A2236 VanDerWaalsContact O-N 3.07Å; A2236-K2244 PolarHBondContact N-O 3.2Å; A2236-Q2246 HydrophobicContact CB-CB 4.38Å; A2236-Q2246 HydrophobicContact CB-CG 3.79Å
2237	E	66.8	Low	73.9	Confident	27 Å²	27	56 Å²	56	13%	0.126	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	142.4	174.8	-58.1	-172.9	126.5	0	0	110.1	R1081 K2244	R1081-E2237 VanDerWaalsContact CD-OE1 3.25Å; R1081-E2237 WeakPolarHBondContact CD-OE1 3.38Å; R1081-E2237 IonicContact CZ-OE1 2.93Å; R1081-E2237 IonicContact CZ-OE2 3.43Å; R1081-E2237 IonicContact NE-OE1 2.66Å; R1081-E2237 IonicContact NH1-OE1 2.79Å; R1081-E2237 PolarHBondContact NH1-OE1 3.47Å; R1081-E2237 IonicContact NH1-OE2 3.09Å; R1081-E2237 PolarHBondContact NH1-OE2 3.05Å; R1081-E2237 VanDerWaalsContact NH1-OE2 3.09Å; E2237-K2244 HydrophobicContact CB-CB 4.22Å; E2237-K2244 HydrophobicContact CB-CD 4.36Å; E2237-K2244 PolarHBondContact N-O 3.47Å; E2237-K2244 PolarHBondContact O-N 3.04Å; E2237-K2244 WeakPolarHBondContact OE2-CD 3.41Å; E2237-K2244 IonicContact OE2-NZ 2.89Å; E2237-K2244 PolarHBondContact OE2-NZ 3.49Å
2238	Q	72.4	Confident	73.5	Confident	100 Å²	100	53.9 Å²	53.9	47%	0.467	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	115.8	173.2	-172.6	-176.2	4.3	0	0	108.6	L2219 L2235	L2219-Q2238 HydrophobicContact CD2-CG 3.82Å; L2235-Q2238 HydrophobicContact CD2-CB 4.28Å
2239	H	64.9	Low	72.8	Confident	26 Å²	26	52.1 Å²	52.1	12%	0.12	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	162.2	170.6	-49.4	-85.8	0	0	0	108.4	D1085 L2219 N2241 L2242	D1085-H2239 IonicContact OD1-CE1 3.01Å; D1085-H2239 PolarHBondContact OD1-CE1 2.98Å; D1085-H2239 VanDerWaalsContact OD1-CE1 3.31Å; D1085-H2239 IonicContact OD1-ND1 3.85Å; D1085-H2239 PolarHBondContact OD1-ND1 3.33Å; L2219-H2239 WeakPolarHBondContact CD2-O 3.29Å; H2239-N2241 PolarHBondContact O-N 3.45Å; H2239-L2242 HydrophobicContact CB-CB 4.39Å; H2239-L2242 PolarHBondContact N-O 3.44Å; H2239-L2242 PolarHBondContact O-N 3.16Å; H2239-L2242 VanDerWaalsContact O-O 3.07Å
2240	L	63.2	Low	72.3	Confident	81 Å²	81	52.9 Å²	52.9	42%	0.424	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-39.2	-39.5	-168.7	-89.7	150.1	0	0	0	116.6	L1088	L1088-L2240 HydrophobicContact CB-CD1 3.86Å
2241	N	71.2	Confident	71.6	Confident	22 Å²	22	62.4 Å²	62.4	12%	0.118	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.8	13.1	179.4	59.5	-27.5	0	0	0	113.7	K2210 L2211 E2216 H2239	K2210-N2241 CarbonylContact C-O 3.56Å; K2210-N2241 WeakPolarHBondContact CA-O 3.11Å; L2211-N2241 PolarHBondContact N-O 3.41Å; E2216-N2241 HydrophobicContact CG-CB 4.44Å; H2239-N2241 PolarHBondContact O-N 3.45Å
2242	L	74.2	Confident	71.8	Confident	21 Å²	21	57.9 Å²	57.9	11%	0.11	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	122.4	-177.2	-178.2	77	0	0	0	110.8	A2208 V2209 K2210 H2239	A2208-L2242 HydrophobicContact CB-CD1 4.46Å; V2209-L2242 WeakPolarHBondContact O-CA 3.4Å; K2210-L2242 HydrophobicContact CB-CD1 3.74Å; K2210-L2242 HydrophobicContact CG-CD1 4.11Å; H2239-L2242 HydrophobicContact CB-CB 4.39Å; H2239-L2242 PolarHBondContact N-O 3.44Å; H2239-L2242 PolarHBondContact O-N 3.16Å; H2239-L2242 VanDerWaalsContact O-O 3.07Å
2243	A	77.4	Confident	71.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.6	171	0	0	0	0	0	110.7	A2208 V2209 L2219 V2223 L2235 F2245	A2208-A2243 WeakPolarHBondContact CA-O 3.47Å; V2209-A2243 PolarHBondContact N-O 3.03Å; V2209-A2243 PolarHBondContact O-N 2.9Å; L2219-A2243 HydrophobicContact CD1-CB 4.16Å; V2223-A2243 HydrophobicContact CG2-CB 4.11Å; L2235-A2243 HydrophobicContact CD1-CB 4.26Å; A2243-F2245 HydrophobicContact CB-CE2 3.61Å; A2243-F2245 HydrophobicContact CB-CZ 3.86Å
2244	K	76.8	Confident	71.5	Confident	34 Å²	34	52.1 Å²	52.1	15%	0.148	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.9	172.2	-74.2	-174.1	-173.3	168	0	110.8	V2207 A2208 A2236 E2237	V2207-K2244 CarbonylContact O-C 3.52Å; V2207-K2244 WeakPolarHBondContact O-CA 3.33Å; A2208-K2244 HydrophobicContact CB-CG 3.84Å; A2236-K2244 PolarHBondContact N-O 3.2Å; E2237-K2244 HydrophobicContact CB-CB 4.22Å; E2237-K2244 HydrophobicContact CB-CD 4.36Å; E2237-K2244 PolarHBondContact N-O 3.47Å; E2237-K2244 PolarHBondContact O-N 3.04Å; E2237-K2244 WeakPolarHBondContact OE2-CD 3.41Å; E2237-K2244 IonicContact OE2-NZ 2.89Å; E2237-K2244 PolarHBondContact OE2-NZ 3.49Å
