A0A077ZHM4_TRITR Loading...

Structure-specific endonuclease subunit SLX4

AlphaFold DB , UniProt , Accession A0A077ZHM4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 861 aa.

						>A0A077ZHM4_TRITR|A0A077ZHM4
MSKKTVSLAEDILFSGSYRLEESSDFFESPPAPSASSTMAISAETCPACAKGLDHYTVIQRRQHINNCLDSEANRKSLLRKRELWMQTTDCPLCCKPLNSGPFRQAHLKQCGKAHKVPPSELLRLMQIQEKIAETRKQSGLSHTKLKKPTISSVRNETASREKDVPKTVFDEQVHLAQALSRSLLEKELPEMVLPTSSKCLKQTLLQTKLEMSSPKTRLGILEARLSDLLVHCLSSYETQEKISKPKYLWPSFESDGPVYTPPVMADENHAEEVASEKAEEPKNKLIALQKQRIELLLSDMSSLLGSDTDMDVEMFCGPGFERCNAHSLILKSRCPSLLKCASKQPSGRYDLFLPEITVDCMRIFLRYLYFADDEFFNSLPHDTVVEVLQRFPPSGWNCEVTGSQTEQQSHGVSCIPAERDNTDDAASENHNFVNSLLNREYDVGCALEDDMVIDLTADEPAYSDGIRSSLNVEAYGNSTNEIDSVRVGVGVENAFSKASEVQDYNTSPKAESLQNSATTASTEQPRRKDWSAQSFFGVETLSLDNSAGDIFDQGSFKATDNSIICSSVEYCHQLSPEIAMQTCKGESRTGSPLPKIGTEVCKKSTVQVDAVSVAKTNFSSPLARMSRKLVKNAILRTPVMQKLNQQGVMVIKTKNVTPALDLTQVATPELHVKLRRYGVRALPKRKAVAVLERIYNETHPYVHENGSIEVPAVKPPVIRRKRRAKEDLSNKETSPEKCNKPDVIEECSLHELSEERISLEESFIPCAPTLNSPKKKVSRASRFWFVIFLQDSVSDDDTLRQLLISNADIYEDILTYKPLNLKNVHRRLRQGGARCSLKNLLNYLDAQCITFSMKKFDEEQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.4	Very low	44.1	Very low	219 Å²	219	115.3 Å²	115.3	100%	1.079	61%	0.606	S	S	*	*				0	-62.9	0	-54.1	-33.4	-179.1	0	0	114.4	K3 K4	M1-K3 PolarHBondContact O-N 3.2Å; M1-K4 PolarHBondContact O-N 2.89Å
2	S	45	Very low	44.2	Very low	87 Å²	87	110.9 Å²	110.9	61%	0.608	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	18.6	-168.4	-160.1	0	0	0	0	118.8
3	K	43.4	Very low	44.1	Very low	192 Å²	192	107.8 Å²	107.8	84%	0.835	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-36.1	175.7	-73.3	-169.4	175.9	-172.8	0	114	M1 T5 V6	M1-K3 PolarHBondContact O-N 3.2Å; K3-T5 PolarHBondContact O-N 3.08Å; K3-V6 PolarHBondContact O-N 2.84Å
4	K	46.1	Very low	44.1	Very low	187 Å²	187	114.3 Å²	114.3	81%	0.813	59%	0.588	S	S	*	*	H	α-helix	trans	-66.1	-23.8	-177.1	-71.6	-164.9	172.5	-167.3	0	113.6	M1 V6	M1-K4 PolarHBondContact O-N 2.89Å; K4-V6 VanDerWaalsContact C-N 3.29Å; K4-V6 PolarHBondContact O-N 2.79Å
5	T	45.7	Very low	43.4	Very low	78 Å²	78	112.5 Å²	112.5	48%	0.479	59%	0.59	S	S	.	*	H	α-helix	trans	-82.3	5	-176.6	62	0	0	0	0	114.9	K3	K3-T5 PolarHBondContact O-N 3.08Å
6	V	43.8	Very low	42.7	Very low	83 Å²	83	109.2 Å²	109.2	50%	0.503	59%	0.591	S	S	.	*	H	α-helix	trans	-96	-50.2	176.1	-176.9	0	0	0	0	110.1	K3 K4 L8 A9 E10	K3-V6 PolarHBondContact O-N 2.84Å; K4-V6 VanDerWaalsContact C-N 3.29Å; K4-V6 PolarHBondContact O-N 2.79Å; V6-L8 VanDerWaalsContact C-N 3.35Å; V6-L8 PolarHBondContact O-N 2.88Å; V6-A9 WeakPolarHBondContact O-CB 3.4Å; V6-A9 PolarHBondContact O-N 2.91Å; V6-E10 PolarHBondContact O-N 2.87Å
7	S	47.6	Very low	42.2	Very low	68 Å²	68	106.4 Å²	106.4	48%	0.476	58%	0.581	S	S	.	*	H	α-helix	trans	-50.8	-52.5	174.5	-162.1	0	0	0	0	111.8	A9 E10 D11	S7-A9 PolarHBondContact O-N 3.38Å; S7-E10 WeakPolarHBondContact O-CA 3.3Å; S7-E10 WeakPolarHBondContact O-CB 3.5Å; S7-E10 PolarHBondContact O-N 2.93Å; S7-D11 VanDerWaalsContact C-OD2 3.31Å; S7-D11 PolarHBondContact O-N 2.84Å; S7-D11 VanDerWaalsContact O-N 3.09Å
8	L	41.6	Very low	41.5	Very low	102 Å²	102	112.1 Å²	112.1	53%	0.534	60%	0.595	S	S	.	*	H	α-helix	trans	-60.8	-16.3	-179.2	-157.2	77.2	0	0	0	114.1	V6 I12	V6-L8 VanDerWaalsContact C-N 3.35Å; V6-L8 PolarHBondContact O-N 2.88Å; L8-I12 HydrophobicContact CG-CD1 4.41Å; L8-I12 VanDerWaalsContact O-CD1 3.28Å; L8-I12 WeakPolarHBondContact O-CD1 3.41Å; L8-I12 VanDerWaalsContact O-CG1 3.29Å; L8-I12 WeakPolarHBondContact O-CG1 3.44Å
9	A	38	Very low	40.8	Very low	27 Å²	27	119.2 Å²	119.2	22%	0.223	61%	0.612	C	S	.	*	H	α-helix	trans	-88.2	-28.7	172.8	0	0	0	0	0	112.2	V6 S7 L13	V6-A9 WeakPolarHBondContact O-CB 3.4Å; V6-A9 PolarHBondContact O-N 2.91Å; S7-A9 PolarHBondContact O-N 3.38Å; A9-L13 WeakPolarHBondContact O-CB 3.48Å; A9-L13 VanDerWaalsContact O-CD1 3.3Å; A9-L13 WeakPolarHBondContact O-CD1 3.32Å; A9-L13 WeakPolarHBondContact O-CG 3.24Å; A9-L13 PolarHBondContact O-N 2.95Å
10	E	46.2	Very low	40.3	Very low	125 Å²	125	121.3 Å²	121.3	58%	0.584	62%	0.624	S	S	*	*	H	α-helix	trans	-73.7	-41	176.2	-65.2	176	138	0	0	110.4	V6 S7 I12 L13	V6-E10 PolarHBondContact O-N 2.87Å; S7-E10 WeakPolarHBondContact O-CA 3.3Å; S7-E10 WeakPolarHBondContact O-CB 3.5Å; S7-E10 PolarHBondContact O-N 2.93Å; E10-I12 VanDerWaalsContact C-N 3.28Å; E10-I12 PolarHBondContact O-N 2.98Å; E10-L13 PolarHBondContact O-N 2.91Å
11	D	46.5	Very low	40	Very low	100 Å²	100	123.4 Å²	123.4	54%	0.535	63%	0.631	S	S	.	*	H	α-helix	trans	-61.9	-31.5	177.5	-55.6	-41.8	0	0	0	113.5	S7 S15	S7-D11 VanDerWaalsContact C-OD2 3.31Å; S7-D11 PolarHBondContact O-N 2.84Å; S7-D11 VanDerWaalsContact O-N 3.09Å; D11-S15 PolarHBondContact O-OG 3.41Å
12	I	45	Very low	39.8	Very low	63 Å²	63	121.6 Å²	121.6	32%	0.323	62%	0.62	S	S	.	*	H	α-helix	trans	-90.3	-13.7	-177.4	-64.7	178.7	0	0	0	112.3	L8 E10 P47 I65	L8-I12 HydrophobicContact CG-CD1 4.41Å; L8-I12 VanDerWaalsContact O-CD1 3.28Å; L8-I12 WeakPolarHBondContact O-CD1 3.41Å; L8-I12 VanDerWaalsContact O-CG1 3.29Å; L8-I12 WeakPolarHBondContact O-CG1 3.44Å; E10-I12 VanDerWaalsContact C-N 3.28Å; E10-I12 PolarHBondContact O-N 2.98Å; I12-P47 HydrophobicContact CD1-CB 4.37Å; I12-P47 HydrophobicContact CD1-CG 3.87Å; I12-I65 HydrophobicContact CG2-CD1 4.18Å; I12-I65 HydrophobicContact CG2-CG2 4.2Å
13	L	43.2	Very low	39.3	Very low	71 Å²	71	122.6 Å²	122.6	37%	0.372	63%	0.627	S	S	.	*	H	α-helix	trans	-88.4	-10.1	-175.5	-83.6	172	0	0	0	115.2	A9 E10	A9-L13 WeakPolarHBondContact O-CB 3.48Å; A9-L13 VanDerWaalsContact O-CD1 3.3Å; A9-L13 WeakPolarHBondContact O-CD1 3.32Å; A9-L13 WeakPolarHBondContact O-CG 3.24Å; A9-L13 PolarHBondContact O-N 2.95Å; E10-L13 PolarHBondContact O-N 2.91Å
14	F	43.5	Very low	38.8	Very low	198 Å²	198	117.8 Å²	117.8	87%	0.868	62%	0.618	S	S	*	*	S	Bend	trans	-112.5	-2.4	-178.8	-81	-84.1	0	0	0	115
15	S	34.4	Very low	38.4	Very low	88 Å²	88	115.5 Å²	115.5	62%	0.615	61%	0.614	S	S	*	*	S	Bend	trans	-111.7	64.4	-165	39.1	0	0	0	0	113.6	D11	D11-S15 PolarHBondContact O-OG 3.41Å
16	G	31.5	Very low	37.8	Very low	59 Å²	59	119.4 Å²	119.4	61%	0.608	63%	0.625	S	S	*	*			trans	161.3	164.2	164.2	0	0	0	0	0	117.7
17	S	34.5	Very low	37.3	Very low	61 Å²	61	122.8 Å²	122.8	43%	0.427	63%	0.633	S	S	.	*			trans	77.1	132.6	176.3	-136.6	0	0	0	0	114.2
18	Y	28.8	Very low	36.6	Very low	209 Å²	209	127.5 Å²	127.5	82%	0.82	65%	0.648	S	S	*	*			cis	-160.2	150.2	-0.3	46.3	-82.7	0	0	0	109.8
19	R	29.2	Very low	36.4	Very low	248 Å²	248	127 Å²	127	94%	0.936	65%	0.653	S	S	*	*			trans	-160.5	125.1	155.4	-154.9	177.2	-167.2	172.5	4	109.9
20	L	30.9	Very low	37.1	Very low	161 Å²	161	131.3 Å²	131.3	84%	0.843	68%	0.679	S	S	*	*			trans	-174.2	136.8	176.9	-155.9	155.8	0	0	0	106.6
21	E	34	Very low	36.8	Very low	165 Å²	165	131.4 Å²	131.4	77%	0.771	69%	0.69	S	S	*	*			cis	-163.2	173.9	-31.7	-145	170.2	-105.4	0	0	108.3
22	E	36.1	Very low	36.3	Very low	181 Å²	181	131 Å²	131	85%	0.846	70%	0.701	S	S	*	*			trans	152.6	103.3	162.8	-91.3	165.5	-163.6	0	0	106.5
23	S	35.7	Very low	36.2	Very low	108 Å²	108	134.3 Å²	134.3	76%	0.755	73%	0.726	S	S	*	*				101.7	147.7	67.2	67.9	0	0	0	0	110.3
24	S	32.6	Very low	35.9	Very low	92 Å²	92	137 Å²	137	64%	0.643	75%	0.751	S	S	*	*			cis	-146.9	177.8	11.4	53.8	0	0	0	0	113.7
25	D	37	Very low	35.5	Very low	139 Å²	139	132.5 Å²	132.5	74%	0.743	75%	0.75	S	S	*	*			trans	79.5	146.7	155.4	-63.3	-50.8	0	0	0	120
26	F	34.1	Very low	35.6	Very low	159 Å²	159	134.3 Å²	134.3	70%	0.697	76%	0.763	S	S	*	*			cis	-165.7	118.8	-15.3	170.8	-100.9	0	0	0	112.7
27	F	32.9	Very low	35.7	Very low	154 Å²	154	136.7 Å²	136.7	68%	0.675	77%	0.77	S	S	*	*			trans	60.6	160.3	152.2	-92.3	-115.7	0	0	0	119.7
28	E	33.7	Very low	35.8	Very low	168 Å²	168	140 Å²	140	79%	0.785	79%	0.788	S	S	*	*			cis	-158	163.5	5.4	-172	162.6	-115.4	0	0	108.5
29	S	37.2	Very low	36.2	Very low	91 Å²	91	138.9 Å²	138.9	64%	0.636	79%	0.792	S	S	*	*			cis	-156.4	165.5	-46.6	-89.2	0	0	0	0	109.6
30	P	51.5	Low	36.5	Very low	118 Å²	118	131.4 Å²	131.4	77%	0.766	78%	0.784	S	S	*	*			trans	-103.8	169.9	-166.2	40.2	-36.9	0	0	0	116
31	P	39.7	Very low	37.2	Very low	126 Å²	126	132.2 Å²	132.2	82%	0.818	79%	0.787	S	S	*	*				-144.4	172	122.1	38.9	-26	0	0	0	113.1
32	A	36.1	Very low	37.6	Very low	93 Å²	93	127.2 Å²	127.2	77%	0.769	77%	0.77	S	S	*	*			cis	-162.3	158.4	-26.6	0	0	0	0	0	107.5
33	P	43.3	Very low	38.7	Very low	132 Å²	132	123.4 Å²	123.4	86%	0.857	77%	0.77	S	S	*	*			trans	-98.6	156.8	-161.2	37	-36.1	0	0	0	116.1
34	S	36.6	Very low	40.4	Very low	128 Å²	128	122.1 Å²	122.1	90%	0.895	75%	0.752	S	S	*	*			trans	-138.4	154.6	154.3	61.9	0	0	0	0	109.4
35	A	34.7	Very low	42.9	Very low	103 Å²	103	121.6 Å²	121.6	85%	0.851	75%	0.745	S	S	*	*			trans	-115.5	154.9	-160.7	0	0	0	0	0	114.3
36	S	38.2	Very low	45.3	Very low	126 Å²	126	115 Å²	115	88%	0.881	71%	0.71	S	S	*	*			trans	-146.7	157.6	144.1	-164	0	0	0	0	109.6
37	S	32.7	Very low	47.6	Very low	109 Å²	109	111 Å²	111	76%	0.762	70%	0.7	S	S	*	*			trans	-129.8	132.1	-165.1	179.6	0	0	0	0	112.2
38	T	36.3	Very low	50	Low	131 Å²	131	105 Å²	105	80%	0.804	68%	0.679	S	S	*	*			trans	-150.1	102.9	171.2	-0.9	0	0	0	0	113	A40	T38-A40 PolarHBondContact O-N 3.22Å
39	M	37.4	Very low	52.6	Low	184 Å²	184	99.5 Å²	99.5	91%	0.906	66%	0.659	S	S	*	*			trans	48.8	62.3	144.6	-59.8	-61.8	175.7	0	0	118.7
40	A	35.8	Very low	54.9	Low	92 Å²	92	99.1 Å²	99.1	76%	0.76	66%	0.661	S	S	*	*			trans	-100.2	121.4	156.3	0	0	0	0	0	110.2	T38 S42	T38-A40 PolarHBondContact O-N 3.22Å; A40-S42 PolarHBondContact O-N 3.26Å; A40-S42 VanDerWaalsContact O-N 3.1Å
41	I	44.7	Very low	56.6	Low	177 Å²	177	99.5 Å²	99.5	91%	0.908	65%	0.651	S	S	*	*			trans	-75.2	99	173.9	-59.6	175.8	0	0	0	107.7
42	S	43.5	Very low	58.8	Low	60 Å²	60	95.1 Å²	95.1	42%	0.42	63%	0.628	S	S	.	*			trans	-72.4	147.7	-167.8	73.2	0	0	0	0	113.7	A40 E44	A40-S42 PolarHBondContact O-N 3.26Å; A40-S42 VanDerWaalsContact O-N 3.1Å; S42-E44 VanDerWaalsContact CB-OE2 3.28Å; S42-E44 WeakPolarHBondContact CB-OE2 3.37Å; S42-E44 PolarHBondContact O-N 3.24Å; S42-E44 PolarHBondContact OG-OE2 3.14Å
43	A	60.2	Low	61.2	Low	102 Å²	102	91 Å²	91	84%	0.843	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	35.9	179.8	0	0	0	0	0	113.1
44	E	70.7	Confident	63.2	Low	80 Å²	80	87.9 Å²	87.9	37%	0.374	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.7	-1.5	-164.5	-62.3	175.9	131.9	0	0	113.1	S42 G52 L53	S42-E44 VanDerWaalsContact CB-OE2 3.28Å; S42-E44 WeakPolarHBondContact CB-OE2 3.37Å; S42-E44 PolarHBondContact O-N 3.24Å; S42-E44 PolarHBondContact OG-OE2 3.14Å; E44-G52 CarbonylContact O-C 3.51Å; E44-G52 WeakPolarHBondContact O-CA 3.5Å; E44-L53 WeakPolarHBondContact O-CA 3.27Å; E44-L53 VanDerWaalsContact O-CB 3.3Å; E44-L53 WeakPolarHBondContact O-CB 3.42Å; E44-L53 PolarHBondContact O-N 3.49Å
45	T	85.3	Confident	65.3	Low	82 Å²	82	90 Å²	90	50%	0.503	57%	0.565	S	S	.	*	B	Isolated β-bridge	trans	-110.2	145.4	174	60.8	0	0	0	0	112.7	K51	T45-K51 CarbonylContact C-O 3.58Å; T45-K51 WeakPolarHBondContact CA-O 3.05Å
46	C	87.8	Confident	67.6	Low	1 Å²	1	89.1 Å²	89.1	1%	0.007	54%	0.54	C	S	.	.			trans	-73.6	120.2	177.5	177.8	0	0	0	0	111.2	A48 C49 A50 K51 L53 H64	C46-A48 PolarHBondContact O-N 3.42Å; C46-C49 PolarHBondContact O-N 3.05Å; C46-C49 VanDerWaalsContact SG-SG 3.65Å; C46-A50 WeakPolarHBondContact O-CA 3.27Å; C46-A50 PolarHBondContact O-N 3.27Å; C46-K51 PolarHBondContact N-O 2.93Å; C46-L53 HydrophobicContact CB-CD1 3.93Å; C46-L53 HydrophobicContact CB-CD2 4.3Å; C46-L53 HydrophobicContact CB-CG 4.17Å; C46-H64 WeakPolarHBondContact CB-NE2 3.37Å; C46-H64 PolarHBondContact SG-CD2 2.79Å; C46-H64 PolarHBondContact SG-NE2 3.36Å
47	P	81.4	Confident	69.9	Low	74 Å²	74	87 Å²	87	48%	0.481	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.4	-174.2	29.1	-38.8	0	0	0	114.3	I12	I12-P47 HydrophobicContact CD1-CB 4.37Å; I12-P47 HydrophobicContact CD1-CG 3.87Å
48	A	83.3	Confident	72.3	Confident	28 Å²	28	84.8 Å²	84.8	23%	0.231	50%	0.503	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-9.6	-177.4	0	0	0	0	0	114.3	C46 C68 L69	C46-A48 PolarHBondContact O-N 3.42Å; A48-C68 HydrophobicContact CB-CB 4.06Å; A48-C68 WeakPolarHBondContact CB-SG 3.37Å; A48-L69 HydrophobicContact CB-CD2 4.17Å
49	C	88.3	Confident	74.6	Confident	53 Å²	53	84 Å²	84	36%	0.358	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.4	8.4	174.9	68.8	0	0	0	0	116.4	C46 K51 H64 C68	C46-C49 PolarHBondContact O-N 3.05Å; C46-C49 VanDerWaalsContact SG-SG 3.65Å; C49-K51 PolarHBondContact O-N 3.05Å; C49-H64 PolarHBondContact SG-NE2 3.4Å; C49-H64 VanDerWaalsContact SG-NE2 3.41Å; C49-C68 VanDerWaalsContact CB-SG 3.57Å
50	A	86.2	Confident	77	Confident	83 Å²	83	80 Å²	80	69%	0.686	47%	0.472	S	S	*	.			trans	57	14	177.5	0	0	0	0	0	116.5	C46	C46-A50 WeakPolarHBondContact O-CA 3.27Å; C46-A50 PolarHBondContact O-N 3.27Å
51	K	85.9	Confident	79.5	Confident	126 Å²	126	78.8 Å²	78.8	55%	0.548	45%	0.448	S	S	.	.			trans	-73.5	139.2	173.8	-68.9	-175.8	175	-169.3	0	111.3	T45 C46 C49	T45-K51 CarbonylContact C-O 3.58Å; T45-K51 WeakPolarHBondContact CA-O 3.05Å; C46-K51 PolarHBondContact N-O 2.93Å; C49-K51 PolarHBondContact O-N 3.05Å
52	G	87.1	Confident	81.4	Confident	34 Å²	34	77.3 Å²	77.3	35%	0.351	43%	0.431	S	S	.	.	B	Isolated β-bridge	trans	-58.9	142.1	166.2	0	0	0	0	0	112.2	E44 D54	E44-G52 CarbonylContact O-C 3.51Å; E44-G52 WeakPolarHBondContact O-CA 3.5Å; G52-D54 WeakPolarHBondContact CA-OD1 3.43Å
53	L	86.6	Confident	83.6	Confident	5 Å²	5	79.4 Å²	79.4	3%	0.026	43%	0.434	C	S	.	.			trans	-128.3	-5.7	-175	-63.2	-176.5	0	0	0	112.1	E44 C46 H55 Y56 R61 H64 I65	E44-L53 WeakPolarHBondContact O-CA 3.27Å; E44-L53 VanDerWaalsContact O-CB 3.3Å; E44-L53 WeakPolarHBondContact O-CB 3.42Å; E44-L53 PolarHBondContact O-N 3.49Å; C46-L53 HydrophobicContact CB-CD1 3.93Å; C46-L53 HydrophobicContact CB-CD2 4.3Å; C46-L53 HydrophobicContact CB-CG 4.17Å; L53-H55 PolarHBondContact O-N 2.97Å; L53-Y56 HydrophobicContact CD2-CD1 4.38Å; L53-Y56 HydrophobicContact CD2-CD2 4.21Å; L53-Y56 HydrophobicContact CD2-CE2 4.41Å; L53-Y56 HydrophobicContact CD2-CG 4.22Å; L53-Y56 WeakPolarHBondContact O-CB 3.44Å; L53-Y56 PolarHBondContact O-N 2.99Å; L53-R61 HydrophobicContact CB-CG 4.1Å; L53-R61 HydrophobicContact CD1-CB 4.49Å; L53-R61 PolarHBondContact O-NE 3.3Å; L53-H64 HydrophobicContact CD2-CB 4.24Å; L53-I65 HydrophobicContact CD1-CD1 4.09Å; L53-I65 HydrophobicContact CD1-CG1 4.07Å
54	D	84.2	Confident	85.1	Confident	68 Å²	68	75.8 Å²	75.8	36%	0.364	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-35.6	-53.3	162.9	27.1	-75.3	0	0	0	112.1	G52 Y56 R61	G52-D54 WeakPolarHBondContact CA-OD1 3.43Å; D54-Y56 VanDerWaalsContact C-N 3.28Å; D54-Y56 PolarHBondContact O-N 2.95Å; D54-R61 PolarHBondContact O-NH2 3.35Å
55	H	81	Confident	86	Confident	171 Å²	171	73.2 Å²	73.2	79%	0.792	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-7.8	177.5	-65.7	77.8	0	0	0	116.1	L53	L53-H55 PolarHBondContact O-N 2.97Å
56	Y	82.8	Confident	86.2	Confident	86 Å²	86	71.8 Å²	71.8	34%	0.337	38%	0.377	S	S	.	.	S	Bend	trans	-98.8	135.2	-175.5	-74.1	-123.8	0	0	0	110.1	L53 D54 Q60 R61 H64	L53-Y56 HydrophobicContact CD2-CD1 4.38Å; L53-Y56 HydrophobicContact CD2-CD2 4.21Å; L53-Y56 HydrophobicContact CD2-CE2 4.41Å; L53-Y56 HydrophobicContact CD2-CG 4.22Å; L53-Y56 WeakPolarHBondContact O-CB 3.44Å; L53-Y56 PolarHBondContact O-N 2.99Å; D54-Y56 VanDerWaalsContact C-N 3.28Å; D54-Y56 PolarHBondContact O-N 2.95Å; Y56-Q60 HydrophobicContact CD1-CB 3.83Å; Y56-Q60 HydrophobicContact CG-CB 4.39Å; Y56-R61 WeakPolarHBondContact O-CG 3.45Å; Y56-R61 PolarHBondContact O-NE 3.19Å; Y56-H64 HydrophobicContact CD1-CB 4.25Å; Y56-H64 HydrophobicContact CE1-CB 4.11Å; Y56-H64 AromaticContact CE1-ND1 3.62Å; Y56-H64 AromaticContact CZ-ND1 3.83Å
57	T	86	Confident	86.3	Confident	82 Å²	82	75.7 Å²	75.7	50%	0.503	40%	0.399	S	S	.	.			trans	-63.1	153.4	168.9	74.7	0	0	0	0	110	I59 Q60 R61	T57-I59 PolarHBondContact O-N 2.62Å; T57-Q60 CarbonylContact O-C 3.47Å; T57-Q60 WeakPolarHBondContact O-CA 3.33Å; T57-Q60 WeakPolarHBondContact O-CB 3.37Å; T57-Q60 PolarHBondContact O-N 3.18Å; T57-Q60 VanDerWaalsContact OG1-CG 3.31Å; T57-Q60 WeakPolarHBondContact OG1-CG 3.12Å; T57-Q60 PolarHBondContact OG1-OE1 3.18Å; T57-R61 WeakPolarHBondContact O-CG 3.17Å; T57-R61 PolarHBondContact O-N 3.23Å
58	V	83.8	Confident	86.8	Confident	61 Å²	61	73.1 Å²	73.1	37%	0.37	38%	0.382	S	S	.	.	H	α-helix	trans	-59.8	-30.1	-170.6	-166.3	0	0	0	0	113.3	R61 R62	V58-R61 PolarHBondContact O-N 2.75Å; V58-R62 PolarHBondContact O-N 3.37Å
59	I	85.3	Confident	87	Confident	116 Å²	116	74.6 Å²	74.6	60%	0.595	39%	0.385	S	S	*	.	H	α-helix	trans	-66.1	-44.9	170.9	-59.8	176.2	0	0	0	110.9	T57 R62 Q63	T57-I59 PolarHBondContact O-N 2.62Å; I59-R62 PolarHBondContact O-N 2.79Å; I59-Q63 PolarHBondContact O-N 2.95Å
60	Q	86.6	Confident	87	Confident	98 Å²	98	76.7 Å²	76.7	46%	0.458	39%	0.393	S	S	.	.	H	α-helix	trans	-65.9	-36.5	175.3	-63.7	167.1	-14.4	0	0	112	Y56 T57 Q63 H64	Y56-Q60 HydrophobicContact CD1-CB 3.83Å; Y56-Q60 HydrophobicContact CG-CB 4.39Å; T57-Q60 CarbonylContact O-C 3.47Å; T57-Q60 WeakPolarHBondContact O-CA 3.33Å; T57-Q60 WeakPolarHBondContact O-CB 3.37Å; T57-Q60 PolarHBondContact O-N 3.18Å; T57-Q60 VanDerWaalsContact OG1-CG 3.31Å; T57-Q60 WeakPolarHBondContact OG1-CG 3.12Å; T57-Q60 PolarHBondContact OG1-OE1 3.18Å; Q60-Q63 PolarHBondContact O-N 3.36Å; Q60-H64 VanDerWaalsContact O-CB 3.23Å; Q60-H64 WeakPolarHBondContact O-CB 3.24Å; Q60-H64 PolarHBondContact O-N 3.06Å
61	R	88.1	Confident	87	Confident	67 Å²	67	76.4 Å²	76.4	25%	0.253	39%	0.386	S	S	.	.	H	α-helix	trans	-57.9	-50.9	171.7	-60.9	-172.9	-168.9	-172.7	-1.6	110.3	L53 D54 Y56 T57 V58 Q63 H64 I65	L53-R61 HydrophobicContact CB-CG 4.1Å; L53-R61 HydrophobicContact CD1-CB 4.49Å; L53-R61 PolarHBondContact O-NE 3.3Å; D54-R61 PolarHBondContact O-NH2 3.35Å; Y56-R61 WeakPolarHBondContact O-CG 3.45Å; Y56-R61 PolarHBondContact O-NE 3.19Å; T57-R61 WeakPolarHBondContact O-CG 3.17Å; T57-R61 PolarHBondContact O-N 3.23Å; V58-R61 PolarHBondContact O-N 2.75Å; R61-Q63 PolarHBondContact O-N 3.33Å; R61-H64 WeakPolarHBondContact O-CB 3.44Å; R61-H64 PolarHBondContact O-N 2.81Å; R61-I65 WeakPolarHBondContact O-CB 3.39Å; R61-I65 VanDerWaalsContact O-CG1 3.27Å; R61-I65 WeakPolarHBondContact O-CG1 3.25Å; R61-I65 PolarHBondContact O-N 3Å
62	R	85.2	Confident	87	Confident	146 Å²	146	72.3 Å²	72.3	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-61.1	-44.7	178.3	-166.1	-179.8	-168.7	-169	7.2	112.1	V58 I59 H64 I65 N66	V58-R62 PolarHBondContact O-N 3.37Å; I59-R62 PolarHBondContact O-N 2.79Å; R62-H64 PolarHBondContact O-N 3.05Å; R62-I65 PolarHBondContact O-N 3.07Å; R62-N66 WeakPolarHBondContact O-CB 3.46Å; R62-N66 PolarHBondContact O-N 3.29Å; R62-N66 PolarHBondContact O-OD1 2.68Å
63	Q	89.3	Confident	86.9	Confident	105 Å²	105	73.2 Å²	73.2	49%	0.491	37%	0.373	S	S	.	.	H	α-helix	trans	-64.9	-39.3	177	-169.8	62.6	48.1	0	0	112	I59 Q60 R61 N67	I59-Q63 PolarHBondContact O-N 2.95Å; Q60-Q63 PolarHBondContact O-N 3.36Å; R61-Q63 PolarHBondContact O-N 3.33Å; Q63-N67 PolarHBondContact NE2-OD1 3.46Å; Q63-N67 VanDerWaalsContact O-CB 3.24Å; Q63-N67 WeakPolarHBondContact O-CB 3.16Å; Q63-N67 PolarHBondContact O-N 3.31Å; Q63-N67 PolarHBondContact O-ND2 3.47Å; Q63-N67 PolarHBondContact O-OD1 3.16Å
64	H	91.3	Very high	86.9	Confident	26 Å²	26	74.5 Å²	74.5	12%	0.12	38%	0.38	C	S	.	.	H	α-helix	trans	-61.3	-51	174	178.6	116.8	0	0	0	111	C46 C49 L53 Y56 Q60 R61 R62 N66 N67 C68	C46-H64 WeakPolarHBondContact CB-NE2 3.37Å; C46-H64 PolarHBondContact SG-CD2 2.79Å; C46-H64 PolarHBondContact SG-NE2 3.36Å; C49-H64 PolarHBondContact SG-NE2 3.4Å; C49-H64 VanDerWaalsContact SG-NE2 3.41Å; L53-H64 HydrophobicContact CD2-CB 4.24Å; Y56-H64 HydrophobicContact CD1-CB 4.25Å; Y56-H64 HydrophobicContact CE1-CB 4.11Å; Y56-H64 AromaticContact CE1-ND1 3.62Å; Y56-H64 AromaticContact CZ-ND1 3.83Å; Q60-H64 VanDerWaalsContact O-CB 3.23Å; Q60-H64 WeakPolarHBondContact O-CB 3.24Å; Q60-H64 PolarHBondContact O-N 3.06Å; R61-H64 WeakPolarHBondContact O-CB 3.44Å; R61-H64 PolarHBondContact O-N 2.81Å; R62-H64 PolarHBondContact O-N 3.05Å; H64-N66 PolarHBondContact O-N 3.26Å; H64-N67 PolarHBondContact O-N 3.03Å; H64-C68 WeakPolarHBondContact O-CB 3.35Å; H64-C68 PolarHBondContact O-N 2.83Å
65	I	90.7	Very high	87	Confident	25 Å²	25	77.8 Å²	77.8	13%	0.128	39%	0.387	C	S	.	.	H	α-helix	trans	-59	-48.4	-179.1	-70.2	163.4	0	0	0	110	I12 L53 R61 R62 C68 L69	I12-I65 HydrophobicContact CG2-CD1 4.18Å; I12-I65 HydrophobicContact CG2-CG2 4.2Å; L53-I65 HydrophobicContact CD1-CD1 4.09Å; L53-I65 HydrophobicContact CD1-CG1 4.07Å; R61-I65 WeakPolarHBondContact O-CB 3.39Å; R61-I65 VanDerWaalsContact O-CG1 3.27Å; R61-I65 WeakPolarHBondContact O-CG1 3.25Å; R61-I65 PolarHBondContact O-N 3Å; R62-I65 PolarHBondContact O-N 3.07Å; I65-C68 PolarHBondContact O-N 3.35Å; I65-L69 HydrophobicContact CG2-CD1 3.78Å; I65-L69 HydrophobicContact CG2-CG 4.35Å; I65-L69 WeakPolarHBondContact O-CB 3.27Å; I65-L69 VanDerWaalsContact O-CG 3.31Å; I65-L69 WeakPolarHBondContact O-CG 3.35Å; I65-L69 PolarHBondContact O-N 2.88Å
66	N	89.4	Confident	87.4	Confident	52 Å²	52	73.3 Å²	73.3	28%	0.278	37%	0.366	S	S	.	.	H	α-helix	trans	-58.4	-54.2	175.9	-68.9	-6.6	0	0	0	111.8	R62 H64 C68 L69 D70	R62-N66 WeakPolarHBondContact O-CB 3.46Å; R62-N66 PolarHBondContact O-N 3.29Å; R62-N66 PolarHBondContact O-OD1 2.68Å; H64-N66 PolarHBondContact O-N 3.26Å; N66-C68 PolarHBondContact O-N 3.08Å; N66-L69 PolarHBondContact O-N 3.37Å; N66-D70 WeakPolarHBondContact O-CB 3.44Å; N66-D70 PolarHBondContact O-N 2.91Å
67	N	90.2	Very high	87.5	Confident	84 Å²	84	71.2 Å²	71.2	45%	0.449	36%	0.364	S	S	.	.	H	α-helix	trans	-56.2	-35.8	178.1	-73.8	-8.4	0	0	0	112.3	Q63 H64 S71	Q63-N67 PolarHBondContact NE2-OD1 3.46Å; Q63-N67 VanDerWaalsContact O-CB 3.24Å; Q63-N67 WeakPolarHBondContact O-CB 3.16Å; Q63-N67 PolarHBondContact O-N 3.31Å; Q63-N67 PolarHBondContact O-ND2 3.47Å; Q63-N67 PolarHBondContact O-OD1 3.16Å; H64-N67 PolarHBondContact O-N 3.03Å; N67-S71 VanDerWaalsContact O-CB 3.31Å; N67-S71 WeakPolarHBondContact O-CB 3.31Å; N67-S71 PolarHBondContact O-N 3.22Å; N67-S71 PolarHBondContact O-OG 3.3Å
68	C	91.2	Very high	87.7	Confident	19 Å²	19	68.8 Å²	68.8	13%	0.128	35%	0.348	C	S	.	.	H	α-helix	trans	-75.5	-47	-179.3	-161.4	0	0	0	0	111.5	A48 C49 H64 I65 N66 D70 S71 E72	A48-C68 HydrophobicContact CB-CB 4.06Å; A48-C68 WeakPolarHBondContact CB-SG 3.37Å; C49-C68 VanDerWaalsContact CB-SG 3.57Å; H64-C68 WeakPolarHBondContact O-CB 3.35Å; H64-C68 PolarHBondContact O-N 2.83Å; I65-C68 PolarHBondContact O-N 3.35Å; N66-C68 PolarHBondContact O-N 3.08Å; C68-D70 VanDerWaalsContact C-N 3.33Å; C68-D70 PolarHBondContact O-N 3.12Å; C68-S71 WeakPolarHBondContact O-CB 3.49Å; C68-S71 PolarHBondContact O-N 3.46Å; C68-S71 VanDerWaalsContact O-N 3.12Å; C68-E72 VanDerWaalsContact O-CB 3.29Å; C68-E72 WeakPolarHBondContact O-CB 3.3Å; C68-E72 PolarHBondContact O-N 2.84Å
69	L	87.3	Confident	88	Confident	59 Å²	59	70.1 Å²	70.1	31%	0.309	35%	0.352	S	S	.	.	H	α-helix	trans	-58.4	-43.4	173.9	-71.4	170.9	0	0	0	111.5	A48 I65 N66 E72 A73	A48-L69 HydrophobicContact CB-CD2 4.17Å; I65-L69 HydrophobicContact CG2-CD1 3.78Å; I65-L69 HydrophobicContact CG2-CG 4.35Å; I65-L69 WeakPolarHBondContact O-CB 3.27Å; I65-L69 VanDerWaalsContact O-CG 3.31Å; I65-L69 WeakPolarHBondContact O-CG 3.35Å; I65-L69 PolarHBondContact O-N 2.88Å; N66-L69 PolarHBondContact O-N 3.37Å; L69-E72 PolarHBondContact O-N 3.42Å; L69-A73 WeakPolarHBondContact O-CB 3.36Å; L69-A73 PolarHBondContact O-N 2.85Å
70	D	87.9	Confident	88.1	Confident	98 Å²	98	72.3 Å²	72.3	52%	0.524	35%	0.353	S	S	.	.	H	α-helix	trans	-61.7	-44.2	173.4	-81.6	-32	0	0	0	111.8	N66 C68 E72 A73 N74	N66-D70 WeakPolarHBondContact O-CB 3.44Å; N66-D70 PolarHBondContact O-N 2.91Å; C68-D70 VanDerWaalsContact C-N 3.33Å; C68-D70 PolarHBondContact O-N 3.12Å; D70-E72 VanDerWaalsContact C-N 3.29Å; D70-E72 PolarHBondContact O-N 2.97Å; D70-A73 PolarHBondContact O-N 3.07Å; D70-N74 VanDerWaalsContact O-CB 3.25Å; D70-N74 WeakPolarHBondContact O-CB 3.28Å; D70-N74 VanDerWaalsContact O-CG 3.3Å; D70-N74 PolarHBondContact O-N 3.46Å; D70-N74 PolarHBondContact O-ND2 3.22Å
71	S	87	Confident	88.2	Confident	77 Å²	77	69.7 Å²	69.7	54%	0.538	34%	0.34	S	S	.	.	H	α-helix	trans	-62.5	-38	176.6	-63.1	0	0	0	0	111.9	N67 C68 N74 R75	N67-S71 VanDerWaalsContact O-CB 3.31Å; N67-S71 WeakPolarHBondContact O-CB 3.31Å; N67-S71 PolarHBondContact O-N 3.22Å; N67-S71 PolarHBondContact O-OG 3.3Å; C68-S71 WeakPolarHBondContact O-CB 3.49Å; C68-S71 PolarHBondContact O-N 3.46Å; C68-S71 VanDerWaalsContact O-N 3.12Å; S71-N74 PolarHBondContact O-N 2.83Å; S71-R75 VanDerWaalsContact O-CB 3.29Å; S71-R75 WeakPolarHBondContact O-CB 3.5Å; S71-R75 PolarHBondContact O-N 2.85Å
72	E	86	Confident	88.2	Confident	39 Å²	39	73.7 Å²	73.7	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-74.8	-38	-178.5	-149.1	-86	132.5	0	0	111.5	C68 L69 D70 R75 K76	C68-E72 VanDerWaalsContact O-CB 3.29Å; C68-E72 WeakPolarHBondContact O-CB 3.3Å; C68-E72 PolarHBondContact O-N 2.84Å; L69-E72 PolarHBondContact O-N 3.42Å; D70-E72 VanDerWaalsContact C-N 3.29Å; D70-E72 PolarHBondContact O-N 2.97Å; E72-R75 WeakPolarHBondContact O-CB 3.46Å; E72-R75 PolarHBondContact O-N 2.75Å; E72-R75 IonicContact OE1-CZ 3.45Å; E72-R75 IonicContact OE1-NE 2.77Å; E72-R75 IonicContact OE1-NH2 2.71Å; E72-R75 PolarHBondContact OE1-NH2 2.99Å; E72-K76 VanDerWaalsContact CD-NZ 3.26Å; E72-K76 WeakPolarHBondContact O-CB 3.5Å; E72-K76 WeakPolarHBondContact O-CG 3.44Å; E72-K76 PolarHBondContact O-N 3.37Å; E72-K76 WeakPolarHBondContact OE1-CE 3.39Å; E72-K76 IonicContact OE1-NZ 3.52Å; E72-K76 PolarHBondContact OE1-NZ 2.73Å; E72-K76 VanDerWaalsContact OE1-NZ 3.12Å; E72-K76 WeakPolarHBondContact OE2-CE 3.46Å; E72-K76 IonicContact OE2-NZ 3.33Å; E72-K76 PolarHBondContact OE2-NZ 3.37Å
73	A	86.2	Confident	88.4	Confident	54 Å²	54	72 Å²	72	45%	0.446	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-43.1	169.3	0	0	0	0	0	112.4	L69 D70 K76 S77	L69-A73 WeakPolarHBondContact O-CB 3.36Å; L69-A73 PolarHBondContact O-N 2.85Å; D70-A73 PolarHBondContact O-N 3.07Å; A73-K76 PolarHBondContact O-N 3Å; A73-S77 WeakPolarHBondContact O-CB 3.22Å; A73-S77 PolarHBondContact O-N 3.38Å
74	N	86.2	Confident	88.3	Confident	32 Å²	32	70.7 Å²	70.7	17%	0.171	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-41.2	173.8	-80.5	-60.9	0	0	0	111.4	D70 S71 S77 L78 V154	D70-N74 VanDerWaalsContact O-CB 3.25Å; D70-N74 WeakPolarHBondContact O-CB 3.28Å; D70-N74 VanDerWaalsContact O-CG 3.3Å; D70-N74 PolarHBondContact O-N 3.46Å; D70-N74 PolarHBondContact O-ND2 3.22Å; S71-N74 PolarHBondContact O-N 2.83Å; N74-S77 PolarHBondContact O-N 3.09Å; N74-L78 WeakPolarHBondContact O-CB 3.32Å; N74-L78 PolarHBondContact O-N 3.42Å; N74-V154 HydrophobicContact CB-CG1 4.29Å; N74-V154 VanDerWaalsContact OD1-CG1 3.3Å; N74-V154 WeakPolarHBondContact OD1-CG1 3.17Å
75	R	86.7	Confident	88.2	Confident	136 Å²	136	70.3 Å²	70.3	51%	0.513	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-48.8	172.9	-176.3	-172.8	72.8	104.3	-1.6	111.7	S71 E72 S77 L78 L79	S71-R75 VanDerWaalsContact O-CB 3.29Å; S71-R75 WeakPolarHBondContact O-CB 3.5Å; S71-R75 PolarHBondContact O-N 2.85Å; E72-R75 WeakPolarHBondContact O-CB 3.46Å; E72-R75 PolarHBondContact O-N 2.75Å; E72-R75 IonicContact OE1-CZ 3.45Å; E72-R75 IonicContact OE1-NE 2.77Å; E72-R75 IonicContact OE1-NH2 2.71Å; E72-R75 PolarHBondContact OE1-NH2 2.99Å; R75-S77 VanDerWaalsContact C-N 3.3Å; R75-S77 PolarHBondContact O-N 3.21Å; R75-L78 PolarHBondContact O-N 3.49Å; R75-L79 HydrophobicContact CG-CD1 4.4Å; R75-L79 WeakPolarHBondContact O-CG 3.17Å; R75-L79 PolarHBondContact O-N 3.38Å
76	K	87.7	Confident	88.1	Confident	77 Å²	77	72.6 Å²	72.6	34%	0.335	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-39.6	175.1	-79.3	164.8	166.5	161.1	0	112.2	E72 A73 R80	E72-K76 VanDerWaalsContact CD-NZ 3.26Å; E72-K76 WeakPolarHBondContact O-CB 3.5Å; E72-K76 WeakPolarHBondContact O-CG 3.44Å; E72-K76 PolarHBondContact O-N 3.37Å; E72-K76 WeakPolarHBondContact OE1-CE 3.39Å; E72-K76 IonicContact OE1-NZ 3.52Å; E72-K76 PolarHBondContact OE1-NZ 2.73Å; E72-K76 VanDerWaalsContact OE1-NZ 3.12Å; E72-K76 WeakPolarHBondContact OE2-CE 3.46Å; E72-K76 IonicContact OE2-NZ 3.33Å; E72-K76 PolarHBondContact OE2-NZ 3.37Å; A73-K76 PolarHBondContact O-N 3Å; K76-R80 WeakPolarHBondContact O-CG 3.27Å; K76-R80 PolarHBondContact O-N 2.9Å
77	S	86.5	Confident	88	Confident	43 Å²	43	74.2 Å²	74.2	30%	0.301	36%	0.364	S	S	.	.	H	α-helix	trans	-69.6	-41.6	175.5	-173.7	0	0	0	0	112.5	A73 N74 R75 L79 R80 K81	A73-S77 WeakPolarHBondContact O-CB 3.22Å; A73-S77 PolarHBondContact O-N 3.38Å; N74-S77 PolarHBondContact O-N 3.09Å; R75-S77 VanDerWaalsContact C-N 3.3Å; R75-S77 PolarHBondContact O-N 3.21Å; S77-L79 PolarHBondContact O-N 2.82Å; S77-R80 PolarHBondContact O-N 3.08Å; S77-K81 WeakPolarHBondContact O-CG 3.31Å; S77-K81 PolarHBondContact O-N 3.01Å
78	L	88.8	Confident	88	Confident	31 Å²	31	70.2 Å²	70.2	16%	0.162	34%	0.343	C	S	.	.	H	α-helix	trans	-59.9	-46.3	174.4	-170.9	154.2	0	0	0	111.4	N74 R75 R80 K81 R82 I151 V154	N74-L78 WeakPolarHBondContact O-CB 3.32Å; N74-L78 PolarHBondContact O-N 3.42Å; R75-L78 PolarHBondContact O-N 3.49Å; L78-R80 PolarHBondContact O-N 3.16Å; L78-K81 PolarHBondContact O-N 2.99Å; L78-R82 HydrophobicContact CD2-CB 4.47Å; L78-R82 WeakPolarHBondContact O-CB 3.24Å; L78-R82 PolarHBondContact O-N 2.8Å; L78-I151 HydrophobicContact CD1-CB 4.3Å; L78-I151 HydrophobicContact CD1-CG1 3.51Å; L78-V154 HydrophobicContact CB-CG2 3.97Å; L78-V154 HydrophobicContact CG-CG2 4.45Å
79	L	89.6	Confident	87.9	Confident	88 Å²	88	70 Å²	70	46%	0.461	34%	0.341	S	S	.	.	H	α-helix	trans	-57.7	-48.8	178.6	-72.3	169.7	0	0	0	111.4	R75 S77 K81 R82 E83	R75-L79 HydrophobicContact CG-CD1 4.4Å; R75-L79 WeakPolarHBondContact O-CG 3.17Å; R75-L79 PolarHBondContact O-N 3.38Å; S77-L79 PolarHBondContact O-N 2.82Å; L79-K81 VanDerWaalsContact C-N 3.33Å; L79-K81 PolarHBondContact O-N 3.37Å; L79-R82 PolarHBondContact O-N 2.81Å; L79-R82 VanDerWaalsContact O-N 3.14Å; L79-E83 WeakPolarHBondContact O-CB 3.33Å; L79-E83 PolarHBondContact O-N 3.23Å
80	R	88.9	Confident	88	Confident	162 Å²	162	67.8 Å²	67.8	61%	0.611	33%	0.329	S	S	*	.	H	α-helix	trans	-59.5	-39.6	175.5	-70.2	177.6	-177.3	174.1	3.5	112.9	K76 S77 L78 L84	K76-R80 WeakPolarHBondContact O-CG 3.27Å; K76-R80 PolarHBondContact O-N 2.9Å; S77-R80 PolarHBondContact O-N 3.08Å; L78-R80 PolarHBondContact O-N 3.16Å; R80-L84 WeakPolarHBondContact O-CB 3.22Å; R80-L84 PolarHBondContact O-N 3.4Å
81	K	88.1	Confident	88.2	Confident	43 Å²	43	63.2 Å²	63.2	19%	0.187	31%	0.305	C	S	.	.	H	α-helix	trans	-69.2	-37.1	175.3	-69.3	-176.7	-172.6	-173.6	0	112.4	S77 L78 L79 L84 W85 P149 V154 E157	S77-K81 WeakPolarHBondContact O-CG 3.31Å; S77-K81 PolarHBondContact O-N 3.01Å; L78-K81 PolarHBondContact O-N 2.99Å; L79-K81 VanDerWaalsContact C-N 3.33Å; L79-K81 PolarHBondContact O-N 3.37Å; K81-L84 PolarHBondContact O-N 2.92Å; K81-W85 WeakPolarHBondContact O-CB 3.36Å; K81-W85 PolarHBondContact O-N 3.2Å; K81-P149 HydrophobicContact CB-CB 3.74Å; K81-P149 HydrophobicContact CB-CG 4.04Å; K81-P149 HydrophobicContact CD-CB 4.5Å; K81-V154 HydrophobicContact CD-CG2 4.31Å; K81-E157 IonicContact NZ-OE1 3.71Å; K81-E157 PolarHBondContact NZ-OE1 2.93Å; K81-E157 IonicContact NZ-OE2 3.3Å; K81-E157 PolarHBondContact NZ-OE2 3.07Å
82	R	89	Confident	88.2	Confident	152 Å²	152	61.3 Å²	61.3	57%	0.574	29%	0.291	S	S	*	.	H	α-helix	trans	-68.1	-43	177.8	-176.8	176.6	176.7	172.7	-2.3	110.9	L78 L79 W85 M86 P149	L78-R82 HydrophobicContact CD2-CB 4.47Å; L78-R82 WeakPolarHBondContact O-CB 3.24Å; L78-R82 PolarHBondContact O-N 2.8Å; L79-R82 PolarHBondContact O-N 2.81Å; L79-R82 VanDerWaalsContact O-N 3.14Å; R82-W85 PolarHBondContact O-N 3.45Å; R82-M86 VanDerWaalsContact O-CG 3.22Å; R82-M86 WeakPolarHBondContact O-CG 3.46Å; R82-M86 PolarHBondContact O-N 3.44Å; R82-P149 HydrophobicContact CB-CG 4.12Å
83	E	88.2	Confident	88.4	Confident	111 Å²	111	61.1 Å²	61.1	52%	0.519	29%	0.291	S	S	.	.	H	α-helix	trans	-57	-52.3	171.4	179.9	-177.4	-174.8	0	0	111.1	L79 W85 M86 Q87	L79-E83 WeakPolarHBondContact O-CB 3.33Å; L79-E83 PolarHBondContact O-N 3.23Å; E83-W85 VanDerWaalsContact C-N 3.3Å; E83-W85 PolarHBondContact O-N 2.9Å; E83-M86 PolarHBondContact O-N 3.14Å; E83-M86 VanDerWaalsContact O-N 3.12Å; E83-Q87 VanDerWaalsContact CG-NE2 3.27Å; E83-Q87 WeakPolarHBondContact O-CG 3.45Å; E83-Q87 PolarHBondContact O-N 3.4Å; E83-Q87 PolarHBondContact OE1-NE2 3.46Å
84	L	88.3	Confident	88.6	Confident	77 Å²	77	60.5 Å²	60.5	40%	0.403	28%	0.283	S	S	.	.	H	α-helix	trans	-57.6	-41.4	176.6	-175.8	65.5	0	0	0	112.4	R80 K81 Q87 T88	R80-L84 WeakPolarHBondContact O-CB 3.22Å; R80-L84 PolarHBondContact O-N 3.4Å; K81-L84 PolarHBondContact O-N 2.92Å; L84-Q87 PolarHBondContact O-N 3.45Å; L84-T88 PolarHBondContact O-N 2.84Å; L84-T88 VanDerWaalsContact O-N 3.13Å; L84-T88 PolarHBondContact O-OG1 2.99Å
85	W	89.5	Confident	88.6	Confident	17 Å²	17	61.6 Å²	61.6	6%	0.064	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-42.6	176.3	-174.7	79.5	0	0	0	111.9	K81 R82 E83 T88 H143 T144 L146 K148 P149	K81-W85 WeakPolarHBondContact O-CB 3.36Å; K81-W85 PolarHBondContact O-N 3.2Å; R82-W85 PolarHBondContact O-N 3.45Å; E83-W85 VanDerWaalsContact C-N 3.3Å; E83-W85 PolarHBondContact O-N 2.9Å; W85-T88 PolarHBondContact O-N 3.04Å; W85-H143 AromaticContact CD2-NE2 3.19Å; W85-H143 AromaticContact CE2-NE2 3.67Å; W85-H143 AromaticContact CE3-NE2 2.66Å; W85-H143 AromaticContact CH2-CE1 2.94Å; W85-H143 WeakPolarHBondContact CH2-CE1 3.38Å; W85-H143 AromaticContact CH2-ND1 3.51Å; W85-H143 AromaticContact CH2-NE2 3.28Å; W85-H143 VanDerWaalsContact CH2-NE2 3.28Å; W85-H143 WeakPolarHBondContact CH2-NE2 3.47Å; W85-H143 AromaticContact CZ2-CE1 3.54Å; W85-H143 AromaticContact CZ2-ND1 3.86Å; W85-H143 AromaticContact CZ2-NE2 3.73Å; W85-H143 AromaticContact CZ3-CE1 3.32Å; W85-H143 WeakPolarHBondContact CZ3-CE1 3.44Å; W85-H143 AromaticContact CZ3-ND1 3.73Å; W85-H143 AromaticContact CZ3-NE2 2.71Å; W85-H143 WeakPolarHBondContact CZ3-NE2 3.47Å; W85-H143 PolarHBondContact O-NE2 2.85Å; W85-T144 PolarHBondContact NE1-OG1 2.94Å; W85-L146 PolarHBondContact NE1-O 3.39Å; W85-K148 HydrophobicContact CD2-CG 4.48Å; W85-K148 HydrophobicContact CH2-CD 4.17Å; W85-K148 HydrophobicContact CH2-CG 4.23Å; W85-K148 HydrophobicContact CZ2-CB 4.06Å; W85-K148 HydrophobicContact CZ2-CD 4.35Å; W85-K148 HydrophobicContact CZ2-CG 4.12Å; W85-K148 HydrophobicContact CZ3-CG 4.44Å; W85-P149 HydrophobicContact CB-CG 4.38Å
86	M	88	Confident	88.7	Confident	73 Å²	73	61.1 Å²	61.1	36%	0.36	29%	0.294	S	S	.	.	H	α-helix	trans	-72	-28.8	177.9	-65.9	-71.9	-73.8	0	0	114	R82 E83 K137 H143	R82-M86 VanDerWaalsContact O-CG 3.22Å; R82-M86 WeakPolarHBondContact O-CG 3.46Å; R82-M86 PolarHBondContact O-N 3.44Å; E83-M86 PolarHBondContact O-N 3.14Å; E83-M86 VanDerWaalsContact O-N 3.12Å; M86-K137 HydrophobicContact CE-CB 4.24Å; M86-K137 HydrophobicContact CE-CD 4.09Å; M86-K137 HydrophobicContact CE-CG 4.17Å; M86-K137 VanDerWaalsContact O-CE 3.24Å; M86-K137 WeakPolarHBondContact O-CE 3.3Å; M86-K137 PolarHBondContact O-NZ 2.99Å; M86-K137 VanDerWaalsContact O-NZ 3.14Å; M86-K137 HydrophobicContact SD-CG 4.32Å; M86-H143 WeakPolarHBondContact CA-NE2 3.42Å; M86-H143 PolarHBondContact SD-NE2 2.99Å
87	Q	87.7	Confident	88.9	Confident	87 Å²	87	59.8 Å²	59.8	41%	0.407	29%	0.293	S	S	.	.	H	α-helix	trans	-83.6	-12.3	176.6	-70.2	177.8	10.7	0	0	113.4	E83 L84 S100	E83-Q87 VanDerWaalsContact CG-NE2 3.27Å; E83-Q87 WeakPolarHBondContact O-CG 3.45Å; E83-Q87 PolarHBondContact O-N 3.4Å; E83-Q87 PolarHBondContact OE1-NE2 3.46Å; L84-Q87 PolarHBondContact O-N 3.45Å; Q87-S100 PolarHBondContact O-N 3.11Å
88	T	89.3	Confident	89	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	143.5	178.5	-60.1	0	0	0	0	110.5	L84 W85 P97 T144 L146	L84-T88 PolarHBondContact O-N 2.84Å; L84-T88 VanDerWaalsContact O-N 3.13Å; L84-T88 PolarHBondContact O-OG1 2.99Å; W85-T88 PolarHBondContact O-N 3.04Å; T88-P97 HydrophobicContact CG2-CB 3.57Å; T88-T144 HydrophobicContact CG2-CG2 3.81Å; T88-T144 WeakPolarHBondContact O-CG2 3.33Å; T88-L146 HydrophobicContact CG2-CD1 3.73Å; T88-L146 HydrophobicContact CG2-CG 4.27Å
89	T	88.2	Confident	88.7	Confident	14 Å²	14	61.4 Å²	61.4	9%	0.086	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	142.7	165	49	0	0	0	0	110	L98 R104 A133	T89-L98 PolarHBondContact N-O 2.92Å; T89-L98 PolarHBondContact O-N 3.48Å; T89-L98 VanDerWaalsContact O-O 3.11Å; T89-R104 PolarHBondContact OG1-NE 3.46Å; T89-R104 PolarHBondContact OG1-NH2 3.33Å; T89-A133 HydrophobicContact CG2-CB 4Å
90	D	91.3	Very high	88.4	Confident	13 Å²	13	60.6 Å²	60.6	7%	0.07	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	149.9	179.1	-66.6	-12.4	0	0	0	111.7	K96 P97 Q129 T144 K145	D90-K96 CarbonylContact C-O 3.57Å; D90-K96 WeakPolarHBondContact CA-O 3.35Å; D90-P97 WeakPolarHBondContact OD1-CA 3.49Å; D90-Q129 VanDerWaalsContact O-CG 3.3Å; D90-Q129 WeakPolarHBondContact O-CG 3.37Å; D90-T144 WeakPolarHBondContact OD1-CB 3.48Å; D90-T144 WeakPolarHBondContact OD2-CA 3.47Å; D90-K145 PolarHBondContact OD1-N 3.48Å; D90-K145 WeakPolarHBondContact OD2-CG 3.49Å; D90-K145 PolarHBondContact OD2-N 3.43Å
91	C	91.2	Very high	88.2	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.014	29%	0.29	C	S	.	.			trans	-68.6	128.8	172	-177.6	0	0	0	0	111.1	L93 C95 K96 L98	C91-L93 PolarHBondContact O-N 2.87Å; C91-C95 WeakPolarHBondContact O-CA 3.47Å; C91-C95 PolarHBondContact O-N 2.9Å; C91-K96 PolarHBondContact N-O 2.96Å; C91-L98 HydrophobicContact CB-CD1 3.87Å
92	P	87.2	Confident	88.2	Confident	37 Å²	37	57 Å²	57	24%	0.24	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-10.5	-179.1	26.2	-34.6	0	0	0	114.7	L108 L125 Q129	P92-L108 HydrophobicContact CG-CD2 4.41Å; P92-L125 HydrophobicContact CB-CB 4.12Å; P92-L125 HydrophobicContact CG-CB 4.12Å; P92-Q129 HydrophobicContact CB-CB 4.2Å; P92-Q129 HydrophobicContact CB-CG 4.44Å
93	L	89.4	Confident	88.2	Confident	35 Å²	35	58 Å²	58	18%	0.183	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-36.4	-176.5	-63	177.4	0	0	0	114.2	C91 C111 H115 V117 L122 L125	C91-L93 PolarHBondContact O-N 2.87Å; L93-C111 VanDerWaalsContact CB-SG 3.57Å; L93-H115 HydrophobicContact CD1-CB 4.22Å; L93-V117 HydrophobicContact CD1-CG2 4.11Å; L93-V117 HydrophobicContact CD2-CG2 3.85Å; L93-L122 HydrophobicContact CD1-CD1 3.72Å; L93-L125 HydrophobicContact CD2-CD1 4.18Å
94	C	91	Very high	88.3	Confident	41 Å²	41	54.4 Å²	54.4	28%	0.277	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	3.8	-179.3	74.5	0	0	0	0	114.4	K96 H107	C94-K96 PolarHBondContact O-N 2.92Å; C94-H107 PolarHBondContact SG-NE2 3.44Å
95	C	86.7	Confident	88.3	Confident	54 Å²	54	56.1 Å²	56.1	37%	0.365	31%	0.306	S	S	.	.			trans	51.8	19.9	-178.7	-50	0	0	0	0	116.1	C91 K145	C91-C95 WeakPolarHBondContact O-CA 3.47Å; C91-C95 PolarHBondContact O-N 2.9Å; C95-K145 HydrophobicContact CB-CD 3.92Å
96	K	89.1	Confident	88.5	Confident	126 Å²	126	57.5 Å²	57.5	55%	0.548	32%	0.321	S	S	.	.			trans	-72.6	134.2	172.6	-69.8	179.7	-177.4	-177.9	0	109.2	D90 C91 C94	D90-K96 CarbonylContact C-O 3.57Å; D90-K96 WeakPolarHBondContact CA-O 3.35Å; C91-K96 PolarHBondContact N-O 2.96Å; C94-K96 PolarHBondContact O-N 2.92Å
97	P	90	Very high	88.7	Confident	50 Å²	50	56 Å²	56	33%	0.325	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	132	173.8	25.2	-32	0	0	0	110.5	T88 D90 L146	T88-P97 HydrophobicContact CG2-CB 3.57Å; D90-P97 WeakPolarHBondContact OD1-CA 3.49Å; P97-L146 HydrophobicContact CB-CD1 4.27Å; P97-L146 HydrophobicContact CB-CD2 3.94Å; P97-L146 HydrophobicContact CB-CG 3.68Å; P97-L146 HydrophobicContact CG-CD2 3.68Å; P97-L146 HydrophobicContact CG-CG 3.99Å
98	L	88.8	Confident	88.9	Confident	23 Å²	23	52.3 Å²	52.3	12%	0.12	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	120.6	179.5	-59.2	171.3	0	0	0	109.9	T89 C91 R104 H107	T89-L98 PolarHBondContact N-O 2.92Å; T89-L98 PolarHBondContact O-N 3.48Å; T89-L98 VanDerWaalsContact O-O 3.11Å; C91-L98 HydrophobicContact CB-CD1 3.87Å; L98-R104 HydrophobicContact CB-CB 4.06Å; L98-R104 HydrophobicContact CB-CG 3.85Å; L98-R104 HydrophobicContact CD1-CB 4.46Å; L98-R104 HydrophobicContact CD1-CG 3.96Å; L98-H107 HydrophobicContact CD1-CB 4.14Å; L98-H107 HydrophobicContact CD2-CB 3.97Å
99	N	84.2	Confident	89	Confident	84 Å²	84	58.7 Å²	58.7	45%	0.449	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	157.2	169.5	-51.3	3.1	0	0	0	109.9	R104	N99-R104 WeakPolarHBondContact O-CB 3.4Å
100	S	82	Confident	89.2	Confident	72 Å²	72	64.7 Å²	64.7	50%	0.503	35%	0.351	S	S	.	.	S	Bend	trans	-55.7	155.5	167.6	53	0	0	0	0	112.6	Q87	Q87-S100 PolarHBondContact O-N 3.11Å
101	G	85.2	Confident	89.3	Confident	39 Å²	39	64.5 Å²	64.5	40%	0.402	35%	0.35	S	S	.	.	S	Bend	trans	106.3	-169.2	177	0	0	0	0	0	116	F103 R104	G101-F103 VanDerWaalsContact C-N 3.33Å; G101-F103 PolarHBondContact O-N 3.38Å; G101-R104 WeakPolarHBondContact O-CB 3.49Å; G101-R104 PolarHBondContact O-N 3.32Å
102	P	88.5	Confident	89.5	Confident	91 Å²	91	64.5 Å²	64.5	59%	0.591	35%	0.35	S	S	*	.	H	α-helix	trans	-67.4	-28.8	-166.8	25.6	-34.8	0	0	0	113.9	R104 Q105 A106	P102-R104 VanDerWaalsContact C-N 3.3Å; P102-R104 PolarHBondContact O-N 2.9Å; P102-Q105 PolarHBondContact O-N 3.37Å; P102-A106 PolarHBondContact O-N 3.07Å
103	F	88.6	Confident	89.8	Confident	173 Å²	173	71.2 Å²	71.2	76%	0.759	38%	0.376	S	S	*	.	H	α-helix	trans	-61.3	-37.1	177.6	-63.2	-75.2	0	0	0	112.5	G101 A106 H107	G101-F103 VanDerWaalsContact C-N 3.33Å; G101-F103 PolarHBondContact O-N 3.38Å; F103-A106 PolarHBondContact O-N 3.22Å; F103-H107 WeakPolarHBondContact O-CB 3.3Å; F103-H107 PolarHBondContact O-N 3.43Å
104	R	90	Very high	90	Very high	34 Å²	34	73.2 Å²	73.2	13%	0.128	40%	0.398	C	S	.	.	H	α-helix	trans	-63.1	-45	174.3	-177.6	170	-178.6	-98.8	5.3	111.4	T89 L98 N99 G101 P102 H107 L108 E130	T89-R104 PolarHBondContact OG1-NE 3.46Å; T89-R104 PolarHBondContact OG1-NH2 3.33Å; L98-R104 HydrophobicContact CB-CB 4.06Å; L98-R104 HydrophobicContact CB-CG 3.85Å; L98-R104 HydrophobicContact CD1-CB 4.46Å; L98-R104 HydrophobicContact CD1-CG 3.96Å; N99-R104 WeakPolarHBondContact O-CB 3.4Å; G101-R104 WeakPolarHBondContact O-CB 3.49Å; G101-R104 PolarHBondContact O-N 3.32Å; P102-R104 VanDerWaalsContact C-N 3.3Å; P102-R104 PolarHBondContact O-N 2.9Å; R104-H107 PolarHBondContact O-N 3.44Å; R104-L108 HydrophobicContact CG-CD1 3.95Å; R104-L108 WeakPolarHBondContact O-CB 3.48Å; R104-L108 WeakPolarHBondContact O-CD1 3.24Å; R104-L108 WeakPolarHBondContact O-CG 3.48Å; R104-L108 PolarHBondContact O-N 2.88Å; R104-E130 IonicContact CZ-OE1 3.73Å; R104-E130 IonicContact NH1-OE1 3.84Å; R104-E130 PolarHBondContact NH1-OE1 3.22Å; R104-E130 IonicContact NH2-OE1 3.14Å; R104-E130 PolarHBondContact NH2-OE1 3.49Å
105	Q	89.4	Confident	90	Very high	114 Å²	114	76.1 Å²	76.1	53%	0.533	41%	0.407	S	S	.	.	H	α-helix	trans	-64.5	-43.5	176.4	-57.5	-175.7	8.1	0	0	112.3	P102 L108 K109	P102-Q105 PolarHBondContact O-N 3.37Å; Q105-L108 PolarHBondContact O-N 3.1Å; Q105-K109 WeakPolarHBondContact O-CB 3.48Å; Q105-K109 VanDerWaalsContact O-CG 3.27Å; Q105-K109 WeakPolarHBondContact O-CG 3.45Å; Q105-K109 PolarHBondContact O-N 2.87Å
106	A	92	Very high	90.2	Very high	46 Å²	46	82.6 Å²	82.6	38%	0.38	43%	0.429	S	S	.	.	H	α-helix	trans	-62.7	-45.1	177.5	0	0	0	0	0	111.3	P102 F103 K109 Q110	P102-A106 PolarHBondContact O-N 3.07Å; F103-A106 PolarHBondContact O-N 3.22Å; A106-K109 PolarHBondContact O-N 2.77Å; A106-Q110 WeakPolarHBondContact O-CG 3.17Å; A106-Q110 PolarHBondContact O-N 3.34Å; A106-Q110 VanDerWaalsContact O-N 3.08Å
107	H	93	Very high	90.4	Very high	40 Å²	40	78.1 Å²	78.1	19%	0.185	41%	0.412	C	S	.	.	H	α-helix	trans	-62.2	-48.6	175	-177.2	86.3	0	0	0	111.9	C94 L98 F103 R104 K109 Q110 C111	C94-H107 PolarHBondContact SG-NE2 3.44Å; L98-H107 HydrophobicContact CD1-CB 4.14Å; L98-H107 HydrophobicContact CD2-CB 3.97Å; F103-H107 WeakPolarHBondContact O-CB 3.3Å; F103-H107 PolarHBondContact O-N 3.43Å; R104-H107 PolarHBondContact O-N 3.44Å; H107-K109 VanDerWaalsContact C-N 3.32Å; H107-K109 PolarHBondContact O-N 2.9Å; H107-Q110 PolarHBondContact O-N 2.98Å; H107-Q110 VanDerWaalsContact O-N 3.1Å; H107-C111 VanDerWaalsContact O-CB 3.27Å; H107-C111 WeakPolarHBondContact O-CB 3.42Å; H107-C111 PolarHBondContact O-N 2.89Å
108	L	91.7	Very high	90.5	Very high	11 Å²	11	79.1 Å²	79.1	6%	0.058	42%	0.419	C	S	.	.	H	α-helix	trans	-57.5	-43.5	178	-74.9	164.9	0	0	0	111.6	P92 R104 Q105 Q110 C111 G112 L122 M126	P92-L108 HydrophobicContact CG-CD2 4.41Å; R104-L108 HydrophobicContact CG-CD1 3.95Å; R104-L108 WeakPolarHBondContact O-CB 3.48Å; R104-L108 WeakPolarHBondContact O-CD1 3.24Å; R104-L108 WeakPolarHBondContact O-CG 3.48Å; R104-L108 PolarHBondContact O-N 2.88Å; Q105-L108 PolarHBondContact O-N 3.1Å; L108-Q110 VanDerWaalsContact C-N 3.33Å; L108-Q110 PolarHBondContact O-N 3.28Å; L108-C111 PolarHBondContact O-N 3.42Å; L108-G112 PolarHBondContact O-N 3.04Å; L108-L122 HydrophobicContact CD2-CD1 4.37Å; L108-M126 HydrophobicContact CD1-CG 4.12Å; L108-M126 HydrophobicContact CD1-SD 3.7Å
109	K	91.4	Very high	90.6	Very high	134 Å²	134	83 Å²	83	58%	0.583	45%	0.445	S	S	*	.	H	α-helix	trans	-63	-34.6	175.9	-73.8	169.7	-179.9	174.3	0	113.1	Q105 A106 H107 K113	Q105-K109 WeakPolarHBondContact O-CB 3.48Å; Q105-K109 VanDerWaalsContact O-CG 3.27Å; Q105-K109 WeakPolarHBondContact O-CG 3.45Å; Q105-K109 PolarHBondContact O-N 2.87Å; A106-K109 PolarHBondContact O-N 2.77Å; H107-K109 VanDerWaalsContact C-N 3.32Å; H107-K109 PolarHBondContact O-N 2.9Å; K109-K113 VanDerWaalsContact O-CG 3.3Å; K109-K113 WeakPolarHBondContact O-CG 3.36Å
110	Q	92.9	Very high	91	Very high	139 Å²	139	83.1 Å²	83.1	65%	0.65	45%	0.452	S	S	*	.	H	α-helix	trans	-76.3	-42.4	174.9	-70.5	173.8	-0.4	0	0	111.9	A106 H107 L108 K113 A114	A106-Q110 WeakPolarHBondContact O-CG 3.17Å; A106-Q110 PolarHBondContact O-N 3.34Å; A106-Q110 VanDerWaalsContact O-N 3.08Å; H107-Q110 PolarHBondContact O-N 2.98Å; H107-Q110 VanDerWaalsContact O-N 3.1Å; L108-Q110 VanDerWaalsContact C-N 3.33Å; L108-Q110 PolarHBondContact O-N 3.28Å; Q110-K113 PolarHBondContact O-N 3.04Å; Q110-A114 PolarHBondContact O-N 2.96Å
111	C	93.9	Very high	91.5	Very high	9 Å²	9	82.6 Å²	82.6	6%	0.061	44%	0.442	C	S	.	.	H	α-helix	trans	-69.7	-44.2	-177.5	-162.8	0	0	0	0	111.7	L93 H107 L108 K113 A114 H115	L93-C111 VanDerWaalsContact CB-SG 3.57Å; H107-C111 VanDerWaalsContact O-CB 3.27Å; H107-C111 WeakPolarHBondContact O-CB 3.42Å; H107-C111 PolarHBondContact O-N 2.89Å; L108-C111 PolarHBondContact O-N 3.42Å; C111-K113 VanDerWaalsContact C-N 3.29Å; C111-K113 PolarHBondContact O-N 3.26Å; C111-A114 WeakPolarHBondContact O-CB 3.36Å; C111-A114 PolarHBondContact O-N 2.91Å; C111-H115 PolarHBondContact O-CD2 2.93Å; C111-H115 VanDerWaalsContact O-CD2 3.31Å; C111-H115 PolarHBondContact O-N 3.24Å
112	G	94.4	Very high	91.8	Very high	2 Å²	2	81.9 Å²	81.9	2%	0.021	43%	0.429	C	S	.	.	H	α-helix	trans	-57.8	-40	173.1	0	0	0	0	0	112.9	L108 H115 K116 V117	L108-G112 PolarHBondContact O-N 3.04Å; G112-H115 PolarHBondContact O-N 3.12Å; G112-K116 PolarHBondContact O-N 3.21Å; G112-V117 PolarHBondContact O-N 3.4Å
113	K	93	Very high	92	Very high	178 Å²	178	82.3 Å²	82.3	77%	0.774	43%	0.426	S	S	*	.	H	α-helix	trans	-63.9	-40.1	172.6	-75.7	178.5	179.2	-174.3	0	112.8	K109 Q110 C111	K109-K113 VanDerWaalsContact O-CG 3.3Å; K109-K113 WeakPolarHBondContact O-CG 3.36Å; Q110-K113 PolarHBondContact O-N 3.04Å; C111-K113 VanDerWaalsContact C-N 3.29Å; C111-K113 PolarHBondContact O-N 3.26Å
114	A	93.9	Very high	92.2	Very high	78 Å²	78	80.8 Å²	80.8	65%	0.645	42%	0.415	S	S	*	.	H	α-helix	trans	-67.4	-40.9	177.8	0	0	0	0	0	112.6	Q110 C111 K116	Q110-A114 PolarHBondContact O-N 2.96Å; C111-A114 WeakPolarHBondContact O-CB 3.36Å; C111-A114 PolarHBondContact O-N 2.91Å; A114-K116 VanDerWaalsContact C-N 3.35Å
115	H	91.2	Very high	92.3	Very high	101 Å²	101	81.5 Å²	81.5	47%	0.468	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	5.7	179.5	-69.4	-99.2	0	0	0	114.1	L93 C111 G112 V117	L93-H115 HydrophobicContact CD1-CB 4.22Å; C111-H115 PolarHBondContact O-CD2 2.93Å; C111-H115 VanDerWaalsContact O-CD2 3.31Å; C111-H115 PolarHBondContact O-N 3.24Å; G112-H115 PolarHBondContact O-N 3.12Å; H115-V117 VanDerWaalsContact C-N 3.25Å; H115-V117 HydrophobicContact CB-CG2 4.02Å; H115-V117 PolarHBondContact O-N 3.29Å
116	K	91.7	Very high	92.3	Very high	191 Å²	191	78 Å²	78	83%	0.83	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	27.2	-179.8	-53.2	179.2	-178	176	0	115.2	G112 A114	G112-K116 PolarHBondContact O-N 3.21Å; A114-K116 VanDerWaalsContact C-N 3.35Å
117	V	92	Very high	92.3	Very high	32 Å²	32	81.3 Å²	81.3	19%	0.194	41%	0.413	C	S	.	.			trans	-82.9	130.6	-179.2	-174.7	0	0	0	0	110.2	L93 G112 H115 E121 L122 L125	L93-V117 HydrophobicContact CD1-CG2 4.11Å; L93-V117 HydrophobicContact CD2-CG2 3.85Å; G112-V117 PolarHBondContact O-N 3.4Å; H115-V117 VanDerWaalsContact C-N 3.25Å; H115-V117 HydrophobicContact CB-CG2 4.02Å; H115-V117 PolarHBondContact O-N 3.29Å; V117-E121 HydrophobicContact CG1-CB 4.06Å; V117-E121 HydrophobicContact CG1-CG 4.28Å; V117-L122 HydrophobicContact CG1-CB 4.16Å; V117-L125 HydrophobicContact CG1-CD1 4.25Å
118	P	92.5	Very high	92.3	Very high	71 Å²	71	83 Å²	83	46%	0.461	42%	0.423	S	S	.	.			trans	-67.5	152.3	178.1	28.1	-34.2	0	0	0	111.5	S120 E121 L122	P118-S120 VanDerWaalsContact C-N 3.27Å; P118-S120 PolarHBondContact O-N 2.94Å; P118-E121 HydrophobicContact CG-CB 3.94Å; P118-E121 PolarHBondContact O-N 3.41Å; P118-L122 WeakPolarHBondContact O-CB 3.44Å; P118-L122 PolarHBondContact O-N 2.66Å
119	P	91.3	Very high	92.2	Very high	103 Å²	103	84.6 Å²	84.6	67%	0.669	43%	0.429	S	S	*	.	H	α-helix	trans	-58.6	-33.2	-173.5	-27	35.8	0	0	0	115.1	L123	P119-L123 WeakPolarHBondContact O-CG 3.23Å; P119-L123 PolarHBondContact O-N 3.38Å; P119-L123 VanDerWaalsContact O-N 3.07Å
120	S	91.9	Very high	92.1	Very high	87 Å²	87	81.3 Å²	81.3	61%	0.608	42%	0.416	S	S	*	.	H	α-helix	trans	-64.5	-52.2	176.6	44.2	0	0	0	0	112.1	P118 L122 L123 R124	P118-S120 VanDerWaalsContact C-N 3.27Å; P118-S120 PolarHBondContact O-N 2.94Å; S120-L122 VanDerWaalsContact C-N 3.31Å; S120-L122 PolarHBondContact O-N 2.99Å; S120-L123 PolarHBondContact O-N 3.4Å; S120-R124 PolarHBondContact O-N 2.98Å
121	E	93	Very high	92.1	Very high	62 Å²	62	82.4 Å²	82.4	29%	0.29	42%	0.419	S	S	.	.	H	α-helix	trans	-68.2	-32.3	178.1	-169.2	60.1	-155.4	0	0	111.4	V117 P118 L123 R124 L125	V117-E121 HydrophobicContact CG1-CB 4.06Å; V117-E121 HydrophobicContact CG1-CG 4.28Å; P118-E121 HydrophobicContact CG-CB 3.94Å; P118-E121 PolarHBondContact O-N 3.41Å; E121-L123 VanDerWaalsContact C-N 3.34Å; E121-L123 PolarHBondContact O-N 2.87Å; E121-R124 PolarHBondContact O-N 3Å; E121-R124 IonicContact OE1-NH1 2.68Å; E121-R124 PolarHBondContact OE1-NH1 3.35Å; E121-R124 WeakPolarHBondContact OE2-CD 3.45Å; E121-R124 IonicContact OE2-CZ 2.66Å; E121-R124 IonicContact OE2-NE 2.79Å; E121-R124 IonicContact OE2-NH1 3.17Å; E121-R124 PolarHBondContact OE2-NH1 3.27Å; E121-L125 HydrophobicContact CG-CD1 4.28Å; E121-L125 HydrophobicContact CG-CG 4.39Å; E121-L125 WeakPolarHBondContact O-CB 3.45Å; E121-L125 VanDerWaalsContact O-CG 3.24Å; E121-L125 WeakPolarHBondContact O-CG 3.36Å; E121-L125 PolarHBondContact O-N 2.88Å
122	L	92.4	Very high	92	Very high	23 Å²	23	85.5 Å²	85.5	12%	0.12	43%	0.434	C	S	.	.	H	α-helix	trans	-61.1	-41.2	172	-180	66.1	0	0	0	112.2	L93 L108 V117 P118 S120 M126	L93-L122 HydrophobicContact CD1-CD1 3.72Å; L108-L122 HydrophobicContact CD2-CD1 4.37Å; V117-L122 HydrophobicContact CG1-CB 4.16Å; P118-L122 WeakPolarHBondContact O-CB 3.44Å; P118-L122 PolarHBondContact O-N 2.66Å; S120-L122 VanDerWaalsContact C-N 3.31Å; S120-L122 PolarHBondContact O-N 2.99Å; L122-M126 WeakPolarHBondContact O-CB 3.48Å; L122-M126 PolarHBondContact O-N 3.34Å
123	L	91.3	Very high	91.8	Very high	100 Å²	100	85.4 Å²	85.4	52%	0.524	43%	0.433	S	S	.	.	H	α-helix	trans	-68.5	-41.2	175.1	-73	168.8	0	0	0	111.6	P119 S120 E121 M126 Q127	P119-L123 WeakPolarHBondContact O-CG 3.23Å; P119-L123 PolarHBondContact O-N 3.38Å; P119-L123 VanDerWaalsContact O-N 3.07Å; S120-L123 PolarHBondContact O-N 3.4Å; E121-L123 VanDerWaalsContact C-N 3.34Å; E121-L123 PolarHBondContact O-N 2.87Å; L123-M126 WeakPolarHBondContact O-CB 3.49Å; L123-M126 PolarHBondContact O-N 2.9Å; L123-Q127 WeakPolarHBondContact O-CG 3.33Å; L123-Q127 PolarHBondContact O-N 2.85Å
124	R	93.1	Very high	91.7	Very high	142 Å²	142	81.1 Å²	81.1	54%	0.536	42%	0.416	S	S	.	.	H	α-helix	trans	-60	-47.9	174.8	-169.8	-164.6	-175.2	-171.4	1.4	111.8	S120 E121 M126 Q127 I128	S120-R124 PolarHBondContact O-N 2.98Å; E121-R124 PolarHBondContact O-N 3Å; E121-R124 IonicContact OE1-NH1 2.68Å; E121-R124 PolarHBondContact OE1-NH1 3.35Å; E121-R124 WeakPolarHBondContact OE2-CD 3.45Å; E121-R124 IonicContact OE2-CZ 2.66Å; E121-R124 IonicContact OE2-NE 2.79Å; E121-R124 IonicContact OE2-NH1 3.17Å; E121-R124 PolarHBondContact OE2-NH1 3.27Å; R124-M126 VanDerWaalsContact C-N 3.28Å; R124-M126 PolarHBondContact O-N 3.46Å; R124-Q127 PolarHBondContact O-N 3.11Å; R124-I128 HydrophobicContact CG-CD1 4.02Å; R124-I128 VanDerWaalsContact O-CG1 3.3Å; R124-I128 WeakPolarHBondContact O-CG1 3.3Å; R124-I128 PolarHBondContact O-N 3.17Å
125	L	92.1	Very high	91.6	Very high	48 Å²	48	81.4 Å²	81.4	25%	0.251	41%	0.41	S	S	.	.	H	α-helix	trans	-62.1	-34.9	175.5	-71.2	171.5	0	0	0	112.1	P92 L93 V117 E121 Q129	P92-L125 HydrophobicContact CB-CB 4.12Å; P92-L125 HydrophobicContact CG-CB 4.12Å; L93-L125 HydrophobicContact CD2-CD1 4.18Å; V117-L125 HydrophobicContact CG1-CD1 4.25Å; E121-L125 HydrophobicContact CG-CD1 4.28Å; E121-L125 HydrophobicContact CG-CG 4.39Å; E121-L125 WeakPolarHBondContact O-CB 3.45Å; E121-L125 VanDerWaalsContact O-CG 3.24Å; E121-L125 WeakPolarHBondContact O-CG 3.36Å; E121-L125 PolarHBondContact O-N 2.88Å; L125-Q129 VanDerWaalsContact O-CB 3.24Å; L125-Q129 WeakPolarHBondContact O-CB 3.24Å; L125-Q129 PolarHBondContact O-N 3.34Å
126	M	89.7	Confident	91.6	Very high	41 Å²	41	82 Å²	82	20%	0.202	41%	0.408	C	S	.	.	H	α-helix	trans	-65.6	-46.4	173.5	-168.6	-169.1	81.5	0	0	111.8	L108 L122 L123 R124 Q129 E130	L108-M126 HydrophobicContact CD1-CG 4.12Å; L108-M126 HydrophobicContact CD1-SD 3.7Å; L122-M126 WeakPolarHBondContact O-CB 3.48Å; L122-M126 PolarHBondContact O-N 3.34Å; L123-M126 WeakPolarHBondContact O-CB 3.49Å; L123-M126 PolarHBondContact O-N 2.9Å; R124-M126 VanDerWaalsContact C-N 3.28Å; R124-M126 PolarHBondContact O-N 3.46Å; M126-Q129 PolarHBondContact O-N 3.37Å; M126-E130 WeakPolarHBondContact O-CB 3.45Å; M126-E130 WeakPolarHBondContact O-CG 3.47Å; M126-E130 PolarHBondContact O-N 3.48Å
127	Q	92.2	Very high	91.5	Very high	115 Å²	115	74.9 Å²	74.9	54%	0.537	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-39.8	176.8	-71.5	175.4	-14.3	0	0	112.4	L123 R124 E130 K131	L123-Q127 WeakPolarHBondContact O-CG 3.33Å; L123-Q127 PolarHBondContact O-N 2.85Å; R124-Q127 PolarHBondContact O-N 3.11Å; Q127-E130 PolarHBondContact O-N 3.13Å; Q127-K131 WeakPolarHBondContact O-CG 3.35Å; Q127-K131 PolarHBondContact O-N 3.29Å
128	I	92	Very high	91.3	Very high	77 Å²	77	80.7 Å²	80.7	40%	0.395	40%	0.402	S	S	.	.	H	α-helix	trans	-63.2	-47	174.6	-70.3	165.8	0	0	0	110.1	R124 E130 K131 I132	R124-I128 HydrophobicContact CG-CD1 4.02Å; R124-I128 VanDerWaalsContact O-CG1 3.3Å; R124-I128 WeakPolarHBondContact O-CG1 3.3Å; R124-I128 PolarHBondContact O-N 3.17Å; I128-E130 VanDerWaalsContact C-N 3.31Å; I128-E130 PolarHBondContact O-N 3.38Å; I128-K131 PolarHBondContact O-N 3.34Å; I128-I132 HydrophobicContact CG2-CD1 3.66Å; I128-I132 HydrophobicContact CG2-CG1 4.42Å; I128-I132 WeakPolarHBondContact O-CB 3.5Å; I128-I132 VanDerWaalsContact O-CG1 3.29Å; I128-I132 WeakPolarHBondContact O-CG1 3.38Å; I128-I132 PolarHBondContact O-N 3Å
129	Q	90.1	Very high	91	Very high	43 Å²	43	80.6 Å²	80.6	20%	0.201	40%	0.403	C	S	.	.	H	α-helix	trans	-63.9	-35	178.1	-176.1	61.8	31.5	0	0	112.6	D90 P92 L125 M126 A133	D90-Q129 VanDerWaalsContact O-CG 3.3Å; D90-Q129 WeakPolarHBondContact O-CG 3.37Å; P92-Q129 HydrophobicContact CB-CB 4.2Å; P92-Q129 HydrophobicContact CB-CG 4.44Å; L125-Q129 VanDerWaalsContact O-CB 3.24Å; L125-Q129 WeakPolarHBondContact O-CB 3.24Å; L125-Q129 PolarHBondContact O-N 3.34Å; M126-Q129 PolarHBondContact O-N 3.37Å; Q129-A133 WeakPolarHBondContact O-CB 3.47Å; Q129-A133 PolarHBondContact O-N 3.17Å
130	E	90.6	Very high	90.6	Very high	66 Å²	66	77.9 Å²	77.9	31%	0.308	39%	0.394	S	S	.	.	H	α-helix	trans	-67.2	-47.3	173.3	-77.2	166.1	-176.8	0	0	111.9	R104 M126 Q127 I128 A133 E134	R104-E130 IonicContact CZ-OE1 3.73Å; R104-E130 IonicContact NH1-OE1 3.84Å; R104-E130 PolarHBondContact NH1-OE1 3.22Å; R104-E130 IonicContact NH2-OE1 3.14Å; R104-E130 PolarHBondContact NH2-OE1 3.49Å; M126-E130 WeakPolarHBondContact O-CB 3.45Å; M126-E130 WeakPolarHBondContact O-CG 3.47Å; M126-E130 PolarHBondContact O-N 3.48Å; Q127-E130 PolarHBondContact O-N 3.13Å; I128-E130 VanDerWaalsContact C-N 3.31Å; I128-E130 PolarHBondContact O-N 3.38Å; E130-A133 PolarHBondContact O-N 2.91Å; E130-E134 PolarHBondContact O-N 3.17Å
131	K	92.5	Very high	90.2	Very high	161 Å²	161	78.7 Å²	78.7	70%	0.7	39%	0.391	S	S	*	.	H	α-helix	trans	-59.6	-47.9	175.2	-74.3	-177	175.8	-171.7	0	112	Q127 I128 A133 E134 T135	Q127-K131 WeakPolarHBondContact O-CG 3.35Å; Q127-K131 PolarHBondContact O-N 3.29Å; I128-K131 PolarHBondContact O-N 3.34Å; K131-A133 VanDerWaalsContact C-N 3.28Å; K131-A133 PolarHBondContact O-N 3.38Å; K131-E134 PolarHBondContact O-N 2.72Å; K131-T135 PolarHBondContact O-N 2.91Å; K131-T135 PolarHBondContact O-OG1 2.91Å
132	I	91	Very high	89.8	Confident	74 Å²	74	79.3 Å²	79.3	38%	0.379	40%	0.402	S	S	.	.	H	α-helix	trans	-60.4	-39.8	176.4	-68.2	168.8	0	0	0	110.9	I128 R136	I128-I132 HydrophobicContact CG2-CD1 3.66Å; I128-I132 HydrophobicContact CG2-CG1 4.42Å; I128-I132 WeakPolarHBondContact O-CB 3.5Å; I128-I132 VanDerWaalsContact O-CG1 3.29Å; I128-I132 WeakPolarHBondContact O-CG1 3.38Å; I128-I132 PolarHBondContact O-N 3Å; I132-R136 WeakPolarHBondContact O-CB 3.24Å; I132-R136 VanDerWaalsContact O-CG 3.22Å; I132-R136 WeakPolarHBondContact O-CG 3.43Å; I132-R136 PolarHBondContact O-N 3.43Å; I132-R136 VanDerWaalsContact O-N 3.12Å
133	A	90.8	Very high	89.6	Confident	1 Å²	1	78.5 Å²	78.5	1%	0.008	40%	0.398	C	S	.	.	H	α-helix	trans	-65.6	-41.9	176.6	0	0	0	0	0	111.9	T89 Q129 E130 K131 R136 K137 H143	T89-A133 HydrophobicContact CG2-CB 4Å; Q129-A133 WeakPolarHBondContact O-CB 3.47Å; Q129-A133 PolarHBondContact O-N 3.17Å; E130-A133 PolarHBondContact O-N 2.91Å; K131-A133 VanDerWaalsContact C-N 3.28Å; K131-A133 PolarHBondContact O-N 3.38Å; A133-R136 PolarHBondContact O-N 3.03Å; A133-K137 WeakPolarHBondContact O-CG 3.4Å; A133-K137 PolarHBondContact O-N 3.2Å; A133-H143 HydrophobicContact CB-CB 4.14Å; A133-H143 WeakPolarHBondContact O-CB 3.35Å
134	E	90.7	Very high	89.5	Confident	87 Å²	87	74.2 Å²	74.2	41%	0.407	38%	0.376	S	S	.	.	H	α-helix	trans	-69.5	-45.4	-178.4	-150.8	58.8	-137	0	0	112.3	E130 K131 R136 K137 Q138	E130-E134 PolarHBondContact O-N 3.17Å; K131-E134 PolarHBondContact O-N 2.72Å; E134-R136 PolarHBondContact O-N 2.68Å; E134-K137 WeakPolarHBondContact O-CB 3.48Å; E134-K137 PolarHBondContact O-N 3.08Å; E134-K137 WeakPolarHBondContact OE1-CD 3.49Å; E134-K137 IonicContact OE1-NZ 3.81Å; E134-K137 WeakPolarHBondContact OE2-CE 3.38Å; E134-K137 IonicContact OE2-NZ 4Å; E134-K137 PolarHBondContact OE2-NZ 3.22Å; E134-Q138 WeakPolarHBondContact O-CG 3.29Å; E134-Q138 PolarHBondContact O-N 2.95Å
135	T	91.3	Very high	89.1	Confident	85 Å²	85	74.5 Å²	74.5	52%	0.521	38%	0.381	S	S	.	.	H	α-helix	trans	-59.3	-34.7	172.7	-53	0	0	0	0	111.7	K131 S139	K131-T135 PolarHBondContact O-N 2.91Å; K131-T135 PolarHBondContact O-OG1 2.91Å; T135-S139 WeakPolarHBondContact O-CB 3.47Å; T135-S139 PolarHBondContact O-N 3.37Å; T135-S139 PolarHBondContact O-OG 3.33Å
136	R	91.2	Very high	88.7	Confident	114 Å²	114	75.2 Å²	75.2	43%	0.43	39%	0.385	S	S	.	.	H	α-helix	trans	-71	-35.4	173.7	-76.6	174.9	176.2	-138.6	3.4	113.4	I132 A133 E134 S139 G140 L141 S142 H143	I132-R136 WeakPolarHBondContact O-CB 3.24Å; I132-R136 VanDerWaalsContact O-CG 3.22Å; I132-R136 WeakPolarHBondContact O-CG 3.43Å; I132-R136 PolarHBondContact O-N 3.43Å; I132-R136 VanDerWaalsContact O-N 3.12Å; A133-R136 PolarHBondContact O-N 3.03Å; E134-R136 PolarHBondContact O-N 2.68Å; R136-S139 WeakPolarHBondContact CA-OG 3.3Å; R136-S139 PolarHBondContact O-OG 3.2Å; R136-G140 PolarHBondContact O-N 3.27Å; R136-L141 HydrophobicContact CB-CB 4.27Å; R136-L141 HydrophobicContact CG-CB 4.36Å; R136-L141 PolarHBondContact O-N 3.27Å; R136-S142 WeakPolarHBondContact CD-O 3.2Å; R136-S142 PolarHBondContact NH1-O 3.24Å; R136-H143 HydrophobicContact CB-CB 3.7Å
137	K	90.3	Very high	88.5	Confident	41 Å²	41	82.8 Å²	82.8	18%	0.178	42%	0.417	C	S	.	.	H	α-helix	trans	-63.5	-46.7	171.7	-69.5	171.4	-158	169.9	0	111	M86 A133 E134 S139 G140 H143	M86-K137 HydrophobicContact CE-CB 4.24Å; M86-K137 HydrophobicContact CE-CD 4.09Å; M86-K137 HydrophobicContact CE-CG 4.17Å; M86-K137 VanDerWaalsContact O-CE 3.24Å; M86-K137 WeakPolarHBondContact O-CE 3.3Å; M86-K137 PolarHBondContact O-NZ 2.99Å; M86-K137 VanDerWaalsContact O-NZ 3.14Å; M86-K137 HydrophobicContact SD-CG 4.32Å; A133-K137 WeakPolarHBondContact O-CG 3.4Å; A133-K137 PolarHBondContact O-N 3.2Å; E134-K137 WeakPolarHBondContact O-CB 3.48Å; E134-K137 PolarHBondContact O-N 3.08Å; E134-K137 WeakPolarHBondContact OE1-CD 3.49Å; E134-K137 IonicContact OE1-NZ 3.81Å; E134-K137 WeakPolarHBondContact OE2-CE 3.38Å; E134-K137 IonicContact OE2-NZ 4Å; E134-K137 PolarHBondContact OE2-NZ 3.22Å; K137-S139 PolarHBondContact O-N 2.94Å; K137-G140 PolarHBondContact O-N 2.98Å; K137-H143 VanDerWaalsContact CE-CD2 3.48Å; K137-H143 WeakPolarHBondContact CE-CD2 3.38Å; K137-H143 HydrophobicContact CG-CB 4.24Å
138	Q	87.7	Confident	88.2	Confident	154 Å²	154	83.6 Å²	83.6	72%	0.72	42%	0.418	S	S	*	.	H	α-helix	trans	-60.8	-43	179.6	-70.4	170	-13.2	0	0	111.9	E134 G140	E134-Q138 WeakPolarHBondContact O-CG 3.29Å; E134-Q138 PolarHBondContact O-N 2.95Å; Q138-G140 PolarHBondContact O-N 3.39Å
139	S	86.6	Confident	87.8	Confident	68 Å²	68	81 Å²	81	48%	0.476	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	7.5	173.9	53.3	0	0	0	0	114.8	T135 R136 K137 L141	T135-S139 WeakPolarHBondContact O-CB 3.47Å; T135-S139 PolarHBondContact O-N 3.37Å; T135-S139 PolarHBondContact O-OG 3.33Å; R136-S139 WeakPolarHBondContact CA-OG 3.3Å; R136-S139 PolarHBondContact O-OG 3.2Å; K137-S139 PolarHBondContact O-N 2.94Å; S139-L141 PolarHBondContact O-N 2.91Å; S139-L141 VanDerWaalsContact O-N 3.12Å
140	G	81.2	Confident	87.5	Confident	47 Å²	47	82.6 Å²	82.6	49%	0.485	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	0.8	178.3	0	0	0	0	0	116.2	R136 K137 Q138	R136-G140 PolarHBondContact O-N 3.27Å; K137-G140 PolarHBondContact O-N 2.98Å; Q138-G140 PolarHBondContact O-N 3.39Å
141	L	84.4	Confident	86.8	Confident	103 Å²	103	85.4 Å²	85.4	54%	0.539	44%	0.435	S	S	.	.			trans	-75.9	169.6	-176.7	-65.3	178.3	0	0	0	113.3	R136 S139 H143	R136-L141 HydrophobicContact CB-CB 4.27Å; R136-L141 HydrophobicContact CG-CB 4.36Å; R136-L141 PolarHBondContact O-N 3.27Å; S139-L141 PolarHBondContact O-N 2.91Å; S139-L141 VanDerWaalsContact O-N 3.12Å; L141-H143 PolarHBondContact O-CE1 2.91Å; L141-H143 PolarHBondContact O-N 3.18Å
142	S	85	Confident	86	Confident	76 Å²	76	80.9 Å²	80.9	53%	0.531	42%	0.424	S	S	.	.			trans	-75.3	105.9	176.5	45.4	0	0	0	0	111.8	R136	R136-S142 WeakPolarHBondContact CD-O 3.2Å; R136-S142 PolarHBondContact NH1-O 3.24Å
143	H	88.1	Confident	85.2	Confident	6 Å²	6	79.2 Å²	79.2	3%	0.028	42%	0.419	C	S	.	.			trans	-91.2	-8.7	178.6	69.6	-82.3	0	0	0	114.4	W85 M86 A133 R136 K137 L141	W85-H143 AromaticContact CD2-NE2 3.19Å; W85-H143 AromaticContact CE2-NE2 3.67Å; W85-H143 AromaticContact CE3-NE2 2.66Å; W85-H143 AromaticContact CH2-CE1 2.94Å; W85-H143 WeakPolarHBondContact CH2-CE1 3.38Å; W85-H143 AromaticContact CH2-ND1 3.51Å; W85-H143 AromaticContact CH2-NE2 3.28Å; W85-H143 VanDerWaalsContact CH2-NE2 3.28Å; W85-H143 WeakPolarHBondContact CH2-NE2 3.47Å; W85-H143 AromaticContact CZ2-CE1 3.54Å; W85-H143 AromaticContact CZ2-ND1 3.86Å; W85-H143 AromaticContact CZ2-NE2 3.73Å; W85-H143 AromaticContact CZ3-CE1 3.32Å; W85-H143 WeakPolarHBondContact CZ3-CE1 3.44Å; W85-H143 AromaticContact CZ3-ND1 3.73Å; W85-H143 AromaticContact CZ3-NE2 2.71Å; W85-H143 WeakPolarHBondContact CZ3-NE2 3.47Å; W85-H143 PolarHBondContact O-NE2 2.85Å; M86-H143 WeakPolarHBondContact CA-NE2 3.42Å; M86-H143 PolarHBondContact SD-NE2 2.99Å; A133-H143 HydrophobicContact CB-CB 4.14Å; A133-H143 WeakPolarHBondContact O-CB 3.35Å; R136-H143 HydrophobicContact CB-CB 3.7Å; K137-H143 VanDerWaalsContact CE-CD2 3.48Å; K137-H143 WeakPolarHBondContact CE-CD2 3.38Å; K137-H143 HydrophobicContact CG-CB 4.24Å; L141-H143 PolarHBondContact O-CE1 2.91Å; L141-H143 PolarHBondContact O-N 3.18Å
144	T	88.2	Confident	84.2	Confident	10 Å²	10	79.3 Å²	79.3	6%	0.061	42%	0.419	C	S	.	.	S	Bend	trans	-139.5	162.1	175.5	55	0	0	0	0	111.9	W85 T88 D90 L146	W85-T144 PolarHBondContact NE1-OG1 2.94Å; T88-T144 HydrophobicContact CG2-CG2 3.81Å; T88-T144 WeakPolarHBondContact O-CG2 3.33Å; D90-T144 WeakPolarHBondContact OD1-CB 3.48Å; D90-T144 WeakPolarHBondContact OD2-CA 3.47Å; T144-L146 PolarHBondContact O-N 2.86Å
145	K	85.4	Confident	83.1	Confident	147 Å²	147	83.8 Å²	83.8	64%	0.639	43%	0.432	S	S	*	.	S	Bend	trans	-76.9	2.3	169.2	-73.2	179.8	-176	-175.2	0	114.1	D90 C95	D90-K145 PolarHBondContact OD1-N 3.48Å; D90-K145 WeakPolarHBondContact OD2-CG 3.49Å; D90-K145 PolarHBondContact OD2-N 3.43Å; C95-K145 HydrophobicContact CB-CD 3.92Å
146	L	84.4	Confident	81.5	Confident	63 Å²	63	85.2 Å²	85.2	33%	0.33	44%	0.437	S	S	.	.	S	Bend	trans	-73.7	137.6	168	-71.4	-175.8	0	0	0	110.7	W85 T88 P97 T144 K148	W85-L146 PolarHBondContact NE1-O 3.39Å; T88-L146 HydrophobicContact CG2-CD1 3.73Å; T88-L146 HydrophobicContact CG2-CG 4.27Å; P97-L146 HydrophobicContact CB-CD1 4.27Å; P97-L146 HydrophobicContact CB-CD2 3.94Å; P97-L146 HydrophobicContact CB-CG 3.68Å; P97-L146 HydrophobicContact CG-CD2 3.68Å; P97-L146 HydrophobicContact CG-CG 3.99Å; T144-L146 PolarHBondContact O-N 2.86Å; L146-K148 PolarHBondContact O-N 2.87Å
147	K	84.6	Confident	79.9	Confident	201 Å²	201	84.3 Å²	84.3	87%	0.874	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-61.4	125.8	172.5	-65.2	-172.8	178.2	-174.1	0	109.6
148	K	85.9	Confident	78.3	Confident	131 Å²	131	85.4 Å²	85.4	57%	0.57	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-57.8	127.3	174.3	-171.1	173.4	-176.6	173.4	0	108.7	W85 L146	W85-K148 HydrophobicContact CD2-CG 4.48Å; W85-K148 HydrophobicContact CH2-CD 4.17Å; W85-K148 HydrophobicContact CH2-CG 4.23Å; W85-K148 HydrophobicContact CZ2-CB 4.06Å; W85-K148 HydrophobicContact CZ2-CD 4.35Å; W85-K148 HydrophobicContact CZ2-CG 4.12Å; W85-K148 HydrophobicContact CZ3-CG 4.44Å; L146-K148 PolarHBondContact O-N 2.87Å
149	P	83.6	Confident	76.7	Confident	23 Å²	23	80.6 Å²	80.6	15%	0.149	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-73.9	131.9	-174.4	27	-33.1	0	0	0	112	K81 R82 W85	K81-P149 HydrophobicContact CB-CB 3.74Å; K81-P149 HydrophobicContact CB-CG 4.04Å; K81-P149 HydrophobicContact CD-CB 4.5Å; R82-P149 HydrophobicContact CB-CG 4.12Å; W85-P149 HydrophobicContact CB-CG 4.38Å