2245	F	80.4	Confident	71.4	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134	176.4	-54.3	-94.7	0	0	0	109.4	Q2206 V2207 V2209 V2223 I2226 C2233 K2234 L2235 A2243	Q2206-F2245 CarbonylContact C-O 3.43Å; Q2206-F2245 VanDerWaalsContact CA-O 3.24Å; Q2206-F2245 WeakPolarHBondContact CA-O 3.46Å; V2207-F2245 PolarHBondContact N-O 3.23Å; V2207-F2245 PolarHBondContact O-N 3.02Å; V2209-F2245 HydrophobicContact CG2-CE2 4.28Å; V2223-F2245 HydrophobicContact CB-CZ 4.41Å; V2223-F2245 HydrophobicContact CG1-CE1 4.27Å; V2223-F2245 HydrophobicContact CG2-CZ 4.04Å; I2226-F2245 HydrophobicContact CB-CE1 4.06Å; I2226-F2245 HydrophobicContact CB-CE2 4.32Å; I2226-F2245 HydrophobicContact CB-CZ 3.91Å; I2226-F2245 HydrophobicContact CD1-CD2 4.28Å; I2226-F2245 HydrophobicContact CD1-CE2 3.48Å; I2226-F2245 VanDerWaalsContact CD1-CE2 3.48Å; I2226-F2245 HydrophobicContact CD1-CZ 3.71Å; I2226-F2245 HydrophobicContact CG1-CE2 4.49Å; I2226-F2245 HydrophobicContact CG1-CZ 4.41Å; I2226-F2245 HydrophobicContact CG2-CD1 3.79Å; I2226-F2245 HydrophobicContact CG2-CD2 3.96Å; I2226-F2245 HydrophobicContact CG2-CE1 3.72Å; I2226-F2245 HydrophobicContact CG2-CE2 3.92Å; I2226-F2245 HydrophobicContact CG2-CG 3.91Å; I2226-F2245 HydrophobicContact CG2-CZ 3.8Å; C2233-F2245 HydrophobicContact CB-CB 4.37Å; K2234-F2245 CarbonylContact O-C 3.56Å; K2234-F2245 WeakPolarHBondContact O-CA 3.47Å; L2235-F2245 HydrophobicContact CB-CD1 4.46Å; L2235-F2245 HydrophobicContact CD1-CD1 4.03Å; L2235-F2245 HydrophobicContact CD1-CE1 3.65Å; L2235-F2245 HydrophobicContact CD1-CZ 3.92Å; A2243-F2245 HydrophobicContact CB-CE2 3.61Å; A2243-F2245 HydrophobicContact CB-CZ 3.86Å
2246	Q	77.6	Confident	71.2	Confident	33 Å²	33	50.8 Å²	50.8	15%	0.154	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	137.1	166.6	-82.3	171.8	-15.6	0	0	110	H2203 Y2205 Q2206 C2233 K2234 A2236	H2203-Q2246 HydrophobicContact CB-CB 4.44Å; H2203-Q2246 HydrophobicContact CB-CG 4.45Å; H2203-Q2246 PolarHBondContact CD2-OE1 3.04Å; Y2205-Q2246 WeakPolarHBondContact O-CA 3.25Å; Q2206-Q2246 HydrophobicContact CG-CG 3.65Å; C2233-Q2246 CarbonylContact C-O 3.57Å; C2233-Q2246 VanDerWaalsContact CA-O 3.3Å; C2233-Q2246 WeakPolarHBondContact CA-O 3.18Å; K2234-Q2246 PolarHBondContact N-O 3.1Å; K2234-Q2246 PolarHBondContact O-N 3.32Å; A2236-Q2246 HydrophobicContact CB-CB 4.38Å; A2236-Q2246 HydrophobicContact CB-CG 3.79Å
2247	L	78.8	Confident	71.5	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.9	-179.1	-69.2	175.6	0	0	0	110	H2203 G2204 Y2205 V2207 L2230 C2233 V2253 A2257	H2203-L2247 CarbonylContact O-C 3.57Å; G2204-L2247 WeakPolarHBondContact CA-O 3.36Å; Y2205-L2247 PolarHBondContact N-O 3.1Å; Y2205-L2247 PolarHBondContact O-N 3.18Å; V2207-L2247 HydrophobicContact CG2-CD1 3.45Å; V2207-L2247 VanDerWaalsContact CG2-CD1 3.45Å; V2207-L2247 HydrophobicContact CG2-CG 4.18Å; L2230-L2247 HydrophobicContact CB-CD2 4.4Å; L2230-L2247 HydrophobicContact CD1-CD2 4.18Å; C2233-L2247 HydrophobicContact CB-CD2 3.64Å; L2247-V2253 HydrophobicContact CB-CG1 3.95Å; L2247-V2253 HydrophobicContact CD1-CG1 3.93Å; L2247-V2253 HydrophobicContact CG-CG1 4.39Å; L2247-A2257 HydrophobicContact CD1-CB 3.61Å
2248	P	72.7	Confident	71.7	Confident	39 Å²	39	48 Å²	48	25%	0.253	24%	0.242	S	C	.	.			trans	-62.5	149.2	-180	27.2	-35.1	0	0	0	111.9	K2232 E2250	K2232-P2248 HydrophobicContact CB-CG 3.93Å; K2232-P2248 HydrophobicContact CD-CG 4.35Å; K2232-P2248 WeakPolarHBondContact O-CD 3.29Å; P2248-E2250 VanDerWaalsContact C-N 3.31Å; P2248-E2250 PolarHBondContact O-N 3.38Å
2249	P	66.5	Low	71.8	Confident	98 Å²	98	45.7 Å²	45.7	64%	0.636	23%	0.233	S	C	*	.			trans	-76.7	75	-178.1	32.2	-35.5	0	0	0	112.2
2250	E	68.2	Low	72.5	Confident	95 Å²	95	44.8 Å²	44.8	44%	0.444	23%	0.23	S	C	.	.			trans	-104.4	146.7	168.5	-62.7	177.9	172.9	0	0	110.7	K2232 P2248 G2252 V2253	K2232-E2250 IonicContact NZ-OE1 2.75Å; K2232-E2250 PolarHBondContact NZ-OE1 2.89Å; K2232-E2250 IonicContact NZ-OE2 2.7Å; K2232-E2250 PolarHBondContact NZ-OE2 3.45Å; P2248-E2250 VanDerWaalsContact C-N 3.31Å; P2248-E2250 PolarHBondContact O-N 3.38Å; E2250-G2252 PolarHBondContact O-N 3.03Å; E2250-V2253 HydrophobicContact CB-CG2 3.65Å; E2250-V2253 WeakPolarHBondContact O-CB 2.8Å; E2250-V2253 VanDerWaalsContact O-CG2 3.3Å; E2250-V2253 WeakPolarHBondContact O-CG2 3.32Å; E2250-V2253 PolarHBondContact O-N 3.06Å
2251	K	62.2	Low	73	Confident	218 Å²	218	41.7 Å²	41.7	95%	0.948	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	136.2	178.4	-73.5	-177.2	174.4	-180	0	111	V2253	K2251-V2253 VanDerWaalsContact C-N 3.31Å; K2251-V2253 PolarHBondContact O-N 2.7Å
2252	G	67.5	Low	73.1	Confident	22 Å²	22	42 Å²	42	23%	0.227	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	2	-178.2	0	0	0	0	0	116	E2250 V2254 L2255 K2256	E2250-G2252 PolarHBondContact O-N 3.03Å; G2252-V2254 VanDerWaalsContact C-N 3.33Å; G2252-V2254 PolarHBondContact O-N 2.87Å; G2252-L2255 PolarHBondContact O-N 3.11Å; G2252-K2256 PolarHBondContact O-N 3.5Å