150	T	84.7	Confident	75.2	Confident	77 Å²	77	80.2 Å²	80.2	47%	0.472	43%	0.432	S	S	.	.			trans	-119.4	156	-178.8	-43.3	0	0	0	0	110.1	S152 S153 V154	T150-S152 PolarHBondContact O-N 3.03Å; T150-S153 PolarHBondContact N-OG 2.9Å; T150-S153 WeakPolarHBondContact O-CA 3.39Å; T150-S153 WeakPolarHBondContact O-CB 3.34Å; T150-S153 PolarHBondContact O-N 3.41Å; T150-S153 PolarHBondContact O-OG 3.18Å; T150-V154 PolarHBondContact O-N 3.37Å
151	I	76.2	Confident	73.8	Confident	124 Å²	124	87.9 Å²	87.9	64%	0.636	45%	0.446	S	S	*	.	H	α-helix	trans	-52	-44	177.1	-60.9	170.4	0	0	0	111.3	L78 S153 V154 R155	L78-I151 HydrophobicContact CD1-CB 4.3Å; L78-I151 HydrophobicContact CD1-CG1 3.51Å; I151-S153 VanDerWaalsContact C-N 3.34Å; I151-S153 PolarHBondContact O-N 3.42Å; I151-V154 PolarHBondContact O-N 3.28Å; I151-V154 VanDerWaalsContact O-N 3.11Å; I151-R155 PolarHBondContact O-N 2.86Å; I151-R155 VanDerWaalsContact O-N 3.09Å
152	S	75.7	Confident	72.4	Confident	66 Å²	66	88.2 Å²	88.2	46%	0.462	45%	0.445	S	S	.	.	H	α-helix	trans	-58.2	-38.9	173.9	51	0	0	0	0	113.6	T150 V154 R155 N156	T150-S152 PolarHBondContact O-N 3.03Å; S152-V154 PolarHBondContact O-N 3.3Å; S152-R155 PolarHBondContact O-N 3.19Å; S152-N156 VanDerWaalsContact O-CB 3.3Å; S152-N156 WeakPolarHBondContact O-CB 3.31Å; S152-N156 PolarHBondContact O-N 3.34Å; S152-N156 PolarHBondContact O-OD1 3.44Å
153	S	72.7	Confident	71	Confident	40 Å²	40	92.2 Å²	92.2	28%	0.28	45%	0.452	S	S	.	.	H	α-helix	trans	-67.9	-20.9	177.5	75	0	0	0	0	113.7	T150 I151	T150-S153 PolarHBondContact N-OG 2.9Å; T150-S153 WeakPolarHBondContact O-CA 3.39Å; T150-S153 WeakPolarHBondContact O-CB 3.34Å; T150-S153 PolarHBondContact O-N 3.41Å; T150-S153 PolarHBondContact O-OG 3.18Å; I151-S153 VanDerWaalsContact C-N 3.34Å; I151-S153 PolarHBondContact O-N 3.42Å
154	V	70.7	Confident	69.6	Low	2 Å²	2	99.4 Å²	99.4	1%	0.012	49%	0.491	C	S	.	.	H	α-helix	trans	-83.6	-49.5	173.2	-171.1	0	0	0	0	110.3	N74 L78 K81 T150 I151 S152 N156 E157 T158	N74-V154 HydrophobicContact CB-CG1 4.29Å; N74-V154 VanDerWaalsContact OD1-CG1 3.3Å; N74-V154 WeakPolarHBondContact OD1-CG1 3.17Å; L78-V154 HydrophobicContact CB-CG2 3.97Å; L78-V154 HydrophobicContact CG-CG2 4.45Å; K81-V154 HydrophobicContact CD-CG2 4.31Å; T150-V154 PolarHBondContact O-N 3.37Å; I151-V154 PolarHBondContact O-N 3.28Å; I151-V154 VanDerWaalsContact O-N 3.11Å; S152-V154 PolarHBondContact O-N 3.3Å; V154-N156 VanDerWaalsContact C-N 3.28Å; V154-N156 PolarHBondContact O-N 2.61Å; V154-E157 PolarHBondContact O-N 3.07Å; V154-T158 PolarHBondContact O-N 3.38Å; V154-T158 VanDerWaalsContact O-N 3.1Å
155	R	66.6	Low	68.8	Low	182 Å²	182	102.7 Å²	102.7	69%	0.687	51%	0.511	S	S	*	.	H	α-helix	trans	-61.3	-34.4	179.2	-165	177.5	-172	178.7	3	112.9	I151 S152 E157 T158 A159	I151-R155 PolarHBondContact O-N 2.86Å; I151-R155 VanDerWaalsContact O-N 3.09Å; S152-R155 PolarHBondContact O-N 3.19Å; R155-E157 VanDerWaalsContact C-N 3.34Å; R155-T158 PolarHBondContact O-OG1 3.3Å; R155-A159 WeakPolarHBondContact O-CB 3.37Å; R155-A159 PolarHBondContact O-N 2.69Å
156	N	59.3	Low	68.2	Low	114 Å²	114	97.7 Å²	97.7	61%	0.61	49%	0.493	S	S	*	.	H	α-helix	trans	-71.1	-29.8	175	-69.6	4.6	0	0	0	112.2	S152 V154 S160	S152-N156 VanDerWaalsContact O-CB 3.3Å; S152-N156 WeakPolarHBondContact O-CB 3.31Å; S152-N156 PolarHBondContact O-N 3.34Å; S152-N156 PolarHBondContact O-OD1 3.44Å; V154-N156 VanDerWaalsContact C-N 3.28Å; V154-N156 PolarHBondContact O-N 2.61Å; N156-S160 VanDerWaalsContact O-CB 3.25Å; N156-S160 WeakPolarHBondContact O-CB 3.48Å; N156-S160 PolarHBondContact O-N 2.72Å
157	E	57.5	Low	67.8	Low	95 Å²	95	102.2 Å²	102.2	44%	0.444	51%	0.51	S	S	.	.	H	α-helix	trans	-76.6	-34.6	176.5	-92.1	179.3	-130	0	0	112.6	K81 V154 R155 S160	K81-E157 IonicContact NZ-OE1 3.71Å; K81-E157 PolarHBondContact NZ-OE1 2.93Å; K81-E157 IonicContact NZ-OE2 3.3Å; K81-E157 PolarHBondContact NZ-OE2 3.07Å; V154-E157 PolarHBondContact O-N 3.07Å; R155-E157 VanDerWaalsContact C-N 3.34Å; E157-S160 WeakPolarHBondContact CA-OG 3.4Å; E157-S160 PolarHBondContact O-N 2.95Å; E157-S160 PolarHBondContact O-OG 2.89Å
158	T	56.4	Low	67.9	Low	64 Å²	64	96.3 Å²	96.3	39%	0.393	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-53	172.1	53.2	0	0	0	0	110.2	V154 R155 S160 R161	V154-T158 PolarHBondContact O-N 3.38Å; V154-T158 VanDerWaalsContact O-N 3.1Å; R155-T158 PolarHBondContact O-OG1 3.3Å; T158-S160 PolarHBondContact O-N 3.04Å; T158-S160 VanDerWaalsContact O-N 3.15Å; T158-R161 WeakPolarHBondContact O-CB 3.42Å; T158-R161 PolarHBondContact O-N 3.3Å
159	A	54.3	Low	67.8	Low	53 Å²	53	94.5 Å²	94.5	44%	0.438	49%	0.491	S	S	.	.	H	α-helix	trans	-58.8	-27.9	175	0	0	0	0	0	113.6	R155 R161 E162	R155-A159 WeakPolarHBondContact O-CB 3.37Å; R155-A159 PolarHBondContact O-N 2.69Å; A159-R161 PolarHBondContact O-N 3.42Å; A159-E162 PolarHBondContact O-N 3.43Å
160	S	54.1	Low	68.1	Low	61 Å²	61	100.4 Å²	100.4	43%	0.427	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.1	176.7	79	0	0	0	0	114.4	N156 E157 T158 K163	N156-S160 VanDerWaalsContact O-CB 3.25Å; N156-S160 WeakPolarHBondContact O-CB 3.48Å; N156-S160 PolarHBondContact O-N 2.72Å; E157-S160 WeakPolarHBondContact CA-OG 3.4Å; E157-S160 PolarHBondContact O-N 2.95Å; E157-S160 PolarHBondContact O-OG 2.89Å; T158-S160 PolarHBondContact O-N 3.04Å; T158-S160 VanDerWaalsContact O-N 3.15Å; S160-K163 WeakPolarHBondContact O-CE 3.2Å
161	R	52.5	Low	68.3	Low	208 Å²	208	99 Å²	99	79%	0.785	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-16.8	177.4	-63.5	174.6	176.1	-160.4	-2.9	112.6	T158 A159 K163	T158-R161 WeakPolarHBondContact O-CB 3.42Å; T158-R161 PolarHBondContact O-N 3.3Å; A159-R161 PolarHBondContact O-N 3.42Å; R161-K163 PolarHBondContact O-N 2.96Å
162	E	54.4	Low	68.7	Low	110 Å²	110	98.1 Å²	98.1	51%	0.514	50%	0.498	S	S	.	.			trans	-100	52	-175	-63	173.5	132.1	0	0	111.1	A159 D164 V165	A159-E162 PolarHBondContact O-N 3.43Å; E162-D164 VanDerWaalsContact C-N 3.3Å; E162-V165 HydrophobicContact CB-CB 4.35Å; E162-V165 HydrophobicContact CB-CG2 3.91Å; E162-V165 HydrophobicContact CG-CG2 4.36Å
163	K	55.8	Low	69.4	Low	159 Å²	159	100.4 Å²	100.4	69%	0.691	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-17.6	-178.9	-69.5	-172.3	179.7	-176	0	114.1	S160 R161	S160-K163 WeakPolarHBondContact O-CE 3.2Å; R161-K163 PolarHBondContact O-N 2.96Å
164	D	59.8	Low	70.3	Confident	157 Å²	157	101.4 Å²	101.4	84%	0.84	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	11.5	-177.4	-50.2	-45.2	0	0	0	112.4	E162	E162-D164 VanDerWaalsContact C-N 3.3Å
165	V	70.1	Confident	71.1	Confident	79 Å²	79	105.7 Å²	105.7	48%	0.479	53%	0.525	S	S	.	.	S	Bend	trans	-96.9	127.8	174.1	-178	0	0	0	0	108.6	E162	E162-V165 HydrophobicContact CB-CB 4.35Å; E162-V165 HydrophobicContact CB-CG2 3.91Å; E162-V165 HydrophobicContact CG-CG2 4.36Å
166	P	73.4	Confident	72.2	Confident	42 Å²	42	102.1 Å²	102.1	27%	0.273	52%	0.519	S	S	.	.			trans	-65.2	141.9	179.5	27.5	-34.7	0	0	0	111.1	D171 E172	P166-D171 VanDerWaalsContact CA-OD2 3.26Å; P166-D171 WeakPolarHBondContact CA-OD2 3.49Å; P166-D171 HydrophobicContact CB-CB 3.93Å; P166-E172 HydrophobicContact CB-CG 3.84Å; P166-E172 HydrophobicContact CG-CG 3.69Å
167	K	76.6	Confident	73.8	Confident	158 Å²	158	99.1 Å²	99.1	69%	0.687	51%	0.51	S	S	*	.			trans	-107.5	-6.7	-168.8	-67.1	175.4	-176	167.2	0	115.1	D171	K167-D171 PolarHBondContact N-OD2 3.1Å
168	T	85.5	Confident	75.4	Confident	78 Å²	78	98.6 Å²	98.6	48%	0.479	51%	0.507	S	S	.	.	S	Bend	trans	-148.4	158.2	179.7	65.2	0	0	0	0	109.2	F170 D171 E172	T168-F170 PolarHBondContact O-N 2.91Å; T168-D171 WeakPolarHBondContact O-CA 3.18Å; T168-D171 VanDerWaalsContact O-CB 3.29Å; T168-D171 WeakPolarHBondContact O-CB 3.37Å; T168-D171 PolarHBondContact O-N 2.7Å; T168-D171 WeakPolarHBondContact OG1-CB 3.4Å; T168-D171 PolarHBondContact OG1-N 2.62Å; T168-D171 VanDerWaalsContact OG1-N 3.13Å; T168-E172 PolarHBondContact O-N 3.46Å
169	V	85.2	Confident	76.8	Confident	93 Å²	93	98 Å²	98	56%	0.564	51%	0.509	S	S	*	.	H	α-helix	trans	-58.5	-30.5	175.1	-177.3	0	0	0	0	111.8	E172 Q173	V169-E172 PolarHBondContact O-N 3.31Å; V169-Q173 WeakPolarHBondContact O-CB 3.44Å; V169-Q173 VanDerWaalsContact O-CG 3.23Å; V169-Q173 WeakPolarHBondContact O-CG 3.46Å; V169-Q173 PolarHBondContact O-N 2.85Å
170	F	88.3	Confident	78.4	Confident	147 Å²	147	100.1 Å²	100.1	65%	0.645	51%	0.513	S	S	*	.	H	α-helix	trans	-67	-40	172.4	-179.7	-101.2	0	0	0	112.4	T168 Q173 V174	T168-F170 PolarHBondContact O-N 2.91Å; F170-Q173 PolarHBondContact O-N 2.68Å; F170-V174 HydrophobicContact CD1-CG2 4.12Å; F170-V174 HydrophobicContact CE1-CG2 3.71Å; F170-V174 HydrophobicContact CE2-CG2 4.19Å; F170-V174 HydrophobicContact CZ-CG2 3.75Å; F170-V174 WeakPolarHBondContact O-CB 3.49Å; F170-V174 VanDerWaalsContact O-CG2 3.28Å; F170-V174 WeakPolarHBondContact O-CG2 3.35Å; F170-V174 PolarHBondContact O-N 3.44Å
171	D	88.6	Confident	80.1	Confident	48 Å²	48	100.3 Å²	100.3	26%	0.257	51%	0.514	S	S	.	.	H	α-helix	trans	-66.9	-37.6	176.5	-163.3	8.2	0	0	0	111.1	P166 K167 T168 H175	P166-D171 VanDerWaalsContact CA-OD2 3.26Å; P166-D171 WeakPolarHBondContact CA-OD2 3.49Å; P166-D171 HydrophobicContact CB-CB 3.93Å; K167-D171 PolarHBondContact N-OD2 3.1Å; T168-D171 WeakPolarHBondContact O-CA 3.18Å; T168-D171 VanDerWaalsContact O-CB 3.29Å; T168-D171 WeakPolarHBondContact O-CB 3.37Å; T168-D171 PolarHBondContact O-N 2.7Å; T168-D171 WeakPolarHBondContact OG1-CB 3.4Å; T168-D171 PolarHBondContact OG1-N 2.62Å; T168-D171 VanDerWaalsContact OG1-N 3.13Å; D171-H175 PolarHBondContact O-N 3.16Å; D171-H175 PolarHBondContact O-ND1 3.38Å; D171-H175 IonicContact OD1-CE1 3.12Å; D171-H175 PolarHBondContact OD1-CE1 2.88Å; D171-H175 IonicContact OD1-ND1 2.68Å; D171-H175 PolarHBondContact OD1-ND1 3.18Å
172	E	85.4	Confident	81.6	Confident	105 Å²	105	97.5 Å²	97.5	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-47.8	169.3	-66	174.2	166.7	0	0	111.8	P166 T168 V169 V174 H175 L176	P166-E172 HydrophobicContact CB-CG 3.84Å; P166-E172 HydrophobicContact CG-CG 3.69Å; T168-E172 PolarHBondContact O-N 3.46Å; V169-E172 PolarHBondContact O-N 3.31Å; E172-V174 VanDerWaalsContact C-N 3.34Å; E172-V174 PolarHBondContact O-N 2.8Å; E172-H175 PolarHBondContact O-N 3.24Å; E172-L176 WeakPolarHBondContact O-CB 3.39Å; E172-L176 PolarHBondContact O-N 2.97Å
173	Q	91.3	Very high	83.1	Confident	113 Å²	113	95.6 Å²	95.6	53%	0.528	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-37.5	177	-75.8	172.7	-0.2	0	0	112.4	V169 F170 L176 A177	V169-Q173 WeakPolarHBondContact O-CB 3.44Å; V169-Q173 VanDerWaalsContact O-CG 3.23Å; V169-Q173 WeakPolarHBondContact O-CG 3.46Å; V169-Q173 PolarHBondContact O-N 2.85Å; F170-Q173 PolarHBondContact O-N 2.68Å; Q173-L176 PolarHBondContact O-N 2.99Å; Q173-A177 WeakPolarHBondContact O-CB 3.22Å; Q173-A177 PolarHBondContact O-N 3.12Å
174	V	91.5	Very high	84.3	Confident	62 Å²	62	93 Å²	93	38%	0.376	50%	0.495	S	S	.	.	H	α-helix	trans	-67.8	-41.5	175	166.2	0	0	0	0	111.2	F170 E172 Q178	F170-V174 HydrophobicContact CD1-CG2 4.12Å; F170-V174 HydrophobicContact CE1-CG2 3.71Å; F170-V174 HydrophobicContact CE2-CG2 4.19Å; F170-V174 HydrophobicContact CZ-CG2 3.75Å; F170-V174 WeakPolarHBondContact O-CB 3.49Å; F170-V174 VanDerWaalsContact O-CG2 3.28Å; F170-V174 WeakPolarHBondContact O-CG2 3.35Å; F170-V174 PolarHBondContact O-N 3.44Å; E172-V174 VanDerWaalsContact C-N 3.34Å; E172-V174 PolarHBondContact O-N 2.8Å; V174-Q178 VanDerWaalsContact O-CB 3.24Å; V174-Q178 WeakPolarHBondContact O-CB 3.22Å; V174-Q178 PolarHBondContact O-N 2.98Å
175	H	86.4	Confident	85.1	Confident	92 Å²	92	91.3 Å²	91.3	43%	0.426	49%	0.486	S	S	.	.	H	α-helix	trans	-65.8	-40.3	173.8	-77.6	96.9	0	0	0	112.2	D171 E172 Q178 A179	D171-H175 PolarHBondContact O-N 3.16Å; D171-H175 PolarHBondContact O-ND1 3.38Å; D171-H175 IonicContact OD1-CE1 3.12Å; D171-H175 PolarHBondContact OD1-CE1 2.88Å; D171-H175 IonicContact OD1-ND1 2.68Å; D171-H175 PolarHBondContact OD1-ND1 3.18Å; E172-H175 PolarHBondContact O-N 3.24Å; H175-Q178 PolarHBondContact O-N 3.42Å; H175-A179 WeakPolarHBondContact O-CB 3.5Å; H175-A179 PolarHBondContact O-N 3.25Å
176	L	90.8	Very high	84.7	Confident	107 Å²	107	92 Å²	92	56%	0.56	48%	0.484	S	S	*	.	H	α-helix	trans	-64.6	-47.8	175.1	179.6	61.1	0	0	0	111.5	E172 Q173 Q178 A179 L180	E172-L176 WeakPolarHBondContact O-CB 3.39Å; E172-L176 PolarHBondContact O-N 2.97Å; Q173-L176 PolarHBondContact O-N 2.99Å; L176-Q178 VanDerWaalsContact C-N 3.32Å; L176-Q178 PolarHBondContact O-N 2.81Å; L176-A179 WeakPolarHBondContact O-CB 3.21Å; L176-A179 PolarHBondContact O-N 3.36Å; L176-A179 VanDerWaalsContact O-N 3.12Å; L176-L180 HydrophobicContact CD1-CD1 4.39Å; L176-L180 HydrophobicContact CD1-CG 4.39Å; L176-L180 HydrophobicContact CG-CD1 4.18Å; L176-L180 WeakPolarHBondContact O-CG 3.43Å; L176-L180 PolarHBondContact O-N 2.82Å
177	A	91.4	Very high	84	Confident	50 Å²	50	98.5 Å²	98.5	41%	0.413	51%	0.508	S	S	.	.	H	α-helix	trans	-59.1	-43.9	175.1	0	0	0	0	0	111.1	Q173 A179 L180 S181	Q173-A177 WeakPolarHBondContact O-CB 3.22Å; Q173-A177 PolarHBondContact O-N 3.12Å; A177-A179 VanDerWaalsContact C-N 3.31Å; A177-A179 PolarHBondContact O-N 3.3Å; A177-L180 PolarHBondContact O-N 3.04Å; A177-S181 WeakPolarHBondContact O-CB 3.48Å; A177-S181 PolarHBondContact O-N 3.06Å; A177-S181 PolarHBondContact O-OG 3.17Å
178	Q	90.8	Very high	83	Confident	84 Å²	84	98.3 Å²	98.3	39%	0.393	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-33.4	175.9	-170.6	-179.3	99.8	0	0	112.7	V174 H175 L176 R182	V174-Q178 VanDerWaalsContact O-CB 3.24Å; V174-Q178 WeakPolarHBondContact O-CB 3.22Å; V174-Q178 PolarHBondContact O-N 2.98Å; H175-Q178 PolarHBondContact O-N 3.42Å; L176-Q178 VanDerWaalsContact C-N 3.32Å; L176-Q178 PolarHBondContact O-N 2.81Å; Q178-R182 VanDerWaalsContact CD-NH2 3.29Å; Q178-R182 VanDerWaalsContact O-CG 3.27Å; Q178-R182 WeakPolarHBondContact O-CG 3.34Å; Q178-R182 PolarHBondContact O-N 3.23Å
179	A	87.3	Confident	80.8	Confident	52 Å²	52	102.1 Å²	102.1	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-70.1	-43.8	173.1	0	0	0	0	0	111.9	H175 L176 A177 R182 S183	H175-A179 WeakPolarHBondContact O-CB 3.5Å; H175-A179 PolarHBondContact O-N 3.25Å; L176-A179 WeakPolarHBondContact O-CB 3.21Å; L176-A179 PolarHBondContact O-N 3.36Å; L176-A179 VanDerWaalsContact O-N 3.12Å; A177-A179 VanDerWaalsContact C-N 3.31Å; A177-A179 PolarHBondContact O-N 3.3Å; A179-R182 PolarHBondContact O-N 3.34Å; A179-S183 PolarHBondContact O-N 3.48Å
180	L	87.6	Confident	78.8	Confident	98 Å²	98	103.1 Å²	103.1	51%	0.513	53%	0.534	S	S	.	.	H	α-helix	trans	-62.9	-45.4	175.6	-69.3	171.8	0	0	0	111.6	L176 A177 R182 S183 L184	L176-L180 HydrophobicContact CD1-CD1 4.39Å; L176-L180 HydrophobicContact CD1-CG 4.39Å; L176-L180 HydrophobicContact CG-CD1 4.18Å; L176-L180 WeakPolarHBondContact O-CG 3.43Å; L176-L180 PolarHBondContact O-N 2.82Å; A177-L180 PolarHBondContact O-N 3.04Å; L180-R182 VanDerWaalsContact C-N 3.3Å; L180-R182 PolarHBondContact O-N 2.91Å; L180-S183 WeakPolarHBondContact O-CB 3.13Å; L180-S183 PolarHBondContact O-N 2.9Å; L180-S183 VanDerWaalsContact O-N 3.11Å; L180-L184 WeakPolarHBondContact O-CG 3.33Å; L180-L184 PolarHBondContact O-N 3.41Å
181	S	89.9	Confident	76.4	Confident	65 Å²	65	105.8 Å²	105.8	46%	0.455	55%	0.549	S	S	.	.	H	α-helix	trans	-59	-38.9	174.1	-57.9	0	0	0	0	112.5	A177 L185	A177-S181 WeakPolarHBondContact O-CB 3.48Å; A177-S181 PolarHBondContact O-N 3.06Å; A177-S181 PolarHBondContact O-OG 3.17Å; S181-L185 WeakPolarHBondContact O-CB 3.39Å; S181-L185 WeakPolarHBondContact O-CD1 3.42Å; S181-L185 VanDerWaalsContact O-CG 3.23Å; S181-L185 WeakPolarHBondContact O-CG 3.44Å; S181-L185 PolarHBondContact O-N 2.88Å
182	R	83.3	Confident	73.9	Confident	148 Å²	148	111.7 Å²	111.7	56%	0.558	58%	0.577	S	S	*	*	H	α-helix	trans	-66.8	-37	174.9	-76.7	172	179.3	140.3	7.6	112.6	Q178 A179 L180	Q178-R182 VanDerWaalsContact CD-NH2 3.29Å; Q178-R182 VanDerWaalsContact O-CG 3.27Å; Q178-R182 WeakPolarHBondContact O-CG 3.34Å; Q178-R182 PolarHBondContact O-N 3.23Å; A179-R182 PolarHBondContact O-N 3.34Å; L180-R182 VanDerWaalsContact C-N 3.3Å; L180-R182 PolarHBondContact O-N 2.91Å
183	S	85.4	Confident	71.6	Confident	71 Å²	71	113.8 Å²	113.8	50%	0.497	60%	0.597	S	S	.	*	H	α-helix	trans	-70	-44.2	178.8	-171.2	0	0	0	0	112.4	A179 L180 E186	A179-S183 PolarHBondContact O-N 3.48Å; L180-S183 WeakPolarHBondContact O-CB 3.13Å; L180-S183 PolarHBondContact O-N 2.9Å; L180-S183 VanDerWaalsContact O-N 3.11Å; S183-E186 PolarHBondContact O-N 3.23Å
184	L	82.6	Confident	68.9	Low	104 Å²	104	114.9 Å²	114.9	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-64.2	-43.3	178	-68.9	169.1	0	0	0	111.9	L180 E186 K187	L180-L184 WeakPolarHBondContact O-CG 3.33Å; L180-L184 PolarHBondContact O-N 3.41Å; L184-E186 PolarHBondContact O-N 2.86Å; L184-K187 PolarHBondContact O-N 2.96Å
185	L	75.2	Confident	65.9	Low	122 Å²	122	117 Å²	117	64%	0.639	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	0.7	175.5	-71	172.3	0	0	0	114.7	S181	S181-L185 WeakPolarHBondContact O-CB 3.39Å; S181-L185 WeakPolarHBondContact O-CD1 3.42Å; S181-L185 VanDerWaalsContact O-CG 3.23Å; S181-L185 WeakPolarHBondContact O-CG 3.44Å; S181-L185 PolarHBondContact O-N 2.88Å
186	E	63.2	Low	63.4	Low	93 Å²	93	118.3 Å²	118.3	44%	0.435	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.3	4.4	173.4	-70	179.2	-172.1	0	0	113	S183 L184 K199	S183-E186 PolarHBondContact O-N 3.23Å; L184-E186 PolarHBondContact O-N 2.86Å; E186-K199 HydrophobicContact CG-CD 4.11Å; E186-K199 VanDerWaalsContact CG-NZ 3.28Å; E186-K199 WeakPolarHBondContact OE1-CD 3.39Å; E186-K199 WeakPolarHBondContact OE1-CE 3.24Å; E186-K199 IonicContact OE1-NZ 2.72Å; E186-K199 PolarHBondContact OE1-NZ 3.47Å
187	K	58.2	Low	60.7	Low	179 Å²	179	118.7 Å²	118.7	78%	0.778	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	-20.7	176.9	-78.6	-169.2	172.3	-173.1	0	116.6	L184	L184-K187 PolarHBondContact O-N 2.96Å
188	E	54.9	Low	58.2	Low	154 Å²	154	122.2 Å²	122.2	72%	0.72	67%	0.668	S	S	*	*	S	Bend	trans	-98.5	14	-166.3	-63.3	-174	148.4	0	0	115.9	P190	E188-P190 WeakPolarHBondContact O-CD 3.45Å
189	L	39.7	Very low	55.6	Low	157 Å²	157	124.7 Å²	124.7	82%	0.822	68%	0.678	S	S	*	*			trans	-108.8	104.2	-178.5	-89.2	163.9	0	0	0	112.3
190	P	43.1	Very low	53.1	Low	114 Å²	114	127.9 Å²	127.9	74%	0.74	70%	0.696	S	S	*	*			trans	-73.5	158.9	176.8	30.5	-35.1	0	0	0	112.8	E188 M192	E188-P190 WeakPolarHBondContact O-CD 3.45Å; P190-M192 PolarHBondContact O-N 2.84Å
191	E	37.1	Very low	50.7	Low	203 Å²	203	130 Å²	130	95%	0.949	71%	0.706	S	S	*	*			trans	-71.9	96.8	-174.4	-63.4	-173.3	116.7	0	0	113.1
192	M	37.6	Very low	48.3	Very low	173 Å²	173	136.1 Å²	136.1	85%	0.852	73%	0.725	S	S	*	*			trans	-137.4	144.7	164.8	-101.7	-179.7	61.6	0	0	112.1	P190 L194	P190-M192 PolarHBondContact O-N 2.84Å; M192-L194 PolarHBondContact O-N 2.9Å; M192-L194 VanDerWaalsContact O-N 3.08Å
193	V	36.3	Very low	46.4	Very low	149 Å²	149	138 Å²	138	90%	0.903	74%	0.74	S	S	*	*			trans	-78.7	97.5	-160.8	-176.2	0	0	0	0	113
194	L	35.1	Very low	43.9	Very low	135 Å²	135	140.9 Å²	140.9	71%	0.707	76%	0.755	S	S	*	*			trans	-136.8	153.2	155.5	-86.5	112.1	0	0	0	109.8	M192 T196	M192-L194 PolarHBondContact O-N 2.9Å; M192-L194 VanDerWaalsContact O-N 3.08Å; L194-T196 PolarHBondContact O-N 3.28Å
195	P	28.1	Very low	41.9	Very low	108 Å²	108	143.3 Å²	143.3	70%	0.701	77%	0.767	S	S	*	*			trans	-81.1	55	-169.3	34.1	-37.5	0	0	0	113.5
196	T	33.5	Very low	40.1	Very low	118 Å²	118	144.4 Å²	144.4	72%	0.724	77%	0.773	S	S	*	*			trans	-81	139.7	172.6	46.9	0	0	0	0	110.7	L194 S198	L194-T196 PolarHBondContact O-N 3.28Å; T196-S198 PolarHBondContact O-N 3.45Å; T196-S198 VanDerWaalsContact O-N 3.12Å
197	S	35.7	Very low	38.6	Very low	115 Å²	115	149.2 Å²	149.2	80%	0.804	80%	0.796	S	S	*	*			trans	-74.9	105.3	-169.8	57.8	0	0	0	0	112.3	K199	S197-K199 PolarHBondContact O-N 2.99Å
198	S	36.8	Very low	37.6	Very low	124 Å²	124	146.2 Å²	146.2	87%	0.867	79%	0.793	S	S	*	*			trans	-53.3	117.3	175.9	-42.1	0	0	0	0	111.5	T196 C200	T196-S198 PolarHBondContact O-N 3.45Å; T196-S198 VanDerWaalsContact O-N 3.12Å; S198-C200 PolarHBondContact O-N 2.75Å
199	K	37.5	Very low	36.9	Very low	137 Å²	137	148.9 Å²	148.9	60%	0.596	80%	0.802	S	S	*	*			trans	-78.4	102.3	176.3	-60.2	174.5	-172.8	166.2	0	109.2	E186 S197 L201	E186-K199 HydrophobicContact CG-CD 4.11Å; E186-K199 VanDerWaalsContact CG-NZ 3.28Å; E186-K199 WeakPolarHBondContact OE1-CD 3.39Å; E186-K199 WeakPolarHBondContact OE1-CE 3.24Å; E186-K199 IonicContact OE1-NZ 2.72Å; E186-K199 PolarHBondContact OE1-NZ 3.47Å; S197-K199 PolarHBondContact O-N 2.99Å; K199-L201 PolarHBondContact O-N 3.15Å
200	C	34.2	Very low	36.9	Very low	119 Å²	119	146.9 Å²	146.9	80%	0.804	79%	0.792	S	S	*	*			trans	-67.3	119.8	164.4	-174.1	0	0	0	0	108.7	S198 K202	S198-C200 PolarHBondContact O-N 2.75Å; C200-K202 PolarHBondContact O-N 2.94Å; C200-K202 VanDerWaalsContact O-N 3.13Å
201	L	37.6	Very low	36.8	Very low	141 Å²	141	151.3 Å²	151.3	74%	0.738	80%	0.802	S	S	*	*			trans	-57.1	115.4	-179.8	-73.9	166.7	0	0	0	110.4	K199 Q203	K199-L201 PolarHBondContact O-N 3.15Å; L201-Q203 PolarHBondContact O-N 2.92Å
202	K	39.7	Very low	37	Very low	194 Å²	194	146.6 Å²	146.6	84%	0.843	78%	0.782	S	S	*	*			trans	-85.2	89.6	174	-70	-178.2	-178.5	176.4	0	109	C200 T204	C200-K202 PolarHBondContact O-N 2.94Å; C200-K202 VanDerWaalsContact O-N 3.13Å; K202-T204 PolarHBondContact O-N 3.36Å
203	Q	43.6	Very low	37.8	Very low	188 Å²	188	141.3 Å²	141.3	88%	0.879	76%	0.762	S	S	*	*			trans	-53	125.1	164.9	-159.1	175.2	26.3	0	0	108.3	L201 L205	L201-Q203 PolarHBondContact O-N 2.92Å; Q203-L205 PolarHBondContact O-N 3.32Å
204	T	31.4	Very low	39.2	Very low	131 Å²	131	137.4 Å²	137.4	80%	0.804	74%	0.741	S	S	*	*			trans	-79.6	64.1	-160.6	-6.5	0	0	0	0	112.6	K202 L206	K202-T204 PolarHBondContact O-N 3.36Å; T204-L206 PolarHBondContact O-N 3.05Å
205	L	41.2	Very low	41	Very low	155 Å²	155	135.9 Å²	135.9	81%	0.812	74%	0.739	S	S	*	*			trans	-65.4	100.9	172.8	-160.1	163	0	0	0	108.4	Q203 Q207	Q203-L205 PolarHBondContact O-N 3.32Å; L205-Q207 PolarHBondContact O-N 3.32Å
206	L	37.3	Very low	43.1	Very low	146 Å²	146	137.9 Å²	137.9	76%	0.764	74%	0.737	S	S	*	*			trans	-49.6	126.9	-178.9	-68.1	167.5	0	0	0	110.1	T204 T208	T204-L206 PolarHBondContact O-N 3.05Å; L206-T208 VanDerWaalsContact C-N 3.34Å; L206-T208 PolarHBondContact O-N 2.89Å
207	Q	32.1	Very low	44.8	Very low	193 Å²	193	134.8 Å²	134.8	90%	0.902	72%	0.718	S	S	*	*			trans	-67.6	93.7	176.1	-71.9	-168.2	-58.3	0	0	109.8	L205 K209	L205-Q207 PolarHBondContact O-N 3.32Å; Q207-K209 PolarHBondContact O-N 3.19Å; Q207-K209 VanDerWaalsContact O-N 3.1Å
208	T	37.2	Very low	46.3	Very low	117 Å²	117	137.6 Å²	137.6	72%	0.718	71%	0.711	S	S	*	*			trans	-58.9	114.9	170.1	42.8	0	0	0	0	108.4	L206 L210	L206-T208 VanDerWaalsContact C-N 3.34Å; L206-T208 PolarHBondContact O-N 2.89Å; T208-L210 PolarHBondContact O-N 3.21Å
209	K	39.4	Very low	48.2	Very low	209 Å²	209	135.8 Å²	135.8	91%	0.909	69%	0.691	S	S	*	*			trans	-81.5	60.7	-165.1	-164.4	173.2	-176.9	173.4	0	111.2	Q207	Q207-K209 PolarHBondContact O-N 3.19Å; Q207-K209 VanDerWaalsContact O-N 3.1Å
210	L	40.4	Very low	49.9	Very low	116 Å²	116	130.8 Å²	130.8	61%	0.607	68%	0.678	S	S	*	*			trans	-141.4	39.1	-159.8	-109.9	152.6	0	0	0	113	T208 M212	T208-L210 PolarHBondContact O-N 3.21Å; L210-M212 HydrophobicContact CD2-CB 4.2Å; L210-M212 HydrophobicContact CD2-CG 3.69Å; L210-M212 PolarHBondContact O-N 3.38Å
211	E	40.4	Very low	51.8	Low	206 Å²	206	128.4 Å²	128.4	96%	0.963	66%	0.656	S	S	*	*			trans	-69.4	68.7	156.3	-74.8	-158.4	132.9	0	0	110.2
212	M	42.5	Very low	53.4	Low	105 Å²	105	126 Å²	126	52%	0.517	64%	0.644	S	S	.	*			trans	-90.2	108.9	174.9	-79	-60.7	-53.8	0	0	110.8	L210	L210-M212 HydrophobicContact CD2-CB 4.2Å; L210-M212 HydrophobicContact CD2-CG 3.69Å; L210-M212 PolarHBondContact O-N 3.38Å
213	S	53.6	Low	55	Low	62 Å²	62	118.9 Å²	118.9	43%	0.434	61%	0.614	S	S	.	*	S	Bend	trans	32.2	114.1	147.8	60.8	0	0	0	0	119.3	T217	S213-T217 WeakPolarHBondContact O-CB 3.36Å; S213-T217 PolarHBondContact O-OG1 2.96Å; S213-T217 PolarHBondContact OG-OG1 3.15Å; S213-T217 VanDerWaalsContact OG-OG1 3.1Å
214	S	66.9	Low	56.2	Low	67 Å²	67	112.1 Å²	112.1	47%	0.469	59%	0.59	S	S	.	*	H	α-helix	trans	62.9	153.5	157.6	83.7	0	0	0	0	118.8	K216 T217 R218	S214-K216 PolarHBondContact O-N 3.03Å; S214-K216 PolarHBondContact OG-N 3.33Å; S214-T217 PolarHBondContact O-N 3.12Å; S214-T217 PolarHBondContact OG-N 3.43Å; S214-T217 VanDerWaalsContact OG-N 3.12Å; S214-T217 PolarHBondContact OG-OG1 3.06Å; S214-R218 PolarHBondContact O-N 2.98Å
215	P	72.8	Confident	58.1	Low	103 Å²	103	113.2 Å²	113.2	67%	0.669	58%	0.579	S	S	*	*	H	α-helix	trans	-58.1	-32.8	168.2	-24.9	35.2	0	0	0	113.2	R218 L219	P215-R218 PolarHBondContact O-N 3.49Å; P215-L219 PolarHBondContact O-N 3.43Å
216	K	71.3	Confident	59.5	Low	149 Å²	149	108.9 Å²	108.9	65%	0.648	56%	0.557	S	S	*	*	H	α-helix	trans	-68.8	-38.1	-178.9	-71.2	-175.9	176.4	179.7	0	113.3	S214 G220	S214-K216 PolarHBondContact O-N 3.03Å; S214-K216 PolarHBondContact OG-N 3.33Å; K216-G220 PolarHBondContact O-N 3.04Å
217	T	69.6	Low	61.1	Low	53 Å²	53	103.7 Å²	103.7	33%	0.325	53%	0.532	S	S	.	.	H	α-helix	trans	-77.1	-30.9	175.1	-36.5	0	0	0	0	111.4	S213 S214 G220 I221	S213-T217 WeakPolarHBondContact O-CB 3.36Å; S213-T217 PolarHBondContact O-OG1 2.96Å; S213-T217 PolarHBondContact OG-OG1 3.15Å; S213-T217 VanDerWaalsContact OG-OG1 3.1Å; S214-T217 PolarHBondContact O-N 3.12Å; S214-T217 PolarHBondContact OG-N 3.43Å; S214-T217 VanDerWaalsContact OG-N 3.12Å; S214-T217 PolarHBondContact OG-OG1 3.06Å; T217-G220 PolarHBondContact O-N 3.18Å; T217-I221 HydrophobicContact CG2-CD1 4.15Å; T217-I221 HydrophobicContact CG2-CG1 4.47Å; T217-I221 WeakPolarHBondContact O-CB 3.48Å; T217-I221 WeakPolarHBondContact O-CD1 3.39Å; T217-I221 WeakPolarHBondContact O-CG1 3.34Å; T217-I221 PolarHBondContact O-N 3.33Å
218	R	67.6	Low	62.6	Low	175 Å²	175	99.3 Å²	99.3	66%	0.66	52%	0.515	S	S	*	.	H	α-helix	trans	-60.4	-46	168.2	-76.7	-174.8	59.9	-158.3	-8	112	S214 P215 I221 L222	S214-R218 PolarHBondContact O-N 2.98Å; P215-R218 PolarHBondContact O-N 3.49Å; R218-I221 PolarHBondContact O-N 2.95Å; R218-L222 WeakPolarHBondContact O-CG 3.47Å; R218-L222 PolarHBondContact O-N 3.06Å
219	L	75.6	Confident	63.8	Low	86 Å²	86	98.6 Å²	98.6	45%	0.45	51%	0.507	S	S	.	.	H	α-helix	trans	-60.9	-50.6	172.6	-84.7	163.6	0	0	0	111.3	P215 I221 L222 E223	P215-L219 PolarHBondContact O-N 3.43Å; L219-I221 VanDerWaalsContact C-N 3.25Å; L219-I221 PolarHBondContact O-N 3.19Å; L219-L222 CarbonylContact O-C 3.45Å; L219-L222 WeakPolarHBondContact O-CA 3.44Å; L219-L222 PolarHBondContact O-N 2.99Å; L219-E223 WeakPolarHBondContact O-CB 3.34Å; L219-E223 WeakPolarHBondContact O-CG 3.41Å; L219-E223 PolarHBondContact O-N 3.36Å
220	G	74.6	Confident	64.8	Low	31 Å²	31	90.9 Å²	90.9	32%	0.32	48%	0.475	S	S	.	.	H	α-helix	trans	-60.2	-29.2	178	0	0	0	0	0	114.7	K216 T217 A224	K216-G220 PolarHBondContact O-N 3.04Å; T217-G220 PolarHBondContact O-N 3.18Å; G220-A224 VanDerWaalsContact O-CB 3.23Å; G220-A224 WeakPolarHBondContact O-CB 3.08Å; G220-A224 PolarHBondContact O-N 3.41Å
221	I	72.3	Confident	65.8	Low	69 Å²	69	89 Å²	89	35%	0.354	47%	0.468	S	S	.	.	H	α-helix	trans	-74.8	-35.7	172.3	-71.1	163.9	0	0	0	111.3	T217 R218 L219 R225	T217-I221 HydrophobicContact CG2-CD1 4.15Å; T217-I221 HydrophobicContact CG2-CG1 4.47Å; T217-I221 WeakPolarHBondContact O-CB 3.48Å; T217-I221 WeakPolarHBondContact O-CD1 3.39Å; T217-I221 WeakPolarHBondContact O-CG1 3.34Å; T217-I221 PolarHBondContact O-N 3.33Å; R218-I221 PolarHBondContact O-N 2.95Å; L219-I221 VanDerWaalsContact C-N 3.25Å; L219-I221 PolarHBondContact O-N 3.19Å; I221-R225 WeakPolarHBondContact O-CB 3.45Å; I221-R225 VanDerWaalsContact O-CG 3.24Å; I221-R225 WeakPolarHBondContact O-CG 3.4Å; I221-R225 PolarHBondContact O-N 2.69Å
222	L	72	Confident	66.2	Low	91 Å²	91	84.9 Å²	84.9	48%	0.476	45%	0.449	S	S	.	.	H	α-helix	trans	-71.8	-44.1	174.4	-70.7	169.3	0	0	0	111.3	R218 L219 R225 L226	R218-L222 WeakPolarHBondContact O-CG 3.47Å; R218-L222 PolarHBondContact O-N 3.06Å; L219-L222 CarbonylContact O-C 3.45Å; L219-L222 WeakPolarHBondContact O-CA 3.44Å; L219-L222 PolarHBondContact O-N 2.99Å; L222-R225 PolarHBondContact O-N 3.22Å; L222-L226 WeakPolarHBondContact O-CB 3.48Å; L222-L226 VanDerWaalsContact O-CG 3.28Å; L222-L226 WeakPolarHBondContact O-CG 3.43Å; L222-L226 PolarHBondContact O-N 2.96Å
223	E	73.1	Confident	66.4	Low	45 Å²	45	82.1 Å²	82.1	21%	0.21	44%	0.439	C	S	.	.	H	α-helix	trans	-56.4	-51.5	173.5	-71.9	164.2	-170.1	0	0	110.4	L219 R225 L226 S227 K332	L219-E223 WeakPolarHBondContact O-CB 3.34Å; L219-E223 WeakPolarHBondContact O-CG 3.41Å; L219-E223 PolarHBondContact O-N 3.36Å; E223-R225 PolarHBondContact O-N 3.13Å; E223-L226 PolarHBondContact O-N 3.42Å; E223-S227 PolarHBondContact O-N 3.3Å; E223-S227 PolarHBondContact O-OG 3.23Å; E223-K332 VanDerWaalsContact CD-NZ 3.31Å; E223-K332 IonicContact OE1-NZ 2.9Å; E223-K332 PolarHBondContact OE1-NZ 2.94Å; E223-K332 IonicContact OE2-NZ 3.78Å; E223-K332 PolarHBondContact OE2-NZ 3.16Å
224	A	69.6	Low	65.8	Low	46 Å²	46	82.5 Å²	82.5	38%	0.38	44%	0.436	S	S	.	.	H	α-helix	trans	-58	-49.1	175	0	0	0	0	0	112.3	G220 L226 S227 D228	G220-A224 VanDerWaalsContact O-CB 3.23Å; G220-A224 WeakPolarHBondContact O-CB 3.08Å; G220-A224 PolarHBondContact O-N 3.41Å; A224-L226 VanDerWaalsContact C-N 3.3Å; A224-L226 PolarHBondContact O-N 3.45Å; A224-S227 PolarHBondContact O-N 3.43Å; A224-D228 WeakPolarHBondContact O-CB 3.46Å; A224-D228 PolarHBondContact O-N 3.37Å
225	R	71.6	Confident	64.4	Low	154 Å²	154	82.3 Å²	82.3	58%	0.581	43%	0.434	S	S	*	.	H	α-helix	trans	-67.2	-27.1	-179.6	-73	-177.2	71.9	-160.1	-0.2	113.9	I221 L222 E223 L229	I221-R225 WeakPolarHBondContact O-CB 3.45Å; I221-R225 VanDerWaalsContact O-CG 3.24Å; I221-R225 WeakPolarHBondContact O-CG 3.4Å; I221-R225 PolarHBondContact O-N 2.69Å; L222-R225 PolarHBondContact O-N 3.22Å; E223-R225 PolarHBondContact O-N 3.13Å; R225-L229 WeakPolarHBondContact O-CB 3.31Å; R225-L229 WeakPolarHBondContact O-CD1 3.49Å; R225-L229 WeakPolarHBondContact O-CG 3.39Å; R225-L229 PolarHBondContact O-N 3.44Å
226	L	69.7	Low	62.9	Low	64 Å²	64	79.5 Å²	79.5	34%	0.335	42%	0.417	S	S	.	.	H	α-helix	trans	-73.2	-45.2	172.2	-75.2	168.7	0	0	0	110.6	L222 E223 A224 D228 L229 L230	L222-L226 WeakPolarHBondContact O-CB 3.48Å; L222-L226 VanDerWaalsContact O-CG 3.28Å; L222-L226 WeakPolarHBondContact O-CG 3.43Å; L222-L226 PolarHBondContact O-N 2.96Å; E223-L226 PolarHBondContact O-N 3.42Å; A224-L226 VanDerWaalsContact C-N 3.3Å; A224-L226 PolarHBondContact O-N 3.45Å; L226-D228 VanDerWaalsContact C-N 3.34Å; L226-D228 PolarHBondContact O-N 3.26Å; L226-L229 PolarHBondContact O-N 2.88Å; L226-L230 WeakPolarHBondContact O-CB 3.36Å; L226-L230 VanDerWaalsContact O-CG 3.26Å; L226-L230 WeakPolarHBondContact O-CG 2.99Å; L226-L230 PolarHBondContact O-N 3.02Å
227	S	71.1	Confident	61.5	Low	36 Å²	36	77.2 Å²	77.2	25%	0.252	41%	0.405	S	S	.	.	H	α-helix	trans	-58.8	-45.2	171.8	-62.2	0	0	0	0	111.5	E223 A224 L230 V231 S333	E223-S227 PolarHBondContact O-N 3.3Å; E223-S227 PolarHBondContact O-OG 3.23Å; A224-S227 PolarHBondContact O-N 3.43Å; S227-L230 PolarHBondContact O-N 3.37Å; S227-V231 WeakPolarHBondContact O-CB 3.46Å; S227-V231 VanDerWaalsContact O-CG2 3.26Å; S227-V231 WeakPolarHBondContact O-CG2 3.32Å; S227-V231 PolarHBondContact O-N 3.46Å; S227-S333 PolarHBondContact OG-O 2.71Å
228	D	62.5	Low	59.9	Low	102 Å²	102	83 Å²	83	55%	0.545	43%	0.428	S	S	.	.	H	α-helix	trans	-57.6	-51.2	176.1	-64.2	-30.2	0	0	0	110.8	A224 L226 V231 H232	A224-D228 WeakPolarHBondContact O-CB 3.46Å; A224-D228 PolarHBondContact O-N 3.37Å; L226-D228 VanDerWaalsContact C-N 3.34Å; L226-D228 PolarHBondContact O-N 3.26Å; D228-V231 PolarHBondContact O-N 2.91Å; D228-H232 VanDerWaalsContact O-CB 3.22Å; D228-H232 WeakPolarHBondContact O-CB 3.36Å; D228-H232 PolarHBondContact O-N 3.35Å
229	L	62.3	Low	58.4	Low	102 Å²	102	80 Å²	80	53%	0.534	43%	0.43	S	S	.	.	H	α-helix	trans	-63.6	-43.2	-179.3	-75.7	168.3	0	0	0	112.8	R225 L226 H232 C233	R225-L229 WeakPolarHBondContact O-CB 3.31Å; R225-L229 WeakPolarHBondContact O-CD1 3.49Å; R225-L229 WeakPolarHBondContact O-CG 3.39Å; R225-L229 PolarHBondContact O-N 3.44Å; L226-L229 PolarHBondContact O-N 2.88Å; L229-H232 PolarHBondContact O-N 3.23Å; L229-C233 PolarHBondContact O-N 3.19Å; L229-C233 PolarHBondContact O-SG 3.22Å
230	L	60.7	Low	56.4	Low	47 Å²	47	83.7 Å²	83.7	25%	0.246	45%	0.445	C	S	.	.	H	α-helix	trans	-71.5	-29.8	-179	-67	169.7	0	0	0	112.5	L226 S227 R334	L226-L230 WeakPolarHBondContact O-CB 3.36Å; L226-L230 VanDerWaalsContact O-CG 3.26Å; L226-L230 WeakPolarHBondContact O-CG 2.99Å; L226-L230 PolarHBondContact O-N 3.02Å; S227-L230 PolarHBondContact O-N 3.37Å; L230-R334 HydrophobicContact CD1-CG 3.99Å
231	V	61.1	Low	54.5	Low	75 Å²	75	87.3 Å²	87.3	46%	0.455	45%	0.453	S	S	.	.	H	α-helix	trans	-80.6	-35.7	173.8	173.2	0	0	0	0	111.7	S227 D228 C233 L234	S227-V231 WeakPolarHBondContact O-CB 3.46Å; S227-V231 VanDerWaalsContact O-CG2 3.26Å; S227-V231 WeakPolarHBondContact O-CG2 3.32Å; S227-V231 PolarHBondContact O-N 3.46Å; D228-V231 PolarHBondContact O-N 2.91Å; V231-C233 VanDerWaalsContact C-N 3.31Å; V231-C233 PolarHBondContact O-N 2.87Å; V231-L234 WeakPolarHBondContact O-CB 3.45Å; V231-L234 PolarHBondContact O-N 3.36Å