2253	V	71.8	Confident	73.3	Confident	17 Å²	17	45 Å²	45	10%	0.103	23%	0.229	C	C	.	.	H	α-helix	trans	-63.5	-36.3	177.7	163.6	0	0	0	0	112.7	L2247 E2250 K2251 L2255 K2256 A2257	L2247-V2253 HydrophobicContact CB-CG1 3.95Å; L2247-V2253 HydrophobicContact CD1-CG1 3.93Å; L2247-V2253 HydrophobicContact CG-CG1 4.39Å; E2250-V2253 HydrophobicContact CB-CG2 3.65Å; E2250-V2253 WeakPolarHBondContact O-CB 2.8Å; E2250-V2253 VanDerWaalsContact O-CG2 3.3Å; E2250-V2253 WeakPolarHBondContact O-CG2 3.32Å; E2250-V2253 PolarHBondContact O-N 3.06Å; K2251-V2253 VanDerWaalsContact C-N 3.31Å; K2251-V2253 PolarHBondContact O-N 2.7Å; V2253-L2255 VanDerWaalsContact C-N 3.31Å; V2253-L2255 PolarHBondContact O-N 3.39Å; V2253-K2256 PolarHBondContact O-N 3Å; V2253-A2257 WeakPolarHBondContact O-CB 3.35Å; V2253-A2257 PolarHBondContact O-N 3.14Å
2254	V	69.6	Low	73.2	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.03	23%	0.229	C	C	.	.	H	α-helix	trans	-58.3	-42.9	177.9	173.7	0	0	0	0	111.2	Y1214 Y2205 G2252 A2257 I2258 L2275	Y1214-V2254 HydrophobicContact CE2-CB 4.39Å; Y1214-V2254 HydrophobicContact CE2-CG1 3.72Å; Y2205-V2254 HydrophobicContact CD1-CG2 4.18Å; Y2205-V2254 HydrophobicContact CD2-CG2 4Å; Y2205-V2254 HydrophobicContact CE1-CG2 3.94Å; Y2205-V2254 HydrophobicContact CE2-CG2 3.75Å; Y2205-V2254 HydrophobicContact CG-CG2 4.21Å; G2252-V2254 VanDerWaalsContact C-N 3.33Å; G2252-V2254 PolarHBondContact O-N 2.87Å; V2254-A2257 PolarHBondContact O-N 3.4Å; V2254-I2258 HydrophobicContact CG1-CD1 3.97Å; V2254-I2258 WeakPolarHBondContact O-CG1 3.35Å; V2254-I2258 PolarHBondContact O-N 3.02Å; V2254-L2275 HydrophobicContact CB-CD2 4.45Å; V2254-L2275 HydrophobicContact CG1-CD2 3.84Å; V2254-L2275 HydrophobicContact CG2-CD2 4.23Å
2255	L	72	Confident	73	Confident	36 Å²	36	47.2 Å²	47.2	19%	0.188	24%	0.239	C	C	.	.	H	α-helix	trans	-64.8	-46	179.2	-147.6	88.3	0	0	0	111.9	V1199 F1200 G2252 V2253 A2257 I2258 D2259	V1199-L2255 HydrophobicContact CB-CD1 4.45Å; V1199-L2255 HydrophobicContact CG1-CD1 3.91Å; F1200-L2255 HydrophobicContact CB-CD1 4.41Å; F1200-L2255 HydrophobicContact CD2-CD2 4.1Å; G2252-L2255 PolarHBondContact O-N 3.11Å; V2253-L2255 VanDerWaalsContact C-N 3.31Å; V2253-L2255 PolarHBondContact O-N 3.39Å; L2255-A2257 VanDerWaalsContact C-N 3.3Å; L2255-A2257 PolarHBondContact O-N 2.8Å; L2255-I2258 PolarHBondContact O-N 3.49Å; L2255-D2259 PolarHBondContact O-N 3.19Å
2256	K	73.3	Confident	72.7	Confident	146 Å²	146	56.2 Å²	56.2	64%	0.635	27%	0.273	S	S	*	.	H	α-helix	trans	-62	-37.8	176.5	-69.4	-177.7	176.8	179.9	0	112.5	L2230 G2252 V2253 D2259 C2260	L2230-K2256 HydrophobicContact CD2-CB 4.36Å; G2252-K2256 PolarHBondContact O-N 3.5Å; V2253-K2256 PolarHBondContact O-N 3Å; K2256-D2259 PolarHBondContact O-N 3.43Å; K2256-C2260 PolarHBondContact O-N 3.14Å
2257	A	72.8	Confident	72.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-72.1	-35.6	178.3	0	0	0	0	0	112.1	V2207 L2230 L2247 V2253 V2254 L2255 C2260 V2261 L2275	V2207-A2257 HydrophobicContact CG2-CB 4.28Å; L2230-A2257 HydrophobicContact CD1-CB 4.45Å; L2247-A2257 HydrophobicContact CD1-CB 3.61Å; V2253-A2257 WeakPolarHBondContact O-CB 3.35Å; V2253-A2257 PolarHBondContact O-N 3.14Å; V2254-A2257 PolarHBondContact O-N 3.4Å; L2255-A2257 VanDerWaalsContact C-N 3.3Å; L2255-A2257 PolarHBondContact O-N 2.8Å; A2257-C2260 PolarHBondContact O-N 2.9Å; A2257-V2261 WeakPolarHBondContact O-CB 3.46Å; A2257-V2261 VanDerWaalsContact O-CG2 3.25Å; A2257-V2261 WeakPolarHBondContact O-CG2 3.38Å; A2257-V2261 PolarHBondContact O-N 3.29Å; A2257-L2275 HydrophobicContact CB-CD1 3.46Å; A2257-L2275 VanDerWaalsContact CB-CD1 3.46Å
2258	I	72.8	Confident	72.2	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-45.6	170	-72.5	166	0	0	0	110.8	L1192 V1199 L1216 V2254 L2255 C2260 V2261 I2262 L2275	L1192-I2258 HydrophobicContact CD2-CG2 4.06Å; V1199-I2258 HydrophobicContact CG1-CD1 4.01Å; V1199-I2258 HydrophobicContact CG2-CD1 4.34Å; L1216-I2258 HydrophobicContact CD2-CD1 4.41Å; V2254-I2258 HydrophobicContact CG1-CD1 3.97Å; V2254-I2258 WeakPolarHBondContact O-CG1 3.35Å; V2254-I2258 PolarHBondContact O-N 3.02Å; L2255-I2258 PolarHBondContact O-N 3.49Å; I2258-C2260 PolarHBondContact O-N 3.01Å; I2258-V2261 PolarHBondContact O-N 3.37Å; I2258-I2262 HydrophobicContact CG2-CD1 3.98Å; I2258-I2262 WeakPolarHBondContact O-CG1 3.46Å; I2258-I2262 PolarHBondContact O-N 3.06Å; I2258-L2275 HydrophobicContact CG1-CD1 4.49Å
2259	D	74.1	Confident	72.1	Confident	52 Å²	52	69.5 Å²	69.5	28%	0.278	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-45.6	178.5	-71.9	-15.5	0	0	0	111.9	R1196 L2255 K2256 V2261 I2262 E2263	R1196-D2259 IonicContact CZ-OD1 3.8Å; R1196-D2259 IonicContact CZ-OD2 2.88Å; R1196-D2259 IonicContact NE-OD1 3.2Å; R1196-D2259 PolarHBondContact NE-OD1 3.27Å; R1196-D2259 IonicContact NH2-OD1 2.77Å; R1196-D2259 PolarHBondContact NH2-OD1 3.29Å; R1196-D2259 IonicContact NH2-OD2 3.39Å; R1196-D2259 PolarHBondContact NH2-OD2 2.96Å; L2255-D2259 PolarHBondContact O-N 3.19Å; K2256-D2259 PolarHBondContact O-N 3.43Å; D2259-V2261 PolarHBondContact O-N 3.05Å; D2259-I2262 PolarHBondContact O-N 2.81Å; D2259-E2263 PolarHBondContact O-N 3.29Å; D2259-E2263 VanDerWaalsContact O-N 3.16Å
2260	C	78.5	Confident	72.2	Confident	8 Å²	8	65.7 Å²	65.7	5%	0.054	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-42.4	173.1	179.4	0	0	0	0	112.1	L2230 K2256 A2257 I2258 I2262 E2263 V2264	L2230-C2260 HydrophobicContact CD1-CB 3.98Å; L2230-C2260 HydrophobicContact CG-CB 4.23Å; K2256-C2260 PolarHBondContact O-N 3.14Å; A2257-C2260 PolarHBondContact O-N 2.9Å; I2258-C2260 PolarHBondContact O-N 3.01Å; C2260-I2262 VanDerWaalsContact C-N 3.32Å; C2260-I2262 PolarHBondContact O-N 3.18Å; C2260-E2263 PolarHBondContact O-N 3.09Å; C2260-V2264 WeakPolarHBondContact O-CB 3.5Å; C2260-V2264 WeakPolarHBondContact O-CG2 3.43Å; C2260-V2264 PolarHBondContact O-N 3.49Å
2261	V	74.1	Confident	71.9	Confident	15 Å²	15	63.1 Å²	63.1	9%	0.091	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-35.7	176.5	162.7	0	0	0	0	112.3	L1192 V2207 A2257 I2258 D2259 V2264 K2265 C2273	L1192-V2261 HydrophobicContact CD2-CG1 4.22Å; V2207-V2261 HydrophobicContact CG1-CG2 3.84Å; A2257-V2261 WeakPolarHBondContact O-CB 3.46Å; A2257-V2261 VanDerWaalsContact O-CG2 3.25Å; A2257-V2261 WeakPolarHBondContact O-CG2 3.38Å; A2257-V2261 PolarHBondContact O-N 3.29Å; I2258-V2261 PolarHBondContact O-N 3.37Å; D2259-V2261 PolarHBondContact O-N 3.05Å; V2261-V2264 PolarHBondContact O-N 2.92Å; V2261-K2265 PolarHBondContact O-N 3.21Å; V2261-C2273 HydrophobicContact CG1-CB 3.92Å
2262	I	74.5	Confident	72.1	Confident	29 Å²	29	53.4 Å²	53.4	15%	0.149	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-45.6	176.2	-68	166.9	0	0	0	110.8	L1192 I2258 D2259 C2260 V2264 K2265 R2266	L1192-I2262 HydrophobicContact CD2-CD1 4.27Å; L1192-I2262 HydrophobicContact CD2-CG1 3.8Å; I2258-I2262 HydrophobicContact CG2-CD1 3.98Å; I2258-I2262 WeakPolarHBondContact O-CG1 3.46Å; I2258-I2262 PolarHBondContact O-N 3.06Å; D2259-I2262 PolarHBondContact O-N 2.81Å; C2260-I2262 VanDerWaalsContact C-N 3.32Å; C2260-I2262 PolarHBondContact O-N 3.18Å; I2262-V2264 VanDerWaalsContact C-N 3.34Å; I2262-V2264 PolarHBondContact O-N 2.94Å; I2262-K2265 PolarHBondContact O-N 2.72Å; I2262-R2266 PolarHBondContact O-N 3.02Å; I2262-R2266 VanDerWaalsContact O-N 3.1Å
2263	E	76.6	Confident	72.3	Confident	85 Å²	85	52.8 Å²	52.8	40%	0.397	24%	0.237	S	C	.	.	H	α-helix	trans	-62.9	-40.7	174.6	-72.1	-161.7	121.4	0	0	112.4	F2225 H2229 D2259 C2260 R2266 R2267	F2225-E2263 HydrophobicContact CE1-CB 4.35Å; F2225-E2263 HydrophobicContact CZ-CB 4.28Å; H2229-E2263 IonicContact CD2-OE2 2.63Å; H2229-E2263 PolarHBondContact CD2-OE2 2.66Å; H2229-E2263 IonicContact NE2-OE2 3.73Å; D2259-E2263 PolarHBondContact O-N 3.29Å; D2259-E2263 VanDerWaalsContact O-N 3.16Å; C2260-E2263 PolarHBondContact O-N 3.09Å; E2263-R2266 WeakPolarHBondContact O-CB 3.48Å; E2263-R2266 PolarHBondContact O-N 2.86Å; E2263-R2266 VanDerWaalsContact O-N 3.15Å; E2263-R2267 PolarHBondContact O-N 3.17Å
2264	V	75.2	Confident	72.3	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.012	24%	0.243	C	C	.	.	H	α-helix	trans	-59.5	-47.9	174.5	159.3	0	0	0	0	111.5	V2209 L2222 F2225 I2226 C2260 V2261 I2262 R2266 R2267 F2268 V2270	V2209-V2264 HydrophobicContact CG1-CG1 3.95Å; L2222-V2264 HydrophobicContact CD1-CG1 3.72Å; L2222-V2264 HydrophobicContact CD1-CG2 4.23Å; F2225-V2264 HydrophobicContact CD1-CG2 3.72Å; F2225-V2264 HydrophobicContact CE1-CG2 3.76Å; I2226-V2264 HydrophobicContact CD1-CG2 4.2Å; I2226-V2264 HydrophobicContact CG1-CG2 3.87Å; C2260-V2264 WeakPolarHBondContact O-CB 3.5Å; C2260-V2264 WeakPolarHBondContact O-CG2 3.43Å; C2260-V2264 PolarHBondContact O-N 3.49Å; V2261-V2264 PolarHBondContact O-N 2.92Å; I2262-V2264 VanDerWaalsContact C-N 3.34Å; I2262-V2264 PolarHBondContact O-N 2.94Å; V2264-R2266 PolarHBondContact O-N 2.9Å; V2264-R2267 PolarHBondContact O-N 2.95Å; V2264-F2268 PolarHBondContact O-N 3.36Å; V2264-V2270 HydrophobicContact CG1-CG2 3.67Å