232	H	50.4	Low	52.7	Low	121 Å²	121	91.4 Å²	91.4	56%	0.56	47%	0.469	S	S	*	.	H	α-helix	trans	-74.5	-20.8	-179	-147.3	-55.9	0	0	0	113.2	D228 L229 S235 S236	D228-H232 VanDerWaalsContact O-CB 3.22Å; D228-H232 WeakPolarHBondContact O-CB 3.36Å; D228-H232 PolarHBondContact O-N 3.35Å; L229-H232 PolarHBondContact O-N 3.23Å; H232-S235 PolarHBondContact O-OG 3Å; H232-S236 PolarHBondContact CE1-OG 3.28Å; H232-S236 VanDerWaalsContact CE1-OG 3.23Å; H232-S236 PolarHBondContact ND1-OG 3.14Å; H232-S236 WeakPolarHBondContact O-CB 3.37Å; H232-S236 PolarHBondContact O-N 3.08Å; H232-S236 PolarHBondContact O-OG 2.92Å
233	C	45.6	Very low	50.6	Low	47 Å²	47	95.9 Å²	95.9	32%	0.318	49%	0.491	S	S	.	.	H	α-helix	trans	-65.8	-39.3	168.7	-67.6	0	0	0	0	111.6	L229 V231 S235 Y237	L229-C233 PolarHBondContact O-N 3.19Å; L229-C233 PolarHBondContact O-SG 3.22Å; V231-C233 VanDerWaalsContact C-N 3.31Å; V231-C233 PolarHBondContact O-N 2.87Å; C233-S235 PolarHBondContact O-N 3.12Å; C233-Y237 WeakPolarHBondContact O-CD2 3.34Å
234	L	41.1	Very low	48.5	Very low	69 Å²	69	97.6 Å²	97.6	36%	0.361	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-40.5	177.9	-77.6	165.4	0	0	0	112.5	V231 A372	V231-L234 WeakPolarHBondContact O-CB 3.45Å; V231-L234 PolarHBondContact O-N 3.36Å; L234-A372 HydrophobicContact CD1-CB 4.26Å; L234-A372 HydrophobicContact CD2-CB 3.84Å; L234-A372 HydrophobicContact CG-CB 4.07Å
235	S	38.9	Very low	46.6	Very low	63 Å²	63	104.9 Å²	104.9	44%	0.441	53%	0.531	S	S	.	.	H	α-helix	trans	-85.7	-15.9	-175.6	58.9	0	0	0	0	115.6	H232 C233 T239	H232-S235 PolarHBondContact O-OG 3Å; C233-S235 PolarHBondContact O-N 3.12Å; S235-T239 PolarHBondContact O-OG1 3Å
236	S	39.7	Very low	44.6	Very low	44 Å²	44	104 Å²	104	31%	0.308	55%	0.546	S	S	.	.	H	α-helix	trans	-104.2	-11	-172.3	-57.2	0	0	0	0	115.1	H232	H232-S236 PolarHBondContact CE1-OG 3.28Å; H232-S236 VanDerWaalsContact CE1-OG 3.23Å; H232-S236 PolarHBondContact ND1-OG 3.14Å; H232-S236 WeakPolarHBondContact O-CB 3.37Å; H232-S236 PolarHBondContact O-N 3.08Å; H232-S236 PolarHBondContact O-OG 2.92Å
237	Y	42.4	Very low	42.8	Very low	102 Å²	102	110 Å²	110	40%	0.4	57%	0.569	S	S	.	*	H	α-helix	trans	-91.6	-37.4	178.7	-84.8	-105.9	0	0	0	112.6	C233 T239 I294	C233-Y237 WeakPolarHBondContact O-CD2 3.34Å; Y237-T239 PolarHBondContact O-N 3.36Å; Y237-I294 HydrophobicContact CE2-CD1 4.09Å; Y237-I294 WeakPolarHBondContact OH-CD1 3.41Å
238	E	36.8	Very low	40.9	Very low	173 Å²	173	119.9 Å²	119.9	81%	0.808	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-23.7	175.8	-64.4	-169.6	114.6	0	0	113.7
239	T	34.9	Very low	39.4	Very low	112 Å²	112	122.5 Å²	122.5	69%	0.687	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	3.9	-172.7	42.8	0	0	0	0	114.9	S235 Y237	S235-T239 PolarHBondContact O-OG1 3Å; Y237-T239 PolarHBondContact O-N 3.36Å
240	Q	34.2	Very low	37.8	Very low	165 Å²	165	129.2 Å²	129.2	77%	0.771	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131	0.9	-178.7	-69.3	-158.7	-15.5	0	0	117
241	E	34.8	Very low	36.3	Very low	106 Å²	106	132 Å²	132	50%	0.495	66%	0.655	S	S	.	*	S	Bend	trans	-125.5	133.5	171.2	-69.4	-164.4	-164.7	0	0	113.8	K291	E241-K291 IonicContact OE1-NZ 2.62Å; E241-K291 PolarHBondContact OE1-NZ 3.32Å
242	K	34	Very low	34.8	Very low	156 Å²	156	133.6 Å²	133.6	68%	0.678	67%	0.669	S	S	*	*			trans	68.7	70.7	160.7	-61.6	140.4	-175.8	151.5	0	117.8	S244	K242-S244 PolarHBondContact O-N 2.81Å
243	I	28.5	Very low	33.8	Very low	184 Å²	184	135.4 Å²	135.4	94%	0.944	68%	0.676	S	S	*	*			trans	-66.1	83.7	135.6	-60.1	175.9	0	0	0	107.9
244	S	29.4	Very low	33.4	Very low	81 Å²	81	140.2 Å²	140.2	57%	0.566	69%	0.694	S	S	*	*	S	Bend	trans	-165.3	83.9	168.9	43	0	0	0	0	113.8	K242	K242-S244 PolarHBondContact O-N 2.81Å
245	K	28.6	Very low	33.2	Very low	199 Å²	199	142.1 Å²	142.1	87%	0.865	71%	0.713	S	S	*	*			trans	69.2	103.8	163.7	-53.7	175.2	-177.1	177.1	0	116.3
246	P	31	Very low	32.9	Very low	137 Å²	137	146.4 Å²	146.4	89%	0.89	73%	0.731	S	S	*	*			trans	-73.9	135.1	168.5	31.9	-33.2	0	0	0	110.5
247	K	30.5	Very low	32.7	Very low	188 Å²	188	147.2 Å²	147.2	82%	0.817	75%	0.746	S	S	*	*			trans	-156.9	58.8	172.1	-143.7	174.8	-173.8	-177.8	0	116.3
248	Y	32	Very low	32.7	Very low	244 Å²	244	147.7 Å²	147.7	96%	0.957	76%	0.762	S	S	*	*			trans	-107.3	98.9	152.1	-64.8	-64.7	0	0	0	108.1
249	L	31.6	Very low	32.4	Very low	157 Å²	157	145.4 Å²	145.4	82%	0.822	76%	0.759	S	S	*	*			trans	-113.7	139.5	175.7	-137	90.8	0	0	0	108.7
250	W	28.5	Very low	32.3	Very low	243 Å²	243	150.6 Å²	150.6	92%	0.92	77%	0.767	S	S	*	*			trans	-65.9	152.2	166.9	-147.9	-97.1	0	0	0	109.5	S252	W250-S252 PolarHBondContact O-N 2.7Å
251	P	29.3	Very low	32.1	Very low	105 Å²	105	147.5 Å²	147.5	68%	0.682	76%	0.76	S	S	*	*			trans	-70.7	128.2	-155.3	-25.4	36.9	0	0	0	117.7
252	S	29.8	Very low	32	Very low	109 Å²	109	148.1 Å²	148.1	76%	0.762	77%	0.773	S	S	*	*			trans	40.6	125.7	136.9	-53.6	0	0	0	0	122.1	W250	W250-S252 PolarHBondContact O-N 2.7Å
253	F	29.2	Very low	32.2	Very low	160 Å²	160	146.8 Å²	146.8	70%	0.702	78%	0.78	S	S	*	*				-147.1	159.4	111.4	-138.2	-115.9	0	0	0	113.2
254	E	36.3	Very low	32.4	Very low	148 Å²	148	143.9 Å²	143.9	69%	0.692	77%	0.771	S	S	*	*			trans	-42.4	166.2	-176.3	-67.5	167.6	-172.9	0	0	119
255	S	36.5	Very low	32.7	Very low	109 Å²	109	148.2 Å²	148.2	76%	0.762	79%	0.785	S	S	*	*			cis	-174.4	169.9	-17.6	59	0	0	0	0	108.7
256	D	33	Very low	33	Very low	153 Å²	153	141.7 Å²	141.7	82%	0.818	77%	0.768	S	S	*	*			cis	-126	-99.2	-14.9	176.2	38.8	0	0	0	109.4
257	G	36.6	Very low	33.1	Very low	60 Å²	60	142.6 Å²	142.6	62%	0.619	77%	0.765	S	S	*	*			cis	155.7	143.9	-18.7	0	0	0	0	0	115.4
258	P	40.7	Very low	33.4	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	76%	0.761	S	S	*	*			cis	-129.3	148.1	-23.4	39.6	-24.6	0	0	0	115.4
259	V	32.2	Very low	33.7	Very low	125 Å²	125	134.2 Å²	134.2	76%	0.758	74%	0.741	S	S	*	*			trans	43.2	119.7	136.9	-175.9	0	0	0	0	121.4
260	Y	31.3	Very low	34	Very low	220 Å²	220	134.8 Å²	134.8	86%	0.863	74%	0.739	S	S	*	*				-147.2	149.1	120.6	-149.1	-96.7	0	0	0	112.4
261	T	30.5	Very low	34.3	Very low	100 Å²	100	126.8 Å²	126.8	61%	0.613	73%	0.725	S	S	*	*			trans	-124.7	142.1	-174.3	45.3	0	0	0	0	112.2
262	P	31.8	Very low	34.6	Very low	119 Å²	119	130.6 Å²	130.6	77%	0.773	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-84.5	143.1	174.5	33.6	-33.3	0	0	0	112
263	P	38.7	Very low	34.7	Very low	128 Å²	128	133.6 Å²	133.6	83%	0.831	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-82.9	155.3	173.7	33.4	-34.2	0	0	0	113
264	V	33.9	Very low	35.2	Very low	124 Å²	124	132 Å²	132	75%	0.752	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-102.2	146.1	176.8	172.3	0	0	0	0	110
265	M	35.5	Very low	34.9	Very low	172 Å²	172	129.9 Å²	129.9	85%	0.847	75%	0.746	S	S	*	*			trans	-165.6	139.7	137.8	-81.2	-30.6	-141.6	0	0	107.4
266	A	33.4	Very low	34.9	Very low	62 Å²	62	129.8 Å²	129.8	51%	0.512	75%	0.746	S	S	.	*			cis	79.5	121.8	39.1	0	0	0	0	0	112.4
267	D	34.8	Very low	35	Very low	156 Å²	156	132 Å²	132	83%	0.834	75%	0.751	S	S	*	*			cis	-129.2	-126.7	-7.4	-71.3	-57.3	0	0	0	110.4
268	E	36.8	Very low	35.1	Very low	158 Å²	158	138.4 Å²	138.4	74%	0.738	76%	0.762	S	S	*	*			cis	-161.3	151.1	3.3	-148	-157.1	-147.4	0	0	112.5
269	N	36.7	Very low	35	Very low	97 Å²	97	137.8 Å²	137.8	52%	0.519	77%	0.766	S	S	.	*			trans	60.4	122.9	146.8	-75.9	-13	0	0	0	126.1
270	H	38	Very low	35.3	Very low	170 Å²	170	138.3 Å²	138.3	79%	0.787	76%	0.76	S	S	*	*			trans	64.3	143.3	130.4	-64.4	-44.7	0	0	0	121.7
271	A	34.5	Very low	36	Very low	75 Å²	75	134.3 Å²	134.3	62%	0.62	75%	0.75	S	S	*	*			cis	-159.8	173.3	-9.9	0	0	0	0	0	110.9
272	E	35.7	Very low	36.8	Very low	184 Å²	184	134.5 Å²	134.5	86%	0.86	75%	0.752	S	S	*	*			trans	24.2	142.2	146.2	-65.6	172.5	172	0	0	120.5
273	E	33.7	Very low	37.7	Very low	173 Å²	173	136.6 Å²	136.6	81%	0.808	75%	0.749	S	S	*	*			cis	-161.8	-166.8	22.6	-145.2	-159.9	152.3	0	0	112.2
274	V	38.3	Very low	38.6	Very low	126 Å²	126	135.7 Å²	135.7	76%	0.764	74%	0.738	S	S	*	*			trans	72.2	106.1	168.2	-164.5	0	0	0	0	117.3
275	A	31.4	Very low	40.2	Very low	103 Å²	103	133.8 Å²	133.8	85%	0.851	72%	0.719	S	S	*	*			trans	-77.6	151	171.4	0	0	0	0	0	113.4
276	S	36.5	Very low	41.6	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	71%	0.705	S	S	*	*			trans	-148.6	122.5	161.1	-167.7	0	0	0	0	110	K278	S276-K278 PolarHBondContact O-N 2.95Å
277	E	33.2	Very low	43.5	Very low	198 Å²	198	131.8 Å²	131.8	93%	0.925	70%	0.702	S	S	*	*			trans	-62.9	129.6	-175.4	-61.3	172	106.1	0	0	111.6
278	K	40.3	Very low	45.3	Very low	196 Å²	196	127.1 Å²	127.1	85%	0.852	69%	0.685	S	S	*	*			trans	-121.6	122.6	169.8	-75.2	-177	178.1	173.5	0	110.1	S276	S276-K278 PolarHBondContact O-N 2.95Å
279	A	37.4	Very low	46.9	Very low	100 Å²	100	123.4 Å²	123.4	83%	0.826	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-70.4	127.7	-168.5	0	0	0	0	0	112.8
280	E	39.7	Very low	48.8	Very low	136 Å²	136	123.7 Å²	123.7	64%	0.636	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-66.1	141	177.4	-36.5	147.7	96.7	0	0	111.6	K285	E280-K285 PolarHBondContact O-NZ 2.71Å; E280-K285 WeakPolarHBondContact OE2-CE 3.22Å; E280-K285 IonicContact OE2-NZ 2.7Å; E280-K285 PolarHBondContact OE2-NZ 2.85Å
281	E	44.4	Very low	50.6	Low	136 Å²	136	119.5 Å²	119.5	64%	0.636	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-62.2	149.2	-177.6	-66.7	-165.5	125.4	0	0	114.4	K283	E281-K283 VanDerWaalsContact C-N 3.26Å; E281-K283 PolarHBondContact O-N 3.06Å; E281-K283 VanDerWaalsContact O-N 3.17Å
282	P	49	Very low	52.8	Low	104 Å²	104	120.8 Å²	120.8	68%	0.675	64%	0.64	S	S	*	*	H	α-helix	trans	-68.8	-16.1	-173.4	27.1	-36.1	0	0	0	114.9	L286	P282-L286 PolarHBondContact O-N 3.08Å
283	K	50.8	Low	55	Low	163 Å²	163	120.2 Å²	120.2	71%	0.709	63%	0.631	S	S	*	*	H	α-helix	trans	-75.4	-47.9	-179.1	-69.3	-176.7	179.8	178	0	112.3	E281 K285 L286 I287	E281-K283 VanDerWaalsContact C-N 3.26Å; E281-K283 PolarHBondContact O-N 3.06Å; E281-K283 VanDerWaalsContact O-N 3.17Å; K283-K285 VanDerWaalsContact C-N 3.26Å; K283-K285 PolarHBondContact O-N 3.03Å; K283-L286 PolarHBondContact O-N 3.12Å; K283-I287 PolarHBondContact O-N 3.26Å; K283-I287 VanDerWaalsContact O-N 3.14Å
284	N	56.8	Low	57.2	Low	109 Å²	109	114.1 Å²	114.1	58%	0.583	60%	0.603	S	S	*	*	H	α-helix	trans	-61.5	-40.3	177.2	-65.9	3.4	0	0	0	110.4	L286 I287 A288	N284-L286 VanDerWaalsContact C-N 3.31Å; N284-L286 PolarHBondContact O-N 3.18Å; N284-I287 PolarHBondContact O-N 2.92Å; N284-A288 VanDerWaalsContact O-CB 3.3Å; N284-A288 WeakPolarHBondContact O-CB 2.71Å; N284-A288 PolarHBondContact O-N 3.32Å
285	K	67.1	Low	59.3	Low	83 Å²	83	113.5 Å²	113.5	36%	0.361	59%	0.592	S	S	.	*	H	α-helix	trans	-56.6	-39	171.1	-79.4	169	167.9	139.7	0	113.4	E280 K283 L289	E280-K285 PolarHBondContact O-NZ 2.71Å; E280-K285 WeakPolarHBondContact OE2-CE 3.22Å; E280-K285 IonicContact OE2-NZ 2.7Å; E280-K285 PolarHBondContact OE2-NZ 2.85Å; K283-K285 VanDerWaalsContact C-N 3.26Å; K283-K285 PolarHBondContact O-N 3.03Å; K285-L289 VanDerWaalsContact O-CB 3.25Å; K285-L289 WeakPolarHBondContact O-CB 3.32Å; K285-L289 WeakPolarHBondContact O-CD1 2.94Å; K285-L289 WeakPolarHBondContact O-CG 3.28Å; K285-L289 PolarHBondContact O-N 3.11Å
286	L	65.7	Low	61.9	Low	105 Å²	105	113.3 Å²	113.3	55%	0.55	58%	0.576	S	S	.	*	H	α-helix	trans	-72.1	-40.1	-179.6	-162.8	147.2	0	0	0	112	P282 K283 N284 L289 Q290	P282-L286 PolarHBondContact O-N 3.08Å; K283-L286 PolarHBondContact O-N 3.12Å; N284-L286 VanDerWaalsContact C-N 3.31Å; N284-L286 PolarHBondContact O-N 3.18Å; L286-L289 PolarHBondContact O-N 3.24Å; L286-Q290 HydrophobicContact CD2-CG 4.38Å; L286-Q290 WeakPolarHBondContact O-CG 3.25Å; L286-Q290 PolarHBondContact O-N 3.11Å
287	I	72.2	Confident	64.2	Low	87 Å²	87	111.8 Å²	111.8	45%	0.446	56%	0.559	S	S	.	*	H	α-helix	trans	-67.4	-43	174.4	-62.3	173	0	0	0	110.8	K283 N284 L289 Q290 K291	K283-I287 PolarHBondContact O-N 3.26Å; K283-I287 VanDerWaalsContact O-N 3.14Å; N284-I287 PolarHBondContact O-N 2.92Å; I287-L289 PolarHBondContact O-N 2.9Å; I287-Q290 WeakPolarHBondContact O-CA 3.07Å; I287-Q290 WeakPolarHBondContact O-CB 3.38Å; I287-Q290 PolarHBondContact O-N 2.97Å; I287-K291 PolarHBondContact O-N 3.35Å
288	A	72.6	Confident	66.7	Low	58 Å²	58	105.8 Å²	105.8	48%	0.479	53%	0.533	S	S	.	.	H	α-helix	trans	-60.9	-43.8	174.6	0	0	0	0	0	111.7	N284 Q290 K291 Q292	N284-A288 VanDerWaalsContact O-CB 3.3Å; N284-A288 WeakPolarHBondContact O-CB 2.71Å; N284-A288 PolarHBondContact O-N 3.32Å; A288-Q290 VanDerWaalsContact C-N 3.25Å; A288-Q290 PolarHBondContact O-N 3.3Å; A288-K291 PolarHBondContact O-N 2.9Å; A288-Q292 VanDerWaalsContact O-CB 3.25Å; A288-Q292 WeakPolarHBondContact O-CB 3.3Å; A288-Q292 PolarHBondContact O-N 3.01Å
289	L	71.7	Confident	68.8	Low	81 Å²	81	99.7 Å²	99.7	42%	0.424	52%	0.515	S	S	.	.	H	α-helix	trans	-65.9	-23.7	173.4	-74.8	168	0	0	0	113.2	K285 L286 I287 R293	K285-L289 VanDerWaalsContact O-CB 3.25Å; K285-L289 WeakPolarHBondContact O-CB 3.32Å; K285-L289 WeakPolarHBondContact O-CD1 2.94Å; K285-L289 WeakPolarHBondContact O-CG 3.28Å; K285-L289 PolarHBondContact O-N 3.11Å; L286-L289 PolarHBondContact O-N 3.24Å; I287-L289 PolarHBondContact O-N 2.9Å; L289-R293 WeakPolarHBondContact O-CB 3.41Å; L289-R293 VanDerWaalsContact O-CD 3.23Å; L289-R293 WeakPolarHBondContact O-CD 3.19Å; L289-R293 WeakPolarHBondContact O-CG 3.48Å; L289-R293 PolarHBondContact O-N 2.7Å
290	Q	74.9	Confident	71.1	Confident	102 Å²	102	99.7 Å²	99.7	48%	0.477	50%	0.501	S	S	.	.	H	α-helix	trans	-75.9	-50.2	171.1	-76.7	173.2	-57.9	0	0	111.2	L286 I287 A288 Q292 R293 I294	L286-Q290 HydrophobicContact CD2-CG 4.38Å; L286-Q290 WeakPolarHBondContact O-CG 3.25Å; L286-Q290 PolarHBondContact O-N 3.11Å; I287-Q290 WeakPolarHBondContact O-CA 3.07Å; I287-Q290 WeakPolarHBondContact O-CB 3.38Å; I287-Q290 PolarHBondContact O-N 2.97Å; A288-Q290 VanDerWaalsContact C-N 3.25Å; A288-Q290 PolarHBondContact O-N 3.3Å; Q290-Q292 PolarHBondContact O-N 2.68Å; Q290-R293 PolarHBondContact O-N 2.68Å; Q290-I294 WeakPolarHBondContact O-CG1 3.39Å; Q290-I294 PolarHBondContact O-N 3.41Å
291	K	77.6	Confident	73.3	Confident	82 Å²	82	95.5 Å²	95.5	36%	0.357	48%	0.482	S	S	.	.	H	α-helix	trans	-56.1	-51.3	174.6	-75.2	-159.9	171.4	-163.4	0	111	E241 I287 A288 R293 I294 E295	E241-K291 IonicContact OE1-NZ 2.62Å; E241-K291 PolarHBondContact OE1-NZ 3.32Å; I287-K291 PolarHBondContact O-N 3.35Å; A288-K291 PolarHBondContact O-N 2.9Å; K291-R293 VanDerWaalsContact C-N 3.29Å; K291-R293 PolarHBondContact O-N 3.36Å; K291-I294 PolarHBondContact O-N 2.92Å; K291-E295 WeakPolarHBondContact O-CG 3.3Å; K291-E295 PolarHBondContact O-N 3.46Å
292	Q	79.2	Confident	75.1	Confident	102 Å²	102	92 Å²	92	48%	0.477	47%	0.472	S	S	.	.	H	α-helix	trans	-57.2	-36.9	177.1	-170.2	-175.4	28.1	0	0	113.3	A288 Q290 L296	A288-Q292 VanDerWaalsContact O-CB 3.25Å; A288-Q292 WeakPolarHBondContact O-CB 3.3Å; A288-Q292 PolarHBondContact O-N 3.01Å; Q290-Q292 PolarHBondContact O-N 2.68Å; Q292-L296 HydrophobicContact CG-CD1 4.24Å; Q292-L296 WeakPolarHBondContact O-CB 3.44Å; Q292-L296 WeakPolarHBondContact O-CD1 3.41Å; Q292-L296 WeakPolarHBondContact O-CG 3.41Å; Q292-L296 PolarHBondContact O-N 3.29Å
293	R	81.8	Confident	76.8	Confident	173 Å²	173	90.4 Å²	90.4	65%	0.653	46%	0.464	S	S	*	.	H	α-helix	trans	-71.6	-32.5	176.2	-80.3	171.4	-177.5	179.4	1.8	113.1	L289 Q290 K291 L297	L289-R293 WeakPolarHBondContact O-CB 3.41Å; L289-R293 VanDerWaalsContact O-CD 3.23Å; L289-R293 WeakPolarHBondContact O-CD 3.19Å; L289-R293 WeakPolarHBondContact O-CG 3.48Å; L289-R293 PolarHBondContact O-N 2.7Å; Q290-R293 PolarHBondContact O-N 2.68Å; K291-R293 VanDerWaalsContact C-N 3.29Å; K291-R293 PolarHBondContact O-N 3.36Å; R293-L297 VanDerWaalsContact O-CB 3.29Å; R293-L297 WeakPolarHBondContact O-CB 3.17Å; R293-L297 PolarHBondContact O-N 3.12Å
294	I	81.4	Confident	78.5	Confident	44 Å²	44	84.8 Å²	84.8	23%	0.226	44%	0.441	C	S	.	.	H	α-helix	trans	-75.5	-41.7	176.5	-67.8	167.3	0	0	0	109.5	Y237 Q290 K291 L297 L298	Y237-I294 HydrophobicContact CE2-CD1 4.09Å; Y237-I294 WeakPolarHBondContact OH-CD1 3.41Å; Q290-I294 WeakPolarHBondContact O-CG1 3.39Å; Q290-I294 PolarHBondContact O-N 3.41Å; K291-I294 PolarHBondContact O-N 2.92Å; I294-L297 PolarHBondContact O-N 3.25Å; I294-L298 HydrophobicContact CG2-CD1 3.93Å; I294-L298 HydrophobicContact CG2-CG 4.39Å; I294-L298 WeakPolarHBondContact O-CB 3.38Å; I294-L298 VanDerWaalsContact O-CG 3.26Å; I294-L298 WeakPolarHBondContact O-CG 3.42Å; I294-L298 PolarHBondContact O-N 2.84Å
295	E	81	Confident	79.7	Confident	114 Å²	114	82.1 Å²	82.1	53%	0.533	43%	0.427	S	S	.	.	H	α-helix	trans	-58.7	-46.4	172.2	-70.8	156.6	-161.8	0	0	111.9	K291 L298 S299	K291-E295 WeakPolarHBondContact O-CG 3.3Å; K291-E295 PolarHBondContact O-N 3.46Å; E295-L298 PolarHBondContact O-N 3.1Å; E295-S299 WeakPolarHBondContact O-CB 3.33Å; E295-S299 PolarHBondContact O-N 3.49Å
296	L	86	Confident	80	Confident	99 Å²	99	81.6 Å²	81.6	52%	0.518	45%	0.445	S	S	.	.	H	α-helix	trans	-61.5	-44.7	173.1	-74.9	167.9	0	0	0	111.8	Q292 L298 S299 D300	Q292-L296 HydrophobicContact CG-CD1 4.24Å; Q292-L296 WeakPolarHBondContact O-CB 3.44Å; Q292-L296 WeakPolarHBondContact O-CD1 3.41Å; Q292-L296 WeakPolarHBondContact O-CG 3.41Å; Q292-L296 PolarHBondContact O-N 3.29Å; L296-L298 VanDerWaalsContact C-N 3.34Å; L296-L298 PolarHBondContact O-N 3.43Å; L296-S299 WeakPolarHBondContact O-CB 3.48Å; L296-S299 PolarHBondContact O-N 3.18Å; L296-D300 PolarHBondContact O-N 2.91Å
297	L	86.3	Confident	80.4	Confident	75 Å²	75	78 Å²	78	39%	0.393	43%	0.429	S	S	.	.	H	α-helix	trans	-62.7	-39.4	177.4	179.5	63.3	0	0	0	112.3	R293 I294 D300 M301	R293-L297 VanDerWaalsContact O-CB 3.29Å; R293-L297 WeakPolarHBondContact O-CB 3.17Å; R293-L297 PolarHBondContact O-N 3.12Å; I294-L297 PolarHBondContact O-N 3.25Å; L297-D300 PolarHBondContact O-N 3.32Å; L297-M301 HydrophobicContact CD1-CE 3.84Å; L297-M301 HydrophobicContact CD1-CG 4.36Å; L297-M301 WeakPolarHBondContact O-CB 3.49Å; L297-M301 WeakPolarHBondContact O-CG 3.46Å; L297-M301 PolarHBondContact O-N 3.43Å
298	L	85.1	Confident	80.7	Confident	72 Å²	72	80.3 Å²	80.3	38%	0.377	44%	0.442	S	S	.	.	H	α-helix	trans	-68.2	-36.5	175.9	-70.5	168.1	0	0	0	111.4	I294 E295 L296 M301 S302 F371	I294-L298 HydrophobicContact CG2-CD1 3.93Å; I294-L298 HydrophobicContact CG2-CG 4.39Å; I294-L298 WeakPolarHBondContact O-CB 3.38Å; I294-L298 VanDerWaalsContact O-CG 3.26Å; I294-L298 WeakPolarHBondContact O-CG 3.42Å; I294-L298 PolarHBondContact O-N 2.84Å; E295-L298 PolarHBondContact O-N 3.1Å; L296-L298 VanDerWaalsContact C-N 3.34Å; L296-L298 PolarHBondContact O-N 3.43Å; L298-M301 PolarHBondContact O-N 3.33Å; L298-S302 WeakPolarHBondContact O-CB 3.28Å; L298-S302 PolarHBondContact O-N 3.2Å; L298-S302 PolarHBondContact O-OG 3.03Å; L298-F371 HydrophobicContact CD2-CB 4.45Å; L298-F371 HydrophobicContact CD2-CD1 3.99Å
299	S	83.9	Confident	80.9	Confident	69 Å²	69	81.7 Å²	81.7	48%	0.483	45%	0.445	S	S	.	.	H	α-helix	trans	-67.2	-39.6	172.3	-169.4	0	0	0	0	112.6	E295 L296 S302 S303	E295-S299 WeakPolarHBondContact O-CB 3.33Å; E295-S299 PolarHBondContact O-N 3.49Å; L296-S299 WeakPolarHBondContact O-CB 3.48Å; L296-S299 PolarHBondContact O-N 3.18Å; S299-S302 PolarHBondContact O-OG 2.86Å; S299-S302 VanDerWaalsContact O-OG 3.11Å; S299-S303 PolarHBondContact O-N 3.32Å
300	D	86.2	Confident	81.2	Confident	100 Å²	100	85.2 Å²	85.2	54%	0.535	46%	0.464	S	S	.	.	H	α-helix	trans	-64.4	-45.5	174.2	-72.5	-17.5	0	0	0	109.9	L296 L297 S302 S303 L304	L296-D300 PolarHBondContact O-N 2.91Å; L297-D300 PolarHBondContact O-N 3.32Å; D300-S302 PolarHBondContact O-N 2.97Å; D300-S303 PolarHBondContact O-N 2.81Å; D300-S303 PolarHBondContact O-OG 3.06Å; D300-L304 WeakPolarHBondContact O-CB 3.42Å; D300-L304 PolarHBondContact O-N 3.14Å
301	M	85.5	Confident	81.6	Confident	48 Å²	48	81.7 Å²	81.7	24%	0.236	45%	0.448	C	S	.	.	H	α-helix	trans	-67.4	-31.1	178.7	-69.5	-67.9	166	0	0	113.6	L297 L298 L304 L305 I330 F371	L297-M301 HydrophobicContact CD1-CE 3.84Å; L297-M301 HydrophobicContact CD1-CG 4.36Å; L297-M301 WeakPolarHBondContact O-CB 3.49Å; L297-M301 WeakPolarHBondContact O-CG 3.46Å; L297-M301 PolarHBondContact O-N 3.43Å; L298-M301 PolarHBondContact O-N 3.33Å; M301-L304 PolarHBondContact O-N 3.12Å; M301-L304 HydrophobicContact SD-CD2 4.16Å; M301-L305 PolarHBondContact O-N 3.06Å; M301-I330 HydrophobicContact SD-CD1 4Å; M301-F371 HydrophobicContact CB-CD1 4.48Å; M301-F371 HydrophobicContact CB-CE1 3.98Å
302	S	82.7	Confident	82.2	Confident	61 Å²	61	80 Å²	80	43%	0.427	44%	0.443	S	S	.	.	H	α-helix	trans	-76.7	-35.4	174.9	68.5	0	0	0	0	112.3	L298 S299 D300 L304 G306	L298-S302 WeakPolarHBondContact O-CB 3.28Å; L298-S302 PolarHBondContact O-N 3.2Å; L298-S302 PolarHBondContact O-OG 3.03Å; S299-S302 PolarHBondContact O-OG 2.86Å; S299-S302 VanDerWaalsContact O-OG 3.11Å; D300-S302 PolarHBondContact O-N 2.97Å; S302-L304 VanDerWaalsContact C-N 3.28Å; S302-L304 PolarHBondContact O-N 3.31Å; S302-G306 PolarHBondContact O-N 3.26Å
303	S	84.8	Confident	82.7	Confident	71 Å²	71	75.3 Å²	75.3	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-59.7	-42	166.6	82.4	0	0	0	0	111	S299 D300 G306 S307	S299-S303 PolarHBondContact O-N 3.32Å; D300-S303 PolarHBondContact O-N 2.81Å; D300-S303 PolarHBondContact O-OG 3.06Å; S303-G306 CarbonylContact O-C 3.56Å; S303-G306 PolarHBondContact O-N 3.25Å; S303-S307 WeakPolarHBondContact O-CB 3.4Å; S303-S307 PolarHBondContact O-N 2.66Å; S303-S307 PolarHBondContact O-OG 3.1Å
304	L	84.9	Confident	83.1	Confident	46 Å²	46	68.6 Å²	68.6	24%	0.241	40%	0.397	C	S	.	.	H	α-helix	trans	-67.2	-42.2	-178.3	-173.9	64.5	0	0	0	113.2	D300 M301 S302 G306 S307 H327 I330	D300-L304 WeakPolarHBondContact O-CB 3.42Å; D300-L304 PolarHBondContact O-N 3.14Å; M301-L304 PolarHBondContact O-N 3.12Å; M301-L304 HydrophobicContact SD-CD2 4.16Å; S302-L304 VanDerWaalsContact C-N 3.28Å; S302-L304 PolarHBondContact O-N 3.31Å; L304-G306 VanDerWaalsContact C-N 3.27Å; L304-G306 PolarHBondContact O-N 3.05Å; L304-S307 WeakPolarHBondContact CA-OG 3.44Å; L304-S307 PolarHBondContact O-N 3.13Å; L304-S307 PolarHBondContact O-OG 3.39Å; L304-S307 VanDerWaalsContact O-OG 3.06Å; L304-H327 PolarHBondContact O-CE1 3.49Å; L304-I330 HydrophobicContact CD2-CD1 4.17Å
305	L	83.1	Confident	83.6	Confident	52 Å²	52	66.5 Å²	66.5	27%	0.272	39%	0.386	S	S	.	.	H	α-helix	trans	-68.5	-26.4	177	-174.5	63.2	0	0	0	112.6	M301 L366 R367 Y370 F371	M301-L305 PolarHBondContact O-N 3.06Å; L305-L366 HydrophobicContact CD1-CB 4.34Å; L305-R367 HydrophobicContact CD2-CG 4.14Å; L305-Y370 HydrophobicContact CB-CD1 3.92Å; L305-Y370 HydrophobicContact CB-CE1 3.85Å; L305-Y370 HydrophobicContact CD1-CD1 4.26Å; L305-Y370 HydrophobicContact CD1-CD2 4.26Å; L305-Y370 HydrophobicContact CD1-CE1 3.89Å; L305-Y370 HydrophobicContact CD1-CE2 3.88Å; L305-Y370 HydrophobicContact CD1-CG 4.43Å; L305-Y370 HydrophobicContact CG-CD1 4.47Å; L305-Y370 HydrophobicContact CG-CE1 4.41Å; L305-F371 HydrophobicContact CB-CZ 4.5Å; L305-F371 HydrophobicContact CD2-CE2 3.69Å; L305-F371 HydrophobicContact CD2-CZ 4.02Å
306	G	72.8	Confident	84.1	Confident	73 Å²	73	62.3 Å²	62.3	75%	0.753	37%	0.366	S	S	*	.	H	α-helix	trans	-94.1	-4.2	176.4	0	0	0	0	0	115.4	S302 S303 L304	S302-G306 PolarHBondContact O-N 3.26Å; S303-G306 CarbonylContact O-C 3.56Å; S303-G306 PolarHBondContact O-N 3.25Å; L304-G306 VanDerWaalsContact C-N 3.27Å; L304-G306 PolarHBondContact O-N 3.05Å
307	S	75.3	Confident	84.3	Confident	29 Å²	29	57.7 Å²	57.7	20%	0.203	34%	0.342	C	S	.	.			trans	-102.9	139.5	-174.7	66.6	0	0	0	0	113.1	S303 L304 T309 M311	S303-S307 WeakPolarHBondContact O-CB 3.4Å; S303-S307 PolarHBondContact O-N 2.66Å; S303-S307 PolarHBondContact O-OG 3.1Å; L304-S307 WeakPolarHBondContact CA-OG 3.44Å; L304-S307 PolarHBondContact O-N 3.13Å; L304-S307 PolarHBondContact O-OG 3.39Å; L304-S307 VanDerWaalsContact O-OG 3.06Å; S307-T309 WeakPolarHBondContact CB-OG1 3.23Å; S307-T309 PolarHBondContact O-N 3.23Å; S307-T309 VanDerWaalsContact O-N 3.11Å; S307-T309 PolarHBondContact OG-OG1 3.22Å; S307-M311 VanDerWaalsContact O-SD 3.4Å
308	D	78.1	Confident	84.3	Confident	135 Å²	135	54.3 Å²	54.3	72%	0.722	33%	0.326	S	S	*	.			trans	-74.6	11.1	171	-71.1	-48.3	0	0	0	114.3	M311	D308-M311 VanDerWaalsContact CA-CE 3.5Å; D308-M311 HydrophobicContact CB-CE 3.88Å; D308-M311 WeakPolarHBondContact OD1-CE 3.27Å
309	T	76.4	Confident	84.1	Confident	88 Å²	88	56.7 Å²	56.7	54%	0.54	35%	0.345	S	S	.	.	S	Bend	trans	-91.2	136.4	-173.9	50.4	0	0	0	0	113	S307 M311 H327	S307-T309 WeakPolarHBondContact CB-OG1 3.23Å; S307-T309 PolarHBondContact O-N 3.23Å; S307-T309 VanDerWaalsContact O-N 3.11Å; S307-T309 PolarHBondContact OG-OG1 3.22Å; T309-M311 PolarHBondContact O-N 3.01Å; T309-H327 PolarHBondContact O-NE2 3.23Å
310	D	77.8	Confident	84.2	Confident	154 Å²	154	56.1 Å²	56.1	82%	0.824	35%	0.351	S	S	*	.	S	Bend	trans	55.2	13	176.6	-68.7	-11	0	0	0	117	D312	D310-D312 PolarHBondContact O-N 2.81Å
311	M	84.3	Confident	84.1	Confident	29 Å²	29	56.5 Å²	56.5	14%	0.143	35%	0.348	C	S	.	.			trans	-61.6	124.9	173.3	-53.2	-178.3	-51	0	0	111.8	S307 D308 T309 N325 R349	S307-M311 VanDerWaalsContact O-SD 3.4Å; D308-M311 VanDerWaalsContact CA-CE 3.5Å; D308-M311 HydrophobicContact CB-CE 3.88Å; D308-M311 WeakPolarHBondContact OD1-CE 3.27Å; T309-M311 PolarHBondContact O-N 3.01Å; M311-N325 HydrophobicContact CB-CB 4.5Å; M311-N325 HydrophobicContact CE-CB 3.92Å; M311-N325 WeakPolarHBondContact CE-ND2 3.5Å; M311-N325 HydrophobicContact CG-CB 4.33Å; M311-N325 HydrophobicContact SD-CB 3.23Å; M311-N325 WeakPolarHBondContact SD-CB 3.42Å; M311-N325 PolarHBondContact SD-ND2 3.33Å; M311-R349 PolarHBondContact O-NE 3.43Å; M311-R349 PolarHBondContact O-NH2 3.42Å
312	D	89.2	Confident	84.2	Confident	46 Å²	46	59.5 Å²	59.5	25%	0.246	36%	0.361	C	S	.	.			trans	-121.1	2	180	69.4	-21.2	0	0	0	114	D310 H327 S328 R349 Y350	D310-D312 PolarHBondContact O-N 2.81Å; D312-H327 WeakPolarHBondContact OD1-CA 3.23Å; D312-S328 WeakPolarHBondContact OD1-CB 3.24Å; D312-S328 PolarHBondContact OD1-N 2.9Å; D312-S328 WeakPolarHBondContact OD2-CB 3.28Å; D312-S328 PolarHBondContact OD2-OG 3.4Å; D312-R349 CarbonylContact O-C 3.57Å; D312-R349 VanDerWaalsContact O-CA 3.31Å; D312-R349 WeakPolarHBondContact O-CA 3.46Å; D312-Y350 PolarHBondContact O-N 2.9Å
313	V	91	Very high	84.5	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.018	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.1	172.2	-167.7	0	0	0	0	110.6	M315 N325 A326 L331 Y350 L352	V313-M315 HydrophobicContact CG1-CG 4.03Å; V313-N325 WeakPolarHBondContact O-CA 3.42Å; V313-A326 HydrophobicContact CB-CB 4.17Å; V313-A326 WeakPolarHBondContact CB-O 3.2Å; V313-A326 PolarHBondContact N-O 2.63Å; V313-A326 PolarHBondContact O-N 3.15Å; V313-L331 HydrophobicContact CG1-CD1 4.17Å; V313-L331 HydrophobicContact CG2-CD1 4.21Å; V313-Y350 CarbonylContact C-O 3.54Å; V313-Y350 VanDerWaalsContact CA-O 3.3Å; V313-Y350 WeakPolarHBondContact CA-O 3.38Å; V313-L352 HydrophobicContact CG1-CD1 3.9Å
314	E	90.4	Very high	84.7	Confident	33 Å²	33	61.7 Å²	61.7	15%	0.154	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	125.2	171.7	-170.3	170.4	-179	0	0	108.8	F316 R323 Y350 D351 L352	E314-F316 HydrophobicContact CB-CE2 4.49Å; E314-F316 HydrophobicContact CG-CE1 4.36Å; E314-F316 HydrophobicContact CG-CE2 4.02Å; E314-F316 HydrophobicContact CG-CZ 3.74Å; E314-R323 WeakPolarHBondContact OE1-CD 3.44Å; E314-R323 IonicContact OE1-CZ 3.02Å; E314-R323 IonicContact OE1-NE 3.17Å; E314-R323 IonicContact OE1-NH1 3.82Å; E314-R323 PolarHBondContact OE1-NH1 2.83Å; E314-Y350 PolarHBondContact N-O 3.21Å; E314-D351 WeakPolarHBondContact O-CA 3.24Å; E314-L352 PolarHBondContact O-N 3.4Å
315	M	90.6	Very high	84.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.6	-175.1	-48.1	-173.7	53.2	0	0	110.1	V313 R323 C324 A326 L338 L352 L354 M362 L366	V313-M315 HydrophobicContact CG1-CG 4.03Å; M315-R323 CarbonylContact O-C 3.53Å; M315-R323 WeakPolarHBondContact O-CA 3.25Å; M315-C324 WeakPolarHBondContact CA-O 3.39Å; M315-C324 HydrophobicContact CB-CB 4.45Å; M315-C324 WeakPolarHBondContact CB-O 3.47Å; M315-C324 WeakPolarHBondContact CG-O 3.32Å; M315-C324 PolarHBondContact N-O 3.11Å; M315-C324 PolarHBondContact O-N 3.3Å; M315-A326 HydrophobicContact SD-CB 4.35Å; M315-L338 HydrophobicContact CE-CD1 4.25Å; M315-L338 HydrophobicContact CE-CD2 4.2Å; M315-L352 CarbonylContact C-O 3.55Å; M315-L352 WeakPolarHBondContact CA-O 3.35Å; M315-L352 HydrophobicContact CB-CB 4.24Å; M315-L352 HydrophobicContact CE-CB 4.33Å; M315-L352 HydrophobicContact CE-CD1 3.84Å; M315-L352 HydrophobicContact CG-CB 4.05Å; M315-L352 HydrophobicContact CG-CD1 4.07Å; M315-L352 HydrophobicContact SD-CD1 4.11Å; M315-L354 HydrophobicContact CE-CD1 3.56Å; M315-M362 HydrophobicContact CE-CE 4.02Å; M315-M362 HydrophobicContact CE-CG 3.76Å; M315-M362 HydrophobicContact CE-SD 3.44Å; M315-M362 WeakPolarHBondContact CE-SD 3.26Å; M315-M362 HydrophobicContact SD-CG 4.33Å; M315-M362 HydrophobicContact SD-SD 4.39Å; M315-L366 HydrophobicContact SD-CD1 4.41Å
316	F	91.3	Very high	85.3	Confident	26 Å²	26	59.4 Å²	59.4	11%	0.114	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	104.4	178.1	-57.3	-85.2	0	0	0	108.8	E314 F321 E322 R323 D351 L352 F353 L354	E314-F316 HydrophobicContact CB-CE2 4.49Å; E314-F316 HydrophobicContact CG-CE1 4.36Å; E314-F316 HydrophobicContact CG-CE2 4.02Å; E314-F316 HydrophobicContact CG-CZ 3.74Å; F316-F321 HydrophobicContact CB-CB 4.36Å; F316-F321 HydrophobicContact CB-CD1 4.15Å; F316-E322 WeakPolarHBondContact CA-O 3.46Å; F316-R323 HydrophobicContact CD1-CG 3.99Å; F316-R323 HydrophobicContact CE1-CG 3.88Å; F316-D351 HydrophobicContact CE2-CB 4.46Å; F316-L352 PolarHBondContact N-O 3.17Å; F316-F353 HydrophobicContact CB-CD1 3.83Å; F316-F353 HydrophobicContact CB-CE1 4.11Å; F316-F353 AromaticContact CD2-CD1 3.77Å; F316-F353 HydrophobicContact CD2-CD1 3.77Å; F316-F353 AromaticContact CD2-CE1 3.36Å; F316-F353 HydrophobicContact CD2-CE1 3.36Å; F316-F353 HydrophobicContact CD2-CE2 4.36Å; F316-F353 HydrophobicContact CD2-CG 4.41Å; F316-F353 AromaticContact CD2-CZ 3.7Å; F316-F353 HydrophobicContact CD2-CZ 3.7Å; F316-F353 AromaticContact CE2-CE1 3.9Å; F316-F353 HydrophobicContact CE2-CE1 3.9Å; F316-F353 AromaticContact CE2-CZ 3.85Å; F316-F353 HydrophobicContact CE2-CZ 3.85Å; F316-F353 HydrophobicContact CG-CD1 4Å; F316-F353 AromaticContact CG-CE1 3.77Å; F316-F353 HydrophobicContact CG-CE1 3.77Å; F316-L354 PolarHBondContact O-N 2.97Å
317	C	90.8	Very high	86.1	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.007	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	148.3	-170.5	-73.4	0	0	0	0	112.6	F321 E322 L354 I357 V359	C317-F321 PolarHBondContact O-N 3.1Å; C317-E322 PolarHBondContact N-O 3.32Å; C317-E322 PolarHBondContact O-N 3.29Å; C317-E322 VanDerWaalsContact O-N 3.08Å; C317-L354 WeakPolarHBondContact CA-O 3.33Å; C317-I357 WeakPolarHBondContact CB-O 3.4Å; C317-V359 HydrophobicContact CB-CB 4.44Å; C317-V359 HydrophobicContact CB-CG2 4.03Å
318	G	86.7	Confident	86.8	Confident	5 Å²	5	56.2 Å²	56.2	5%	0.052	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	178	176.4	0	0	0	0	0	114.8	G320 F321 L354 P355 I357	G318-G320 PolarHBondContact O-N 3.18Å; G318-F321 PolarHBondContact O-N 3.01Å; G318-F321 VanDerWaalsContact O-N 3.12Å; G318-L354 PolarHBondContact N-O 3.25Å; G318-L354 VanDerWaalsContact N-O 3.14Å; G318-P355 CarbonylContact C-O 3.28Å; G318-P355 VanDerWaalsContact C-O 3.28Å; G318-P355 VanDerWaalsContact CA-O 3.3Å; G318-P355 WeakPolarHBondContact CA-O 3.29Å; G318-I357 WeakPolarHBondContact CA-O 3.48Å; G318-I357 PolarHBondContact N-O 2.94Å
319	P	81.3	Confident	87.3	Confident	121 Å²	121	54.1 Å²	54.1	79%	0.786	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.4	-179.9	27.6	-35.6	0	0	0	113.7
320	G	84.5	Confident	87.9	Confident	58 Å²	58	50.8 Å²	50.8	60%	0.598	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-8.5	174.5	0	0	0	0	0	114.8	G318 E322	G318-G320 PolarHBondContact O-N 3.18Å; G320-E322 PolarHBondContact O-N 2.91Å
321	F	85.1	Confident	88.5	Confident	108 Å²	108	43.4 Å²	43.4	47%	0.474	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	39.7	-169.1	-61.7	-84.6	0	0	0	112.8	F316 C317 G318 F353 P355	F316-F321 HydrophobicContact CB-CB 4.36Å; F316-F321 HydrophobicContact CB-CD1 4.15Å; C317-F321 PolarHBondContact O-N 3.1Å; G318-F321 PolarHBondContact O-N 3.01Å; G318-F321 VanDerWaalsContact O-N 3.12Å; F321-F353 HydrophobicContact CD1-CD1 4.44Å; F321-P355 HydrophobicContact CE1-CB 4.29Å; F321-P355 HydrophobicContact CZ-CB 4.38Å
322	E	88.1	Confident	88.7	Confident	110 Å²	110	46.8 Å²	46.8	51%	0.514	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	148.4	176.6	-84.4	-179.3	-120.3	0	0	110.8	F316 C317 G320 V359	F316-E322 WeakPolarHBondContact CA-O 3.46Å; C317-E322 PolarHBondContact N-O 3.32Å; C317-E322 PolarHBondContact O-N 3.29Å; C317-E322 VanDerWaalsContact O-N 3.08Å; G320-E322 PolarHBondContact O-N 2.91Å; E322-V359 HydrophobicContact CB-CG2 3.29Å; E322-V359 HydrophobicContact CG-CG2 4.2Å
323	R	88.3	Confident	88.5	Confident	163 Å²	163	45 Å²	45	62%	0.615	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	134.4	-167.1	-60.4	176.3	-168.8	-141.9	9.2	112.1	E314 M315 F316	E314-R323 WeakPolarHBondContact OE1-CD 3.44Å; E314-R323 IonicContact OE1-CZ 3.02Å; E314-R323 IonicContact OE1-NE 3.17Å; E314-R323 IonicContact OE1-NH1 3.82Å; E314-R323 PolarHBondContact OE1-NH1 2.83Å; M315-R323 CarbonylContact O-C 3.53Å; M315-R323 WeakPolarHBondContact O-CA 3.25Å; F316-R323 HydrophobicContact CD1-CG 3.99Å; F316-R323 HydrophobicContact CE1-CG 3.88Å
324	C	88.4	Confident	88.4	Confident	15 Å²	15	45.4 Å²	45.4	10%	0.101	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.2	168.5	-166.8	0	0	0	0	108.6	M315 V359 L366	M315-C324 WeakPolarHBondContact CA-O 3.39Å; M315-C324 HydrophobicContact CB-CB 4.45Å; M315-C324 WeakPolarHBondContact CB-O 3.47Å; M315-C324 WeakPolarHBondContact CG-O 3.32Å; M315-C324 PolarHBondContact N-O 3.11Å; M315-C324 PolarHBondContact O-N 3.3Å; C324-V359 HydrophobicContact CB-CG1 4.21Å; C324-L366 VanDerWaalsContact SG-CD1 3.51Å
325	N	89.4	Confident	88.3	Confident	51 Å²	51	43.9 Å²	43.9	27%	0.273	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	150.4	-173.8	-57.3	-31.8	0	0	0	110.7	M311 V313	M311-N325 HydrophobicContact CB-CB 4.5Å; M311-N325 HydrophobicContact CE-CB 3.92Å; M311-N325 WeakPolarHBondContact CE-ND2 3.5Å; M311-N325 HydrophobicContact CG-CB 4.33Å; M311-N325 HydrophobicContact SD-CB 3.23Å; M311-N325 WeakPolarHBondContact SD-CB 3.42Å; M311-N325 PolarHBondContact SD-ND2 3.33Å; V313-N325 WeakPolarHBondContact O-CA 3.42Å
326	A	90.9	Very high	88.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	173.8	-179.9	0	0	0	0	0	112.9	V313 M315 L331 L366	V313-A326 HydrophobicContact CB-CB 4.17Å; V313-A326 WeakPolarHBondContact CB-O 3.2Å; V313-A326 PolarHBondContact N-O 2.63Å; V313-A326 PolarHBondContact O-N 3.15Å; M315-A326 HydrophobicContact SD-CB 4.35Å; A326-L331 HydrophobicContact CB-CD1 4.31Å; A326-L366 HydrophobicContact CB-CD2 3.99Å
327	H	90.7	Very high	88	Confident	15 Å²	15	46 Å²	46	7%	0.069	25%	0.248	C	C	.	.			trans	-110.8	121.3	-179.6	-61.8	91.7	0	0	0	110.6	L304 T309 D312 L329 I330 L331 Y370	L304-H327 PolarHBondContact O-CE1 3.49Å; T309-H327 PolarHBondContact O-NE2 3.23Å; D312-H327 WeakPolarHBondContact OD1-CA 3.23Å; H327-L329 PolarHBondContact O-N 2.88Å; H327-L329 VanDerWaalsContact O-N 3.16Å; H327-I330 HydrophobicContact CB-CD1 4.41Å; H327-I330 PolarHBondContact O-N 3.38Å; H327-L331 PolarHBondContact O-N 2.9Å; H327-L331 VanDerWaalsContact O-N 3.16Å; H327-Y370 PolarHBondContact N-OH 3.02Å; H327-Y370 AromaticContact ND1-CZ 3.97Å; H327-Y370 PolarHBondContact ND1-OH 3.41Å
328	S	90.2	Very high	88	Confident	20 Å²	20	46 Å²	46	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-27.4	-175.8	78.3	0	0	0	0	112.1	D312 I330 K332	D312-S328 WeakPolarHBondContact OD1-CB 3.24Å; D312-S328 PolarHBondContact OD1-N 2.9Å; D312-S328 WeakPolarHBondContact OD2-CB 3.28Å; D312-S328 PolarHBondContact OD2-OG 3.4Å; S328-I330 VanDerWaalsContact C-N 3.35Å; S328-I330 PolarHBondContact O-N 2.84Å; S328-K332 WeakPolarHBondContact O-CB 3.43Å; S328-K332 PolarHBondContact O-N 3.41Å
329	L	88	Confident	88.1	Confident	90 Å²	90	46.9 Å²	46.9	47%	0.471	25%	0.251	S	S	.	.	H	α-helix	trans	-60.7	-41.4	173.7	-177.7	63.2	0	0	0	112.3	H327 S333	H327-L329 PolarHBondContact O-N 2.88Å; H327-L329 VanDerWaalsContact O-N 3.16Å; L329-S333 WeakPolarHBondContact O-CB 3.37Å; L329-S333 PolarHBondContact O-N 3.41Å; L329-S333 PolarHBondContact O-OG 3.18Å
330	I	88.9	Confident	88.4	Confident	18 Å²	18	49.4 Å²	49.4	9%	0.092	25%	0.25	C	C	.	.	H	α-helix	trans	-76.5	-45.2	-179.6	-64.7	173.2	0	0	0	109.4	M301 L304 H327 S328 K332 S333 R334 Y370	M301-I330 HydrophobicContact SD-CD1 4Å; L304-I330 HydrophobicContact CD2-CD1 4.17Å; H327-I330 HydrophobicContact CB-CD1 4.41Å; H327-I330 PolarHBondContact O-N 3.38Å; S328-I330 VanDerWaalsContact C-N 3.35Å; S328-I330 PolarHBondContact O-N 2.84Å; I330-K332 VanDerWaalsContact C-N 3.33Å; I330-K332 PolarHBondContact O-N 3.49Å; I330-S333 PolarHBondContact O-N 2.87Å; I330-S333 VanDerWaalsContact O-N 3.17Å; I330-S333 PolarHBondContact O-OG 3.28Å; I330-R334 WeakPolarHBondContact O-CB 3.31Å; I330-R334 PolarHBondContact O-N 3.22Å; I330-Y370 HydrophobicContact CB-CE2 4.34Å; I330-Y370 HydrophobicContact CD1-CD1 3.65Å; I330-Y370 HydrophobicContact CD1-CD2 4.31Å; I330-Y370 HydrophobicContact CD1-CE1 3.35Å; I330-Y370 HydrophobicContact CD1-CE2 4.08Å; I330-Y370 HydrophobicContact CD1-CG 4.14Å; I330-Y370 HydrophobicContact CG2-CD2 3.78Å; I330-Y370 HydrophobicContact CG2-CE2 3.86Å; I330-Y370 HydrophobicContact CG2-CG 4.34Å
331	L	90.1	Very high	88.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-43.6	174	-57.6	-169	0	0	0	111.6	V313 A326 H327 S333 C335 L338 L339 L352 L366 L369	V313-L331 HydrophobicContact CG1-CD1 4.17Å; V313-L331 HydrophobicContact CG2-CD1 4.21Å; A326-L331 HydrophobicContact CB-CD1 4.31Å; H327-L331 PolarHBondContact O-N 2.9Å; H327-L331 VanDerWaalsContact O-N 3.16Å; L331-S333 VanDerWaalsContact C-N 3.29Å; L331-S333 PolarHBondContact O-N 3.37Å; L331-C335 CarbonylContact O-C 3.6Å; L331-C335 VanDerWaalsContact O-CA 3.29Å; L331-C335 WeakPolarHBondContact O-CA 3.3Å; L331-C335 PolarHBondContact O-N 3.05Å; L331-L338 HydrophobicContact CD1-CD2 4.22Å; L331-L338 HydrophobicContact CD1-CG 4.45Å; L331-L338 HydrophobicContact CD2-CD2 4.1Å; L331-L339 HydrophobicContact CB-CB 4.19Å; L331-L352 HydrophobicContact CD1-CD1 4.46Å; L331-L366 HydrophobicContact CD2-CD2 3.97Å; L331-L369 HydrophobicContact CD2-CD1 3.86Å
332	K	88.2	Confident	88.6	Confident	99 Å²	99	46.1 Å²	46.1	43%	0.43	23%	0.231	S	C	.	.	H	α-helix	trans	-64.5	-28.8	178.4	-170.9	-175.9	172.5	-159.2	0	113.8	E223 S328 I330 L339	E223-K332 VanDerWaalsContact CD-NZ 3.31Å; E223-K332 IonicContact OE1-NZ 2.9Å; E223-K332 PolarHBondContact OE1-NZ 2.94Å; E223-K332 IonicContact OE2-NZ 3.78Å; E223-K332 PolarHBondContact OE2-NZ 3.16Å; S328-K332 WeakPolarHBondContact O-CB 3.43Å; S328-K332 PolarHBondContact O-N 3.41Å; I330-K332 VanDerWaalsContact C-N 3.33Å; I330-K332 PolarHBondContact O-N 3.49Å; K332-L339 HydrophobicContact CB-CD2 3.66Å; K332-L339 HydrophobicContact CG-CD2 4.27Å
333	S	86.4	Confident	88.5	Confident	10 Å²	10	43.9 Å²	43.9	7%	0.07	23%	0.228	C	C	.	.	H	α-helix	trans	-96.5	-22.6	-177.4	52.7	0	0	0	0	114.3	S227 L329 I330 L331 S395	S227-S333 PolarHBondContact OG-O 2.71Å; L329-S333 WeakPolarHBondContact O-CB 3.37Å; L329-S333 PolarHBondContact O-N 3.41Å; L329-S333 PolarHBondContact O-OG 3.18Å; I330-S333 PolarHBondContact O-N 2.87Å; I330-S333 VanDerWaalsContact O-N 3.17Å; I330-S333 PolarHBondContact O-OG 3.28Å; L331-S333 VanDerWaalsContact C-N 3.29Å; L331-S333 PolarHBondContact O-N 3.37Å; S333-S395 PolarHBondContact O-OG 2.83Å
334	R	87.8	Confident	88.6	Confident	11 Å²	11	41 Å²	41	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-118.3	-29.9	-177.1	-67	-86.2	-81.3	159.3	1.3	114.6	L230 I330 Y368 L369 P394 S395	L230-R334 HydrophobicContact CD1-CG 3.99Å; I330-R334 WeakPolarHBondContact O-CB 3.31Å; I330-R334 PolarHBondContact O-N 3.22Å; R334-Y368 PolarHBondContact NH2-O 3.49Å; R334-L369 HydrophobicContact CB-CD2 4.04Å; R334-L369 PolarHBondContact NE-O 3.03Å; R334-L369 PolarHBondContact NH2-O 3.23Å; R334-P394 CarbonylContact O-C 3.56Å; R334-P394 VanDerWaalsContact O-CA 3.25Å; R334-P394 WeakPolarHBondContact O-CA 3.4Å; R334-P394 WeakPolarHBondContact O-CB 3.49Å; R334-S395 PolarHBondContact O-N 3.47Å; R334-S395 PolarHBondContact O-OG 3.27Å
335	C	89	Confident	88.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.			trans	-141.2	70.5	178.6	-166.9	0	0	0	0	112.5	L331 S337 L338 L369 F392	L331-C335 CarbonylContact O-C 3.6Å; L331-C335 VanDerWaalsContact O-CA 3.29Å; L331-C335 WeakPolarHBondContact O-CA 3.3Å; L331-C335 PolarHBondContact O-N 3.05Å; C335-S337 PolarHBondContact O-N 3.2Å; C335-S337 VanDerWaalsContact O-N 3.07Å; C335-S337 PolarHBondContact SG-OG 2.94Å; C335-L338 HydrophobicContact CB-CB 4.35Å; C335-L338 PolarHBondContact O-N 3.19Å; C335-L338 VanDerWaalsContact SG-CB 3.58Å; C335-L369 HydrophobicContact CB-CD1 3.76Å; C335-L369 HydrophobicContact CB-CD2 3.82Å; C335-L369 HydrophobicContact CB-CG 4.49Å; C335-F392 PolarHBondContact SG-O 2.67Å; C335-F392 VanDerWaalsContact SG-O 3.39Å
336	P	87.6	Confident	88	Confident	48 Å²	48	46.3 Å²	46.3	31%	0.312	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-7	-175.8	-14.3	28.8	0	0	0	114	K340	P336-K340 VanDerWaalsContact O-CD 3.3Å; P336-K340 WeakPolarHBondContact O-CD 3.41Å; P336-K340 VanDerWaalsContact O-CE 3.27Å; P336-K340 WeakPolarHBondContact O-CE 3.46Å; P336-K340 VanDerWaalsContact O-CG 3.27Å; P336-K340 WeakPolarHBondContact O-CG 3.41Å
337	S	88	Confident	87.5	Confident	23 Å²	23	50 Å²	50	16%	0.161	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-56	171	40.1	0	0	0	0	110.3	C335 L339 K340 P393	C335-S337 PolarHBondContact O-N 3.2Å; C335-S337 VanDerWaalsContact O-N 3.07Å; C335-S337 PolarHBondContact SG-OG 2.94Å; S337-L339 VanDerWaalsContact C-N 3.35Å; S337-L339 PolarHBondContact O-N 3.07Å; S337-K340 WeakPolarHBondContact O-CB 3.46Å; S337-K340 PolarHBondContact O-N 2.97Å; S337-P393 PolarHBondContact OG-O 3.47Å
338	L	89.9	Confident	87.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-55.7	-44.7	179.4	-179.5	59.1	0	0	0	112.7	M315 L331 C335 K340 C341 L352 L354 F365 F392	M315-L338 HydrophobicContact CE-CD1 4.25Å; M315-L338 HydrophobicContact CE-CD2 4.2Å; L331-L338 HydrophobicContact CD1-CD2 4.22Å; L331-L338 HydrophobicContact CD1-CG 4.45Å; L331-L338 HydrophobicContact CD2-CD2 4.1Å; C335-L338 HydrophobicContact CB-CB 4.35Å; C335-L338 PolarHBondContact O-N 3.19Å; C335-L338 VanDerWaalsContact SG-CB 3.58Å; L338-K340 PolarHBondContact O-N 3.19Å; L338-C341 WeakPolarHBondContact O-CB 3.37Å; L338-C341 PolarHBondContact O-N 2.8Å; L338-C341 VanDerWaalsContact O-N 3.09Å; L338-L352 HydrophobicContact CD1-CD1 3.98Å; L338-L352 HydrophobicContact CD1-CD2 4.14Å; L338-L352 HydrophobicContact CG-CD1 4.06Å; L338-L354 HydrophobicContact CD1-CD1 4.07Å; L338-F365 HydrophobicContact CD2-CE1 4.39Å; L338-F392 HydrophobicContact CB-CB 4.39Å; L338-F392 HydrophobicContact CB-CD1 3.9Å; L338-F392 HydrophobicContact CB-CG 4.25Å; L338-F392 HydrophobicContact CD1-CD1 3.81Å; L338-F392 HydrophobicContact CD1-CD2 4.26Å; L338-F392 HydrophobicContact CD1-CE1 3.73Å; L338-F392 HydrophobicContact CD1-CE2 4.17Å; L338-F392 HydrophobicContact CD1-CG 4.09Å; L338-F392 HydrophobicContact CD1-CZ 3.91Å; L338-F392 HydrophobicContact CG-CD1 4.47Å
339	L	88.8	Confident	87	Confident	25 Å²	25	55.4 Å²	55.4	13%	0.131	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-67.9	-18.3	179.4	-170.3	62.3	0	0	0	113.9	L331 K332 S337 A342 Y350	L331-L339 HydrophobicContact CB-CB 4.19Å; K332-L339 HydrophobicContact CB-CD2 3.66Å; K332-L339 HydrophobicContact CG-CD2 4.27Å; S337-L339 VanDerWaalsContact C-N 3.35Å; S337-L339 PolarHBondContact O-N 3.07Å; L339-A342 HydrophobicContact CD1-CB 4.19Å; L339-A342 WeakPolarHBondContact O-CB 3.21Å; L339-A342 PolarHBondContact O-N 3.49Å; L339-Y350 HydrophobicContact CD1-CD1 4.04Å; L339-Y350 HydrophobicContact CD1-CD2 4.43Å; L339-Y350 HydrophobicContact CD1-CE1 4.28Å; L339-Y350 HydrophobicContact CD1-CG 4.11Å
340	K	87.2	Confident	87.1	Confident	173 Å²	173	54 Å²	54	75%	0.752	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-76	-24.6	172.5	-70.5	163.6	-172.5	170.3	0	112.8	P336 S337 L338 A342	P336-K340 VanDerWaalsContact O-CD 3.3Å; P336-K340 WeakPolarHBondContact O-CD 3.41Å; P336-K340 VanDerWaalsContact O-CE 3.27Å; P336-K340 WeakPolarHBondContact O-CE 3.46Å; P336-K340 VanDerWaalsContact O-CG 3.27Å; P336-K340 WeakPolarHBondContact O-CG 3.41Å; S337-K340 WeakPolarHBondContact O-CB 3.46Å; S337-K340 PolarHBondContact O-N 2.97Å; L338-K340 PolarHBondContact O-N 3.19Å; K340-A342 VanDerWaalsContact C-N 3.25Å
341	C	85.7	Confident	87.1	Confident	82 Å²	82	54.1 Å²	54.1	55%	0.554	29%	0.293	S	S	*	.	S	Bend	trans	-80.7	-9.7	175.4	-63.2	0	0	0	0	112.3	L338 L352 F392	L338-C341 WeakPolarHBondContact O-CB 3.37Å; L338-C341 PolarHBondContact O-N 2.8Å; L338-C341 VanDerWaalsContact O-N 3.09Å; C341-L352 HydrophobicContact CB-CD2 3.96Å; C341-F392 HydrophobicContact CB-CE1 4.33Å
342	A	88.1	Confident	87.1	Confident	15 Å²	15	54.2 Å²	54.2	12%	0.124	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-77.7	128.1	-180	0	0	0	0	0	112	L339 K340 Y350 L352	L339-A342 HydrophobicContact CD1-CB 4.19Å; L339-A342 WeakPolarHBondContact O-CB 3.21Å; L339-A342 PolarHBondContact O-N 3.49Å; K340-A342 VanDerWaalsContact C-N 3.25Å; A342-Y350 HydrophobicContact CB-CD1 3.85Å; A342-Y350 HydrophobicContact CB-CG 4.37Å; A342-L352 HydrophobicContact CB-CD1 4.09Å; A342-L352 HydrophobicContact CB-CD2 3.83Å; A342-L352 HydrophobicContact CB-CG 3.62Å
343	S	87.7	Confident	87.2	Confident	63 Å²	63	55 Å²	55	44%	0.441	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	125	170.7	65.3	0	0	0	0	109.9	Q345 Y350 D351	S343-Q345 PolarHBondContact O-N 3.21Å; S343-Y350 CarbonylContact O-C 3.56Å; S343-Y350 WeakPolarHBondContact O-CA 3.28Å; S343-D351 PolarHBondContact N-O 3.01Å; S343-D351 PolarHBondContact O-N 2.92Å; S343-D351 PolarHBondContact OG-O 3.27Å
344	K	88.7	Confident	87.4	Confident	102 Å²	102	55.1 Å²	55.1	44%	0.443	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	116	-179.8	-166.9	-166.1	172.1	-168.3	0	110.6	R349 Y350 T816	K344-R349 CarbonylContact C-O 3.49Å; K344-R349 WeakPolarHBondContact CA-O 3.42Å; K344-Y350 HydrophobicContact CB-CD1 4.07Å; K344-Y350 HydrophobicContact CB-CE1 3.87Å; K344-Y350 HydrophobicContact CD-CE1 4.4Å; K344-Y350 HydrophobicContact CG-CD1 4.21Å; K344-Y350 HydrophobicContact CG-CE1 3.87Å; K344-T816 PolarHBondContact NZ-O 2.9Å
345	Q	85.8	Confident	87.3	Confident	60 Å²	60	57.3 Å²	57.3	28%	0.28	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-61.9	154.2	171.4	-72.1	-167.5	-3.2	0	0	112.1	S343 S347 G348 R349 D351	S343-Q345 PolarHBondContact O-N 3.21Å; Q345-S347 WeakPolarHBondContact CB-OG 3.38Å; Q345-S347 PolarHBondContact O-N 3.11Å; Q345-S347 PolarHBondContact OE1-OG 2.99Å; Q345-G348 PolarHBondContact O-N 3.35Å; Q345-G348 VanDerWaalsContact O-N 3.07Å; Q345-R349 HydrophobicContact CB-CB 4.48Å; Q345-R349 PolarHBondContact N-O 3.27Å; Q345-D351 VanDerWaalsContact CD-OD1 3.3Å; Q345-D351 WeakPolarHBondContact CG-OD1 3.45Å; Q345-D351 VanDerWaalsContact CG-OD2 3.28Å; Q345-D351 WeakPolarHBondContact CG-OD2 3.37Å; Q345-D351 PolarHBondContact NE2-OD1 2.79Å; Q345-D351 PolarHBondContact NE2-OD2 3.23Å
346	P	81.1	Confident	87.1	Confident	118 Å²	118	63.1 Å²	63.1	77%	0.766	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.2	169	27.3	-35.4	0	0	0	113.1	G348	P346-G348 PolarHBondContact O-N 3.02Å
347	S	80.5	Confident	87.1	Confident	77 Å²	77	61.3 Å²	61.3	54%	0.538	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-18	173.3	66.9	0	0	0	0	113.9	Q345 R349	Q345-S347 WeakPolarHBondContact CB-OG 3.38Å; Q345-S347 PolarHBondContact O-N 3.11Å; Q345-S347 PolarHBondContact OE1-OG 2.99Å; S347-R349 WeakPolarHBondContact OG-CB 3.23Å; S347-R349 PolarHBondContact OG-N 3.18Å
348	G	81.5	Confident	87.2	Confident	31 Å²	31	64 Å²	64	32%	0.32	34%	0.343	S	S	.	.	S	Bend	trans	101.1	-20	-170	0	0	0	0	0	114.3	Q345 P346	Q345-G348 PolarHBondContact O-N 3.35Å; Q345-G348 VanDerWaalsContact O-N 3.07Å; P346-G348 PolarHBondContact O-N 3.02Å
349	R	87.2	Confident	87.2	Confident	119 Å²	119	64.3 Å²	64.3	45%	0.449	35%	0.345	S	S	.	.			trans	-72.1	170.6	177.2	-67.8	-173	160.9	176.9	-7	113	M311 D312 K344 Q345 S347	M311-R349 PolarHBondContact O-NE 3.43Å; M311-R349 PolarHBondContact O-NH2 3.42Å; D312-R349 CarbonylContact O-C 3.57Å; D312-R349 VanDerWaalsContact O-CA 3.31Å; D312-R349 WeakPolarHBondContact O-CA 3.46Å; K344-R349 CarbonylContact C-O 3.49Å; K344-R349 WeakPolarHBondContact CA-O 3.42Å; Q345-R349 HydrophobicContact CB-CB 4.48Å; Q345-R349 PolarHBondContact N-O 3.27Å; S347-R349 WeakPolarHBondContact OG-CB 3.23Å; S347-R349 PolarHBondContact OG-N 3.18Å
350	Y	90.4	Very high	87.3	Confident	59 Å²	59	67.5 Å²	67.5	23%	0.231	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.5	-177.4	-72.5	-84.9	0	0	0	111.2	D312 V313 E314 L339 A342 S343 K344	D312-Y350 PolarHBondContact O-N 2.9Å; V313-Y350 CarbonylContact C-O 3.54Å; V313-Y350 VanDerWaalsContact CA-O 3.3Å; V313-Y350 WeakPolarHBondContact CA-O 3.38Å; E314-Y350 PolarHBondContact N-O 3.21Å; L339-Y350 HydrophobicContact CD1-CD1 4.04Å; L339-Y350 HydrophobicContact CD1-CD2 4.43Å; L339-Y350 HydrophobicContact CD1-CE1 4.28Å; L339-Y350 HydrophobicContact CD1-CG 4.11Å; A342-Y350 HydrophobicContact CB-CD1 3.85Å; A342-Y350 HydrophobicContact CB-CG 4.37Å; S343-Y350 CarbonylContact O-C 3.56Å; S343-Y350 WeakPolarHBondContact O-CA 3.28Å; K344-Y350 HydrophobicContact CB-CD1 4.07Å; K344-Y350 HydrophobicContact CB-CE1 3.87Å; K344-Y350 HydrophobicContact CD-CE1 4.4Å; K344-Y350 HydrophobicContact CG-CD1 4.21Å; K344-Y350 HydrophobicContact CG-CE1 3.87Å
351	D	90.4	Very high	87.4	Confident	22 Å²	22	59.3 Å²	59.3	12%	0.118	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.8	178.3	-56	-6.2	0	0	0	109.4	E314 F316 S343 Q345 F353	E314-D351 WeakPolarHBondContact O-CA 3.24Å; F316-D351 HydrophobicContact CE2-CB 4.46Å; S343-D351 PolarHBondContact N-O 3.01Å; S343-D351 PolarHBondContact O-N 2.92Å; S343-D351 PolarHBondContact OG-O 3.27Å; Q345-D351 VanDerWaalsContact CD-OD1 3.3Å; Q345-D351 WeakPolarHBondContact CG-OD1 3.45Å; Q345-D351 VanDerWaalsContact CG-OD2 3.28Å; Q345-D351 WeakPolarHBondContact CG-OD2 3.37Å; Q345-D351 PolarHBondContact NE2-OD1 2.79Å; Q345-D351 PolarHBondContact NE2-OD2 3.23Å; D351-F353 HydrophobicContact CB-CE2 3.87Å; D351-F353 HydrophobicContact CB-CZ 4.43Å
352	L	89.9	Confident	87.7	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.3	176.6	-85.7	162.1	0	0	0	110.3	V313 E314 M315 F316 L331 L338 C341 A342	V313-L352 HydrophobicContact CG1-CD1 3.9Å; E314-L352 PolarHBondContact O-N 3.4Å; M315-L352 CarbonylContact C-O 3.55Å; M315-L352 WeakPolarHBondContact CA-O 3.35Å; M315-L352 HydrophobicContact CB-CB 4.24Å; M315-L352 HydrophobicContact CE-CB 4.33Å; M315-L352 HydrophobicContact CE-CD1 3.84Å; M315-L352 HydrophobicContact CG-CB 4.05Å; M315-L352 HydrophobicContact CG-CD1 4.07Å; M315-L352 HydrophobicContact SD-CD1 4.11Å; F316-L352 PolarHBondContact N-O 3.17Å; L331-L352 HydrophobicContact CD1-CD1 4.46Å; L338-L352 HydrophobicContact CD1-CD1 3.98Å; L338-L352 HydrophobicContact CD1-CD2 4.14Å; L338-L352 HydrophobicContact CG-CD1 4.06Å; C341-L352 HydrophobicContact CB-CD2 3.96Å; A342-L352 HydrophobicContact CB-CD1 4.09Å; A342-L352 HydrophobicContact CB-CD2 3.83Å; A342-L352 HydrophobicContact CB-CG 3.62Å
353	F	90.4	Very high	87.7	Confident	115 Å²	115	59.8 Å²	59.8	50%	0.504	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	113.7	175.4	-64.9	-86.1	0	0	0	109.7	F316 F321 D351	F316-F353 HydrophobicContact CB-CD1 3.83Å; F316-F353 HydrophobicContact CB-CE1 4.11Å; F316-F353 AromaticContact CD2-CD1 3.77Å; F316-F353 HydrophobicContact CD2-CD1 3.77Å; F316-F353 AromaticContact CD2-CE1 3.36Å; F316-F353 HydrophobicContact CD2-CE1 3.36Å; F316-F353 HydrophobicContact CD2-CE2 4.36Å; F316-F353 HydrophobicContact CD2-CG 4.41Å; F316-F353 AromaticContact CD2-CZ 3.7Å; F316-F353 HydrophobicContact CD2-CZ 3.7Å; F316-F353 AromaticContact CE2-CE1 3.9Å; F316-F353 HydrophobicContact CE2-CE1 3.9Å; F316-F353 AromaticContact CE2-CZ 3.85Å; F316-F353 HydrophobicContact CE2-CZ 3.85Å; F316-F353 HydrophobicContact CG-CD1 4Å; F316-F353 AromaticContact CG-CE1 3.77Å; F316-F353 HydrophobicContact CG-CE1 3.77Å; F321-F353 HydrophobicContact CD1-CD1 4.44Å; D351-F353 HydrophobicContact CB-CE2 3.87Å; D351-F353 HydrophobicContact CB-CZ 4.43Å
354	L	89.2	Confident	87.8	Confident	13 Å²	13	58.2 Å²	58.2	7%	0.068	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	65.7	-172.6	-62.9	174.9	0	0	0	110.5	M315 F316 C317 G318 L338 E356 I357 M362 F392	M315-L354 HydrophobicContact CE-CD1 3.56Å; F316-L354 PolarHBondContact O-N 2.97Å; C317-L354 WeakPolarHBondContact CA-O 3.33Å; G318-L354 PolarHBondContact N-O 3.25Å; G318-L354 VanDerWaalsContact N-O 3.14Å; L338-L354 HydrophobicContact CD1-CD1 4.07Å; L354-E356 PolarHBondContact O-N 2.9Å; L354-I357 PolarHBondContact O-N 3.32Å; L354-M362 HydrophobicContact CD1-CE 3.66Å; L354-F392 HydrophobicContact CD2-CE2 4.14Å; L354-F392 HydrophobicContact CD2-CZ 3.69Å
355	P	86.4	Confident	87.8	Confident	57 Å²	57	53.4 Å²	53.4	37%	0.37	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.8	-174.2	28.5	-36.2	0	0	0	113.6	G318 F321	G318-P355 CarbonylContact C-O 3.28Å; G318-P355 VanDerWaalsContact C-O 3.28Å; G318-P355 VanDerWaalsContact CA-O 3.3Å; G318-P355 WeakPolarHBondContact CA-O 3.29Å; F321-P355 HydrophobicContact CE1-CB 4.29Å; F321-P355 HydrophobicContact CZ-CB 4.38Å
356	E	84.9	Confident	88.1	Confident	122 Å²	122	50.5 Å²	50.5	57%	0.57	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-21.2	-178.5	-68.6	153.8	-119.7	0	0	113.2	L354 R391	L354-E356 PolarHBondContact O-N 2.9Å; E356-R391 VanDerWaalsContact CD-NH2 3.32Å; E356-R391 IonicContact OE1-NH2 2.72Å; E356-R391 PolarHBondContact OE1-NH2 2.8Å; E356-R391 IonicContact OE2-CZ 2.98Å; E356-R391 IonicContact OE2-NH1 3.36Å; E356-R391 PolarHBondContact OE2-NH1 2.93Å; E356-R391 IonicContact OE2-NH2 3.5Å; E356-R391 PolarHBondContact OE2-NH2 2.83Å
357	I	87.7	Confident	88.4	Confident	10 Å²	10	49.2 Å²	49.2	5%	0.051	25%	0.245	C	C	.	.	S	Bend	trans	-112.5	129.4	-174.5	-58.8	167.9	0	0	0	109.9	C317 G318 L354 C361 M362 V388 F392	C317-I357 WeakPolarHBondContact CB-O 3.4Å; G318-I357 WeakPolarHBondContact CA-O 3.48Å; G318-I357 PolarHBondContact N-O 2.94Å; L354-I357 PolarHBondContact O-N 3.32Å; I357-C361 HydrophobicContact CG2-CB 4.03Å; I357-M362 HydrophobicContact CB-CE 4.46Å; I357-M362 HydrophobicContact CD1-CE 4.27Å; I357-M362 HydrophobicContact CG2-CE 3.92Å; I357-V388 HydrophobicContact CD1-CG2 4.3Å; I357-V388 HydrophobicContact CG2-CG2 4.49Å; I357-F392 HydrophobicContact CD1-CD2 4.33Å; I357-F392 HydrophobicContact CD1-CE2 3.73Å
358	T	90.4	Very high	88.8	Confident	79 Å²	79	46.7 Å²	46.7	49%	0.485	22%	0.224	S	C	.	.			trans	-69.2	154	179.6	62.5	0	0	0	0	112.5	D360 C361 M362	T358-D360 VanDerWaalsContact C-N 3.31Å; T358-D360 PolarHBondContact O-N 2.76Å; T358-C361 PolarHBondContact O-N 3.09Å; T358-C361 VanDerWaalsContact OG1-CB 3.29Å; T358-C361 WeakPolarHBondContact OG1-CB 3.29Å; T358-M362 PolarHBondContact O-N 2.96Å
359	V	90.4	Very high	89.1	Confident	6 Å²	6	45.2 Å²	45.2	4%	0.036	21%	0.209	C	C	.	.	H	α-helix	trans	-61	-41.3	-178.5	-164	0	0	0	0	111.6	C317 E322 C324 M362 R363	C317-V359 HydrophobicContact CB-CB 4.44Å; C317-V359 HydrophobicContact CB-CG2 4.03Å; E322-V359 HydrophobicContact CB-CG2 3.29Å; E322-V359 HydrophobicContact CG-CG2 4.2Å; C324-V359 HydrophobicContact CB-CG1 4.21Å; V359-M362 CarbonylContact O-C 3.54Å; V359-M362 WeakPolarHBondContact O-CB 3.29Å; V359-M362 PolarHBondContact O-N 3.2Å; V359-M362 VanDerWaalsContact O-N 3.16Å; V359-R363 HydrophobicContact CG1-CG 4.4Å; V359-R363 VanDerWaalsContact CG1-CZ 3.47Å; V359-R363 WeakPolarHBondContact O-CG 3.44Å; V359-R363 PolarHBondContact O-N 3.33Å
360	D	89.5	Confident	89.2	Confident	92 Å²	92	39.8 Å²	39.8	49%	0.492	19%	0.189	S	C	.	.	H	α-helix	trans	-69.7	-39.3	-177.7	-57.9	-52	0	0	0	111.5	T358 M362 R363 I364	T358-D360 VanDerWaalsContact C-N 3.31Å; T358-D360 PolarHBondContact O-N 2.76Å; D360-M362 VanDerWaalsContact C-N 3.28Å; D360-M362 PolarHBondContact O-N 3.06Å; D360-R363 PolarHBondContact O-N 2.91Å; D360-R363 IonicContact OD1-CZ 2.61Å; D360-R363 IonicContact OD1-NH1 2.72Å; D360-R363 PolarHBondContact OD1-NH1 3.38Å; D360-I364 WeakPolarHBondContact O-CB 3.36Å; D360-I364 VanDerWaalsContact O-CD1 3.3Å; D360-I364 WeakPolarHBondContact O-CD1 3.45Å; D360-I364 WeakPolarHBondContact O-CG1 3.22Å; D360-I364 PolarHBondContact O-N 3.43Å
361	C	90.3	Very high	89	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.014	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-43.4	168.8	-178	0	0	0	0	111.5	I357 T358 I364 F365 L380	I357-C361 HydrophobicContact CG2-CB 4.03Å; T358-C361 PolarHBondContact O-N 3.09Å; T358-C361 VanDerWaalsContact OG1-CB 3.29Å; T358-C361 WeakPolarHBondContact OG1-CB 3.29Å; C361-I364 PolarHBondContact O-N 2.86Å; C361-F365 WeakPolarHBondContact O-CB 3.36Å; C361-F365 PolarHBondContact O-N 2.76Å; C361-L380 HydrophobicContact CB-CD1 4.38Å; C361-L380 HydrophobicContact CB-CD2 3.95Å
362	M	90.4	Very high	88.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.7	-39.3	176.3	-167.8	56.7	55.6	0	0	113.2	M315 L354 I357 T358 V359 D360 F365 L366	M315-M362 HydrophobicContact CE-CE 4.02Å; M315-M362 HydrophobicContact CE-CG 3.76Å; M315-M362 HydrophobicContact CE-SD 3.44Å; M315-M362 WeakPolarHBondContact CE-SD 3.26Å; M315-M362 HydrophobicContact SD-CG 4.33Å; M315-M362 HydrophobicContact SD-SD 4.39Å; L354-M362 HydrophobicContact CD1-CE 3.66Å; I357-M362 HydrophobicContact CB-CE 4.46Å; I357-M362 HydrophobicContact CD1-CE 4.27Å; I357-M362 HydrophobicContact CG2-CE 3.92Å; T358-M362 PolarHBondContact O-N 2.96Å; V359-M362 CarbonylContact O-C 3.54Å; V359-M362 WeakPolarHBondContact O-CB 3.29Å; V359-M362 PolarHBondContact O-N 3.2Å; V359-M362 VanDerWaalsContact O-N 3.16Å; D360-M362 VanDerWaalsContact C-N 3.28Å; D360-M362 PolarHBondContact O-N 3.06Å; M362-F365 PolarHBondContact O-N 3.42Å; M362-F365 HydrophobicContact SD-CD1 4.17Å; M362-L366 HydrophobicContact CG-CD1 4.14Å; M362-L366 WeakPolarHBondContact O-CB 3.42Å; M362-L366 VanDerWaalsContact O-CG 3.27Å; M362-L366 WeakPolarHBondContact O-CG 3.35Å; M362-L366 PolarHBondContact O-N 3.28Å
363	R	89.2	Confident	87.8	Confident	107 Å²	107	41 Å²	41	40%	0.404	20%	0.199	S	C	.	.	H	α-helix	trans	-61	-45	174.9	-74.7	169.6	177.8	139.4	3.7	111	V359 D360 L366 R367	V359-R363 HydrophobicContact CG1-CG 4.4Å; V359-R363 VanDerWaalsContact CG1-CZ 3.47Å; V359-R363 WeakPolarHBondContact O-CG 3.44Å; V359-R363 PolarHBondContact O-N 3.33Å; D360-R363 PolarHBondContact O-N 2.91Å; D360-R363 IonicContact OD1-CZ 2.61Å; D360-R363 IonicContact OD1-NH1 2.72Å; D360-R363 PolarHBondContact OD1-NH1 3.38Å; R363-L366 PolarHBondContact O-N 3.44Å; R363-R367 PolarHBondContact O-N 3Å
364	I	89.1	Confident	87.2	Confident	30 Å²	30	39.9 Å²	39.9	15%	0.154	20%	0.199	C	C	.	.	H	α-helix	trans	-66.8	-42.8	178.1	-61.8	159.2	0	0	0	110.2	D360 C361 L366 R367 Y368 F376 S379 L380	D360-I364 WeakPolarHBondContact O-CB 3.36Å; D360-I364 VanDerWaalsContact O-CD1 3.3Å; D360-I364 WeakPolarHBondContact O-CD1 3.45Å; D360-I364 WeakPolarHBondContact O-CG1 3.22Å; D360-I364 PolarHBondContact O-N 3.43Å; C361-I364 PolarHBondContact O-N 2.86Å; I364-L366 VanDerWaalsContact C-N 3.34Å; I364-L366 PolarHBondContact O-N 2.55Å; I364-R367 WeakPolarHBondContact O-CB 2.97Å; I364-R367 PolarHBondContact O-N 2.76Å; I364-Y368 PolarHBondContact O-N 2.81Å; I364-F376 VanDerWaalsContact CG2-CA 3.47Å; I364-F376 HydrophobicContact CG2-CB 3.93Å; I364-F376 HydrophobicContact CG2-CD2 4.03Å; I364-F376 HydrophobicContact CG2-CG 4.49Å; I364-S379 WeakPolarHBondContact CG2-OG 3.34Å; I364-L380 HydrophobicContact CB-CD1 4.38Å; I364-L380 HydrophobicContact CD1-CD1 4.48Å; I364-L380 HydrophobicContact CD1-CD2 4.24Å; I364-L380 HydrophobicContact CD1-CG 4.2Å; I364-L380 HydrophobicContact CG2-CD1 4.21Å
365	F	90.2	Very high	86.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-38.4	174	-173.9	-122.3	0	0	0	112.4	L338 C361 M362 Y368 L369 F376 V388 L389 F392	L338-F365 HydrophobicContact CD2-CE1 4.39Å; C361-F365 WeakPolarHBondContact O-CB 3.36Å; C361-F365 PolarHBondContact O-N 2.76Å; M362-F365 PolarHBondContact O-N 3.42Å; M362-F365 HydrophobicContact SD-CD1 4.17Å; F365-Y368 HydrophobicContact CE2-CD1 4.46Å; F365-Y368 WeakPolarHBondContact O-CB 3.49Å; F365-Y368 PolarHBondContact O-N 3.5Å; F365-L369 HydrophobicContact CD1-CD1 4.13Å; F365-L369 HydrophobicContact CE1-CD1 3.84Å; F365-L369 HydrophobicContact CE1-CG 4.35Å; F365-L369 HydrophobicContact CZ-CD1 4.26Å; F365-L369 HydrophobicContact CZ-CD2 4.28Å; F365-L369 HydrophobicContact CZ-CG 4.38Å; F365-L369 WeakPolarHBondContact O-CG 3.44Å; F365-L369 PolarHBondContact O-N 3.35Å; F365-F376 HydrophobicContact CB-CD2 4.05Å; F365-F376 HydrophobicContact CB-CE2 3.83Å; F365-F376 HydrophobicContact CD2-CD2 4.1Å; F365-F376 HydrophobicContact CD2-CE1 4.04Å; F365-F376 AromaticContact CD2-CE2 3.62Å; F365-F376 HydrophobicContact CD2-CE2 3.62Å; F365-F376 AromaticContact CD2-CZ 3.59Å; F365-F376 HydrophobicContact CD2-CZ 3.59Å; F365-F376 HydrophobicContact CE2-CE1 4.42Å; F365-F376 HydrophobicContact CE2-CZ 4.17Å; F365-F376 HydrophobicContact CG-CE2 4.13Å; F365-F376 HydrophobicContact CG-CZ 4.47Å; F365-V388 HydrophobicContact CD1-CG1 4.11Å; F365-V388 HydrophobicContact CD2-CG1 3.86Å; F365-V388 HydrophobicContact CE1-CG1 4.19Å; F365-V388 HydrophobicContact CE2-CG1 3.96Å; F365-V388 HydrophobicContact CG-CG1 3.94Å; F365-V388 HydrophobicContact CZ-CG1 4.12Å; F365-L389 HydrophobicContact CE2-CD2 4.31Å; F365-F392 HydrophobicContact CE1-CB 4.28Å; F365-F392 HydrophobicContact CZ-CB 4.31Å
366	L	90.2	Very high	86.4	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.2	-39.7	173	-74.2	166.5	0	0	0	112	L305 M315 C324 A326 L331 M362 R363 I364 Y368 L369 Y370	L305-L366 HydrophobicContact CD1-CB 4.34Å; M315-L366 HydrophobicContact SD-CD1 4.41Å; C324-L366 VanDerWaalsContact SG-CD1 3.51Å; A326-L366 HydrophobicContact CB-CD2 3.99Å; L331-L366 HydrophobicContact CD2-CD2 3.97Å; M362-L366 HydrophobicContact CG-CD1 4.14Å; M362-L366 WeakPolarHBondContact O-CB 3.42Å; M362-L366 VanDerWaalsContact O-CG 3.27Å; M362-L366 WeakPolarHBondContact O-CG 3.35Å; M362-L366 PolarHBondContact O-N 3.28Å; R363-L366 PolarHBondContact O-N 3.44Å; I364-L366 VanDerWaalsContact C-N 3.34Å; I364-L366 PolarHBondContact O-N 2.55Å; L366-Y368 VanDerWaalsContact C-N 3.33Å; L366-Y368 PolarHBondContact O-N 3.38Å; L366-L369 HydrophobicContact CD2-CD1 4.49Å; L366-L369 PolarHBondContact O-N 2.62Å; L366-L369 VanDerWaalsContact O-N 3.15Å; L366-Y370 HydrophobicContact CD2-CE2 4.18Å; L366-Y370 WeakPolarHBondContact O-CD2 3.35Å; L366-Y370 PolarHBondContact O-N 3Å
367	R	88.3	Confident	86.3	Confident	90 Å²	90	38.5 Å²	38.5	34%	0.34	19%	0.186	S	C	.	.	H	α-helix	trans	-56	-47	170.2	-74.1	-178.1	62.5	155.2	-1.9	111.4	L305 R363 I364 L369 Y370 F371 D373 E375	L305-R367 HydrophobicContact CD2-CG 4.14Å; R363-R367 PolarHBondContact O-N 3Å; I364-R367 WeakPolarHBondContact O-CB 2.97Å; I364-R367 PolarHBondContact O-N 2.76Å; R367-L369 PolarHBondContact O-N 2.89Å; R367-Y370 PolarHBondContact O-N 2.91Å; R367-F371 HydrophobicContact CB-CD2 4.02Å; R367-F371 HydrophobicContact CB-CE2 4.31Å; R367-F371 HydrophobicContact CG-CD2 4.29Å; R367-F371 HydrophobicContact CG-CE2 4.11Å; R367-F371 VanDerWaalsContact O-CD2 3.27Å; R367-F371 WeakPolarHBondContact O-CD2 3.44Å; R367-F371 PolarHBondContact O-N 3.26Å; R367-D373 IonicContact CZ-OD2 2.93Å; R367-D373 IonicContact NE-OD2 3.16Å; R367-D373 PolarHBondContact NE-OD2 2.84Å; R367-D373 IonicContact NH2-OD2 3.1Å; R367-D373 PolarHBondContact NH2-OD2 3.12Å; R367-E375 IonicContact CZ-OE1 3.17Å; R367-E375 IonicContact CZ-OE2 2.81Å; R367-E375 IonicContact NE-OE2 2.69Å; R367-E375 PolarHBondContact NE-OE2 2.8Å; R367-E375 IonicContact NH1-OE1 3Å; R367-E375 PolarHBondContact NH1-OE1 2.89Å; R367-E375 IonicContact NH1-OE2 3.95Å; R367-E375 PolarHBondContact NH1-OE2 2.86Å; R367-E375 IonicContact NH2-OE1 2.68Å; R367-E375 PolarHBondContact NH2-OE1 2.89Å; R367-E375 IonicContact NH2-OE2 2.7Å; R367-E375 PolarHBondContact NH2-OE2 3Å; R367-E375 VanDerWaalsContact NH2-OE2 3.1Å
368	Y	88.8	Confident	86	Confident	24 Å²	24	44.5 Å²	44.5	9%	0.094	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-42.6	174.5	175.6	-100.8	0	0	0	112.5	R334 I364 F365 L366 Y370 A372 D373 F376 F377 P394	R334-Y368 PolarHBondContact NH2-O 3.49Å; I364-Y368 PolarHBondContact O-N 2.81Å; F365-Y368 HydrophobicContact CE2-CD1 4.46Å; F365-Y368 WeakPolarHBondContact O-CB 3.49Å; F365-Y368 PolarHBondContact O-N 3.5Å; L366-Y368 VanDerWaalsContact C-N 3.33Å; L366-Y368 PolarHBondContact O-N 3.38Å; Y368-Y370 PolarHBondContact O-N 2.83Å; Y368-A372 WeakPolarHBondContact O-CA 3.04Å; Y368-A372 PolarHBondContact O-N 2.86Å; Y368-D373 WeakPolarHBondContact CD2-O 3.29Å; Y368-F376 HydrophobicContact CG-CB 4.28Å; Y368-F376 HydrophobicContact CG-CD1 4.39Å; Y368-F377 HydrophobicContact CD2-CE2 4.21Å; Y368-F377 AromaticContact CE2-CE2 3.75Å; Y368-F377 HydrophobicContact CE2-CE2 3.75Å; Y368-F377 HydrophobicContact CE2-CZ 4.34Å; Y368-P394 HydrophobicContact CE1-CG 4.28Å
369	L	89.1	Confident	85.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65	-36.7	177.4	-67.2	-179.8	0	0	0	113.3	L331 R334 C335 F365 L366 R367 P394	L331-L369 HydrophobicContact CD2-CD1 3.86Å; R334-L369 HydrophobicContact CB-CD2 4.04Å; R334-L369 PolarHBondContact NE-O 3.03Å; R334-L369 PolarHBondContact NH2-O 3.23Å; C335-L369 HydrophobicContact CB-CD1 3.76Å; C335-L369 HydrophobicContact CB-CD2 3.82Å; C335-L369 HydrophobicContact CB-CG 4.49Å; F365-L369 HydrophobicContact CD1-CD1 4.13Å; F365-L369 HydrophobicContact CE1-CD1 3.84Å; F365-L369 HydrophobicContact CE1-CG 4.35Å; F365-L369 HydrophobicContact CZ-CD1 4.26Å; F365-L369 HydrophobicContact CZ-CD2 4.28Å; F365-L369 HydrophobicContact CZ-CG 4.38Å; F365-L369 WeakPolarHBondContact O-CG 3.44Å; F365-L369 PolarHBondContact O-N 3.35Å; L366-L369 HydrophobicContact CD2-CD1 4.49Å; L366-L369 PolarHBondContact O-N 2.62Å; L366-L369 VanDerWaalsContact O-N 3.15Å; R367-L369 PolarHBondContact O-N 2.89Å; L369-P394 HydrophobicContact CD2-CB 4.23Å
370	Y	88.8	Confident	85.2	Confident	6 Å²	6	45 Å²	45	2%	0.024	22%	0.222	C	C	.	.	H	α-helix	trans	-81.7	-49.7	-178.7	-80.2	-125.4	0	0	0	112.9	L305 H327 I330 L366 R367 Y368	L305-Y370 HydrophobicContact CB-CD1 3.92Å; L305-Y370 HydrophobicContact CB-CE1 3.85Å; L305-Y370 HydrophobicContact CD1-CD1 4.26Å; L305-Y370 HydrophobicContact CD1-CD2 4.26Å; L305-Y370 HydrophobicContact CD1-CE1 3.89Å; L305-Y370 HydrophobicContact CD1-CE2 3.88Å; L305-Y370 HydrophobicContact CD1-CG 4.43Å; L305-Y370 HydrophobicContact CG-CD1 4.47Å; L305-Y370 HydrophobicContact CG-CE1 4.41Å; H327-Y370 PolarHBondContact N-OH 3.02Å; H327-Y370 AromaticContact ND1-CZ 3.97Å; H327-Y370 PolarHBondContact ND1-OH 3.41Å; I330-Y370 HydrophobicContact CB-CE2 4.34Å; I330-Y370 HydrophobicContact CD1-CD1 3.65Å; I330-Y370 HydrophobicContact CD1-CD2 4.31Å; I330-Y370 HydrophobicContact CD1-CE1 3.35Å; I330-Y370 HydrophobicContact CD1-CE2 4.08Å; I330-Y370 HydrophobicContact CD1-CG 4.14Å; I330-Y370 HydrophobicContact CG2-CD2 3.78Å; I330-Y370 HydrophobicContact CG2-CE2 3.86Å; I330-Y370 HydrophobicContact CG2-CG 4.34Å; L366-Y370 HydrophobicContact CD2-CE2 4.18Å; L366-Y370 WeakPolarHBondContact O-CD2 3.35Å; L366-Y370 PolarHBondContact O-N 3Å; R367-Y370 PolarHBondContact O-N 2.91Å; Y368-Y370 PolarHBondContact O-N 2.83Å