2265	K	72.9	Confident	72.6	Confident	78 Å²	78	53.8 Å²	53.8	34%	0.339	24%	0.243	S	C	.	.	H	α-helix	trans	-65.1	-21.8	176.4	-116.3	176.8	-177.6	170.6	0	112.6	Y1138 E1218 V2261 I2262 V2270	Y1138-K2265 PolarHBondContact OH-NZ 3.47Å; E1218-K2265 IonicContact OE1-NZ 3.53Å; E1218-K2265 PolarHBondContact OE1-NZ 2.97Å; V2261-K2265 PolarHBondContact O-N 3.21Å; I2262-K2265 PolarHBondContact O-N 2.72Å; K2265-V2270 HydrophobicContact CG-CB 4.23Å; K2265-V2270 HydrophobicContact CG-CG1 4.49Å
2266	R	74.9	Confident	72.5	Confident	190 Å²	190	55 Å²	55	72%	0.717	25%	0.25	S	S	*	.	H	α-helix	trans	-81.9	-45.2	173	-98.1	-173.2	178.4	145.3	15.2	113.7	E1193 I2262 E2263 V2264	E1193-R2266 IonicContact OE1-CZ 3.7Å; E1193-R2266 IonicContact OE1-NH2 2.98Å; E1193-R2266 PolarHBondContact OE1-NH2 3.37Å; I2262-R2266 PolarHBondContact O-N 3.02Å; I2262-R2266 VanDerWaalsContact O-N 3.1Å; E2263-R2266 WeakPolarHBondContact O-CB 3.48Å; E2263-R2266 PolarHBondContact O-N 2.86Å; E2263-R2266 VanDerWaalsContact O-N 3.15Å; V2264-R2266 PolarHBondContact O-N 2.9Å
2267	R	74.2	Confident	72.4	Confident	171 Å²	171	50 Å²	50	65%	0.645	23%	0.229	S	C	*	.	H	α-helix	trans	-84.1	-31.5	-175.1	-83.4	-175.6	168.7	164.4	0.2	114	E2263 V2264	E2263-R2267 PolarHBondContact O-N 3.17Å; V2264-R2267 PolarHBondContact O-N 2.95Å
2268	F	72.1	Confident	72.3	Confident	34 Å²	34	50.1 Å²	50.1	15%	0.149	23%	0.23	C	C	.	.	S	Bend	trans	-121.1	144.2	-175.1	-58.8	-84.1	0	0	0	110.6	L2211 L2222 F2225 V2264 V2270	L2211-F2268 HydrophobicContact CD2-CB 4.29Å; L2222-F2268 HydrophobicContact CD1-CB 4.11Å; L2222-F2268 HydrophobicContact CD1-CD1 4.46Å; L2222-F2268 HydrophobicContact CD1-CD2 3.62Å; L2222-F2268 HydrophobicContact CD1-CE2 4.12Å; L2222-F2268 HydrophobicContact CD1-CG 3.81Å; F2225-F2268 HydrophobicContact CB-CE2 4.16Å; F2225-F2268 HydrophobicContact CB-CZ 4.33Å; F2225-F2268 AromaticContact CD1-CE2 3.98Å; F2225-F2268 HydrophobicContact CD1-CE2 3.98Å; F2225-F2268 HydrophobicContact CG-CE2 4Å; V2264-F2268 PolarHBondContact O-N 3.36Å; F2268-V2270 VanDerWaalsContact C-N 3.27Å; F2268-V2270 HydrophobicContact CB-CG2 4.12Å; F2268-V2270 PolarHBondContact O-N 3.08Å
2269	K	70	Confident	72.3	Confident	150 Å²	150	51.4 Å²	51.4	65%	0.652	24%	0.24	S	C	*	.			trans	-76.6	80.1	175.7	-73.2	-170.1	176.3	-176	0	110.5	L2212	L2212-K2269 WeakPolarHBondContact CB-O 3.27Å; L2212-K2269 PolarHBondContact N-O 3.14Å
2270	V	68	Low	72.1	Confident	18 Å²	18	49.3 Å²	49.3	11%	0.109	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.6	178.7	175.5	0	0	0	0	110.3	V2209 K2210 L2211 V2264 K2265 F2268 A2272 C2273	V2209-V2270 HydrophobicContact CG1-CB 4.49Å; V2209-V2270 HydrophobicContact CG1-CG1 3.74Å; V2209-V2270 HydrophobicContact CG1-CG2 3.84Å; K2210-V2270 CarbonylContact O-C 3.28Å; K2210-V2270 WeakPolarHBondContact O-CA 3.47Å; K2210-V2270 VanDerWaalsContact O-CG1 3.3Å; K2210-V2270 WeakPolarHBondContact O-CG1 3.23Å; L2211-V2270 HydrophobicContact CD2-CG2 4.19Å; V2264-V2270 HydrophobicContact CG1-CG2 3.67Å; K2265-V2270 HydrophobicContact CG-CB 4.23Å; K2265-V2270 HydrophobicContact CG-CG1 4.49Å; F2268-V2270 VanDerWaalsContact C-N 3.27Å; F2268-V2270 HydrophobicContact CB-CG2 4.12Å; F2268-V2270 PolarHBondContact O-N 3.08Å; V2270-A2272 WeakPolarHBondContact CG1-O 3.45Å; V2270-C2273 HydrophobicContact CG1-CB 4.25Å
2271	E	63.6	Low	71.7	Confident	41 Å²	41	52.6 Å²	52.6	19%	0.192	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-50.5	175.6	166.6	174.3	174.8	0	0	111.7	I1128 K2210 L2212	I1128-E2271 HydrophobicContact CD1-CB 4.34Å; I1128-E2271 HydrophobicContact CD1-CG 3.77Å; I1128-E2271 HydrophobicContact CG1-CG 3.72Å; K2210-E2271 HydrophobicContact CB-CB 4.38Å; K2210-E2271 HydrophobicContact CD-CG 4.14Å; K2210-E2271 WeakPolarHBondContact CD-OE2 3.42Å; K2210-E2271 VanDerWaalsContact CE-CD 3.45Å; K2210-E2271 WeakPolarHBondContact CE-OE1 3.42Å; K2210-E2271 WeakPolarHBondContact CE-OE2 3.23Å; K2210-E2271 HydrophobicContact CG-CB 4.38Å; K2210-E2271 HydrophobicContact CG-CG 4.48Å; K2210-E2271 VanDerWaalsContact NZ-CD 3.3Å; K2210-E2271 IonicContact NZ-OE1 3.08Å; K2210-E2271 PolarHBondContact NZ-OE1 3.08Å; K2210-E2271 IonicContact NZ-OE2 3.27Å; K2210-E2271 PolarHBondContact NZ-OE2 2.66Å; K2210-E2271 PolarHBondContact O-N 3.06Å; L2212-E2271 HydrophobicContact CD1-CB 4.19Å
2272	A	65.9	Low	71.5	Confident	15 Å²	15	52.8 Å²	52.8	12%	0.124	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	148.5	-175.4	0	0	0	0	0	110.5	E1218 K2210 V2270	E1218-A2272 VanDerWaalsContact OE2-CA 3.25Å; E1218-A2272 WeakPolarHBondContact OE2-CA 3.38Å; E1218-A2272 WeakPolarHBondContact OE2-CB 3.47Å; K2210-A2272 HydrophobicContact CB-CB 4.3Å; K2210-A2272 PolarHBondContact N-O 3.27Å; K2210-A2272 PolarHBondContact O-N 3.36Å; V2270-A2272 WeakPolarHBondContact CG1-O 3.45Å