371	F	84.7	Confident	85	Confident	52 Å²	52	44.4 Å²	44.4	23%	0.228	22%	0.224	C	C	.	.	H	α-helix	trans	-103.3	-15.1	-170.8	-49.8	-62.5	0	0	0	114.2	L298 M301 L305 R367 D373	L298-F371 HydrophobicContact CD2-CB 4.45Å; L298-F371 HydrophobicContact CD2-CD1 3.99Å; M301-F371 HydrophobicContact CB-CD1 4.48Å; M301-F371 HydrophobicContact CB-CE1 3.98Å; L305-F371 HydrophobicContact CB-CZ 4.5Å; L305-F371 HydrophobicContact CD2-CE2 3.69Å; L305-F371 HydrophobicContact CD2-CZ 4.02Å; R367-F371 HydrophobicContact CB-CD2 4.02Å; R367-F371 HydrophobicContact CB-CE2 4.31Å; R367-F371 HydrophobicContact CG-CD2 4.29Å; R367-F371 HydrophobicContact CG-CE2 4.11Å; R367-F371 VanDerWaalsContact O-CD2 3.27Å; R367-F371 WeakPolarHBondContact O-CD2 3.44Å; R367-F371 PolarHBondContact O-N 3.26Å; F371-D373 VanDerWaalsContact C-N 3.3Å; F371-D373 HydrophobicContact CB-CB 4Å
372	A	78.1	Confident	84.6	Confident	20 Å²	20	50.4 Å²	50.4	17%	0.165	25%	0.252	C	S	.	.			trans	60.6	38.7	-164.5	0	0	0	0	0	113.1	L234 Y368	L234-A372 HydrophobicContact CD1-CB 4.26Å; L234-A372 HydrophobicContact CD2-CB 3.84Å; L234-A372 HydrophobicContact CG-CB 4.07Å; Y368-A372 WeakPolarHBondContact O-CA 3.04Å; Y368-A372 PolarHBondContact O-N 2.86Å
373	D	78.6	Confident	84.3	Confident	35 Å²	35	56.4 Å²	56.4	19%	0.187	28%	0.284	C	S	.	.			trans	-80.3	120.3	-176.2	177.4	4.6	0	0	0	112.8	R367 Y368 F371 E375	R367-D373 IonicContact CZ-OD2 2.93Å; R367-D373 IonicContact NE-OD2 3.16Å; R367-D373 PolarHBondContact NE-OD2 2.84Å; R367-D373 IonicContact NH2-OD2 3.1Å; R367-D373 PolarHBondContact NH2-OD2 3.12Å; Y368-D373 WeakPolarHBondContact CD2-O 3.29Å; F371-D373 VanDerWaalsContact C-N 3.3Å; F371-D373 HydrophobicContact CB-CB 4Å; D373-E375 PolarHBondContact O-N 3.39Å; D373-E375 WeakPolarHBondContact OD1-CB 3.42Å; D373-E375 WeakPolarHBondContact OD1-CG 3.49Å; D373-E375 PolarHBondContact OD1-N 2.8Å
374	D	77	Confident	84.2	Confident	93 Å²	93	53.4 Å²	53.4	50%	0.497	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-3.6	-177.8	-63.5	-47.4	0	0	0	114.2	F376 F377 N378	D374-F376 PolarHBondContact O-N 3.13Å; D374-F377 PolarHBondContact O-N 3.45Å; D374-N378 PolarHBondContact O-N 2.84Å; D374-N378 PolarHBondContact O-ND2 3.44Å
375	E	77.6	Confident	84	Confident	83 Å²	83	52.4 Å²	52.4	39%	0.388	27%	0.272	S	S	.	.	H	α-helix	trans	-48.1	-32.7	167.6	-83.7	-176.2	-159.1	0	0	111.9	R367 D373 F377 N378 S379	R367-E375 IonicContact CZ-OE1 3.17Å; R367-E375 IonicContact CZ-OE2 2.81Å; R367-E375 IonicContact NE-OE2 2.69Å; R367-E375 PolarHBondContact NE-OE2 2.8Å; R367-E375 IonicContact NH1-OE1 3Å; R367-E375 PolarHBondContact NH1-OE1 2.89Å; R367-E375 IonicContact NH1-OE2 3.95Å; R367-E375 PolarHBondContact NH1-OE2 2.86Å; R367-E375 IonicContact NH2-OE1 2.68Å; R367-E375 PolarHBondContact NH2-OE1 2.89Å; R367-E375 IonicContact NH2-OE2 2.7Å; R367-E375 PolarHBondContact NH2-OE2 3Å; R367-E375 VanDerWaalsContact NH2-OE2 3.1Å; D373-E375 PolarHBondContact O-N 3.39Å; D373-E375 WeakPolarHBondContact OD1-CB 3.42Å; D373-E375 WeakPolarHBondContact OD1-CG 3.49Å; D373-E375 PolarHBondContact OD1-N 2.8Å; E375-F377 VanDerWaalsContact C-N 3.34Å; E375-F377 PolarHBondContact O-N 2.82Å; E375-N378 PolarHBondContact O-N 3.31Å; E375-N378 VanDerWaalsContact O-N 3.17Å; E375-S379 VanDerWaalsContact O-CB 3.28Å; E375-S379 WeakPolarHBondContact O-CB 3.27Å; E375-S379 PolarHBondContact O-N 2.93Å; E375-S379 PolarHBondContact O-OG 3.19Å
376	F	81.9	Confident	83.8	Confident	1 Å²	1	53.9 Å²	53.9	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-35.8	178.6	177.2	-108.2	0	0	0	114.7	I364 F365 Y368 D374 L380 V385 V388 L389	I364-F376 VanDerWaalsContact CG2-CA 3.47Å; I364-F376 HydrophobicContact CG2-CB 3.93Å; I364-F376 HydrophobicContact CG2-CD2 4.03Å; I364-F376 HydrophobicContact CG2-CG 4.49Å; F365-F376 HydrophobicContact CB-CD2 4.05Å; F365-F376 HydrophobicContact CB-CE2 3.83Å; F365-F376 HydrophobicContact CD2-CD2 4.1Å; F365-F376 HydrophobicContact CD2-CE1 4.04Å; F365-F376 AromaticContact CD2-CE2 3.62Å; F365-F376 HydrophobicContact CD2-CE2 3.62Å; F365-F376 AromaticContact CD2-CZ 3.59Å; F365-F376 HydrophobicContact CD2-CZ 3.59Å; F365-F376 HydrophobicContact CE2-CE1 4.42Å; F365-F376 HydrophobicContact CE2-CZ 4.17Å; F365-F376 HydrophobicContact CG-CE2 4.13Å; F365-F376 HydrophobicContact CG-CZ 4.47Å; Y368-F376 HydrophobicContact CG-CB 4.28Å; Y368-F376 HydrophobicContact CG-CD1 4.39Å; D374-F376 PolarHBondContact O-N 3.13Å; F376-L380 HydrophobicContact CD2-CD1 3.63Å; F376-L380 HydrophobicContact CE2-CD1 3.65Å; F376-V385 HydrophobicContact CD1-CG1 4.45Å; F376-V385 HydrophobicContact CE1-CG1 3.81Å; F376-V385 HydrophobicContact CZ-CG1 4.14Å; F376-V385 HydrophobicContact CZ-CG2 4.47Å; F376-V385 WeakPolarHBondContact O-CG2 3.3Å; F376-V388 HydrophobicContact CE2-CG1 4.31Å; F376-V388 HydrophobicContact CZ-CB 4.29Å; F376-V388 HydrophobicContact CZ-CG1 4Å; F376-L389 HydrophobicContact CE1-CD1 4.06Å; F376-L389 HydrophobicContact CE1-CD2 4.04Å; F376-L389 HydrophobicContact CE1-CG 3.96Å; F376-L389 HydrophobicContact CZ-CG 4.3Å
377	F	81.8	Confident	83.6	Confident	79 Å²	79	58 Å²	58	35%	0.346	30%	0.301	S	S	.	.	H	α-helix	trans	-83.8	-18.5	177.7	-61.2	-78.2	0	0	0	113.1	Y368 D374 E375 V385 L389 W397	Y368-F377 HydrophobicContact CD2-CE2 4.21Å; Y368-F377 AromaticContact CE2-CE2 3.75Å; Y368-F377 HydrophobicContact CE2-CE2 3.75Å; Y368-F377 HydrophobicContact CE2-CZ 4.34Å; D374-F377 PolarHBondContact O-N 3.45Å; E375-F377 VanDerWaalsContact C-N 3.34Å; E375-F377 PolarHBondContact O-N 2.82Å; F377-V385 HydrophobicContact CD1-CG1 3.88Å; F377-V385 HydrophobicContact CE1-CG1 4.14Å; F377-L389 HydrophobicContact CE1-CD1 3.93Å; F377-W397 HydrophobicContact CE1-CH2 4.47Å; F377-W397 HydrophobicContact CE1-CZ3 4.49Å; F377-W397 HydrophobicContact CZ-CZ3 4.36Å
378	N	82	Confident	83.5	Confident	136 Å²	136	53.8 Å²	53.8	73%	0.727	29%	0.285	S	S	*	.	H	α-helix	trans	-103.6	-24.7	-172.2	-68.9	-74.3	0	0	0	114.1	D374 E375	D374-N378 PolarHBondContact O-N 2.84Å; D374-N378 PolarHBondContact O-ND2 3.44Å; E375-N378 PolarHBondContact O-N 3.31Å; E375-N378 VanDerWaalsContact O-N 3.17Å
379	S	80.7	Confident	83.4	Confident	66 Å²	66	52.9 Å²	52.9	46%	0.462	28%	0.282	S	S	.	.	S	Bend	trans	-100.2	-12.1	-173.6	61.3	0	0	0	0	114.9	I364 E375	I364-S379 WeakPolarHBondContact CG2-OG 3.34Å; E375-S379 VanDerWaalsContact O-CB 3.28Å; E375-S379 WeakPolarHBondContact O-CB 3.27Å; E375-S379 PolarHBondContact O-N 2.93Å; E375-S379 PolarHBondContact O-OG 3.19Å
380	L	83.8	Confident	83.3	Confident	28 Å²	28	58.9 Å²	58.9	15%	0.147	31%	0.31	C	S	.	.	S	Bend	trans	-116.5	150.6	-177	-72.2	167.8	0	0	0	111.1	C361 I364 F376 V385	C361-L380 HydrophobicContact CB-CD1 4.38Å; C361-L380 HydrophobicContact CB-CD2 3.95Å; I364-L380 HydrophobicContact CB-CD1 4.38Å; I364-L380 HydrophobicContact CD1-CD1 4.48Å; I364-L380 HydrophobicContact CD1-CD2 4.24Å; I364-L380 HydrophobicContact CD1-CG 4.2Å; I364-L380 HydrophobicContact CG2-CD1 4.21Å; F376-L380 HydrophobicContact CD2-CD1 3.63Å; F376-L380 HydrophobicContact CE2-CD1 3.65Å; L380-V385 HydrophobicContact CB-CG2 3.59Å; L380-V385 HydrophobicContact CD1-CG2 4.43Å
381	P	84.6	Confident	83.1	Confident	80 Å²	80	63.5 Å²	63.5	52%	0.519	33%	0.327	S	S	.	.			trans	-58.9	139.3	171.8	-21.2	33	0	0	0	111.2	D383 T384 V385	P381-D383 PolarHBondContact O-N 3.48Å; P381-D383 VanDerWaalsContact O-N 3.15Å; P381-T384 WeakPolarHBondContact O-CB 3.27Å; P381-T384 PolarHBondContact O-N 2.97Å; P381-V385 PolarHBondContact O-N 3.42Å
382	H	82	Confident	83.3	Confident	129 Å²	129	61.2 Å²	61.2	60%	0.597	32%	0.317	S	S	*	.	H	α-helix	trans	-50.9	-42	-179.3	176.7	-90.9	0	0	0	112.6	T384 V385 V386	H382-T384 PolarHBondContact O-N 3.12Å; H382-V385 WeakPolarHBondContact O-CB 3.44Å; H382-V385 PolarHBondContact O-N 2.85Å; H382-V386 WeakPolarHBondContact O-CG2 3.47Å; H382-V386 PolarHBondContact O-N 2.9Å
383	D	85	Confident	83.7	Confident	126 Å²	126	62.8 Å²	62.8	67%	0.674	33%	0.326	S	S	*	.	H	α-helix	trans	-64.3	-39.8	-179.7	-54	-25.1	0	0	0	112	P381 V386 E387	P381-D383 PolarHBondContact O-N 3.48Å; P381-D383 VanDerWaalsContact O-N 3.15Å; D383-V386 PolarHBondContact O-N 3.43Å; D383-E387 WeakPolarHBondContact O-CB 3.3Å; D383-E387 PolarHBondContact O-N 3.03Å
384	T	85.5	Confident	84	Confident	44 Å²	44	61.6 Å²	61.6	27%	0.27	32%	0.32	S	S	.	.	H	α-helix	trans	-68.2	-39.1	174.9	-49.2	0	0	0	0	111.6	P381 H382 E387 V388	P381-T384 WeakPolarHBondContact O-CB 3.27Å; P381-T384 PolarHBondContact O-N 2.97Å; H382-T384 PolarHBondContact O-N 3.12Å; T384-E387 PolarHBondContact O-N 3.47Å; T384-V388 WeakPolarHBondContact O-CG2 3.17Å; T384-V388 PolarHBondContact O-N 2.7Å
385	V	86	Confident	84	Confident	8 Å²	8	59.5 Å²	59.5	5%	0.048	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-45.9	174.5	171.2	0	0	0	0	110.5	F376 F377 L380 P381 H382 V388 L389	F376-V385 HydrophobicContact CD1-CG1 4.45Å; F376-V385 HydrophobicContact CE1-CG1 3.81Å; F376-V385 HydrophobicContact CZ-CG1 4.14Å; F376-V385 HydrophobicContact CZ-CG2 4.47Å; F376-V385 WeakPolarHBondContact O-CG2 3.3Å; F377-V385 HydrophobicContact CD1-CG1 3.88Å; F377-V385 HydrophobicContact CE1-CG1 4.14Å; L380-V385 HydrophobicContact CB-CG2 3.59Å; L380-V385 HydrophobicContact CD1-CG2 4.43Å; P381-V385 PolarHBondContact O-N 3.42Å; H382-V385 WeakPolarHBondContact O-CB 3.44Å; H382-V385 PolarHBondContact O-N 2.85Å; V385-V388 PolarHBondContact O-N 3.11Å; V385-L389 HydrophobicContact CG1-CD1 3.75Å; V385-L389 WeakPolarHBondContact O-CB 3.46Å; V385-L389 VanDerWaalsContact O-CG 3.26Å; V385-L389 WeakPolarHBondContact O-CG 3.31Å; V385-L389 PolarHBondContact O-N 3Å
386	V	84.9	Confident	83.5	Confident	31 Å²	31	59.2 Å²	59.2	19%	0.188	33%	0.332	C	S	.	.	H	α-helix	trans	-64.6	-43.6	176.7	170.9	0	0	0	0	111.5	H382 D383 V388 L389 Q390	H382-V386 WeakPolarHBondContact O-CG2 3.47Å; H382-V386 PolarHBondContact O-N 2.9Å; D383-V386 PolarHBondContact O-N 3.43Å; V386-V388 PolarHBondContact O-N 3.25Å; V386-L389 PolarHBondContact O-N 2.99Å; V386-Q390 HydrophobicContact CG1-CG 4.15Å; V386-Q390 VanDerWaalsContact CG1-NE2 3.3Å; V386-Q390 WeakPolarHBondContact O-CB 3.44Å; V386-Q390 VanDerWaalsContact O-CG 3.3Å; V386-Q390 WeakPolarHBondContact O-CG 3.49Å; V386-Q390 PolarHBondContact O-N 3.29Å
387	E	85.7	Confident	82.9	Confident	87 Å²	87	63.1 Å²	63.1	41%	0.407	35%	0.346	S	S	.	.	H	α-helix	trans	-58.7	-49.3	176.8	-171	-171.4	166.6	0	0	111.5	D383 T384 L389 Q390 R391	D383-E387 WeakPolarHBondContact O-CB 3.3Å; D383-E387 PolarHBondContact O-N 3.03Å; T384-E387 PolarHBondContact O-N 3.47Å; E387-L389 PolarHBondContact O-N 2.84Å; E387-Q390 PolarHBondContact O-N 3.34Å; E387-R391 VanDerWaalsContact O-CB 3.25Å; E387-R391 WeakPolarHBondContact O-CB 3.31Å; E387-R391 PolarHBondContact O-N 3.29Å; E387-R391 IonicContact OE1-NH1 3.34Å
388	V	87.5	Confident	81.8	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.006	36%	0.358	C	S	.	.	H	α-helix	trans	-62.7	-42.3	178.9	171.1	0	0	0	0	111.4	I357 F365 F376 T384 V385 V386 R391 F392	I357-V388 HydrophobicContact CD1-CG2 4.3Å; I357-V388 HydrophobicContact CG2-CG2 4.49Å; F365-V388 HydrophobicContact CD1-CG1 4.11Å; F365-V388 HydrophobicContact CD2-CG1 3.86Å; F365-V388 HydrophobicContact CE1-CG1 4.19Å; F365-V388 HydrophobicContact CE2-CG1 3.96Å; F365-V388 HydrophobicContact CG-CG1 3.94Å; F365-V388 HydrophobicContact CZ-CG1 4.12Å; F376-V388 HydrophobicContact CE2-CG1 4.31Å; F376-V388 HydrophobicContact CZ-CB 4.29Å; F376-V388 HydrophobicContact CZ-CG1 4Å; T384-V388 WeakPolarHBondContact O-CG2 3.17Å; T384-V388 PolarHBondContact O-N 2.7Å; V385-V388 PolarHBondContact O-N 3.11Å; V386-V388 PolarHBondContact O-N 3.25Å; V388-R391 PolarHBondContact O-N 3.35Å; V388-F392 WeakPolarHBondContact O-CA 3.16Å; V388-F392 PolarHBondContact O-N 3.03Å
389	L	87.2	Confident	80.4	Confident	6 Å²	6	61.8 Å²	61.8	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-72.4	-33.8	179.8	-71.5	170.6	0	0	0	113.5	F365 F376 F377 V385 V386 E387 P393 P394 W397	F365-L389 HydrophobicContact CE2-CD2 4.31Å; F376-L389 HydrophobicContact CE1-CD1 4.06Å; F376-L389 HydrophobicContact CE1-CD2 4.04Å; F376-L389 HydrophobicContact CE1-CG 3.96Å; F376-L389 HydrophobicContact CZ-CG 4.3Å; F377-L389 HydrophobicContact CE1-CD1 3.93Å; V385-L389 HydrophobicContact CG1-CD1 3.75Å; V385-L389 WeakPolarHBondContact O-CB 3.46Å; V385-L389 VanDerWaalsContact O-CG 3.26Å; V385-L389 WeakPolarHBondContact O-CG 3.31Å; V385-L389 PolarHBondContact O-N 3Å; V386-L389 PolarHBondContact O-N 2.99Å; E387-L389 PolarHBondContact O-N 2.84Å; L389-P393 WeakPolarHBondContact O-CA 3.42Å; L389-P393 WeakPolarHBondContact O-CB 3.44Å; L389-P393 WeakPolarHBondContact O-CD 3.21Å; L389-P393 VanDerWaalsContact O-N 3.16Å; L389-P394 HydrophobicContact CD2-CG 4.11Å; L389-W397 HydrophobicContact CB-CZ2 4.5Å; L389-W397 HydrophobicContact CD1-CH2 3.74Å; L389-W397 HydrophobicContact CD1-CZ2 3.78Å; L389-W397 HydrophobicContact CD1-CZ3 4.22Å
390	Q	85.6	Confident	78.8	Confident	125 Å²	125	66.8 Å²	66.8	58%	0.584	36%	0.364	S	S	*	.	H	α-helix	trans	-69.2	-38.8	173.2	-74.3	-177.4	8.8	0	0	111.6	V386 E387	V386-Q390 HydrophobicContact CG1-CG 4.15Å; V386-Q390 VanDerWaalsContact CG1-NE2 3.3Å; V386-Q390 WeakPolarHBondContact O-CB 3.44Å; V386-Q390 VanDerWaalsContact O-CG 3.3Å; V386-Q390 WeakPolarHBondContact O-CG 3.49Å; V386-Q390 PolarHBondContact O-N 3.29Å; E387-Q390 PolarHBondContact O-N 3.34Å
391	R	85	Confident	77	Confident	104 Å²	104	71.2 Å²	71.2	39%	0.392	39%	0.392	S	S	.	.	H	α-helix	trans	-77.2	-38.4	-179.2	-161.9	174.9	-167.4	139.6	-5.6	112.8	E356 E387 V388 P393	E356-R391 VanDerWaalsContact CD-NH2 3.32Å; E356-R391 IonicContact OE1-NH2 2.72Å; E356-R391 PolarHBondContact OE1-NH2 2.8Å; E356-R391 IonicContact OE2-CZ 2.98Å; E356-R391 IonicContact OE2-NH1 3.36Å; E356-R391 PolarHBondContact OE2-NH1 2.93Å; E356-R391 IonicContact OE2-NH2 3.5Å; E356-R391 PolarHBondContact OE2-NH2 2.83Å; E387-R391 VanDerWaalsContact O-CB 3.25Å; E387-R391 WeakPolarHBondContact O-CB 3.31Å; E387-R391 PolarHBondContact O-N 3.29Å; E387-R391 IonicContact OE1-NH1 3.34Å; V388-R391 PolarHBondContact O-N 3.35Å; R391-P393 VanDerWaalsContact C-CD 3.48Å
392	F	88.6	Confident	74.8	Confident	4 Å²	4	70.5 Å²	70.5	2%	0.018	39%	0.387	C	S	.	.	S	Bend	trans	-130.6	62.2	-176.1	-56.7	-58.8	0	0	0	112.2	C335 L338 C341 L354 I357 F365 V388 P394	C335-F392 PolarHBondContact SG-O 2.67Å; C335-F392 VanDerWaalsContact SG-O 3.39Å; L338-F392 HydrophobicContact CB-CB 4.39Å; L338-F392 HydrophobicContact CB-CD1 3.9Å; L338-F392 HydrophobicContact CB-CG 4.25Å; L338-F392 HydrophobicContact CD1-CD1 3.81Å; L338-F392 HydrophobicContact CD1-CD2 4.26Å; L338-F392 HydrophobicContact CD1-CE1 3.73Å; L338-F392 HydrophobicContact CD1-CE2 4.17Å; L338-F392 HydrophobicContact CD1-CG 4.09Å; L338-F392 HydrophobicContact CD1-CZ 3.91Å; L338-F392 HydrophobicContact CG-CD1 4.47Å; C341-F392 HydrophobicContact CB-CE1 4.33Å; L354-F392 HydrophobicContact CD2-CE2 4.14Å; L354-F392 HydrophobicContact CD2-CZ 3.69Å; I357-F392 HydrophobicContact CD1-CD2 4.33Å; I357-F392 HydrophobicContact CD1-CE2 3.73Å; F365-F392 HydrophobicContact CE1-CB 4.28Å; F365-F392 HydrophobicContact CZ-CB 4.31Å; V388-F392 WeakPolarHBondContact O-CA 3.16Å; V388-F392 PolarHBondContact O-N 3.03Å; F392-P394 WeakPolarHBondContact O-CD 3.48Å
393	P	87	Confident	72.3	Confident	53 Å²	53	67.7 Å²	67.7	34%	0.344	39%	0.393	S	S	.	.			trans	-61.7	125.3	-177	23.2	-33.6	0	0	0	110.8	S337 L389 R391 W397	S337-P393 PolarHBondContact OG-O 3.47Å; L389-P393 WeakPolarHBondContact O-CA 3.42Å; L389-P393 WeakPolarHBondContact O-CB 3.44Å; L389-P393 WeakPolarHBondContact O-CD 3.21Å; L389-P393 VanDerWaalsContact O-N 3.16Å; R391-P393 VanDerWaalsContact C-CD 3.48Å; P393-W397 HydrophobicContact CB-CB 4.49Å
394	P	84.3	Confident	69.8	Low	10 Å²	10	66.9 Å²	66.9	7%	0.065	40%	0.396	C	S	.	.			trans	-72.6	158.4	176.9	27.8	-31.4	0	0	0	111.4	R334 Y368 L369 L389 F392 G396 W397	R334-P394 CarbonylContact O-C 3.56Å; R334-P394 VanDerWaalsContact O-CA 3.25Å; R334-P394 WeakPolarHBondContact O-CA 3.4Å; R334-P394 WeakPolarHBondContact O-CB 3.49Å; Y368-P394 HydrophobicContact CE1-CG 4.28Å; L369-P394 HydrophobicContact CD2-CB 4.23Å; L389-P394 HydrophobicContact CD2-CG 4.11Å; F392-P394 WeakPolarHBondContact O-CD 3.48Å; P394-G396 PolarHBondContact O-N 3.35Å; P394-G396 VanDerWaalsContact O-N 3.07Å; P394-W397 HydrophobicContact CG-CB 4.05Å; P394-W397 WeakPolarHBondContact O-CB 3.38Å; P394-W397 PolarHBondContact O-N 3.46Å
395	S	76.6	Confident	67.1	Low	48 Å²	48	73.7 Å²	73.7	34%	0.336	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	108.6	-176.9	56.9	0	0	0	0	111.4	S333 R334	S333-S395 PolarHBondContact O-OG 2.83Å; R334-S395 PolarHBondContact O-N 3.47Å; R334-S395 PolarHBondContact O-OG 3.27Å
396	G	68.3	Low	64.6	Low	78 Å²	78	80.3 Å²	80.3	80%	0.804	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	115.7	-8.4	-175.1	0	0	0	0	0	113.9	P394 N398	P394-G396 PolarHBondContact O-N 3.35Å; P394-G396 VanDerWaalsContact O-N 3.07Å; G396-N398 PolarHBondContact O-N 2.91Å
397	W	69.9	Low	62	Low	82 Å²	82	86.3 Å²	86.3	31%	0.311	49%	0.492	S	S	.	.			trans	-71	121	175.3	-172.1	-102.2	0	0	0	112	F377 L389 P393 P394	F377-W397 HydrophobicContact CE1-CH2 4.47Å; F377-W397 HydrophobicContact CE1-CZ3 4.49Å; F377-W397 HydrophobicContact CZ-CZ3 4.36Å; L389-W397 HydrophobicContact CB-CZ2 4.5Å; L389-W397 HydrophobicContact CD1-CH2 3.74Å; L389-W397 HydrophobicContact CD1-CZ2 3.78Å; L389-W397 HydrophobicContact CD1-CZ3 4.22Å; P393-W397 HydrophobicContact CB-CB 4.49Å; P394-W397 HydrophobicContact CG-CB 4.05Å; P394-W397 WeakPolarHBondContact O-CB 3.38Å; P394-W397 PolarHBondContact O-N 3.46Å
398	N	58.7	Low	59.4	Low	111 Å²	111	89 Å²	89	59%	0.594	51%	0.505	S	S	*	.			trans	-102.6	126.9	168.2	-78.9	-4.3	0	0	0	109.1	G396 E400	G396-N398 PolarHBondContact O-N 2.91Å; N398-E400 PolarHBondContact O-N 2.83Å
399	C	51.6	Low	56.9	Low	77 Å²	77	97.5 Å²	97.5	52%	0.52	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-77.5	2.6	-173.8	-156.8	0	0	0	0	114.6	V401	C399-V401 PolarHBondContact O-N 3.06Å
400	E	46.4	Very low	54.3	Low	171 Å²	171	101 Å²	101	80%	0.799	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-75.6	-6.3	-171.1	-62.2	176.2	152	0	0	113.8	N398	N398-E400 PolarHBondContact O-N 2.83Å
401	V	47.1	Very low	52	Low	121 Å²	121	103.8 Å²	103.8	73%	0.733	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-85.2	-18.5	-173	-175	0	0	0	0	113.5	C399	C399-V401 PolarHBondContact O-N 3.06Å
402	T	38.5	Very low	49.3	Very low	65 Å²	65	102.3 Å²	102.3	40%	0.399	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-115.1	23.6	-174.7	63.6	0	0	0	0	113.8	S404	T402-S404 PolarHBondContact O-N 3.16Å
403	G	29.5	Very low	46.7	Very low	70 Å²	70	109.1 Å²	109.1	72%	0.722	64%	0.641	S	S	*	*			trans	-89.6	37.5	-174.7	0	0	0	0	0	115.8	Q405	G403-Q405 PolarHBondContact O-N 2.74Å; G403-Q405 VanDerWaalsContact O-N 3.08Å
404	S	32.7	Very low	44	Very low	108 Å²	108	111 Å²	111	76%	0.755	66%	0.656	S	S	*	*			trans	-76.5	96.1	-171.5	-62.6	0	0	0	0	113.7	T402	T402-S404 PolarHBondContact O-N 3.16Å
405	Q	28.9	Very low	41.2	Very low	187 Å²	187	116.6 Å²	116.6	87%	0.874	69%	0.693	S	S	*	*			trans	35	103.7	151.2	-60.6	179.9	5.4	0	0	118	G403	G403-Q405 PolarHBondContact O-N 2.74Å; G403-Q405 VanDerWaalsContact O-N 3.08Å
406	T	31.9	Very low	39.1	Very low	148 Å²	148	121.5 Å²	121.5	91%	0.908	71%	0.714	S	S	*	*			trans	-142.9	126.8	142.3	-55.5	0	0	0	0	108.8
407	E	30.4	Very low	37.4	Very low	156 Å²	156	123.2 Å²	123.2	73%	0.729	71%	0.711	S	S	*	*			trans	-101.8	152.7	-174	-88.3	-162	83	0	0	113.1
408	Q	32.6	Very low	35.6	Very low	145 Å²	145	124.3 Å²	124.3	68%	0.678	74%	0.737	S	S	*	*			trans	70.6	150.7	150.3	-68.4	166.7	43.2	0	0	120.4
409	Q	34	Very low	34.6	Very low	179 Å²	179	126 Å²	126	84%	0.836	74%	0.742	S	S	*	*			trans	68.8	141.5	168.4	-60.7	172.7	44.3	0	0	118.2
410	S	33.8	Very low	34.1	Very low	79 Å²	79	130.9 Å²	130.9	55%	0.552	75%	0.749	S	S	*	*			cis	-168.7	153.9	-32.4	45.9	0	0	0	0	108.8
411	H	36.8	Very low	33.7	Very low	183 Å²	183	128.2 Å²	128.2	85%	0.847	74%	0.74	S	S	*	*			trans	61.5	126.2	176.5	-41	-80.9	0	0	0	115.5
412	G	28.8	Very low	33.3	Very low	74 Å²	74	128.3 Å²	128.3	76%	0.763	74%	0.737	S	S	*	*			cis	101.8	85.5	7.3	0	0	0	0	0	112.7
413	V	33.4	Very low	33.5	Very low	146 Å²	146	130.8 Å²	130.8	89%	0.885	75%	0.752	S	S	*	*			trans	-149.9	132.3	163.7	139.3	0	0	0	0	111.3
414	S	30.9	Very low	34	Very low	94 Å²	94	133.6 Å²	133.6	66%	0.657	75%	0.751	S	S	*	*			trans	24	118.7	157.3	-147.2	0	0	0	0	121.9
415	C	25.4	Very low	34.3	Very low	126 Å²	126	135.3 Å²	135.3	85%	0.851	75%	0.751	S	S	*	*			trans	-80.1	153.2	140.2	-64.4	0	0	0	0	109.8
416	I	32.4	Very low	34.8	Very low	151 Å²	151	130.8 Å²	130.8	77%	0.774	75%	0.746	S	S	*	*			trans	-133.6	121.2	166.2	-59.2	-177.9	0	0	0	108
417	P	31.8	Very low	35.1	Very low	115 Å²	115	128.8 Å²	128.8	75%	0.747	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-86.9	169.7	-179.9	36	-35.5	0	0	0	112.7
418	A	32.2	Very low	35.2	Very low	104 Å²	104	126.5 Å²	126.5	86%	0.86	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-81.1	126.6	177.8	0	0	0	0	0	112.9
419	E	38.6	Very low	35.4	Very low	147 Å²	147	128.8 Å²	128.8	69%	0.687	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-85.7	160.4	156.6	-66.7	-169.4	110.5	0	0	109.2
420	R	40.5	Very low	35.4	Very low	180 Å²	180	126.5 Å²	126.5	68%	0.679	75%	0.75	S	S	*	*			cis	-155.2	168	1.9	-124.3	174.8	-86	140.7	-2.2	105.1
421	D	37.6	Very low	35.5	Very low	114 Å²	114	131.7 Å²	131.7	61%	0.61	77%	0.765	S	S	*	*			cis	-153.8	152.5	26.9	-92.7	-51.9	0	0	0	110.5
422	N	39.2	Very low	35.3	Very low	124 Å²	124	130 Å²	130	66%	0.663	76%	0.762	S	S	*	*			trans	32.4	140.1	131.8	-39.2	-34.4	0	0	0	120.7
423	T	42.3	Very low	35.5	Very low	116 Å²	116	135.9 Å²	135.9	71%	0.712	77%	0.767	S	S	*	*			cis	-169.3	-176.9	-2.4	18.9	0	0	0	0	107.1
424	D	39.9	Very low	35.6	Very low	130 Å²	130	133.1 Å²	133.1	70%	0.695	75%	0.75	S	S	*	*			cis	-156.4	-173.7	7.8	-132.5	-43.9	0	0	0	112.5
425	D	39.4	Very low	35.4	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	77%	0.765	S	S	*	*			trans	62.7	90.9	150	-81.4	-35.8	0	0	0	121.5
426	A	38.8	Very low	35.7	Very low	92 Å²	92	135.6 Å²	135.6	76%	0.76	76%	0.755	S	S	*	*				105.1	134.3	109.2	0	0	0	0	0	121.9
427	A	37.4	Very low	35.8	Very low	107 Å²	107	136.4 Å²	136.4	88%	0.884	76%	0.76	S	S	*	*			trans	65.8	94.2	158.3	0	0	0	0	0	119.2
428	S	32.4	Very low	35.9	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	77%	0.766	S	S	*	*			trans	-103.8	135.1	158.4	172.2	0	0	0	0	110.1
429	E	38.3	Very low	35.8	Very low	194 Å²	194	141 Å²	141	91%	0.907	76%	0.763	S	S	*	*			trans	-126	138.7	157.5	-74.2	-161.7	147.4	0	0	110.3
430	N	33	Very low	35.5	Very low	131 Å²	131	145.8 Å²	145.8	70%	0.701	78%	0.775	S	S	*	*			trans	-73.1	152	-175.6	-66.3	-83.2	0	0	0	112
431	H	37.3	Very low	35.3	Very low	188 Å²	188	145.2 Å²	145.2	87%	0.87	78%	0.78	S	S	*	*				-160.1	122.7	123.2	-112.2	-71	0	0	0	113.1
432	N	31.4	Very low	35	Very low	148 Å²	148	150.5 Å²	150.5	79%	0.791	79%	0.793	S	S	*	*			trans	-71.5	139.5	172.7	-65.5	-59.3	0	0	0	111
433	F	33	Very low	34.7	Very low	197 Å²	197	152.2 Å²	152.2	86%	0.864	80%	0.802	S	S	*	*			trans	-144.4	119.1	171.2	-162.1	-115.7	0	0	0	114.2
434	V	35.3	Very low	34.2	Very low	88 Å²	88	152.8 Å²	152.8	53%	0.533	81%	0.805	S	S	.	*			trans	66	75.4	165.8	-172.7	0	0	0	0	116.9
435	N	28.1	Very low	34	Very low	179 Å²	179	150.3 Å²	150.3	96%	0.957	81%	0.81	S	S	*	*				-83.7	92.8	124	-92.5	-29.5	0	0	0	108
436	S	31.2	Very low	33.5	Very low	93 Å²	93	149.5 Å²	149.5	65%	0.65	81%	0.814	S	S	*	*			trans	-165.3	80.9	172.7	-161.1	0	0	0	0	112.8
437	L	34.4	Very low	33.2	Very low	168 Å²	168	148 Å²	148	88%	0.88	80%	0.802	S	S	*	*	S	Bend	trans	-162.1	5.5	164.4	-117.8	164.2	0	0	0	115.1
438	L	33.4	Very low	33.1	Very low	165 Å²	165	147.8 Å²	147.8	86%	0.864	79%	0.785	S	S	*	*	S	Bend	trans	-127	92.4	167	-72.5	170.9	0	0	0	106.8
439	N	29.5	Very low	33.2	Very low	150 Å²	150	146.7 Å²	146.7	80%	0.802	77%	0.768	S	S	*	*			trans	165	87	159.6	-88.4	0.9	0	0	0	108.7
440	R	32.8	Very low	33	Very low	248 Å²	248	143.8 Å²	143.8	94%	0.936	76%	0.759	S	S	*	*			trans	-150.2	99.4	149.1	-103.9	-168.9	74.5	140.7	4.2	106.3
441	E	37	Very low	33	Very low	168 Å²	168	144.9 Å²	144.9	79%	0.785	77%	0.765	S	S	*	*			trans	-70.5	-178.6	-179.4	-72.5	153.3	111.7	0	0	111.6
442	Y	31.2	Very low	32.9	Very low	225 Å²	225	144 Å²	144	88%	0.882	76%	0.763	S	S	*	*			trans	-61.2	141.8	169.8	-73.9	-120.1	0	0	0	109.6
443	D	33.5	Very low	32.9	Very low	160 Å²	160	143.3 Å²	143.3	86%	0.856	76%	0.764	S	S	*	*			trans	-144.2	150	149.8	-154.6	-9.7	0	0	0	109.2
444	V	31.1	Very low	32.9	Very low	128 Å²	128	140.9 Å²	140.9	78%	0.776	76%	0.759	S	S	*	*			trans	-132.8	110.8	-165.8	177.1	0	0	0	0	109.3
445	G	35.3	Very low	32.8	Very low	77 Å²	77	143 Å²	143	79%	0.794	77%	0.767	S	S	*	*			trans	-146	109.8	-177.4	0	0	0	0	0	113.6
446	C	29.2	Very low	33.3	Very low	127 Å²	127	142.1 Å²	142.1	86%	0.858	76%	0.761	S	S	*	*			trans	-90.4	165.8	153.2	-71.6	0	0	0	0	108.7
447	A	32.7	Very low	33.3	Very low	61 Å²	61	143.5 Å²	143.5	50%	0.504	77%	0.766	S	S	.	*			cis	-176.7	159.7	-28.5	0	0	0	0	0	107.1
448	L	35.3	Very low	33.3	Very low	102 Å²	102	139.6 Å²	139.6	53%	0.534	76%	0.758	S	S	.	*			trans	68.8	157.2	167.7	-45.4	-177.4	0	0	0	114.9	A533	L448-A533 HydrophobicContact CD1-CB 3.97Å
449	E	34.9	Very low	33.7	Very low	84 Å²	84	139.4 Å²	139.4	39%	0.393	76%	0.758	S	S	.	*			cis	-155.1	155.8	-13.6	-119.6	160.5	-150.9	0	0	111.1	A533 Q534	E449-A533 WeakPolarHBondContact OE1-CB 3.45Å; E449-Q534 WeakPolarHBondContact OE2-CG 3.41Å; E449-Q534 PolarHBondContact OE2-NE2 3.16Å
450	D	33.2	Very low	34	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	76%	0.758	S	S	*	*			trans	52.6	147.9	147.1	-60	-8.8	0	0	0	126.1
451	D	33.3	Very low	34.3	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	75%	0.749	S	S	*	*			trans	59.1	140.2	154.9	-71.2	-9.5	0	0	0	121.2
452	M	34.6	Very low	34.2	Very low	168 Å²	168	130 Å²	130	83%	0.828	74%	0.744	S	S	*	*			cis	-137.8	165.6	21.8	-69.4	179.9	-75.7	0	0	114
453	V	32.1	Very low	34.4	Very low	135 Å²	135	129.3 Å²	129.3	82%	0.818	74%	0.742	S	S	*	*			trans	-89.5	134.7	165.6	175.9	0	0	0	0	110.9
454	I	33.5	Very low	34.6	Very low	146 Å²	146	126 Å²	126	75%	0.749	73%	0.731	S	S	*	*			trans	-131.8	125.6	155.1	-59.5	-178.6	0	0	0	108	L456	I454-L456 HydrophobicContact CG2-CD1 4.37Å; I454-L456 HydrophobicContact CG2-CG 4.21Å
455	D	33.4	Very low	34.9	Very low	131 Å²	131	127.1 Å²	127.1	70%	0.701	73%	0.733	S	S	*	*			trans	-116	127.1	173.6	-179.3	19.8	0	0	0	108.2
456	L	36.8	Very low	35	Very low	161 Å²	161	126.3 Å²	126.3	84%	0.843	72%	0.724	S	S	*	*			trans	-146.4	119.1	176.7	-76.5	-179.8	0	0	0	110.5	I454	I454-L456 HydrophobicContact CG2-CD1 4.37Å; I454-L456 HydrophobicContact CG2-CG 4.21Å
457	T	31.5	Very low	35.5	Very low	122 Å²	122	127.9 Å²	127.9	75%	0.748	72%	0.722	S	S	*	*			trans	-102.6	162.3	177.7	55.1	0	0	0	0	112.3
458	A	36	Very low	35.6	Very low	87 Å²	87	135.3 Å²	135.3	72%	0.719	74%	0.737	S	S	*	*			trans	78.4	149.2	-179.7	0	0	0	0	0	113.8
459	D	40.5	Very low	35.9	Very low	161 Å²	161	135.5 Å²	135.5	86%	0.861	75%	0.747	S	S	*	*			cis	-136.5	165.7	26.2	-74.7	-59.5	0	0	0	115.4
460	E	35.5	Very low	36	Very low	169 Å²	169	135.9 Å²	135.9	79%	0.79	76%	0.759	S	S	*	*			trans	-81.4	163.4	158.9	-89.7	-92.4	157	0	0	109.8
461	P	39.9	Very low	36.2	Very low	117 Å²	117	137 Å²	137	76%	0.76	76%	0.764	S	S	*	*			cis	-151.8	177.3	42.5	42.2	-19.9	0	0	0	120.2
462	A	35.4	Very low	36.4	Very low	83 Å²	83	136 Å²	136	69%	0.686	76%	0.759	S	S	*	*			trans	-16.4	153.3	160	0	0	0	0	0	121.7
463	Y	35.7	Very low	36.7	Very low	210 Å²	210	133.8 Å²	133.8	82%	0.824	76%	0.755	S	S	*	*				175.1	126.6	108.2	-164.4	-109.9	0	0	0	115.5
464	S	36.5	Very low	36.9	Very low	89 Å²	89	135.2 Å²	135.2	62%	0.622	75%	0.752	S	S	*	*			trans	63.9	161.6	155.7	80.3	0	0	0	0	120
465	D	37.3	Very low	36.9	Very low	153 Å²	153	131.7 Å²	131.7	82%	0.818	75%	0.745	S	S	*	*			cis	-155.8	158	-6.2	-142.8	-25.8	0	0	0	113.3
466	G	37.7	Very low	37	Very low	60 Å²	60	136.8 Å²	136.8	62%	0.619	76%	0.756	S	S	*	*			trans	65.3	159.8	153.9	0	0	0	0	0	121.1
467	I	39.3	Very low	37	Very low	160 Å²	160	132.1 Å²	132.1	82%	0.821	75%	0.747	S	S	*	*			cis	-147.5	124.1	-5.4	-70.6	-167.9	0	0	0	110.3
468	R	36.3	Very low	37.2	Very low	217 Å²	217	134.3 Å²	134.3	82%	0.819	75%	0.754	S	S	*	*			trans	48.8	127.2	142.1	-135.2	-179.7	-173.9	155.9	-0.9	119.3
469	S	39.9	Very low	37.2	Very low	106 Å²	106	134.5 Å²	134.5	74%	0.741	75%	0.75	S	S	*	*				177.4	173.5	67	-54.9	0	0	0	0	110.2
470	S	38.7	Very low	37.1	Very low	91 Å²	91	131.8 Å²	131.8	64%	0.636	74%	0.74	S	S	*	*			cis	-177.6	170.8	-35.1	-81.6	0	0	0	0	108.9
471	L	37	Very low	37.2	Very low	156 Å²	156	130.7 Å²	130.7	82%	0.817	74%	0.739	S	S	*	*			trans	75.4	104.3	177.9	-49.2	175	0	0	0	114
472	N	36.6	Very low	37.1	Very low	133 Å²	133	132.8 Å²	132.8	71%	0.711	74%	0.739	S	S	*	*				76.8	141.2	55.1	-60	42.1	0	0	0	112.1
473	V	40.5	Very low	37.4	Very low	123 Å²	123	135.2 Å²	135.2	75%	0.745	74%	0.739	S	S	*	*			cis	-147.1	146.9	39.6	170.7	0	0	0	0	113.9
474	E	37	Very low	37.5	Very low	164 Å²	164	132.5 Å²	132.5	77%	0.766	74%	0.739	S	S	*	*			trans	-7.5	171.2	150.3	-64.7	147.3	-139.9	0	0	122.6
475	A	34.6	Very low	37.5	Very low	73 Å²	73	133 Å²	133	60%	0.603	74%	0.742	S	S	*	*			cis	-178.2	-176.8	-25.1	0	0	0	0	0	110.7
476	Y	35.1	Very low	37.5	Very low	237 Å²	237	132.2 Å²	132.2	93%	0.929	74%	0.743	S	S	*	*			trans	69.5	145.5	174.1	-57.7	-90.5	0	0	0	118
477	G	36.2	Very low	37.4	Very low	63 Å²	63	140.2 Å²	140.2	65%	0.649	75%	0.754	S	S	*	*			cis	160.7	136.7	-15.1	0	0	0	0	0	115.3
478	N	34.9	Very low	37.2	Very low	168 Å²	168	139.3 Å²	139.3	90%	0.898	76%	0.756	S	S	*	*			trans	63.5	153.1	158.2	-65.4	-0.6	0	0	0	120
479	S	37.5	Very low	37.2	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	76%	0.755	S	S	*	*			cis	-167.2	174.1	-15.6	57.4	0	0	0	0	113.3
480	T	38.5	Very low	36.8	Very low	104 Å²	104	134.1 Å²	134.1	64%	0.638	76%	0.759	S	S	*	*			trans	69.8	115.7	146.3	43.4	0	0	0	0	123.9
481	N	37.8	Very low	36.6	Very low	145 Å²	145	133.5 Å²	133.5	78%	0.775	77%	0.767	S	S	*	*			trans	70.9	157	133.9	-45.8	-7.3	0	0	0	119.5
482	E	37.3	Very low	36.4	Very low	161 Å²	161	132 Å²	132	75%	0.752	76%	0.764	S	S	*	*			cis	-137.6	146.2	8.3	-81.4	-169.1	130.9	0	0	114.3
483	I	41	Very low	36.3	Very low	135 Å²	135	134.8 Å²	134.8	69%	0.692	77%	0.773	S	S	*	*				43	119.2	128.4	-51	170.8	0	0	0	120.4
484	D	38.7	Very low	35.7	Very low	152 Å²	152	136.5 Å²	136.5	81%	0.813	78%	0.778	S	S	*	*				-166.3	179.1	86.9	-144.6	-17.9	0	0	0	114
485	S	36.1	Very low	35.6	Very low	100 Å²	100	133.2 Å²	133.2	70%	0.699	78%	0.779	S	S	*	*			trans	-132.8	-176.8	-146.9	-49.7	0	0	0	0	116.7
486	V	37.7	Very low	35.5	Very low	137 Å²	137	139 Å²	139	83%	0.83	79%	0.791	S	S	*	*			trans	123.5	88.4	164	174.4	0	0	0	0	111.3
487	R	36	Very low	35.3	Very low	227 Å²	227	133 Å²	133	86%	0.857	78%	0.783	S	S	*	*				80.5	88	77.9	-173.2	-178.7	-102.3	-150.9	-4.3	112.2
488	V	33.7	Very low	35.3	Very low	142 Å²	142	140 Å²	140	86%	0.861	80%	0.796	S	S	*	*				79.2	129	89.5	167.1	0	0	0	0	114.5
489	G	36.6	Very low	35.3	Very low	78 Å²	78	136.4 Å²	136.4	80%	0.804	79%	0.789	S	S	*	*			trans	-173.3	88.7	170	0	0	0	0	0	111.3
490	V	31.3	Very low	34.9	Very low	136 Å²	136	137.8 Å²	137.8	82%	0.824	80%	0.799	S	S	*	*			trans	-101.7	136.4	173.9	174.4	0	0	0	0	108.7	V492	V490-V492 HydrophobicContact CG1-CG2 4.35Å
491	G	35.9	Very low	34.6	Very low	78 Å²	78	142 Å²	142	80%	0.804	81%	0.811	S	S	*	*			trans	-139.3	118.3	171.8	0	0	0	0	0	110.2
492	V	30.9	Very low	34.3	Very low	123 Å²	123	140.2 Å²	140.2	75%	0.745	81%	0.805	S	S	*	*			trans	-127.4	125.4	174.9	174.2	0	0	0	0	106.7	V490	V490-V492 HydrophobicContact CG1-CG2 4.35Å
493	E	35.9	Very low	34.2	Very low	192 Å²	192	141.2 Å²	141.2	90%	0.897	81%	0.81	S	S	*	*			trans	-154.3	129.9	168.8	-121.3	160.5	-135.9	0	0	111.8
494	N	27.9	Very low	33.7	Very low	160 Å²	160	140.6 Å²	140.6	86%	0.856	81%	0.808	S	S	*	*			trans	-108.1	130.8	170.2	-79.1	-37.5	0	0	0	107.9
495	A	34.8	Very low	33.6	Very low	94 Å²	94	144.1 Å²	144.1	78%	0.777	81%	0.811	S	S	*	*			trans	-154.2	115.8	168.5	0	0	0	0	0	115.8
496	F	33	Very low	33.3	Very low	195 Å²	195	146.4 Å²	146.4	86%	0.855	82%	0.816	S	S	*	*			trans	39.1	105.4	135.7	-73.4	-88.6	0	0	0	122.9
497	S	30.3	Very low	33.2	Very low	110 Å²	110	146.4 Å²	146.4	77%	0.769	82%	0.816	S	S	*	*				19.5	119.3	116.4	-48.2	0	0	0	0	121.3
498	K	36.2	Very low	33.1	Very low	212 Å²	212	140.6 Å²	140.6	92%	0.922	81%	0.811	S	S	*	*			trans	177.6	158.4	141.4	-99.2	176.5	177.9	-178.7	0	107.8
499	A	34.2	Very low	33.1	Very low	91 Å²	91	140.2 Å²	140.2	75%	0.752	81%	0.811	S	S	*	*			cis	-162.4	167.3	-28.6	0	0	0	0	0	107.7
500	S	29	Very low	33.4	Very low	121 Å²	121	145.9 Å²	145.9	85%	0.846	81%	0.814	S	S	*	*			trans	-71.4	144.7	178.5	-44.2	0	0	0	0	113.3
501	E	32.9	Very low	33.5	Very low	192 Å²	192	143.9 Å²	143.9	90%	0.897	81%	0.811	S	S	*	*			trans	-151.8	167.8	139.2	-161.2	129.6	-144.9	0	0	110.5
502	V	30.2	Very low	33.7	Very low	108 Å²	108	149 Å²	149	66%	0.655	81%	0.814	S	S	*	*			trans	-117.5	143.7	-163.5	173.6	0	0	0	0	111.3
503	Q	35.8	Very low	33.8	Very low	183 Å²	183	147.9 Å²	147.9	86%	0.855	81%	0.812	S	S	*	*			trans	-160.1	121.8	148	-117	152.2	75.8	0	0	112.7
504	D	30.7	Very low	34.1	Very low	121 Å²	121	145.9 Å²	145.9	65%	0.647	81%	0.806	S	S	*	*			trans	-78.7	151.1	170.6	-61.6	-80.9	0	0	0	111.9
505	Y	36	Very low	34.5	Very low	226 Å²	226	145.2 Å²	145.2	89%	0.886	80%	0.798	S	S	*	*			trans	-150.6	128.9	142	-89	-67.6	0	0	0	110.9
506	N	30.4	Very low	34.6	Very low	149 Å²	149	146.9 Å²	146.9	80%	0.797	79%	0.794	S	S	*	*			trans	-103.5	140.5	178.9	-81.4	-73.7	0	0	0	111.4
507	T	35.4	Very low	34.9	Very low	136 Å²	136	143.2 Å²	143.2	83%	0.834	79%	0.793	S	S	*	*			trans	-143.6	103	161.8	-45.2	0	0	0	0	113.5
508	S	33.9	Very low	35.3	Very low	106 Å²	106	142.3 Å²	142.3	74%	0.741	79%	0.792	S	S	*	*			trans	28.1	125.4	148	-51.2	0	0	0	0	122.8
509	P	34.1	Very low	35.3	Very low	133 Å²	133	137.7 Å²	137.7	86%	0.864	78%	0.782	S	S	*	*			trans	-78.2	168.2	147.7	36	-33.3	0	0	0	111.3
510	K	42.3	Very low	35.4	Very low	198 Å²	198	139.9 Å²	139.9	86%	0.861	79%	0.786	S	S	*	*			trans	-114.2	137.6	-178.7	-152.3	-176.3	-173.7	-164.7	0	111.4
511	A	33	Very low	35.7	Very low	94 Å²	94	138.1 Å²	138.1	78%	0.777	78%	0.778	S	S	*	*			trans	-133.1	156.7	172.9	0	0	0	0	0	110
512	E	40.1	Very low	35.9	Very low	185 Å²	185	134.8 Å²	134.8	86%	0.864	78%	0.777	S	S	*	*			trans	-114.2	164.3	170.7	-69.9	-173.4	159.2	0	0	110.6
513	S	34.4	Very low	35.9	Very low	100 Å²	100	135.6 Å²	135.6	70%	0.699	78%	0.782	S	S	*	*			trans	-111	157	-148.3	-175.9	0	0	0	0	114.5
514	L	40.9	Very low	35.8	Very low	149 Å²	149	136 Å²	136	78%	0.78	78%	0.784	S	S	*	*			trans	141.3	138.8	137.1	-74.4	168.8	0	0	0	111.4
515	Q	37.5	Very low	35.9	Very low	146 Å²	146	138.8 Å²	138.8	68%	0.682	79%	0.793	S	S	*	*			cis	-161.7	164.3	-35.9	-149	176.8	-6.6	0	0	108.5
516	N	36.7	Very low	35.7	Very low	130 Å²	130	133.9 Å²	133.9	70%	0.695	79%	0.788	S	S	*	*			trans	77.2	117.2	170.6	-47.2	-33.8	0	0	0	114.7
517	S	39.8	Very low	35.7	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	80%	0.795	S	S	*	*				71.9	132.7	71.3	-59.5	0	0	0	0	112.2
518	A	37.3	Very low	35.4	Very low	91 Å²	91	142.9 Å²	142.9	75%	0.752	80%	0.796	S	S	*	*			cis	-169.2	167.1	8	0	0	0	0	0	108.9
519	T	36	Very low	35.4	Very low	116 Å²	116	147.6 Å²	147.6	71%	0.712	80%	0.803	S	S	*	*			cis	-173.2	161.4	-15.5	-89.2	0	0	0	0	109.1
520	T	37	Very low	35.2	Very low	136 Å²	136	147.2 Å²	147.2	83%	0.834	79%	0.794	S	S	*	*			trans	64.7	159.8	171.6	43.7	0	0	0	0	119.8
521	A	34.7	Very low	34.7	Very low	84 Å²	84	150.1 Å²	150.1	69%	0.694	80%	0.8	S	S	*	*			cis	178.4	132.1	-45.6	0	0	0	0	0	110.4
522	S	37.1	Very low	34.6	Very low	123 Å²	123	150.8 Å²	150.8	86%	0.86	80%	0.799	S	S	*	*			trans	-179.6	123.5	137.5	-81.5	0	0	0	0	113.2
523	T	30.7	Very low	34.2	Very low	125 Å²	125	145 Å²	145	77%	0.767	78%	0.782	S	S	*	*			trans	-43.5	158.8	157.8	-8.8	0	0	0	0	112.4
524	E	34.5	Very low	34.1	Very low	192 Å²	192	147.6 Å²	147.6	90%	0.897	78%	0.783	S	S	*	*				-142.9	179.1	54.8	-79.5	-164.1	126.4	0	0	116.5
525	Q	31.4	Very low	33.5	Very low	179 Å²	179	143.9 Å²	143.9	84%	0.836	77%	0.77	S	S	*	*			trans	-103.2	157.9	-164.7	-81.5	-169.1	-18.5	0	0	115.6
526	P	32.8	Very low	33.3	Very low	122 Å²	122	147 Å²	147	79%	0.792	78%	0.781	S	S	*	*			trans	-82.9	159	174.2	35.3	-36.5	0	0	0	113.4
527	R	30.7	Very low	32.8	Very low	250 Å²	250	149.7 Å²	149.7	94%	0.943	79%	0.787	S	S	*	*			trans	-127.8	139.6	161.2	-79.3	-171.1	172.2	-172.2	-1	111.7
528	R	28.4	Very low	32.6	Very low	225 Å²	225	147.5 Å²	147.5	85%	0.849	78%	0.783	S	S	*	*			trans	-77.5	156.3	170.7	-56.2	-179.3	-178.6	-162.5	2.5	110.7
529	K	35	Very low	32.1	Very low	205 Å²	205	148.9 Å²	148.9	89%	0.891	78%	0.782	S	S	*	*				-158.9	141.9	125.5	-108.2	171.7	-177.4	-173.2	0	110.2
530	D	28.9	Very low	31.9	Very low	125 Å²	125	152.5 Å²	152.5	67%	0.668	79%	0.791	S	S	*	*			trans	-85.7	157.2	173.6	-46.5	-94.5	0	0	0	110
531	W	32.8	Very low	31.5	Very low	259 Å²	259	151.4 Å²	151.4	98%	0.981	78%	0.784	S	S	*	*			trans	172.7	175.8	134.3	-89.1	20.8	0	0	0	110.8
532	S	30	Very low	31.4	Very low	108 Å²	108	155.1 Å²	155.1	76%	0.755	79%	0.791	S	S	*	*			trans	-113.1	161.1	-152.8	45	0	0	0	0	116.2
533	A	31.7	Very low	31	Very low	62 Å²	62	153.7 Å²	153.7	51%	0.512	78%	0.782	S	S	.	*			trans	33.2	130.8	146.7	0	0	0	0	0	121.6	L448 E449	L448-A533 HydrophobicContact CD1-CB 3.97Å; E449-A533 WeakPolarHBondContact OE1-CB 3.45Å
534	Q	33.2	Very low	31	Very low	156 Å²	156	154.5 Å²	154.5	73%	0.729	78%	0.78	S	S	*	*				-167.1	171.9	116.2	-105.3	-176.7	6.1	0	0	110.9	E449	E449-Q534 WeakPolarHBondContact OE2-CG 3.41Å; E449-Q534 PolarHBondContact OE2-NE2 3.16Å
535	S	28.6	Very low	30.8	Very low	71 Å²	71	150.9 Å²	150.9	50%	0.497	77%	0.767	S	S	.	*			trans	-120.7	156.6	-172.8	53.3	0	0	0	0	112.9
536	F	31.5	Very low	30.7	Very low	210 Å²	210	148.9 Å²	148.9	92%	0.921	76%	0.762	S	S	*	*			trans	-147.5	150.2	156.3	-129.7	-90.9	0	0	0	112.1
537	F	27.3	Very low	30.7	Very low	188 Å²	188	147.8 Å²	147.8	83%	0.825	76%	0.758	S	S	*	*			trans	-120.9	154.5	178.4	-118.7	-86.8	0	0	0	109.4
538	G	34.2	Very low	30.7	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	75%	0.754	S	S	*	*			trans	-153.7	139.6	173.8	0	0	0	0	0	110.9
539	V	27.2	Very low	30.9	Very low	119 Å²	119	133.6 Å²	133.6	72%	0.721	75%	0.748	S	S	*	*			trans	-139.9	137.3	-174.5	174.2	0	0	0	0	108.3
540	E	32.3	Very low	30.7	Very low	193 Å²	193	131 Å²	131	90%	0.902	75%	0.745	S	S	*	*			trans	-158.8	165.5	150.9	-118.2	160.2	-152.7	0	0	111
541	T	27.5	Very low	30.8	Very low	113 Å²	113	132.7 Å²	132.7	69%	0.693	75%	0.752	S	S	*	*			trans	-135.1	-164.2	-163.4	54.3	0	0	0	0	111.7
542	L	32.6	Very low	30.6	Very low	161 Å²	161	128.6 Å²	128.6	84%	0.843	74%	0.741	S	S	*	*			trans	87.6	155.2	172.4	-50.2	171.5	0	0	0	116.6
543	S	29.2	Very low	30.7	Very low	94 Å²	94	129.8 Å²	129.8	66%	0.657	74%	0.739	S	S	*	*			cis	-176.5	168.9	-39.5	-146.5	0	0	0	0	109.7
544	L	31.4	Very low	30.8	Very low	142 Å²	142	134.5 Å²	134.5	74%	0.743	75%	0.751	S	S	*	*			trans	65.5	156.4	168.1	-82.3	77	0	0	0	116.2
545	D	31.1	Very low	30.6	Very low	116 Å²	116	130.6 Å²	130.6	62%	0.62	75%	0.752	S	S	*	*			cis	-167.9	155.5	-19.4	-115.2	6.9	0	0	0	111.2
546	N	29.3	Very low	30.7	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	76%	0.764	S	S	*	*			trans	58.1	155.3	143.7	-66.8	-37.1	0	0	0	121.7
547	S	32.5	Very low	30.5	Very low	100 Å²	100	130.7 Å²	130.7	70%	0.699	76%	0.757	S	S	*	*			cis	-167.6	147.6	-13.9	49.4	0	0	0	0	113.3
548	A	30.3	Very low	30.8	Very low	105 Å²	105	130.3 Å²	130.3	87%	0.868	76%	0.755	S	S	*	*			trans	60.7	129.2	137.1	0	0	0	0	0	124.2
549	G	32.4	Very low	30.7	Very low	71 Å²	71	131 Å²	131	73%	0.732	75%	0.753	S	S	*	*			trans	111.1	152.1	131.5	0	0	0	0	0	118.6
550	D	30.1	Very low	31	Very low	152 Å²	152	130.5 Å²	130.5	81%	0.813	75%	0.751	S	S	*	*			cis	-169.9	179.7	-21.4	-144.8	-27.4	0	0	0	111.2
551	I	31	Very low	31	Very low	160 Å²	160	127.7 Å²	127.7	82%	0.821	74%	0.742	S	S	*	*			trans	84.4	157.7	159	-65.1	152.3	0	0	0	117.7
552	F	28.8	Very low	31.5	Very low	173 Å²	173	129.7 Å²	129.7	76%	0.759	75%	0.749	S	S	*	*			trans	-142.5	-165	-145.4	-150.7	-103.5	0	0	0	111.8
553	D	32.4	Very low	31.6	Very low	133 Å²	133	126.4 Å²	126.4	71%	0.711	74%	0.739	S	S	*	*			trans	77.6	152.4	166.8	-75.4	-17.9	0	0	0	120.4
554	Q	33.1	Very low	31.6	Very low	161 Å²	161	129.3 Å²	129.3	75%	0.752	75%	0.746	S	S	*	*			cis	179.6	148.6	-47.7	-112.2	-167.6	101.2	0	0	110.4
555	G	30.6	Very low	31.6	Very low	73 Å²	73	130.5 Å²	130.5	75%	0.753	75%	0.751	S	S	*	*			trans	89.3	160.7	161.3	0	0	0	0	0	117.1
556	S	29.4	Very low	31.5	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	76%	0.761	S	S	*	*			cis	-168	168.9	-7.8	-163.3	0	0	0	0	111.6
557	F	28	Very low	31.5	Very low	175 Å²	175	130 Å²	130	77%	0.768	77%	0.766	S	S	*	*			trans	69.9	157.3	166.7	-103.6	-118.2	0	0	0	118.6
558	K	33.6	Very low	31.5	Very low	180 Å²	180	130.3 Å²	130.3	78%	0.783	77%	0.768	S	S	*	*			cis	175.7	159.6	-48.7	-100.7	-92.2	-174.7	176.9	0	109.7
559	A	31.8	Very low	31.7	Very low	85 Å²	85	132.3 Å²	132.3	70%	0.702	77%	0.769	S	S	*	*			trans	74.2	150	160.8	0	0	0	0	0	117.7
560	T	33.3	Very low	31.6	Very low	110 Å²	110	137.1 Å²	137.1	68%	0.675	77%	0.773	S	S	*	*			cis	-163.8	142.6	-10.2	18.5	0	0	0	0	112.3
561	D	33.6	Very low	31.7	Very low	134 Å²	134	139.8 Å²	139.8	72%	0.717	77%	0.773	S	S	*	*			trans	56.2	154.3	136.7	-52.5	-11.3	0	0	0	125.4
562	N	37.1	Very low	31.5	Very low	154 Å²	154	137.3 Å²	137.3	82%	0.824	77%	0.768	S	S	*	*			trans	92	148.7	161.3	-52.7	-71.9	0	0	0	119.1
563	S	34.4	Very low	31.9	Very low	92 Å²	92	136.4 Å²	136.4	64%	0.643	77%	0.766	S	S	*	*			cis	-168.3	147.4	-35.1	52.5	0	0	0	0	111.7
564	I	29	Very low	32	Very low	155 Å²	155	137.5 Å²	137.5	80%	0.795	77%	0.767	S	S	*	*			trans	36.9	126.3	146.7	-53	161.8	0	0	0	120.4
565	I	32.8	Very low	32	Very low	168 Å²	168	138 Å²	138	86%	0.862	77%	0.774	S	S	*	*				-172.1	154.6	129.4	-99	155.3	0	0	0	110.9
566	C	27.2	Very low	31.9	Very low	123 Å²	123	139.3 Å²	139.3	83%	0.831	77%	0.772	S	S	*	*			trans	-148.9	142.7	-178.7	172.3	0	0	0	0	110.7
567	S	30.8	Very low	32.5	Very low	117 Å²	117	139.5 Å²	139.5	82%	0.818	77%	0.77	S	S	*	*			trans	-176.3	160.1	149.9	47.7	0	0	0	0	114.5
568	S	31.5	Very low	32.9	Very low	108 Å²	108	140.4 Å²	140.4	76%	0.755	78%	0.777	S	S	*	*			trans	-83.1	166.9	-170.3	-35.5	0	0	0	0	116
569	V	34.6	Very low	32.7	Very low	146 Å²	146	139.3 Å²	139.3	89%	0.885	78%	0.778	S	S	*	*			trans	-135.9	143.2	146.2	-176.2	0	0	0	0	109
570	E	30.8	Very low	32.8	Very low	172 Å²	172	139.6 Å²	139.6	80%	0.804	78%	0.781	S	S	*	*			trans	-96.6	167.7	-176.7	-54.8	166.4	110.4	0	0	112.4
571	Y	32.6	Very low	32.7	Very low	208 Å²	208	142 Å²	142	82%	0.816	79%	0.786	S	S	*	*			trans	-157.5	134.5	133.4	-119.6	-77.1	0	0	0	111.8	H573	Y571-H573 AromaticContact CE1-NE2 3.67Å
572	C	27.5	Very low	32.8	Very low	108 Å²	108	143.3 Å²	143.3	73%	0.73	79%	0.788	S	S	*	*			trans	-153.4	145.3	172.9	-176.9	0	0	0	0	109.1
573	H	36	Very low	32.5	Very low	155 Å²	155	141.9 Å²	141.9	72%	0.718	79%	0.785	S	S	*	*			trans	-125.6	132.7	170.4	-84.5	-58.3	0	0	0	110.5	Y571	Y571-H573 AromaticContact CE1-NE2 3.67Å
574	Q	34.4	Very low	32.1	Very low	156 Å²	156	142.8 Å²	142.8	73%	0.729	79%	0.79	S	S	*	*			trans	-81.1	163.6	-175.4	-49	93.4	-21.5	0	0	112.2
575	L	33.7	Very low	32.3	Very low	171 Å²	171	145.3 Å²	145.3	90%	0.895	80%	0.795	S	S	*	*				-165.9	140.6	118.8	-99.3	161.3	0	0	0	110.1
576	S	28.9	Very low	32.3	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	79%	0.787	S	S	*	*			trans	-144.1	-155.5	-175.5	-37.8	0	0	0	0	107.8
577	P	42.1	Very low	32.5	Very low	112 Å²	112	143.7 Å²	143.7	73%	0.727	79%	0.79	S	S	*	*				-116.9	-172	-57.1	38	-25.4	0	0	0	110.3
578	E	34.5	Very low	32.7	Very low	194 Å²	194	142.5 Å²	142.5	91%	0.907	78%	0.781	S	S	*	*				-155.7	159	128.7	-128.6	178.8	176.6	0	0	113.6
579	I	30.2	Very low	32.9	Very low	157 Å²	157	148.2 Å²	148.2	81%	0.805	79%	0.786	S	S	*	*			trans	-134	126.1	-174.8	-63.3	169.8	0	0	0	108.5
580	A	34.3	Very low	32.9	Very low	92 Å²	92	147.8 Å²	147.8	76%	0.76	78%	0.784	S	S	*	*			trans	-146.8	115.2	166	0	0	0	0	0	112.4
581	M	31.2	Very low	33.1	Very low	159 Å²	159	143.6 Å²	143.6	78%	0.783	79%	0.787	S	S	*	*				25.8	148.7	129.3	-39.4	-160.1	97.7	0	0	119.6
582	Q	34.7	Very low	33.5	Very low	163 Å²	163	139.1 Å²	139.1	76%	0.762	79%	0.786	S	S	*	*			cis	-160.9	178.9	13.5	-140.5	158.4	7.5	0	0	111.7
583	T	31.2	Very low	34.1	Very low	123 Å²	123	138.9 Å²	138.9	76%	0.755	78%	0.783	S	S	*	*			trans	-100.7	147.8	-177.2	46.2	0	0	0	0	114.4
584	C	26.7	Very low	34.1	Very low	111 Å²	111	138.2 Å²	138.2	75%	0.75	78%	0.784	S	S	*	*			trans	72.9	125	147.2	-71.8	0	0	0	0	122.9
585	K	33.7	Very low	34.3	Very low	209 Å²	209	136.9 Å²	136.9	91%	0.909	79%	0.789	S	S	*	*			trans	80	149.1	146.2	-63.7	173.6	178.4	-179.2	0	120.6
586	G	32.5	Very low	34.5	Very low	67 Å²	67	137.3 Å²	137.3	69%	0.691	78%	0.784	S	S	*	*			trans	89.1	93.5	167.9	0	0	0	0	0	113.9
587	E	31.7	Very low	34.8	Very low	190 Å²	190	140.7 Å²	140.7	89%	0.888	79%	0.792	S	S	*	*				89.6	137.1	67.5	-79.7	-165.5	139.4	0	0	115.7
588	S	32.9	Very low	34.6	Very low	91 Å²	91	138.6 Å²	138.6	64%	0.636	79%	0.791	S	S	*	*			trans	70.7	112.5	153.8	-71.6	0	0	0	0	122
589	R	37.2	Very low	34.8	Very low	228 Å²	228	135.9 Å²	135.9	86%	0.86	79%	0.788	S	S	*	*			trans	71.5	158.3	138.8	-57.2	173.1	-171.8	-161.3	0.9	117.1
590	T	34.1	Very low	35.2	Very low	137 Å²	137	135.2 Å²	135.2	84%	0.84	78%	0.781	S	S	*	*			cis	-165.8	138.6	-26.4	28.5	0	0	0	0	106.1
591	G	35.7	Very low	35.3	Very low	84 Å²	84	136 Å²	136	87%	0.866	78%	0.777	S	S	*	*			trans	164.7	118.9	170.1	0	0	0	0	0	116
592	S	39.8	Very low	35.5	Very low	114 Å²	114	132.3 Å²	132.3	80%	0.797	77%	0.765	S	S	*	*			trans	-130.5	179.7	176.7	61.8	0	0	0	0	108.3
593	P	40.3	Very low	35.5	Very low	104 Å²	104	132 Å²	132	68%	0.675	76%	0.762	S	S	*	*			cis	-135.6	-169.7	-29.1	37.4	-17.8	0	0	0	113.6
594	L	35.4	Very low	35.7	Very low	141 Å²	141	135.6 Å²	135.6	74%	0.738	77%	0.767	S	S	*	*			trans	27.5	145.6	136	-73.5	168.4	0	0	0	121.7
595	P	38.7	Very low	35.9	Very low	128 Å²	128	135.5 Å²	135.5	83%	0.831	77%	0.767	S	S	*	*				-152.9	-160.3	67.3	43.4	-22	0	0	0	117.9
596	K	37.8	Very low	35.8	Very low	179 Å²	179	131.2 Å²	131.2	78%	0.778	76%	0.758	S	S	*	*			trans	-121	154.5	-166	-43.1	164.4	-175.8	172.7	0	112.8
597	I	36.4	Very low	35.9	Very low	172 Å²	172	134.8 Å²	134.8	88%	0.882	77%	0.766	S	S	*	*			trans	-143.2	143	147.2	-71.5	101.5	0	0	0	104.1
598	G	38.4	Very low	35.9	Very low	67 Å²	67	133.1 Å²	133.1	69%	0.691	76%	0.759	S	S	*	*			cis	132	155.8	20.2	0	0	0	0	0	107.3
599	T	38.8	Very low	36	Very low	137 Å²	137	134.3 Å²	134.3	84%	0.84	76%	0.762	S	S	*	*			cis	-156.4	175.8	-4.3	68.4	0	0	0	0	106
600	E	37.4	Very low	35.8	Very low	143 Å²	143	130.3 Å²	130.3	67%	0.668	76%	0.758	S	S	*	*			cis	-165.7	-171.4	-3.2	-144.9	-69.4	79	0	0	105.6
601	V	37.6	Very low	35.7	Very low	110 Å²	110	128.3 Å²	128.3	67%	0.667	76%	0.755	S	S	*	*			trans	75.8	125.6	151.3	164.9	0	0	0	0	116.5
602	C	33.5	Very low	35.6	Very low	81 Å²	81	131.4 Å²	131.4	55%	0.547	76%	0.757	S	S	.	*			cis	-159.1	142.3	-2	-121.2	0	0	0	0	113.1
603	K	36.5	Very low	35.1	Very low	157 Å²	157	131 Å²	131	68%	0.683	75%	0.754	S	S	*	*				38.8	133.2	125.1	-63.4	168.6	-157.5	138.4	0	118.2
604	K	35.2	Very low	34.7	Very low	198 Å²	198	132.1 Å²	132.1	86%	0.861	76%	0.759	S	S	*	*			cis	-167.5	155.9	25.2	-120.7	163.6	-177	-176.7	0	111.2
605	S	29.6	Very low	34.4	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	76%	0.761	S	S	*	*			trans	-131.5	162.9	156.1	61.1	0	0	0	0	109.7
606	T	33	Very low	34.2	Very low	119 Å²	119	132.5 Å²	132.5	73%	0.73	76%	0.759	S	S	*	*			trans	130.8	97	167.6	-60.1	0	0	0	0	113.7
607	V	34	Very low	33.9	Very low	142 Å²	142	129.6 Å²	129.6	86%	0.861	76%	0.756	S	S	*	*			trans	-165	118.2	143.4	178.4	0	0	0	0	102.9
608	Q	32.6	Very low	34	Very low	155 Å²	155	128.8 Å²	128.8	72%	0.724	75%	0.754	S	S	*	*			cis	91.1	122.5	17.9	-140.9	-178.5	40.3	0	0	116
609	V	34.3	Very low	33.7	Very low	116 Å²	116	135.1 Å²	135.1	70%	0.703	76%	0.763	S	S	*	*			trans	62.6	120.7	169.6	-74.3	0	0	0	0	122.6
610	D	33.1	Very low	33.8	Very low	144 Å²	144	133.1 Å²	133.1	77%	0.77	75%	0.754	S	S	*	*				76	108	126.2	-55.4	-10.9	0	0	0	124.6
611	A	31.4	Very low	33.9	Very low	96 Å²	96	129.5 Å²	129.5	79%	0.793	75%	0.745	S	S	*	*				48.3	101.8	121.8	0	0	0	0	0	121.2
612	V	33.6	Very low	34.1	Very low	148 Å²	148	129.6 Å²	129.6	90%	0.897	75%	0.748	S	S	*	*			trans	-133.5	123.5	136.6	178.5	0	0	0	0	109.8
613	S	29	Very low	34.5	Very low	107 Å²	107	130.8 Å²	130.8	75%	0.748	75%	0.748	S	S	*	*			trans	-85.1	139.1	170	58.5	0	0	0	0	111.7
614	V	32.7	Very low	34.8	Very low	126 Å²	126	124.9 Å²	124.9	76%	0.764	73%	0.729	S	S	*	*			trans	-166.7	139.6	141.8	129.9	0	0	0	0	110.1
615	A	29.7	Very low	35.3	Very low	95 Å²	95	125.6 Å²	125.6	79%	0.785	73%	0.726	S	S	*	*			trans	-73.2	135.3	176.1	0	0	0	0	0	111.5
616	K	34.7	Very low	35.7	Very low	182 Å²	182	127 Å²	127	79%	0.791	72%	0.722	S	S	*	*			trans	-144.4	103.1	160.9	-110	152.6	-170.6	171	0	112.1
617	T	30.8	Very low	36.4	Very low	118 Å²	118	123.3 Å²	123.3	72%	0.724	70%	0.702	S	S	*	*			trans	-29	129.2	162.9	50.2	0	0	0	0	114.4
618	N	37.7	Very low	36.8	Very low	156 Å²	156	125.2 Å²	125.2	83%	0.834	69%	0.693	S	S	*	*			trans	-139.3	103.6	160.7	-93.6	-58.5	0	0	0	110.8	S620	N618-S620 VanDerWaalsContact C-N 3.31Å; N618-S620 PolarHBondContact O-N 3.4Å
619	F	33	Very low	37.4	Very low	200 Å²	200	126.1 Å²	126.1	88%	0.877	70%	0.695	S	S	*	*			trans	-70.8	81	176.3	-87.4	-99.1	0	0	0	111	S621	F619-S621 VanDerWaalsContact C-N 3.26Å; F619-S621 PolarHBondContact O-N 3Å
620	S	40	Very low	38	Very low	94 Å²	94	125.6 Å²	125.6	66%	0.657	69%	0.687	S	S	*	*			trans	-67.2	85.8	166.1	168.1	0	0	0	0	109.8	N618	N618-S620 VanDerWaalsContact C-N 3.31Å; N618-S620 PolarHBondContact O-N 3.4Å
621	S	40.6	Very low	38.5	Very low	67 Å²	67	121.5 Å²	121.5	47%	0.469	67%	0.667	S	S	.	*			trans	-51.5	155.6	-173.1	73.1	0	0	0	0	114.3	F619 L623 A624	F619-S621 VanDerWaalsContact C-N 3.26Å; F619-S621 PolarHBondContact O-N 3Å; S621-L623 PolarHBondContact O-N 3.14Å; S621-A624 PolarHBondContact O-N 2.72Å
622	P	41	Very low	39.4	Very low	112 Å²	112	125.5 Å²	125.5	73%	0.727	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.2	-22.1	-176	-30.8	36.8	0	0	0	116.5	A624 R625	P622-A624 PolarHBondContact O-N 3.2Å; P622-R625 PolarHBondContact O-N 3.34Å; P622-R625 VanDerWaalsContact O-N 3.14Å
623	L	41.3	Very low	40	Very low	107 Å²	107	125.1 Å²	125.1	56%	0.56	66%	0.66	S	S	*	*	H	α-helix	trans	-54.7	-34.9	172.7	-113.4	68.8	0	0	0	113.1	S621 R625 M626 S627	S621-L623 PolarHBondContact O-N 3.14Å; L623-R625 PolarHBondContact O-N 2.79Å; L623-M626 PolarHBondContact O-N 3.22Å; L623-S627 PolarHBondContact O-N 3.48Å
624	A	44.1	Very low	40.6	Very low	33 Å²	33	120.9 Å²	120.9	27%	0.273	63%	0.631	S	S	.	*	H	α-helix	trans	-73.4	-7.2	-178.6	0	0	0	0	0	114.5	S621 P622 R628	S621-A624 PolarHBondContact O-N 2.72Å; P622-A624 PolarHBondContact O-N 3.2Å; A624-R628 PolarHBondContact O-NE 3.25Å
625	R	44.3	Very low	41.5	Very low	213 Å²	213	120.2 Å²	120.2	80%	0.804	62%	0.622	S	S	*	*	H	α-helix	trans	-95.7	-22.6	172	-165.3	169.4	177.5	175.1	-3.2	112.2	P622 L623	P622-R625 PolarHBondContact O-N 3.34Å; P622-R625 VanDerWaalsContact O-N 3.14Å; L623-R625 PolarHBondContact O-N 2.79Å
626	M	38.4	Very low	42.1	Very low	136 Å²	136	122.1 Å²	122.1	67%	0.67	62%	0.619	S	S	*	*	H	α-helix	trans	-80.5	-38	177.4	-61.1	-168.8	85.2	0	0	112.9	L623 R628 K629 L630	L623-M626 PolarHBondContact O-N 3.22Å; M626-R628 VanDerWaalsContact C-N 3.32Å; M626-R628 PolarHBondContact O-N 2.63Å; M626-K629 PolarHBondContact O-N 3.12Å; M626-L630 PolarHBondContact O-N 2.95Å
627	S	47.7	Very low	43	Very low	43 Å²	43	120.4 Å²	120.4	30%	0.301	61%	0.607	S	S	.	*	H	α-helix	trans	-56.3	-43.7	178.1	49.7	0	0	0	0	112.5	L623 K629 L630 V631	L623-S627 PolarHBondContact O-N 3.48Å; S627-K629 VanDerWaalsContact C-N 3.3Å; S627-K629 PolarHBondContact O-N 2.7Å; S627-L630 PolarHBondContact O-N 3.47Å; S627-V631 WeakPolarHBondContact O-CG2 3.26Å; S627-V631 PolarHBondContact O-N 3.26Å
628	R	43.8	Very low	44.2	Very low	181 Å²	181	118.1 Å²	118.1	68%	0.683	59%	0.593	S	S	*	*	H	α-helix	trans	-64.3	-26.2	179.6	-75.3	-173.3	-93.1	-170.9	-7	114.5	A624 M626	A624-R628 PolarHBondContact O-NE 3.25Å; M626-R628 VanDerWaalsContact C-N 3.32Å; M626-R628 PolarHBondContact O-N 2.63Å
629	K	43.6	Very low	45.3	Very low	175 Å²	175	115.4 Å²	115.4	76%	0.761	58%	0.584	S	S	*	*	H	α-helix	trans	-83	-21.6	172	-75	-159.4	173.3	-166	0	113.4	M626 S627	M626-K629 PolarHBondContact O-N 3.12Å; S627-K629 VanDerWaalsContact C-N 3.3Å; S627-K629 PolarHBondContact O-N 2.7Å
630	L	46.6	Very low	47	Very low	104 Å²	104	110.6 Å²	110.6	55%	0.545	57%	0.571	S	S	.	*	H	α-helix	trans	-80.5	-38.2	173.8	-82.5	161.5	0	0	0	112.7	M626 S627 K632 N633 A634	M626-L630 PolarHBondContact O-N 2.95Å; S627-L630 PolarHBondContact O-N 3.47Å; L630-K632 PolarHBondContact O-N 2.78Å; L630-N633 PolarHBondContact O-N 2.68Å; L630-N633 VanDerWaalsContact O-N 3.14Å; L630-A634 PolarHBondContact O-N 2.95Å
631	V	45.5	Very low	47.8	Very low	58 Å²	58	110 Å²	110	35%	0.352	56%	0.559	S	S	.	*	H	α-helix	trans	-62.2	-40.8	179.8	173.3	0	0	0	0	112.3	S627 N633 A634	S627-V631 WeakPolarHBondContact O-CG2 3.26Å; S627-V631 PolarHBondContact O-N 3.26Å; V631-N633 PolarHBondContact O-N 3.31Å; V631-A634 WeakPolarHBondContact O-CB 3.23Å; V631-A634 PolarHBondContact O-N 3.17Å; V631-A634 VanDerWaalsContact O-N 3.17Å
632	K	48.9	Very low	48.7	Very low	181 Å²	181	111 Å²	111	79%	0.787	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-24.5	176.4	-84.4	-165.7	171.2	-171	0	114	L630	L630-K632 PolarHBondContact O-N 2.78Å
633	N	46.6	Very low	49.7	Very low	140 Å²	140	112.1 Å²	112.1	75%	0.749	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	7.4	-179.5	-65.9	12.4	0	0	0	112.7	L630 V631	L630-N633 PolarHBondContact O-N 2.68Å; L630-N633 VanDerWaalsContact O-N 3.14Å; V631-N633 PolarHBondContact O-N 3.31Å
634	A	41.8	Very low	50.6	Low	18 Å²	18	109.3 Å²	109.3	15%	0.149	53%	0.534	C	S	.	.			trans	-84.9	-22.3	179.8	0	0	0	0	0	113.3	L630 V631 L636 R694	L630-A634 PolarHBondContact O-N 2.95Å; V631-A634 WeakPolarHBondContact O-CB 3.23Å; V631-A634 PolarHBondContact O-N 3.17Å; V631-A634 VanDerWaalsContact O-N 3.17Å; A634-L636 PolarHBondContact O-N 3.37Å; A634-R694 PolarHBondContact O-NH2 3.22Å; A634-R694 VanDerWaalsContact O-NH2 3.08Å
635	I	50.9	Low	51.4	Low	111 Å²	111	111 Å²	111	57%	0.569	54%	0.539	S	S	*	.			trans	-73.1	94.8	-177	-46	177.8	0	0	0	110.2	R637	I635-R637 HydrophobicContact CB-CG 4.36Å; I635-R637 HydrophobicContact CG2-CG 3.59Å; I635-R637 PolarHBondContact O-N 2.8Å
636	L	42.3	Very low	52.4	Low	136 Å²	136	108.2 Å²	108.2	71%	0.712	54%	0.535	S	S	*	.			trans	-67.7	79.6	163.8	-74	172.8	0	0	0	109.4	A634 T638	A634-L636 PolarHBondContact O-N 3.37Å; L636-T638 VanDerWaalsContact C-N 3.28Å; L636-T638 PolarHBondContact O-N 2.79Å
637	R	53	Low	53.6	Low	146 Å²	146	108.2 Å²	108.2	55%	0.551	53%	0.534	S	S	*	.			trans	-65.4	83.5	176.8	-74.1	-169.5	170.7	-161	-3	110.7	I635 Q642	I635-R637 HydrophobicContact CB-CG 4.36Å; I635-R637 HydrophobicContact CG2-CG 3.59Å; I635-R637 PolarHBondContact O-N 2.8Å; R637-Q642 HydrophobicContact CB-CG 3.86Å; R637-Q642 PolarHBondContact O-NE2 3.4Å
638	T	56.5	Low	53.7	Low	70 Å²	70	109.4 Å²	109.4	43%	0.429	55%	0.552	S	S	.	*			trans	-54	150.8	168.1	64.3	0	0	0	0	110.1	L636 V640 M641 Q642	L636-T638 VanDerWaalsContact C-N 3.28Å; L636-T638 PolarHBondContact O-N 2.79Å; T638-V640 PolarHBondContact O-N 2.96Å; T638-M641 PolarHBondContact O-N 3.09Å; T638-M641 WeakPolarHBondContact OG1-CG 3.37Å; T638-M641 PolarHBondContact OG1-N 3.33Å; T638-Q642 PolarHBondContact O-N 3.07Å
639	P	61.9	Low	54	Low	99 Å²	99	104.1 Å²	104.1	64%	0.643	54%	0.54	S	S	*	.	H	α-helix	trans	-55.3	-29.3	177.8	-28.1	36	0	0	0	113.4	Q642 K643	P639-Q642 PolarHBondContact O-N 2.88Å; P639-K643 PolarHBondContact O-N 3.43Å
640	V	67.9	Low	54.4	Low	99 Å²	99	100.5 Å²	100.5	60%	0.6	53%	0.527	S	S	*	.	H	α-helix	trans	-65.3	-49	173.2	-176.1	0	0	0	0	111.4	T638 Q642 K643 L644	T638-V640 PolarHBondContact O-N 2.96Å; V640-Q642 VanDerWaalsContact C-N 3.26Å; V640-Q642 PolarHBondContact O-N 3.43Å; V640-K643 PolarHBondContact O-N 3.47Å; V640-L644 HydrophobicContact CG1-CD1 4Å; V640-L644 WeakPolarHBondContact O-CB 3.47Å; V640-L644 WeakPolarHBondContact O-CG 3.2Å; V640-L644 PolarHBondContact O-N 3.25Å
641	M	56.6	Low	54.8	Low	81 Å²	81	100.9 Å²	100.9	40%	0.399	53%	0.534	S	S	.	.	H	α-helix	trans	-64.1	-29.1	175.1	-78	-105.9	62.9	0	0	113.1	T638 N645	T638-M641 PolarHBondContact O-N 3.09Å; T638-M641 WeakPolarHBondContact OG1-CG 3.37Å; T638-M641 PolarHBondContact OG1-N 3.33Å; M641-N645 WeakPolarHBondContact O-CB 3.44Å; M641-N645 PolarHBondContact O-N 3.24Å; M641-N645 PolarHBondContact O-ND2 3.27Å
642	Q	60.7	Low	55.4	Low	88 Å²	88	102.1 Å²	102.1	41%	0.411	54%	0.537	S	S	.	.	H	α-helix	trans	-70	-48.4	173.8	-63.2	-172.5	24.6	0	0	111.5	R637 T638 P639 V640 N645 Q646	R637-Q642 HydrophobicContact CB-CG 3.86Å; R637-Q642 PolarHBondContact O-NE2 3.4Å; T638-Q642 PolarHBondContact O-N 3.07Å; P639-Q642 PolarHBondContact O-N 2.88Å; V640-Q642 VanDerWaalsContact C-N 3.26Å; V640-Q642 PolarHBondContact O-N 3.43Å; Q642-N645 PolarHBondContact O-N 3.18Å; Q642-Q646 VanDerWaalsContact O-CG 3.31Å; Q642-Q646 WeakPolarHBondContact O-CG 3.26Å; Q642-Q646 PolarHBondContact O-N 2.98Å
643	K	61.7	Low	55.6	Low	136 Å²	136	100.7 Å²	100.7	59%	0.591	53%	0.531	S	S	*	.	H	α-helix	trans	-61.5	-44.6	176.1	-74.2	-171.3	174	-167.1	0	112.5	P639 V640 N645 Q646 Q647	P639-K643 PolarHBondContact O-N 3.43Å; V640-K643 PolarHBondContact O-N 3.47Å; K643-N645 PolarHBondContact O-N 2.84Å; K643-Q646 CarbonylContact O-C 2.88Å; K643-Q646 WeakPolarHBondContact O-CB 3.34Å; K643-Q646 PolarHBondContact O-N 3.4Å; K643-Q646 VanDerWaalsContact O-N 3.11Å; K643-Q647 WeakPolarHBondContact O-CB 3.34Å; K643-Q647 VanDerWaalsContact O-CG 3.32Å; K643-Q647 WeakPolarHBondContact O-CG 3.38Å; K643-Q647 PolarHBondContact O-N 3.06Å; K643-Q647 PolarHBondContact O-OE1 2.86Å
644	L	60.7	Low	56.3	Low	47 Å²	47	99.7 Å²	99.7	25%	0.246	53%	0.53	C	S	.	.	H	α-helix	trans	-59.5	-43.2	177	-76	171.8	0	0	0	112.3	V640 Q647 G648 V649	V640-L644 HydrophobicContact CG1-CD1 4Å; V640-L644 WeakPolarHBondContact O-CB 3.47Å; V640-L644 WeakPolarHBondContact O-CG 3.2Å; V640-L644 PolarHBondContact O-N 3.25Å; L644-Q647 CarbonylContact O-C 3.58Å; L644-Q647 PolarHBondContact O-N 3.22Å; L644-G648 PolarHBondContact O-N 3.44Å; L644-G648 VanDerWaalsContact O-N 3.11Å; L644-V649 HydrophobicContact CD2-CB 3.99Å; L644-V649 HydrophobicContact CD2-CG1 4.06Å; L644-V649 PolarHBondContact O-N 3.45Å
645	N	59.1	Low	57.2	Low	70 Å²	70	106.8 Å²	106.8	37%	0.374	56%	0.558	S	S	.	*	H	α-helix	trans	-67.1	-34.6	174.2	-78.5	-16.2	0	0	0	113	M641 Q642 K643 Q647 G648	M641-N645 WeakPolarHBondContact O-CB 3.44Å; M641-N645 PolarHBondContact O-N 3.24Å; M641-N645 PolarHBondContact O-ND2 3.27Å; Q642-N645 PolarHBondContact O-N 3.18Å; K643-N645 PolarHBondContact O-N 2.84Å; N645-Q647 VanDerWaalsContact C-N 3.28Å; N645-G648 PolarHBondContact O-N 3.34Å
646	Q	65.4	Low	57.6	Low	154 Å²	154	107.7 Å²	107.7	72%	0.72	56%	0.564	S	S	*	*	H	α-helix	trans	-68.3	-27.9	173.8	-73.2	166.2	-18.9	0	0	112.4	Q642 K643	Q642-Q646 VanDerWaalsContact O-CG 3.31Å; Q642-Q646 WeakPolarHBondContact O-CG 3.26Å; Q642-Q646 PolarHBondContact O-N 2.98Å; K643-Q646 CarbonylContact O-C 2.88Å; K643-Q646 WeakPolarHBondContact O-CB 3.34Å; K643-Q646 PolarHBondContact O-N 3.4Å; K643-Q646 VanDerWaalsContact O-N 3.11Å
647	Q	64.8	Low	58.6	Low	136 Å²	136	103.5 Å²	103.5	64%	0.636	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-1.1	176.2	-68.1	171.8	-45.1	0	0	113.3	K643 L644 N645 V649	K643-Q647 WeakPolarHBondContact O-CB 3.34Å; K643-Q647 VanDerWaalsContact O-CG 3.32Å; K643-Q647 WeakPolarHBondContact O-CG 3.38Å; K643-Q647 PolarHBondContact O-N 3.06Å; K643-Q647 PolarHBondContact O-OE1 2.86Å; L644-Q647 CarbonylContact O-C 3.58Å; L644-Q647 PolarHBondContact O-N 3.22Å; N645-Q647 VanDerWaalsContact C-N 3.28Å; Q647-V649 HydrophobicContact CB-CG2 4.12Å; Q647-V649 PolarHBondContact O-N 3.05Å
648	G	49.2	Very low	59.6	Low	67 Å²	67	100.2 Å²	100.2	69%	0.691	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	6.5	-175.6	0	0	0	0	0	115.3	L644 N645 M650	L644-G648 PolarHBondContact O-N 3.44Å; L644-G648 VanDerWaalsContact O-N 3.11Å; N645-G648 PolarHBondContact O-N 3.34Å; G648-M650 PolarHBondContact O-N 3.35Å
649	V	50.5	Low	60.4	Low	71 Å²	71	102.2 Å²	102.2	43%	0.43	55%	0.554	S	S	.	*			trans	-93.2	89.9	-172	-175.5	0	0	0	0	111.2	L644 Q647 V651	L644-V649 HydrophobicContact CD2-CB 3.99Å; L644-V649 HydrophobicContact CD2-CG1 4.06Å; L644-V649 PolarHBondContact O-N 3.45Å; Q647-V649 HydrophobicContact CB-CG2 4.12Å; Q647-V649 PolarHBondContact O-N 3.05Å; V649-V651 HydrophobicContact CG1-CG2 4.31Å
650	M	51.9	Low	61	Low	98 Å²	98	100.8 Å²	100.8	48%	0.483	55%	0.551	S	S	.	*			trans	-89.7	111.6	165.3	-84.5	-172.9	55.8	0	0	111.4	G648 I652 I709	G648-M650 PolarHBondContact O-N 3.35Å; M650-I652 HydrophobicContact CB-CG1 4.2Å; M650-I652 HydrophobicContact CE-CD1 4.2Å; M650-I652 HydrophobicContact CE-CG1 4.09Å; M650-I652 PolarHBondContact O-N 2.83Å; M650-I709 HydrophobicContact CE-CD1 3.97Å
651	V	55.8	Low	61.4	Low	113 Å²	113	101.4 Å²	101.4	69%	0.685	55%	0.55	S	S	*	*			trans	-78.9	85.1	173.9	-175.3	0	0	0	0	110	V649 K653	V649-V651 HydrophobicContact CG1-CG2 4.31Å; V651-K653 PolarHBondContact O-N 3.31Å
652	I	56.7	Low	62.6	Low	83 Å²	83	101 Å²	101	43%	0.426	55%	0.549	S	S	.	.			trans	-84	108.7	177.8	-54.1	174.7	0	0	0	109.5	M650 T654 V703	M650-I652 HydrophobicContact CB-CG1 4.2Å; M650-I652 HydrophobicContact CE-CD1 4.2Å; M650-I652 HydrophobicContact CE-CG1 4.09Å; M650-I652 PolarHBondContact O-N 2.83Å; I652-T654 HydrophobicContact CG2-CG2 3.81Å; I652-T654 PolarHBondContact O-N 3.36Å; I652-T654 VanDerWaalsContact O-N 3.1Å; I652-V703 HydrophobicContact CD1-CG1 4.47Å; I652-V703 HydrophobicContact CG2-CB 4.1Å; I652-V703 HydrophobicContact CG2-CG2 3.93Å
653	K	53.3	Low	63.6	Low	151 Å²	151	98 Å²	98	66%	0.657	54%	0.536	S	S	*	.			trans	-80.1	86	172.6	-72.9	-173.1	176.4	-173.8	0	110.8	V651 K655	V651-K653 PolarHBondContact O-N 3.31Å; K653-K655 PolarHBondContact O-N 3.09Å
654	T	61.9	Low	64.6	Low	119 Å²	119	95.7 Å²	95.7	73%	0.73	53%	0.533	S	S	*	.			trans	-72.4	-13.2	178.4	54.7	0	0	0	0	114.2	I652	I652-T654 HydrophobicContact CG2-CG2 3.81Å; I652-T654 PolarHBondContact O-N 3.36Å; I652-T654 VanDerWaalsContact O-N 3.1Å
655	K	61.4	Low	65.6	Low	167 Å²	167	101 Å²	101	73%	0.726	56%	0.557	S	S	*	*	S	Bend	trans	-139.4	157.5	177.3	-61.2	-176.8	-177.6	178.3	0	109.9	K653	K653-K655 PolarHBondContact O-N 3.09Å
656	N	59.3	Low	66.8	Low	131 Å²	131	98.4 Å²	98.4	70%	0.701	54%	0.544	S	S	*	.			trans	58.8	52.7	-178.7	-57.3	-14.4	0	0	0	114.2
657	V	62.7	Low	67.9	Low	48 Å²	48	93 Å²	93	29%	0.291	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-69.7	127.4	168.3	-176.7	0	0	0	0	109.2	P659 H700 Y702	V657-P659 WeakPolarHBondContact O-CD 3.25Å; V657-H700 HydrophobicContact CG1-CB 4.39Å; V657-Y702 HydrophobicContact CG1-CE2 4.26Å
658	T	73.9	Confident	69	Low	76 Å²	76	90.2 Å²	90.2	47%	0.466	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-55.4	125	174.7	-42.9	0	0	0	0	109.9	Y696 H700	T658-Y696 WeakPolarHBondContact O-CE2 3.45Å; T658-Y696 PolarHBondContact O-OH 3.41Å; T658-H700 WeakPolarHBondContact CB-NE2 3.27Å; T658-H700 PolarHBondContact OG1-NE2 2.87Å
659	P	73.6	Confident	70.9	Confident	112 Å²	112	91 Å²	91	73%	0.727	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-59.5	141.7	179.6	-26.9	35.8	0	0	0	112.9	V657 L661	V657-P659 WeakPolarHBondContact O-CD 3.25Å; P659-L661 PolarHBondContact O-N 2.96Å; P659-L661 VanDerWaalsContact O-N 3.12Å
660	A	74.2	Confident	72.7	Confident	70 Å²	70	92 Å²	92	58%	0.579	51%	0.511	S	S	*	.			trans	-66.1	110.2	175.2	0	0	0	0	0	110.2	Y696	A660-Y696 HydrophobicContact CB-CE1 3.85Å; A660-Y696 HydrophobicContact CB-CE2 4.31Å; A660-Y696 PolarHBondContact N-OH 2.9Å
661	L	75.6	Confident	74.6	Confident	112 Å²	112	87.3 Å²	87.3	59%	0.586	49%	0.488	S	S	*	.			trans	-67.7	132.5	176.3	-172.3	72.4	0	0	0	110.1	P659 L663	P659-L661 PolarHBondContact O-N 2.96Å; P659-L661 VanDerWaalsContact O-N 3.12Å; L661-L663 PolarHBondContact O-N 3.49Å
662	D	81.8	Confident	76.2	Confident	71 Å²	71	84.5 Å²	84.5	38%	0.38	47%	0.467	S	S	.	.			trans	-70.6	91.1	175.5	-175.3	-3.2	0	0	0	111.4	T664 Q665 V666	D662-T664 PolarHBondContact O-N 2.95Å; D662-T664 WeakPolarHBondContact OD1-CA 3.46Å; D662-T664 VanDerWaalsContact OD1-CB 3.24Å; D662-T664 WeakPolarHBondContact OD1-CB 3.08Å; D662-T664 WeakPolarHBondContact OD1-CG2 3.48Å; D662-T664 PolarHBondContact OD1-N 3.48Å; D662-T664 PolarHBondContact OD1-OG1 2.79Å; D662-T664 PolarHBondContact OD2-OG1 2.99Å; D662-Q665 WeakPolarHBondContact OD2-CG 3.44Å; D662-Q665 PolarHBondContact OD2-NE2 2.86Å; D662-V666 WeakPolarHBondContact O-CG2 3.34Å
663	L	82.3	Confident	77.9	Confident	25 Å²	25	83.6 Å²	83.6	13%	0.131	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-13	177.1	-66.8	165.8	0	0	0	113.4	L661 L671 V689 L692 E693	L661-L663 PolarHBondContact O-N 3.49Å; L663-L671 HydrophobicContact CB-CD2 4.42Å; L663-L671 HydrophobicContact CD2-CD2 4Å; L663-V689 HydrophobicContact CB-CB 4.45Å; L663-V689 HydrophobicContact CB-CG1 3.94Å; L663-V689 HydrophobicContact CB-CG2 4.16Å; L663-V689 WeakPolarHBondContact O-CG2 3.33Å; L663-L692 HydrophobicContact CD1-CB 3.56Å; L663-L692 HydrophobicContact CD2-CB 4.04Å; L663-L692 HydrophobicContact CD2-CD1 3.94Å; L663-L692 HydrophobicContact CG-CB 4.45Å; L663-E693 HydrophobicContact CD1-CB 4.28Å
664	T	82.1	Confident	79.6	Confident	88 Å²	88	78.2 Å²	78.2	54%	0.54	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-36.4	-178.5	75.9	0	0	0	0	112	D662 K685	D662-T664 PolarHBondContact O-N 2.95Å; D662-T664 WeakPolarHBondContact OD1-CA 3.46Å; D662-T664 VanDerWaalsContact OD1-CB 3.24Å; D662-T664 WeakPolarHBondContact OD1-CB 3.08Å; D662-T664 WeakPolarHBondContact OD1-CG2 3.48Å; D662-T664 PolarHBondContact OD1-N 3.48Å; D662-T664 PolarHBondContact OD1-OG1 2.79Å; D662-T664 PolarHBondContact OD2-OG1 2.99Å; T664-K685 WeakPolarHBondContact O-CE 3.49Å; T664-K685 PolarHBondContact O-NZ 2.95Å
665	Q	82.7	Confident	81.1	Confident	158 Å²	158	72.6 Å²	72.6	74%	0.738	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-33.9	178.2	-63.9	-178.1	50	0	0	112	D662	D662-Q665 WeakPolarHBondContact OD2-CG 3.44Å; D662-Q665 PolarHBondContact OD2-NE2 2.86Å
666	V	82.8	Confident	82.4	Confident	16 Å²	16	73 Å²	73	10%	0.097	40%	0.404	C	S	.	.	S	Bend	trans	-52	137	-177.8	179.3	0	0	0	0	113.2	D662 E670 L671 K674 K685	D662-V666 WeakPolarHBondContact O-CG2 3.34Å; V666-E670 HydrophobicContact CG1-CB 3.39Å; V666-E670 HydrophobicContact CG1-CG 4.33Å; V666-L671 HydrophobicContact CB-CD2 4.17Å; V666-L671 HydrophobicContact CB-CG 4.22Å; V666-L671 HydrophobicContact CG1-CD2 4.01Å; V666-L671 HydrophobicContact CG1-CG 3.83Å; V666-K674 HydrophobicContact CG1-CD 4.17Å; V666-K685 PolarHBondContact O-NZ 2.89Å