2273	C	72.2	Confident	71.4	Confident	9 Å²	9	51.5 Å²	51.5	6%	0.061	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	114	179.9	-143	0	0	0	0	110.7	E1218 A2208 V2261 V2270	E1218-C2273 PolarHBondContact OE2-N 3.38Å; A2208-C2273 WeakPolarHBondContact O-CA 3.43Å; V2261-C2273 HydrophobicContact CG1-CB 3.92Å; V2270-C2273 HydrophobicContact CG1-CB 4.25Å
2274	S	70.9	Confident	71.2	Confident	33 Å²	33	48.1 Å²	48.1	23%	0.231	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.3	-175.2	67	0	0	0	0	112.2	V2207 A2208	V2207-S2274 WeakPolarHBondContact CA-O 3.29Å; A2208-S2274 WeakPolarHBondContact CB-OG 3.28Å; A2208-S2274 PolarHBondContact N-O 3.28Å; A2208-S2274 PolarHBondContact O-N 3.38Å
2275	L	75.1	Confident	70.9	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.047	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	96.4	179.9	-165.9	142.9	0	0	0	111	L1216 Q2206 V2207 V2254 A2257 I2258	L1216-L2275 CarbonylContact C-O 3.57Å; L1216-L2275 PolarHBondContact N-O 3.47Å; L1216-L2275 VanDerWaalsContact N-O 3.07Å; L1216-L2275 PolarHBondContact O-N 3.31Å; Q2206-L2275 WeakPolarHBondContact O-CA 3.35Å; V2207-L2275 HydrophobicContact CG2-CD1 3.87Å; V2207-L2275 HydrophobicContact CG2-CG 4.25Å; V2254-L2275 HydrophobicContact CB-CD2 4.45Å; V2254-L2275 HydrophobicContact CG1-CD2 3.84Å; V2254-L2275 HydrophobicContact CG2-CD2 4.23Å; A2257-L2275 HydrophobicContact CB-CD1 3.46Å; A2257-L2275 VanDerWaalsContact CB-CD1 3.46Å; I2258-L2275 HydrophobicContact CG1-CD1 4.49Å
2276	N	70	Confident	70.8	Confident	63 Å²	63	46.2 Å²	46.2	34%	0.337	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	159	-167.7	-61	6.1	0	0	0	111	S1217 Y2205 Q2206	S1217-N2276 VanDerWaalsContact CB-OD1 3.23Å; S1217-N2276 WeakPolarHBondContact CB-OD1 3.34Å; Y2205-N2276 CarbonylContact C-O 3.52Å; Y2205-N2276 WeakPolarHBondContact CA-O 3.37Å; Q2206-N2276 PolarHBondContact N-O 3.21Å; Q2206-N2276 PolarHBondContact O-N 3.1Å
2277	Q	71.6	Confident	70.5	Confident	41 Å²	41	38.7 Å²	38.7	19%	0.192	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	150.3	162.3	-164.8	-175.9	1.2	0	0	109.2	S2279	Q2277-S2279 PolarHBondContact O-N 3.42Å
2278	T	72	Confident	70.1	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.012	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-57.6	128.6	175.8	45.7	0	0	0	0	112.2	G2202 G2204 Q2206	G2202-T2278 WeakPolarHBondContact CA-OG1 3.48Å; G2204-T2278 PolarHBondContact O-N 2.85Å; G2204-T2278 VanDerWaalsContact O-N 3.14Å; G2204-T2278 PolarHBondContact O-OG1 2.63Å; Q2206-T2278 HydrophobicContact CG-CG2 4.02Å
2279	S	72.2	Confident	69.9	Low	35 Å²	35	33.6 Å²	33.6	25%	0.245	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-74.8	158.8	178.8	75.6	0	0	0	0	112.5	Q2277 D2281 D2282 V2283	Q2277-S2279 PolarHBondContact O-N 3.42Å; S2279-D2281 PolarHBondContact O-N 2.98Å; S2279-D2281 PolarHBondContact OG-N 3.01Å; S2279-D2282 PolarHBondContact O-N 3.46Å; S2279-D2282 PolarHBondContact OG-N 2.9Å; S2279-D2282 PolarHBondContact OG-OD2 3.28Å; S2279-V2283 PolarHBondContact O-N 3.11Å; S2279-V2283 VanDerWaalsContact O-N 3.13Å
2280	L	70.6	Confident	69.6	Low	7 Å²	7	30.1 Å²	30.1	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-29.6	171.3	-171.3	76.8	0	0	0	111.6	L2023 E2174 L2197 V2283 F2284	L2023-L2280 HydrophobicContact CD1-CD2 3.54Å; L2023-L2280 HydrophobicContact CD1-CG 4.4Å; E2174-L2280 HydrophobicContact CG-CB 4Å; E2174-L2280 HydrophobicContact CG-CD2 4.07Å; E2174-L2280 WeakPolarHBondContact OE1-CB 3.37Å; E2174-L2280 PolarHBondContact OE1-N 3.35Å; L2197-L2280 HydrophobicContact CB-CD1 4.17Å; L2197-L2280 HydrophobicContact CD1-CD1 4.03Å; L2280-V2283 PolarHBondContact O-N 3.16Å; L2280-F2284 VanDerWaalsContact O-CB 3.28Å; L2280-F2284 WeakPolarHBondContact O-CB 3.45Å; L2280-F2284 PolarHBondContact O-N 3.16Å
2281	D	68.7	Low	69.2	Low	77 Å²	77	30.4 Å²	30.4	41%	0.412	17%	0.171	S	C	.	.	H	α-helix	trans	-66.2	-39	174.3	-93.4	3.4	0	0	0	112.2	S2279 F2284 V2285	S2279-D2281 PolarHBondContact O-N 2.98Å; S2279-D2281 PolarHBondContact OG-N 3.01Å; D2281-F2284 PolarHBondContact O-N 3.14Å; D2281-V2285 WeakPolarHBondContact O-CB 3.49Å; D2281-V2285 VanDerWaalsContact O-CG2 3.29Å; D2281-V2285 WeakPolarHBondContact O-CG2 3.17Å; D2281-V2285 PolarHBondContact O-N 3.06Å
2282	D	71.4	Confident	68.9	Low	19 Å²	19	30.5 Å²	30.5	10%	0.102	18%	0.179	C	C	.	.	H	α-helix	trans	-70.5	-38.2	175.8	-67.7	-62.6	0	0	0	112	R1081 S2279 F2284 V2285 S2286	R1081-D2282 IonicContact CZ-OD1 2.66Å; R1081-D2282 IonicContact NH1-OD1 2.76Å; R1081-D2282 PolarHBondContact NH1-OD1 3.39Å; R1081-D2282 IonicContact NH2-OD1 3.31Å; R1081-D2282 PolarHBondContact NH2-OD1 2.83Å; S2279-D2282 PolarHBondContact O-N 3.46Å; S2279-D2282 PolarHBondContact OG-N 2.9Å; S2279-D2282 PolarHBondContact OG-OD2 3.28Å; D2282-F2284 VanDerWaalsContact C-N 3.33Å; D2282-V2285 PolarHBondContact O-N 3.34Å; D2282-S2286 PolarHBondContact O-N 3Å
2283	V	72.3	Confident	68.3	Low	2 Å²	2	37 Å²	37	1%	0.012	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-43.1	170.6	171.6	0	0	0	0	110.7	F2201 S2279 L2280 S2286 L2287	F2201-V2283 HydrophobicContact CB-CG1 3.61Å; S2279-V2283 PolarHBondContact O-N 3.11Å; S2279-V2283 VanDerWaalsContact O-N 3.13Å; L2280-V2283 PolarHBondContact O-N 3.16Å; V2283-S2286 PolarHBondContact O-N 3.12Å; V2283-S2286 PolarHBondContact O-OG 3.02Å; V2283-S2286 VanDerWaalsContact O-OG 3.09Å; V2283-L2287 HydrophobicContact CG1-CD1 4.06Å; V2283-L2287 WeakPolarHBondContact O-CG 3.27Å; V2283-L2287 PolarHBondContact O-N 3.48Å; V2283-L2287 VanDerWaalsContact O-N 3.14Å
2284	F	71	Confident	67.2	Low	14 Å²	14	42.9 Å²	42.9	6%	0.061	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-41.5	176.5	177.4	-101.2	0	0	0	112.3	P1077 H2025 I2182 L2280 D2281 D2282 A2288	P1077-F2284 HydrophobicContact CG-CD1 4.32Å; P1077-F2284 HydrophobicContact CG-CE1 4.49Å; H2025-F2284 HydrophobicContact CB-CZ 4.21Å; I2182-F2284 HydrophobicContact CG2-CD2 4.37Å; L2280-F2284 VanDerWaalsContact O-CB 3.28Å; L2280-F2284 WeakPolarHBondContact O-CB 3.45Å; L2280-F2284 PolarHBondContact O-N 3.16Å; D2281-F2284 PolarHBondContact O-N 3.14Å; D2282-F2284 VanDerWaalsContact C-N 3.33Å; F2284-A2288 VanDerWaalsContact O-CB 3.24Å; F2284-A2288 WeakPolarHBondContact O-CB 3.45Å; F2284-A2288 PolarHBondContact O-N 3.28Å
2285	V	68.5	Low	66	Low	4 Å²	4	44.4 Å²	44.4	2%	0.024	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-40.2	176.3	167.8	0	0	0	0	111.4	P1077 D2281 D2282 A2288 Q2289	P1077-V2285 HydrophobicContact CB-CG2 3.9Å; D2281-V2285 WeakPolarHBondContact O-CB 3.49Å; D2281-V2285 VanDerWaalsContact O-CG2 3.29Å; D2281-V2285 WeakPolarHBondContact O-CG2 3.17Å; D2281-V2285 PolarHBondContact O-N 3.06Å; D2282-V2285 PolarHBondContact O-N 3.34Å; V2285-A2288 PolarHBondContact O-N 3.14Å; V2285-Q2289 HydrophobicContact CG1-CG 4.42Å; V2285-Q2289 WeakPolarHBondContact O-CB 3.42Å; V2285-Q2289 VanDerWaalsContact O-CG 3.31Å; V2285-Q2289 WeakPolarHBondContact O-CG 3.36Å; V2285-Q2289 PolarHBondContact O-N 3.09Å
2286	S	71.6	Confident	64.7	Low	37 Å²	37	48.7 Å²	48.7	26%	0.259	26%	0.262	S	S	.	.	H	α-helix	trans	-63.6	-49.3	177.1	82.7	0	0	0	0	111.1	D2282 V2283 A2288 Q2289 T2290	D2282-S2286 PolarHBondContact O-N 3Å; V2283-S2286 PolarHBondContact O-N 3.12Å; V2283-S2286 PolarHBondContact O-OG 3.02Å; V2283-S2286 VanDerWaalsContact O-OG 3.09Å; S2286-A2288 VanDerWaalsContact C-N 3.32Å; S2286-A2288 PolarHBondContact O-N 3.09Å; S2286-Q2289 WeakPolarHBondContact O-CB 3.43Å; S2286-Q2289 PolarHBondContact O-N 2.97Å; S2286-Q2289 VanDerWaalsContact O-N 3.13Å; S2286-T2290 PolarHBondContact O-N 3.45Å; S2286-T2290 PolarHBondContact O-OG1 3.46Å
2287	L	69	Low	63.5	Low	32 Å²	32	51.5 Å²	51.5	17%	0.168	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-39.5	176.5	-70	169.1	0	0	0	112.5	I2182 F2201 V2283 T2290 Q2291	I2182-L2287 HydrophobicContact CD1-CD1 3.93Å; F2201-L2287 HydrophobicContact CD1-CD2 4.34Å; V2283-L2287 HydrophobicContact CG1-CD1 4.06Å; V2283-L2287 WeakPolarHBondContact O-CG 3.27Å; V2283-L2287 PolarHBondContact O-N 3.48Å; V2283-L2287 VanDerWaalsContact O-N 3.14Å; L2287-T2290 PolarHBondContact O-N 3.37Å; L2287-Q2291 WeakPolarHBondContact O-CG 3.49Å; L2287-Q2291 PolarHBondContact O-N 2.98Å; L2287-Q2291 VanDerWaalsContact O-N 3.13Å
2288	A	65.6	Low	61.8	Low	12 Å²	12	57.2 Å²	57.2	10%	0.099	31%	0.307	C	S	.	.	H	α-helix	trans	-69.5	-34.9	176.3	0	0	0	0	0	112.8	F2284 V2285 S2286 Q2291 A2292	F2284-A2288 VanDerWaalsContact O-CB 3.24Å; F2284-A2288 WeakPolarHBondContact O-CB 3.45Å; F2284-A2288 PolarHBondContact O-N 3.28Å; V2285-A2288 PolarHBondContact O-N 3.14Å; S2286-A2288 VanDerWaalsContact C-N 3.32Å; S2286-A2288 PolarHBondContact O-N 3.09Å; A2288-Q2291 PolarHBondContact O-N 3.01Å; A2288-A2292 WeakPolarHBondContact O-CB 3.46Å; A2288-A2292 PolarHBondContact O-N 2.96Å
2289	Q	66.9	Low	60	Low	86 Å²	86	66.2 Å²	66.2	40%	0.402	35%	0.347	S	S	.	.	H	α-helix	trans	-66.4	-37.2	172.9	-75.7	-178.7	17.3	0	0	112	Y1078 V2285 S2286 A2292 K2293	Y1078-Q2289 HydrophobicContact CD2-CG 4.03Å; Y1078-Q2289 HydrophobicContact CE2-CG 3.83Å; V2285-Q2289 HydrophobicContact CG1-CG 4.42Å; V2285-Q2289 WeakPolarHBondContact O-CB 3.42Å; V2285-Q2289 VanDerWaalsContact O-CG 3.31Å; V2285-Q2289 WeakPolarHBondContact O-CG 3.36Å; V2285-Q2289 PolarHBondContact O-N 3.09Å; S2286-Q2289 WeakPolarHBondContact O-CB 3.43Å; S2286-Q2289 PolarHBondContact O-N 2.97Å; S2286-Q2289 VanDerWaalsContact O-N 3.13Å; Q2289-A2292 PolarHBondContact O-N 3.4Å; Q2289-K2293 PolarHBondContact O-N 3.47Å
2290	T	65.2	Low	59.3	Low	76 Å²	76	67.8 Å²	67.8	47%	0.466	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-45.5	174	-30.8	0	0	0	0	110.9	S2286 L2287 A2292 K2293 F2294	S2286-T2290 PolarHBondContact O-N 3.45Å; S2286-T2290 PolarHBondContact O-OG1 3.46Å; L2287-T2290 PolarHBondContact O-N 3.37Å; T2290-A2292 PolarHBondContact O-N 2.99Å; T2290-K2293 PolarHBondContact O-N 3.42Å; T2290-F2294 WeakPolarHBondContact O-CD2 3.39Å; T2290-F2294 PolarHBondContact O-N 2.85Å
2291	Q	58.6	Low	58.8	Low	25 Å²	25	71 Å²	71	12%	0.117	37%	0.368	C	S	.	.	H	α-helix	trans	-58.7	-45.9	174.2	-72	168	28.2	0	0	112.2	H2025 L2287 A2288 K2293 F2294 D2295	H2025-Q2291 PolarHBondContact ND1-OE1 3.47Å; L2287-Q2291 WeakPolarHBondContact O-CG 3.49Å; L2287-Q2291 PolarHBondContact O-N 2.98Å; L2287-Q2291 VanDerWaalsContact O-N 3.13Å; A2288-Q2291 PolarHBondContact O-N 3.01Å; Q2291-K2293 PolarHBondContact O-N 3.37Å; Q2291-F2294 PolarHBondContact O-N 3.19Å; Q2291-F2294 VanDerWaalsContact O-N 3.12Å; Q2291-D2295 PolarHBondContact O-N 3.44Å
2292	A	56.6	Low	58.2	Low	43 Å²	43	70.7 Å²	70.7	36%	0.355	37%	0.366	S	S	.	.	H	α-helix	trans	-59.9	-33.1	-179.5	0	0	0	0	0	112.8	A2288 Q2289 T2290 T2296	A2288-A2292 WeakPolarHBondContact O-CB 3.46Å; A2288-A2292 PolarHBondContact O-N 2.96Å; Q2289-A2292 PolarHBondContact O-N 3.4Å; T2290-A2292 PolarHBondContact O-N 2.99Å; A2292-T2296 PolarHBondContact O-OG1 3.23Å; A2292-T2296 VanDerWaalsContact O-OG1 3.1Å
2293	K	54.2	Low	57.4	Low	150 Å²	150	73.7 Å²	73.7	65%	0.652	38%	0.381	S	S	*	.	H	α-helix	trans	-68.3	-45.1	173.8	-72.3	178	178.2	178.1	0	112.1	Q2289 T2290 Q2291 D2295 T2296 V2297	Q2289-K2293 PolarHBondContact O-N 3.47Å; T2290-K2293 PolarHBondContact O-N 3.42Å; Q2291-K2293 PolarHBondContact O-N 3.37Å; K2293-D2295 VanDerWaalsContact C-N 3.34Å; K2293-D2295 PolarHBondContact O-N 3.37Å; K2293-T2296 PolarHBondContact O-N 3.21Å; K2293-T2296 PolarHBondContact O-OG1 3.34Å; K2293-V2297 WeakPolarHBondContact O-CG2 3.39Å; K2293-V2297 PolarHBondContact O-N 3.29Å
2294	F	50	Low	56.5	Low	133 Å²	133	78.2 Å²	78.2	58%	0.583	40%	0.404	S	S	*	.	H	α-helix	trans	-61.1	-40.9	175.6	-88.5	-83.2	0	0	0	112.3	T2290 Q2291 T2296 V2297 E2298	T2290-F2294 WeakPolarHBondContact O-CD2 3.39Å; T2290-F2294 PolarHBondContact O-N 2.85Å; Q2291-F2294 PolarHBondContact O-N 3.19Å; Q2291-F2294 VanDerWaalsContact O-N 3.12Å; F2294-T2296 PolarHBondContact O-N 3.1Å; F2294-T2296 VanDerWaalsContact O-N 3.13Å; F2294-V2297 PolarHBondContact O-N 3.25Å; F2294-E2298 PolarHBondContact O-N 3.38Å
2295	D	45.1	Very low	55.5	Low	65 Å²	65	82.5 Å²	82.5	35%	0.348	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.4	-179.8	-130.3	64.3	0	0	0	113.9	H2185 Q2291 K2293 K2299	H2185-D2295 IonicContact CE1-OD1 2.59Å; Q2291-D2295 PolarHBondContact O-N 3.44Å; K2293-D2295 VanDerWaalsContact C-N 3.34Å; K2293-D2295 PolarHBondContact O-N 3.37Å; D2295-K2299 WeakPolarHBondContact O-CG 3.5Å; D2295-K2299 PolarHBondContact O-NZ 3.36Å; D2295-K2299 IonicContact OD2-NZ 2.71Å; D2295-K2299 PolarHBondContact OD2-NZ 3.4Å
2296	T	48.5	Very low	54.6	Low	100 Å²	100	88.1 Å²	88.1	61%	0.613	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-5.8	169.5	33.4	0	0	0	0	114.7	A2292 K2293 F2294	A2292-T2296 PolarHBondContact O-OG1 3.23Å; A2292-T2296 VanDerWaalsContact O-OG1 3.1Å; K2293-T2296 PolarHBondContact O-N 3.21Å; K2293-T2296 PolarHBondContact O-OG1 3.34Å; F2294-T2296 PolarHBondContact O-N 3.1Å; F2294-T2296 VanDerWaalsContact O-N 3.13Å
2297	V	43.2	Very low	53.3	Low	122 Å²	122	92 Å²	92	74%	0.739	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-26.1	175.1	175.8	0	0	0	0	111	K2293 F2294	K2293-V2297 WeakPolarHBondContact O-CG2 3.39Å; K2293-V2297 PolarHBondContact O-N 3.29Å; F2294-V2297 PolarHBondContact O-N 3.25Å
2298	E	36.9	Very low	52	Low	160 Å²	160	97 Å²	97	75%	0.748	50%	0.496	S	S	*	.			trans	-85.8	-1.1	174	-127.2	-163	172.1	0	0	114.4	F2294	F2294-E2298 PolarHBondContact O-N 3.38Å
2299	K	32.9	Very low	50.7	Low	192 Å²	192	104.7 Å²	104.7	84%	0.835	53%	0.533	S	S	*	.			trans	-116.5	0	175.6	-70.2	-167	-161.2	79.3	0	111.4	D2295	D2295-K2299 WeakPolarHBondContact O-CG 3.5Å; D2295-K2299 PolarHBondContact O-NZ 3.36Å; D2295-K2299 IonicContact OD2-NZ 2.71Å; D2295-K2299 PolarHBondContact OD2-NZ 3.4Å

Retrieved 2,299 of 2,299 residues in 1764.4 ms (Link to these results)

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