667	A	89.1	Confident	83.9	Confident	42 Å²	42	76.2 Å²	76.2	35%	0.347	41%	0.407	S	S	.	.			trans	-65.7	155.5	179.5	0	0	0	0	0	113.3	P669 E670 L671	A667-P669 HydrophobicContact CB-CG 4.35Å; A667-E670 PolarHBondContact O-N 3.28Å; A667-L671 WeakPolarHBondContact O-CG 3.21Å; A667-L671 PolarHBondContact O-N 3.28Å
668	T	88.2	Confident	85.2	Confident	77 Å²	77	80.1 Å²	80.1	47%	0.472	42%	0.417	S	S	.	.	H	α-helix	trans	-54.2	-47.7	176.7	30.7	0	0	0	0	115	E670 L671 H672 K685	T668-E670 PolarHBondContact O-N 3.22Å; T668-L671 PolarHBondContact O-N 3.08Å; T668-H672 PolarHBondContact O-N 3.21Å; T668-K685 HydrophobicContact CG2-CB 4.09Å; T668-K685 HydrophobicContact CG2-CD 4.28Å
669	P	88.6	Confident	85.9	Confident	82 Å²	82	80 Å²	80	53%	0.532	43%	0.43	S	S	.	.	H	α-helix	trans	-65.5	-37.5	177.9	25	-35	0	0	0	112.5	A667 H672 V673	A667-P669 HydrophobicContact CB-CG 4.35Å; P669-H672 CarbonylContact O-C 3.58Å; P669-H672 PolarHBondContact O-N 3.05Å; P669-H672 VanDerWaalsContact O-N 3.13Å; P669-V673 WeakPolarHBondContact O-CG2 3.21Å; P669-V673 PolarHBondContact O-N 2.76Å
670	E	89.1	Confident	86.6	Confident	92 Å²	92	76.7 Å²	76.7	43%	0.43	41%	0.408	S	S	.	.	H	α-helix	trans	-62.9	-41.4	175	-87.2	-169.2	-101.8	0	0	112.6	V666 A667 T668 H672 V673 K674	V666-E670 HydrophobicContact CG1-CB 3.39Å; V666-E670 HydrophobicContact CG1-CG 4.33Å; A667-E670 PolarHBondContact O-N 3.28Å; T668-E670 PolarHBondContact O-N 3.22Å; E670-H672 PolarHBondContact O-N 3.07Å; E670-V673 PolarHBondContact O-N 2.86Å; E670-K674 WeakPolarHBondContact O-CB 3.34Å; E670-K674 WeakPolarHBondContact O-CD 3.33Å; E670-K674 WeakPolarHBondContact O-CG 3.1Å; E670-K674 PolarHBondContact O-N 3.14Å; E670-K674 IonicContact OE2-NZ 3.97Å; E670-K674 PolarHBondContact OE2-NZ 3.2Å
671	L	90.7	Very high	87.3	Confident	1 Å²	1	82.3 Å²	82.3	1%	0.005	41%	0.414	C	S	.	.	H	α-helix	trans	-60.9	-35.7	173.8	-72.1	169.1	0	0	0	111	L663 V666 A667 T668 K674 L675 K685 A688 V689 L692	L663-L671 HydrophobicContact CB-CD2 4.42Å; L663-L671 HydrophobicContact CD2-CD2 4Å; V666-L671 HydrophobicContact CB-CD2 4.17Å; V666-L671 HydrophobicContact CB-CG 4.22Å; V666-L671 HydrophobicContact CG1-CD2 4.01Å; V666-L671 HydrophobicContact CG1-CG 3.83Å; A667-L671 WeakPolarHBondContact O-CG 3.21Å; A667-L671 PolarHBondContact O-N 3.28Å; T668-L671 PolarHBondContact O-N 3.08Å; L671-K674 PolarHBondContact O-N 2.85Å; L671-L675 WeakPolarHBondContact O-CB 3.43Å; L671-L675 VanDerWaalsContact O-CG 3.3Å; L671-L675 WeakPolarHBondContact O-CG 3.44Å; L671-L675 PolarHBondContact O-N 3.39Å; L671-K685 HydrophobicContact CD1-CB 4.35Å; L671-K685 HydrophobicContact CD1-CD 3.84Å; L671-K685 HydrophobicContact CD1-CG 3.64Å; L671-A688 HydrophobicContact CB-CB 4.13Å; L671-V689 HydrophobicContact CD1-CG2 3.98Å; L671-V689 HydrophobicContact CD2-CG2 4.17Å; L671-L692 HydrophobicContact CD2-CD1 3.73Å
672	H	90.5	Very high	88	Confident	53 Å²	53	80.3 Å²	80.3	25%	0.245	41%	0.414	C	S	.	.	H	α-helix	trans	-73.5	-31.4	174.2	-66.3	177.1	0	0	0	113.4	T668 P669 E670 R676 L683	T668-H672 PolarHBondContact O-N 3.21Å; P669-H672 CarbonylContact O-C 3.58Å; P669-H672 PolarHBondContact O-N 3.05Å; P669-H672 VanDerWaalsContact O-N 3.13Å; E670-H672 PolarHBondContact O-N 3.07Å; H672-R676 WeakPolarHBondContact O-CB 3.25Å; H672-R676 WeakPolarHBondContact O-CG 3.48Å; H672-R676 PolarHBondContact O-N 2.67Å; H672-R676 PolarHBondContact O-NE 2.91Å; H672-L683 PolarHBondContact NE2-O 2.93Å
673	V	91.1	Very high	88.4	Confident	64 Å²	64	78.9 Å²	78.9	39%	0.388	41%	0.406	S	S	.	.	H	α-helix	trans	-66.5	-45.6	169.1	171.4	0	0	0	0	110.5	P669 E670 R676 R677	P669-V673 WeakPolarHBondContact O-CG2 3.21Å; P669-V673 PolarHBondContact O-N 2.76Å; E670-V673 PolarHBondContact O-N 2.86Å; V673-R676 PolarHBondContact O-N 3.5Å; V673-R677 PolarHBondContact O-N 3.12Å; V673-R677 VanDerWaalsContact O-N 3.16Å
674	K	89.5	Confident	88.9	Confident	39 Å²	39	82 Å²	82	17%	0.17	43%	0.428	C	S	.	.	H	α-helix	trans	-61.9	-42	176.5	-73.7	157.7	174.9	158.7	0	111.4	V666 E670 L671 R677 Y678 L692	V666-K674 HydrophobicContact CG1-CD 4.17Å; E670-K674 WeakPolarHBondContact O-CB 3.34Å; E670-K674 WeakPolarHBondContact O-CD 3.33Å; E670-K674 WeakPolarHBondContact O-CG 3.1Å; E670-K674 PolarHBondContact O-N 3.14Å; E670-K674 IonicContact OE2-NZ 3.97Å; E670-K674 PolarHBondContact OE2-NZ 3.2Å; L671-K674 PolarHBondContact O-N 2.85Å; K674-R677 PolarHBondContact O-N 3.29Å; K674-Y678 WeakPolarHBondContact O-CD2 3.23Å; K674-L692 HydrophobicContact CB-CD1 3.75Å; K674-L692 HydrophobicContact CB-CD2 4.11Å
675	L	92.9	Very high	89.3	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-64.3	-41	172.2	-76.9	177.5	0	0	0	113.4	L671 R677 Y678 G679 V680 L683 A688 V691 L692	L671-L675 WeakPolarHBondContact O-CB 3.43Å; L671-L675 VanDerWaalsContact O-CG 3.3Å; L671-L675 WeakPolarHBondContact O-CG 3.44Å; L671-L675 PolarHBondContact O-N 3.39Å; L675-R677 VanDerWaalsContact C-N 3.28Å; L675-R677 PolarHBondContact O-N 3.21Å; L675-Y678 CarbonylContact O-C 3.58Å; L675-Y678 WeakPolarHBondContact O-CA 3.24Å; L675-Y678 PolarHBondContact O-N 2.86Å; L675-G679 PolarHBondContact O-N 2.83Å; L675-V680 HydrophobicContact CB-CB 4.2Å; L675-V680 HydrophobicContact CD2-CB 3.97Å; L675-V680 HydrophobicContact CD2-CG1 4.06Å; L675-V680 HydrophobicContact CD2-CG2 4.38Å; L675-V680 PolarHBondContact O-N 2.73Å; L675-V680 VanDerWaalsContact O-N 3.12Å; L675-L683 HydrophobicContact CD1-CB 3.96Å; L675-L683 HydrophobicContact CD1-CD1 4.29Å; L675-L683 HydrophobicContact CD1-CG 4.3Å; L675-A688 HydrophobicContact CD1-CB 3.62Å; L675-A688 HydrophobicContact CG-CB 4.32Å; L675-V691 HydrophobicContact CD2-CB 4.14Å; L675-V691 HydrophobicContact CD2-CG1 3.72Å; L675-L692 HydrophobicContact CD2-CD1 4.37Å; L675-L692 HydrophobicContact CD2-CD2 4.06Å; L675-L692 HydrophobicContact CD2-CG 3.85Å; L675-L692 HydrophobicContact CG-CD1 4.3Å; L675-L692 HydrophobicContact CG-CG 4.31Å
676	R	90.1	Very high	89.7	Confident	175 Å²	175	85 Å²	85	66%	0.66	43%	0.425	S	S	*	.	H	α-helix	trans	-62.7	-31.8	178	-82.9	-174.9	-73.1	-170.8	0.5	112.8	H672 V673 Y678 G679	H672-R676 WeakPolarHBondContact O-CB 3.25Å; H672-R676 WeakPolarHBondContact O-CG 3.48Å; H672-R676 PolarHBondContact O-N 2.67Å; H672-R676 PolarHBondContact O-NE 2.91Å; V673-R676 PolarHBondContact O-N 3.5Å; R676-Y678 PolarHBondContact O-N 3.3Å; R676-G679 PolarHBondContact O-N 3.48Å
677	R	89.7	Confident	90.1	Very high	200 Å²	200	90.5 Å²	90.5	76%	0.755	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.1	171.3	-67	179	-177.4	-172.3	-0.3	113.4	V673 K674 L675	V673-R677 PolarHBondContact O-N 3.12Å; V673-R677 VanDerWaalsContact O-N 3.16Å; K674-R677 PolarHBondContact O-N 3.29Å; L675-R677 VanDerWaalsContact C-N 3.28Å; L675-R677 PolarHBondContact O-N 3.21Å
678	Y	89.9	Confident	90.2	Very high	130 Å²	130	88.5 Å²	88.5	51%	0.51	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	14	176.5	-56.8	-69.7	0	0	0	113.2	K674 L675 R676 V680 L692 I695	K674-Y678 WeakPolarHBondContact O-CD2 3.23Å; L675-Y678 CarbonylContact O-C 3.58Å; L675-Y678 WeakPolarHBondContact O-CA 3.24Å; L675-Y678 PolarHBondContact O-N 2.86Å; R676-Y678 PolarHBondContact O-N 3.3Å; Y678-V680 PolarHBondContact O-N 2.97Å; Y678-L692 HydrophobicContact CD2-CD2 3.66Å; Y678-L692 HydrophobicContact CE2-CD2 3.63Å; Y678-I695 HydrophobicContact CD1-CG2 3.94Å; Y678-I695 HydrophobicContact CD2-CD1 3.94Å; Y678-I695 HydrophobicContact CD2-CG2 4.32Å; Y678-I695 HydrophobicContact CE1-CG2 3.67Å; Y678-I695 HydrophobicContact CE2-CG2 4.07Å; Y678-I695 HydrophobicContact CG-CD1 3.92Å; Y678-I695 HydrophobicContact CG-CG2 4.25Å
679	G	88.9	Confident	90.4	Very high	72 Å²	72	85.8 Å²	85.8	74%	0.742	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.2	8.4	178.7	0	0	0	0	0	115.7	L675 R676	L675-G679 PolarHBondContact O-N 2.83Å; R676-G679 PolarHBondContact O-N 3.48Å
680	V	88.9	Confident	90.5	Very high	44 Å²	44	83.9 Å²	83.9	27%	0.267	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-84	133.5	-176.4	-171.7	0	0	0	0	110.6	L675 Y678 L683 V691	L675-V680 HydrophobicContact CB-CB 4.2Å; L675-V680 HydrophobicContact CD2-CB 3.97Å; L675-V680 HydrophobicContact CD2-CG1 4.06Å; L675-V680 HydrophobicContact CD2-CG2 4.38Å; L675-V680 PolarHBondContact O-N 2.73Å; L675-V680 VanDerWaalsContact O-N 3.12Å; Y678-V680 PolarHBondContact O-N 2.97Å; V680-L683 HydrophobicContact CG1-CD1 3.94Å; V680-V691 HydrophobicContact CG1-CG1 4.47Å; V680-V691 HydrophobicContact CG2-CG1 4.33Å
681	R	89.3	Confident	90.5	Very high	187 Å²	187	81.6 Å²	81.6	71%	0.706	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-53.7	154	171.4	-75.4	174.9	76	-170.1	0.9	110.5	L683 E755	R681-L683 PolarHBondContact O-N 3.38Å; R681-E755 IonicContact CZ-OE1 3.32Å; R681-E755 IonicContact NH1-OE1 3Å; R681-E755 IonicContact NH2-OE1 3.91Å; R681-E755 PolarHBondContact NH2-OE1 3.5Å
682	A	90	Very high	90.6	Very high	70 Å²	70	82.1 Å²	82.1	58%	0.579	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-55.4	132.4	173.9	0	0	0	0	0	111.5
683	L	90.4	Very high	90.5	Very high	42 Å²	42	83.6 Å²	83.6	22%	0.22	41%	0.407	C	S	.	.			trans	-128.1	150	-177.7	-71.7	172.6	0	0	0	111.2	H672 L675 V680 R681 K687 A688 V691	H672-L683 PolarHBondContact NE2-O 2.93Å; L675-L683 HydrophobicContact CD1-CB 3.96Å; L675-L683 HydrophobicContact CD1-CD1 4.29Å; L675-L683 HydrophobicContact CD1-CG 4.3Å; V680-L683 HydrophobicContact CG1-CD1 3.94Å; R681-L683 PolarHBondContact O-N 3.38Å; L683-K687 HydrophobicContact CB-CB 4.04Å; L683-K687 HydrophobicContact CD1-CB 4.31Å; L683-K687 HydrophobicContact CD2-CD 4.32Å; L683-A688 HydrophobicContact CB-CB 4.28Å; L683-V691 HydrophobicContact CD1-CG2 3.98Å
684	P	92.1	Very high	90.4	Very high	90 Å²	90	85.9 Å²	85.9	58%	0.584	41%	0.409	S	S	*	.			trans	-55.1	142.5	171.5	-25.5	34	0	0	0	112	R686 K687 A688	P684-R686 VanDerWaalsContact C-N 3.3Å; P684-R686 PolarHBondContact O-N 3.41Å; P684-K687 WeakPolarHBondContact O-CA 3.18Å; P684-K687 WeakPolarHBondContact O-CB 3.41Å; P684-K687 PolarHBondContact O-N 2.91Å; P684-A688 PolarHBondContact O-N 2.71Å
685	K	90.7	Very high	90.3	Very high	76 Å²	76	85.4 Å²	85.4	33%	0.33	41%	0.408	S	S	.	.	H	α-helix	trans	-42.3	-48.6	-169.2	176.5	153.5	177.5	169.5	0	114.2	T664 V666 T668 L671 K687 A688 V689	T664-K685 WeakPolarHBondContact O-CE 3.49Å; T664-K685 PolarHBondContact O-NZ 2.95Å; V666-K685 PolarHBondContact O-NZ 2.89Å; T668-K685 HydrophobicContact CG2-CB 4.09Å; T668-K685 HydrophobicContact CG2-CD 4.28Å; L671-K685 HydrophobicContact CD1-CB 4.35Å; L671-K685 HydrophobicContact CD1-CD 3.84Å; L671-K685 HydrophobicContact CD1-CG 3.64Å; K685-K687 PolarHBondContact O-N 3.47Å; K685-A688 PolarHBondContact O-N 3.46Å; K685-A688 VanDerWaalsContact O-N 3.16Å; K685-V689 HydrophobicContact CG-CG2 4.31Å; K685-V689 WeakPolarHBondContact O-CG2 3.49Å; K685-V689 PolarHBondContact O-N 2.93Å
686	R	90.6	Very high	90.1	Very high	233 Å²	233	87.9 Å²	87.9	88%	0.879	42%	0.417	S	S	*	.	H	α-helix	trans	-60.9	-36.8	178.8	-64.8	-176.5	-178.6	176.1	0.9	114.3	P684 A690	P684-R686 VanDerWaalsContact C-N 3.3Å; P684-R686 PolarHBondContact O-N 3.41Å; R686-A690 PolarHBondContact O-N 3.11Å
687	K	91.1	Very high	89.8	Confident	131 Å²	131	81.2 Å²	81.2	57%	0.57	40%	0.395	S	S	*	.	H	α-helix	trans	-75.9	-37.8	173.8	-70.8	-173.3	-179.3	179.7	0	111.3	L683 P684 K685 A690 V691	L683-K687 HydrophobicContact CB-CB 4.04Å; L683-K687 HydrophobicContact CD1-CB 4.31Å; L683-K687 HydrophobicContact CD2-CD 4.32Å; P684-K687 WeakPolarHBondContact O-CA 3.18Å; P684-K687 WeakPolarHBondContact O-CB 3.41Å; P684-K687 PolarHBondContact O-N 2.91Å; K685-K687 PolarHBondContact O-N 3.47Å; K687-A690 PolarHBondContact O-N 3.02Å; K687-V691 WeakPolarHBondContact O-CB 3.39Å; K687-V691 VanDerWaalsContact O-CG2 3.31Å; K687-V691 WeakPolarHBondContact O-CG2 3.29Å; K687-V691 PolarHBondContact O-N 3.37Å
688	A	91.6	Very high	89.5	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-62.9	-46.4	178.4	0	0	0	0	0	112.1	L671 L675 L683 P684 K685 V691 L692	L671-A688 HydrophobicContact CB-CB 4.13Å; L675-A688 HydrophobicContact CD1-CB 3.62Å; L675-A688 HydrophobicContact CG-CB 4.32Å; L683-A688 HydrophobicContact CB-CB 4.28Å; P684-A688 PolarHBondContact O-N 2.71Å; K685-A688 PolarHBondContact O-N 3.46Å; K685-A688 VanDerWaalsContact O-N 3.16Å; A688-V691 PolarHBondContact O-N 2.83Å; A688-L692 WeakPolarHBondContact O-CB 3.21Å; A688-L692 WeakPolarHBondContact O-CG 3.41Å; A688-L692 PolarHBondContact O-N 2.91Å
689	V	92.1	Very high	89.2	Confident	21 Å²	21	72.4 Å²	72.4	13%	0.127	37%	0.373	C	S	.	.	H	α-helix	trans	-57.3	-55.7	173.8	172.2	0	0	0	0	110.6	L663 L671 K685 V691 L692 E693	L663-V689 HydrophobicContact CB-CB 4.45Å; L663-V689 HydrophobicContact CB-CG1 3.94Å; L663-V689 HydrophobicContact CB-CG2 4.16Å; L663-V689 WeakPolarHBondContact O-CG2 3.33Å; L671-V689 HydrophobicContact CD1-CG2 3.98Å; L671-V689 HydrophobicContact CD2-CG2 4.17Å; K685-V689 HydrophobicContact CG-CG2 4.31Å; K685-V689 WeakPolarHBondContact O-CG2 3.49Å; K685-V689 PolarHBondContact O-N 2.93Å; V689-V691 VanDerWaalsContact C-N 3.27Å; V689-V691 PolarHBondContact O-N 3.36Å; V689-L692 PolarHBondContact O-N 3.42Å; V689-L692 VanDerWaalsContact O-N 3.09Å; V689-E693 VanDerWaalsContact O-CB 3.27Å; V689-E693 WeakPolarHBondContact O-CB 3.22Å; V689-E693 PolarHBondContact O-N 2.83Å
690	A	90.8	Very high	88.6	Confident	41 Å²	41	71.3 Å²	71.3	34%	0.339	35%	0.348	S	S	.	.	H	α-helix	trans	-62.1	-29.2	-177.4	0	0	0	0	0	114	R686 K687 R694	R686-A690 PolarHBondContact O-N 3.11Å; K687-A690 PolarHBondContact O-N 3.02Å; A690-R694 VanDerWaalsContact O-CB 3.25Å; A690-R694 WeakPolarHBondContact O-CB 3.27Å; A690-R694 PolarHBondContact O-N 3.44Å; A690-R694 VanDerWaalsContact O-N 3.08Å
691	V	90.6	Very high	87.9	Confident	45 Å²	45	72.6 Å²	72.6	27%	0.273	36%	0.357	S	S	.	.	H	α-helix	trans	-74.4	-42.7	173.6	168	0	0	0	0	111.3	L675 V680 L683 K687 A688 V689 R694 I695	L675-V691 HydrophobicContact CD2-CB 4.14Å; L675-V691 HydrophobicContact CD2-CG1 3.72Å; V680-V691 HydrophobicContact CG1-CG1 4.47Å; V680-V691 HydrophobicContact CG2-CG1 4.33Å; L683-V691 HydrophobicContact CD1-CG2 3.98Å; K687-V691 WeakPolarHBondContact O-CB 3.39Å; K687-V691 VanDerWaalsContact O-CG2 3.31Å; K687-V691 WeakPolarHBondContact O-CG2 3.29Å; K687-V691 PolarHBondContact O-N 3.37Å; A688-V691 PolarHBondContact O-N 2.83Å; V689-V691 VanDerWaalsContact C-N 3.27Å; V689-V691 PolarHBondContact O-N 3.36Å; V691-R694 PolarHBondContact O-N 3.02Å; V691-I695 HydrophobicContact CG1-CD1 3.79Å; V691-I695 WeakPolarHBondContact O-CD1 3.45Å; V691-I695 VanDerWaalsContact O-CG1 3.24Å; V691-I695 WeakPolarHBondContact O-CG1 3.49Å; V691-I695 PolarHBondContact O-N 2.87Å
692	L	90.8	Very high	86.7	Confident	11 Å²	11	70.6 Å²	70.6	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-69.3	-37.7	178	-70.6	168.5	0	0	0	112.2	L663 L671 K674 L675 Y678 A688 V689 I695 Y696	L663-L692 HydrophobicContact CD1-CB 3.56Å; L663-L692 HydrophobicContact CD2-CB 4.04Å; L663-L692 HydrophobicContact CD2-CD1 3.94Å; L663-L692 HydrophobicContact CG-CB 4.45Å; L671-L692 HydrophobicContact CD2-CD1 3.73Å; K674-L692 HydrophobicContact CB-CD1 3.75Å; K674-L692 HydrophobicContact CB-CD2 4.11Å; L675-L692 HydrophobicContact CD2-CD1 4.37Å; L675-L692 HydrophobicContact CD2-CD2 4.06Å; L675-L692 HydrophobicContact CD2-CG 3.85Å; L675-L692 HydrophobicContact CG-CD1 4.3Å; L675-L692 HydrophobicContact CG-CG 4.31Å; Y678-L692 HydrophobicContact CD2-CD2 3.66Å; Y678-L692 HydrophobicContact CE2-CD2 3.63Å; A688-L692 WeakPolarHBondContact O-CB 3.21Å; A688-L692 WeakPolarHBondContact O-CG 3.41Å; A688-L692 PolarHBondContact O-N 2.91Å; V689-L692 PolarHBondContact O-N 3.42Å; V689-L692 VanDerWaalsContact O-N 3.09Å; L692-I695 PolarHBondContact O-N 3.22Å; L692-Y696 WeakPolarHBondContact O-CB 3.28Å; L692-Y696 PolarHBondContact O-N 3.3Å
693	E	89.6	Confident	85.3	Confident	84 Å²	84	69.2 Å²	69.2	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-61.5	-45	171	-178.3	-175.9	-170.9	0	0	111.3	L663 V689 Y696 N697	L663-E693 HydrophobicContact CD1-CB 4.28Å; V689-E693 VanDerWaalsContact O-CB 3.27Å; V689-E693 WeakPolarHBondContact O-CB 3.22Å; V689-E693 PolarHBondContact O-N 2.83Å; E693-Y696 PolarHBondContact O-N 3.24Å; E693-N697 VanDerWaalsContact O-CG 3.29Å; E693-N697 PolarHBondContact O-N 3.47Å; E693-N697 PolarHBondContact O-ND2 3.15Å
694	R	88.6	Confident	83.8	Confident	113 Å²	113	71 Å²	71	43%	0.426	34%	0.342	S	S	.	.	H	α-helix	trans	-61.5	-45.4	173.3	-179.7	178.1	173.7	-146	-19.4	112	A634 A690 V691 Y696 N697 E698	A634-R694 PolarHBondContact O-NH2 3.22Å; A634-R694 VanDerWaalsContact O-NH2 3.08Å; A690-R694 VanDerWaalsContact O-CB 3.25Å; A690-R694 WeakPolarHBondContact O-CB 3.27Å; A690-R694 PolarHBondContact O-N 3.44Å; A690-R694 VanDerWaalsContact O-N 3.08Å; V691-R694 PolarHBondContact O-N 3.02Å; R694-Y696 VanDerWaalsContact C-N 3.31Å; R694-Y696 PolarHBondContact O-N 2.87Å; R694-N697 PolarHBondContact O-N 3.26Å; R694-E698 HydrophobicContact CG-CG 4.46Å; R694-E698 IonicContact CZ-OE1 3.67Å; R694-E698 IonicContact CZ-OE2 2.62Å; R694-E698 IonicContact NE-OE1 2.7Å; R694-E698 PolarHBondContact NE-OE1 3.45Å; R694-E698 IonicContact NE-OE2 2.63Å; R694-E698 IonicContact NH2-OE1 3.12Å; R694-E698 PolarHBondContact NH2-OE1 2.93Å; R694-E698 IonicContact NH2-OE2 3.38Å; R694-E698 WeakPolarHBondContact O-CB 3.16Å; R694-E698 WeakPolarHBondContact O-CG 3.46Å; R694-E698 PolarHBondContact O-N 3.18Å
695	I	88.1	Confident	82.5	Confident	28 Å²	28	76.5 Å²	76.5	14%	0.144	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-39.9	177.7	-70.7	163.2	0	0	0	110.8	Y678 V691 L692 E698 T699	Y678-I695 HydrophobicContact CD1-CG2 3.94Å; Y678-I695 HydrophobicContact CD2-CD1 3.94Å; Y678-I695 HydrophobicContact CD2-CG2 4.32Å; Y678-I695 HydrophobicContact CE1-CG2 3.67Å; Y678-I695 HydrophobicContact CE2-CG2 4.07Å; Y678-I695 HydrophobicContact CG-CD1 3.92Å; Y678-I695 HydrophobicContact CG-CG2 4.25Å; V691-I695 HydrophobicContact CG1-CD1 3.79Å; V691-I695 WeakPolarHBondContact O-CD1 3.45Å; V691-I695 VanDerWaalsContact O-CG1 3.24Å; V691-I695 WeakPolarHBondContact O-CG1 3.49Å; V691-I695 PolarHBondContact O-N 2.87Å; L692-I695 PolarHBondContact O-N 3.22Å; I695-E698 PolarHBondContact O-N 3.43Å; I695-T699 HydrophobicContact CG2-CG2 4.38Å; I695-T699 WeakPolarHBondContact O-CB 3.37Å; I695-T699 WeakPolarHBondContact O-CG2 3.34Å; I695-T699 PolarHBondContact O-N 3.48Å; I695-T699 PolarHBondContact O-OG1 3.23Å
696	Y	88	Confident	81.2	Confident	52 Å²	52	79.5 Å²	79.5	20%	0.204	38%	0.38	C	S	.	.	H	α-helix	trans	-60	-50.7	173.5	173.2	-92.5	0	0	0	111.2	T658 A660 L692 E693 R694 E698 T699 H700	T658-Y696 WeakPolarHBondContact O-CE2 3.45Å; T658-Y696 PolarHBondContact O-OH 3.41Å; A660-Y696 HydrophobicContact CB-CE1 3.85Å; A660-Y696 HydrophobicContact CB-CE2 4.31Å; A660-Y696 PolarHBondContact N-OH 2.9Å; L692-Y696 WeakPolarHBondContact O-CB 3.28Å; L692-Y696 PolarHBondContact O-N 3.3Å; E693-Y696 PolarHBondContact O-N 3.24Å; R694-Y696 VanDerWaalsContact C-N 3.31Å; R694-Y696 PolarHBondContact O-N 2.87Å; Y696-E698 VanDerWaalsContact C-N 3.32Å; Y696-E698 PolarHBondContact O-N 3.25Å; Y696-T699 PolarHBondContact O-N 3.31Å; Y696-T699 VanDerWaalsContact O-N 3.17Å; Y696-T699 PolarHBondContact O-OG1 3.23Å; Y696-T699 VanDerWaalsContact O-OG1 3.11Å; Y696-H700 AromaticContact CD2-ND1 3.91Å; Y696-H700 HydrophobicContact CE2-CB 4.49Å; Y696-H700 WeakPolarHBondContact O-CB 3.29Å; Y696-H700 PolarHBondContact O-N 3Å; Y696-H700 PolarHBondContact O-ND1 3.47Å
697	N	83.7	Confident	79.7	Confident	36 Å²	36	71.1 Å²	71.1	19%	0.193	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-33.2	179	-66.8	-21.1	0	0	0	113.4	E693 R694	E693-N697 VanDerWaalsContact O-CG 3.29Å; E693-N697 PolarHBondContact O-N 3.47Å; E693-N697 PolarHBondContact O-ND2 3.15Å; R694-N697 PolarHBondContact O-N 3.26Å
698	E	83.9	Confident	77.8	Confident	64 Å²	64	67.4 Å²	67.4	30%	0.299	36%	0.356	S	S	.	.	H	α-helix	trans	-79.5	-23	176.7	-74.8	175.9	-176.9	0	0	113.4	R694 I695 Y696	R694-E698 HydrophobicContact CG-CG 4.46Å; R694-E698 IonicContact CZ-OE1 3.67Å; R694-E698 IonicContact CZ-OE2 2.62Å; R694-E698 IonicContact NE-OE1 2.7Å; R694-E698 PolarHBondContact NE-OE1 3.45Å; R694-E698 IonicContact NE-OE2 2.63Å; R694-E698 IonicContact NH2-OE1 3.12Å; R694-E698 PolarHBondContact NH2-OE1 2.93Å; R694-E698 IonicContact NH2-OE2 3.38Å; R694-E698 WeakPolarHBondContact O-CB 3.16Å; R694-E698 WeakPolarHBondContact O-CG 3.46Å; R694-E698 PolarHBondContact O-N 3.18Å; I695-E698 PolarHBondContact O-N 3.43Å; Y696-E698 VanDerWaalsContact C-N 3.32Å; Y696-E698 PolarHBondContact O-N 3.25Å
699	T	83.2	Confident	76.2	Confident	81 Å²	81	71.6 Å²	71.6	50%	0.497	38%	0.378	S	S	.	.	H	α-helix	trans	-94.9	-18.5	177.1	51.8	0	0	0	0	113.7	I695 Y696 P701	I695-T699 HydrophobicContact CG2-CG2 4.38Å; I695-T699 WeakPolarHBondContact O-CB 3.37Å; I695-T699 WeakPolarHBondContact O-CG2 3.34Å; I695-T699 PolarHBondContact O-N 3.48Å; I695-T699 PolarHBondContact O-OG1 3.23Å; Y696-T699 PolarHBondContact O-N 3.31Å; Y696-T699 VanDerWaalsContact O-N 3.17Å; Y696-T699 PolarHBondContact O-OG1 3.23Å; Y696-T699 VanDerWaalsContact O-OG1 3.11Å; T699-P701 VanDerWaalsContact C-CD 3.4Å
700	H	77.5	Confident	74.4	Confident	49 Å²	49	76.5 Å²	76.5	23%	0.227	40%	0.399	C	S	.	.	S	Bend	trans	-127.9	60.5	178.7	-58.9	75.8	0	0	0	110.9	V657 T658 Y696 Y702	V657-H700 HydrophobicContact CG1-CB 4.39Å; T658-H700 WeakPolarHBondContact CB-NE2 3.27Å; T658-H700 PolarHBondContact OG1-NE2 2.87Å; Y696-H700 AromaticContact CD2-ND1 3.91Å; Y696-H700 HydrophobicContact CE2-CB 4.49Å; Y696-H700 WeakPolarHBondContact O-CB 3.29Å; Y696-H700 PolarHBondContact O-N 3Å; Y696-H700 PolarHBondContact O-ND1 3.47Å; H700-Y702 PolarHBondContact O-N 3.41Å
701	P	73.5	Confident	72.7	Confident	70 Å²	70	77.7 Å²	77.7	46%	0.455	40%	0.402	S	S	.	.			trans	-66	125.7	177.8	28.3	-34.5	0	0	0	110.6	T699 I709	T699-P701 VanDerWaalsContact C-CD 3.4Å; P701-I709 HydrophobicContact CB-CG2 3.99Å
702	Y	63.3	Low	70.9	Confident	145 Å²	145	79.3 Å²	79.3	57%	0.569	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.4	168.8	-88.2	-97.5	0	0	0	109.8	V657 H700 E710	V657-Y702 HydrophobicContact CG1-CE2 4.26Å; H700-Y702 PolarHBondContact O-N 3.41Å; Y702-E710 PolarHBondContact O-N 2.93Å
703	V	60.5	Low	69	Low	42 Å²	42	81.8 Å²	81.8	26%	0.255	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.8	173.1	-170.4	0	0	0	0	106.7	I652 I709	I652-V703 HydrophobicContact CD1-CG1 4.47Å; I652-V703 HydrophobicContact CG2-CB 4.1Å; I652-V703 HydrophobicContact CG2-CG2 3.93Å; V703-I709 HydrophobicContact CG1-CG1 4.49Å; V703-I709 HydrophobicContact CG2-CG1 4.23Å
704	H	60.6	Low	67.3	Low	78 Å²	78	81.7 Å²	81.7	36%	0.361	44%	0.44	S	S	.	.			trans	-73.4	160	174	-65.2	-72.5	0	0	0	110.5	N706 G707 S708 E710	H704-N706 WeakPolarHBondContact CB-OD1 3.37Å; H704-N706 PolarHBondContact O-N 3.4Å; H704-G707 PolarHBondContact O-N 3.44Å; H704-S708 PolarHBondContact N-O 3.3Å; H704-E710 IonicContact CD2-OE2 2.7Å; H704-E710 IonicContact CE1-OE2 3.74Å; H704-E710 VanDerWaalsContact NE2-CD 3.28Å; H704-E710 IonicContact NE2-OE2 3.81Å; H704-E710 PolarHBondContact NE2-OE2 3.45Å
705	E	63.8	Low	65.4	Low	206 Å²	206	84.3 Å²	84.3	96%	0.963	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-22.1	-178.6	-58.6	-176.5	151.6	0	0	113	G707	E705-G707 PolarHBondContact O-N 3.31Å
706	N	63.7	Low	63.2	Low	140 Å²	140	87 Å²	87	75%	0.749	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-3.6	174.6	-32.2	69	0	0	0	114.2	H704 S708	H704-N706 WeakPolarHBondContact CB-OD1 3.37Å; H704-N706 PolarHBondContact O-N 3.4Å; N706-S708 PolarHBondContact O-N 2.84Å
707	G	57.9	Low	61	Low	56 Å²	56	89.9 Å²	89.9	58%	0.577	50%	0.499	S	S	*	.	S	Bend	trans	76.5	1.6	-170.4	0	0	0	0	0	114.6	H704 E705	H704-G707 PolarHBondContact O-N 3.44Å; E705-G707 PolarHBondContact O-N 3.31Å
708	S	52.9	Low	59.1	Low	54 Å²	54	93.8 Å²	93.8	38%	0.378	52%	0.524	S	S	.	.			trans	-78.6	121.3	176.8	44.4	0	0	0	0	111.5	H704 N706	H704-S708 PolarHBondContact N-O 3.3Å; N706-S708 PolarHBondContact O-N 2.84Å
709	I	58	Low	57.1	Low	87 Å²	87	97.6 Å²	97.6	45%	0.446	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	109.5	172.9	-45.9	178.1	0	0	0	108.7	M650 P701 V703 V711	M650-I709 HydrophobicContact CE-CD1 3.97Å; P701-I709 HydrophobicContact CB-CG2 3.99Å; V703-I709 HydrophobicContact CG1-CG1 4.49Å; V703-I709 HydrophobicContact CG2-CG1 4.23Å; I709-V711 HydrophobicContact CG2-CG2 4.45Å
710	E	53.5	Low	55	Low	124 Å²	124	104.7 Å²	104.7	58%	0.579	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.6	105.5	172.6	-79.3	-166	155	0	0	110.9	Y702 H704 P712	Y702-E710 PolarHBondContact O-N 2.93Å; H704-E710 IonicContact CD2-OE2 2.7Å; H704-E710 IonicContact CE1-OE2 3.74Å; H704-E710 VanDerWaalsContact NE2-CD 3.28Å; H704-E710 IonicContact NE2-OE2 3.81Å; H704-E710 PolarHBondContact NE2-OE2 3.45Å; E710-P712 WeakPolarHBondContact O-CD 3.48Å
711	V	54.9	Low	53.3	Low	67 Å²	67	111.6 Å²	111.6	41%	0.406	59%	0.587	S	S	.	*			trans	-85.1	116.2	167.9	-178.9	0	0	0	0	108.4	I709 A713	I709-V711 HydrophobicContact CG2-CG2 4.45Å; V711-A713 PolarHBondContact O-N 2.86Å
712	P	53.4	Low	51.7	Low	78 Å²	78	116.9 Å²	116.9	51%	0.506	60%	0.603	S	S	.	*			trans	-58.2	122.9	179.5	-25.9	35.7	0	0	0	111.4	E710 V714	E710-P712 WeakPolarHBondContact O-CD 3.48Å; P712-V714 PolarHBondContact O-N 2.86Å
713	A	51.8	Low	50.5	Low	63 Å²	63	121.3 Å²	121.3	52%	0.521	62%	0.618	S	S	.	*			trans	-76.3	70.7	-175.6	0	0	0	0	0	112.1	V711 K715	V711-A713 PolarHBondContact O-N 2.86Å; A713-K715 PolarHBondContact O-N 3.23Å
714	V	52.1	Low	49.4	Very low	82 Å²	82	129.5 Å²	129.5	50%	0.497	65%	0.645	S	S	.	*			trans	-55.2	112.4	177.9	-178.3	0	0	0	0	109.7	P712	P712-V714 PolarHBondContact O-N 2.86Å
715	K	48.9	Very low	48.2	Very low	169 Å²	169	130.1 Å²	130.1	74%	0.735	66%	0.663	S	S	*	*			trans	-68.7	126.5	179.2	-65.7	172.1	-175.3	166.6	0	108.7	A713	A713-K715 PolarHBondContact O-N 3.23Å
716	P	41.9	Very low	47	Very low	85 Å²	85	129.6 Å²	129.6	55%	0.552	66%	0.658	S	S	*	*			trans	-60.7	138.9	176.5	25.2	-33.5	0	0	0	109.9	V718	P716-V718 PolarHBondContact O-N 3.43Å
717	P	42.2	Very low	45.8	Very low	111 Å²	111	131.5 Å²	131.5	72%	0.721	66%	0.662	S	S	*	*			trans	-65.8	107.5	-173.2	24.6	-33.8	0	0	0	111	I719	P717-I719 PolarHBondContact O-N 2.79Å
718	V	43.9	Very low	44.7	Very low	118 Å²	118	136.2 Å²	136.2	72%	0.715	67%	0.674	S	S	*	*			trans	-72	91.2	179.7	-177.1	0	0	0	0	109.6	P716 R720	P716-V718 PolarHBondContact O-N 3.43Å; V718-R720 VanDerWaalsContact C-N 3.27Å; V718-R720 HydrophobicContact CG1-CG 4.43Å; V718-R720 PolarHBondContact O-N 3.01Å
719	I	41.8	Very low	44.3	Very low	145 Å²	145	142.3 Å²	142.3	74%	0.744	70%	0.702	S	S	*	*			trans	-68.7	88.4	171.6	-56.2	179	0	0	0	108.3	P717 R721	P717-I719 PolarHBondContact O-N 2.79Å; I719-R721 PolarHBondContact O-N 3.02Å
720	R	40.3	Very low	43.2	Very low	230 Å²	230	142.5 Å²	142.5	87%	0.868	71%	0.711	S	S	*	*			trans	-59.3	95.8	168.3	-80.7	-176.9	163.9	-177.6	-5.4	108.9	V718 K722	V718-R720 VanDerWaalsContact C-N 3.27Å; V718-R720 HydrophobicContact CG1-CG 4.43Å; V718-R720 PolarHBondContact O-N 3.01Å; R720-K722 PolarHBondContact O-N 3.23Å
721	R	41	Very low	42.5	Very low	194 Å²	194	142.9 Å²	142.9	73%	0.732	72%	0.717	S	S	*	*			trans	-59.7	102.4	167.5	-81.9	-177.7	164.6	137.2	-4.7	108.2	I719 R723	I719-R721 PolarHBondContact O-N 3.02Å; R721-R723 PolarHBondContact O-N 3.22Å
722	K	39.2	Very low	41.6	Very low	180 Å²	180	147.3 Å²	147.3	78%	0.783	73%	0.73	S	S	*	*			trans	-69.9	75.5	-179.3	-168.7	173.8	-175.9	174	0	110	R720 R724	R720-K722 PolarHBondContact O-N 3.23Å; K722-R724 VanDerWaalsContact C-N 3.32Å; K722-R724 PolarHBondContact O-N 3.44Å
723	R	38.7	Very low	40.8	Very low	239 Å²	239	149.7 Å²	149.7	90%	0.902	74%	0.735	S	S	*	*			trans	-60.2	97.4	163.8	-80	-176.4	168.7	170	-4	107.2	R721 A725	R721-R723 PolarHBondContact O-N 3.22Å; R723-A725 PolarHBondContact O-N 2.91Å
724	R	36.8	Very low	40.1	Very low	213 Å²	213	153.2 Å²	153.2	80%	0.804	75%	0.75	S	S	*	*			trans	-63.9	112.8	160.8	-72.9	-177.9	177.3	-103.6	11.8	106	K722	K722-R724 VanDerWaalsContact C-N 3.32Å; K722-R724 PolarHBondContact O-N 3.44Å
725	A	35.9	Very low	39.2	Very low	91 Å²	91	154.3 Å²	154.3	75%	0.752	76%	0.762	S	S	*	*			trans	-59.4	136.8	150.4	0	0	0	0	0	106.7	R723	R723-A725 PolarHBondContact O-N 2.91Å
726	K	38.2	Very low	38.5	Very low	195 Å²	195	152.3 Å²	152.3	85%	0.848	77%	0.766	S	S	*	*			trans	-119.3	93.5	169	-166.6	-172	-176.9	-164.7	0	104.5
727	E	38.6	Very low	38.3	Very low	180 Å²	180	157.6 Å²	157.6	84%	0.841	78%	0.783	S	S	*	*			trans	-75	144.1	169.6	-69.2	173.8	141	0	0	108.1
728	D	35.9	Very low	37.9	Very low	156 Å²	156	161.6 Å²	161.6	83%	0.834	79%	0.789	S	S	*	*			trans	-78.1	134.6	-175.7	-57.4	-70.5	0	0	0	110.8
729	L	42.8	Very low	37.3	Very low	182 Å²	182	161.6 Å²	161.6	95%	0.953	79%	0.793	S	S	*	*			trans	-149.9	137.8	153.7	-108.9	170.2	0	0	0	109.1
730	S	35.8	Very low	37.2	Very low	91 Å²	91	161.5 Å²	161.5	64%	0.636	79%	0.794	S	S	*	*			trans	-94.6	146.7	-170.4	-179.9	0	0	0	0	111.9
731	N	37.8	Very low	36.8	Very low	131 Å²	131	160 Å²	160	70%	0.701	79%	0.794	S	S	*	*				155.9	137.3	122.5	-77.9	-23.1	0	0	0	112.8
732	K	37.3	Very low	36.8	Very low	160 Å²	160	155.4 Å²	155.4	70%	0.696	79%	0.789	S	S	*	*			trans	59.5	151.7	143.8	-68.4	173.3	158	-86.6	0	118.6
733	E	36.6	Very low	36.5	Very low	129 Å²	129	153.7 Å²	153.7	60%	0.603	79%	0.789	S	S	*	*			cis	-162	149.1	-11.7	-119.9	157	174.5	0	0	109.6
734	T	35.5	Very low	36.3	Very low	136 Å²	136	147.8 Å²	147.8	83%	0.834	78%	0.779	S	S	*	*			trans	56.6	157.1	161.2	45.6	0	0	0	0	119
735	S	33.8	Very low	36.2	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	78%	0.779	S	S	*	*			cis	-158.2	155.6	-20.5	42.6	0	0	0	0	108.5
736	P	33.9	Very low	35.9	Very low	127 Å²	127	149.1 Å²	149.1	83%	0.825	78%	0.782	S	S	*	*			trans	-100.7	157.6	-171.6	38.1	-34.3	0	0	0	114.6
737	E	37.5	Very low	35.6	Very low	195 Å²	195	149.3 Å²	149.3	91%	0.911	79%	0.786	S	S	*	*			trans	-143	175.2	160.3	-145.7	164.3	-158	0	0	112.9
738	K	35.5	Very low	34.8	Very low	195 Å²	195	146.5 Å²	146.5	85%	0.848	79%	0.785	S	S	*	*			trans	-111	155.6	-156.8	-52.4	160.4	-176.8	164.2	0	111.9
739	C	31.1	Very low	34.6	Very low	119 Å²	119	145.2 Å²	145.2	80%	0.804	79%	0.788	S	S	*	*				-176.2	159	102.9	-145.6	0	0	0	0	115
740	N	38.3	Very low	33.7	Very low	142 Å²	142	144.6 Å²	144.6	76%	0.759	79%	0.785	S	S	*	*			trans	-62.2	141.7	-168.7	-56.1	-39.1	0	0	0	119.6
741	K	33.1	Very low	33.4	Very low	198 Å²	198	148.3 Å²	148.3	86%	0.861	79%	0.792	S	S	*	*				3.3	164.8	126.5	-64.7	-177.8	-177	-179.5	0	120.7
742	P	39.4	Very low	32.9	Very low	99 Å²	99	149.7 Å²	149.7	64%	0.643	79%	0.794	S	S	*	*			cis	-140.5	-149.9	-30.2	39.5	-17.8	0	0	0	113.1
743	D	34.2	Very low	32.6	Very low	144 Å²	144	149.9 Å²	149.9	77%	0.77	80%	0.802	S	S	*	*			trans	77.1	145	163.5	-63	-14.1	0	0	0	118.8
744	V	33.6	Very low	32.4	Very low	115 Å²	115	148.1 Å²	148.1	70%	0.697	80%	0.804	S	S	*	*			cis	-164	166	-27.3	114.8	0	0	0	0	108.1
745	I	35.1	Very low	31.9	Very low	158 Å²	158	149.5 Å²	149.5	81%	0.81	80%	0.801	S	S	*	*			trans	69.2	153.1	-178.3	-64.6	150.4	0	0	0	114.5
746	E	29.2	Very low	31.9	Very low	173 Å²	173	150.6 Å²	150.6	81%	0.808	79%	0.794	S	S	*	*			cis	-174.4	114.3	-49.5	175.9	174.7	-167.3	0	0	106.6
747	E	32.6	Very low	31.9	Very low	200 Å²	200	152 Å²	152	94%	0.935	78%	0.783	S	S	*	*			trans	-157.9	157.1	160.1	-131.7	178.2	-163	0	0	112.7
748	C	22.3	Very low	31.3	Very low	120 Å²	120	150.1 Å²	150.1	81%	0.811	78%	0.778	S	S	*	*			trans	-87.9	141.5	-164.2	-72.8	0	0	0	0	114.8
749	S	30.9	Very low	31	Very low	130 Å²	130	145.9 Å²	145.9	91%	0.909	77%	0.773	S	S	*	*			trans	-161.9	152.2	146	-93.3	0	0	0	0	115.4
750	L	24.6	Very low	31.1	Very low	168 Å²	168	147.3 Å²	147.3	88%	0.88	77%	0.771	S	S	*	*			trans	-81.8	133.9	-173.3	-67.7	151.7	0	0	0	113.5
751	H	29.2	Very low	30.7	Very low	170 Å²	170	147.4 Å²	147.4	79%	0.787	77%	0.767	S	S	*	*			trans	-146.5	128	147.9	-96.9	-90.6	0	0	0	107.6
752	E	27.1	Very low	30.7	Very low	159 Å²	159	145.3 Å²	145.3	74%	0.743	76%	0.761	S	S	*	*				84.9	75.7	52.6	-165.5	-163.2	-133.8	0	0	113.4
753	L	31.6	Very low	30.5	Very low	164 Å²	164	145.7 Å²	145.7	86%	0.859	77%	0.765	S	S	*	*			trans	-145.2	107	162.3	-74.4	-179	0	0	0	107.7
754	S	30.7	Very low	30.5	Very low	93 Å²	93	147 Å²	147	65%	0.65	77%	0.765	S	S	*	*				102	89	65	69.3	0	0	0	0	111.6	E756	S754-E756 PolarHBondContact O-N 3.15Å
755	E	26.9	Very low	30.6	Very low	164 Å²	164	149.5 Å²	149.5	77%	0.766	77%	0.773	S	S	*	*			trans	-68.1	114.7	168.9	-62.4	168	-171.1	0	0	109.7	R681	R681-E755 IonicContact CZ-OE1 3.32Å; R681-E755 IonicContact NH1-OE1 3Å; R681-E755 IonicContact NH2-OE1 3.91Å; R681-E755 PolarHBondContact NH2-OE1 3.5Å
756	E	33.5	Very low	30.4	Very low	129 Å²	129	147.2 Å²	147.2	60%	0.603	77%	0.768	S	S	*	*			trans	-127.8	117	175.4	-82.2	-108.9	106	0	0	112.3	S754	S754-E756 PolarHBondContact O-N 3.15Å
757	R	33.5	Very low	30.6	Very low	157 Å²	157	145.1 Å²	145.1	59%	0.592	77%	0.771	S	S	*	*			trans	58.6	119.9	142.6	-51.9	-175.2	-154.9	172.5	23.1	118.5
758	I	25.7	Very low	30.8	Very low	155 Å²	155	140 Å²	140	80%	0.795	76%	0.762	S	S	*	*				68.1	135.9	67.5	-60.8	163.8	0	0	0	112.6
759	S	27.9	Very low	31.4	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	76%	0.762	S	S	*	*			trans	78.9	149.2	-176.7	-70.5	0	0	0	0	115.6
760	L	33	Very low	31.4	Very low	149 Å²	149	140.4 Å²	140.4	78%	0.78	76%	0.758	S	S	*	*			cis	-143.9	155.8	5	-128.8	152	0	0	0	111.4
761	E	30.3	Very low	32	Very low	144 Å²	144	139.1 Å²	139.1	67%	0.673	75%	0.752	S	S	*	*			trans	-81.1	-173.5	161.9	-145.5	162.5	171	0	0	108.6	K839	E761-K839 IonicContact OE2-NZ 3.37Å; E761-K839 PolarHBondContact OE2-NZ 3.47Å
762	E	32.4	Very low	32.3	Very low	155 Å²	155	138.1 Å²	138.1	72%	0.724	75%	0.752	S	S	*	*			trans	60.4	113.1	166.3	-56.3	-177.2	134.6	0	0	120.9
763	S	36.8	Very low	32.8	Very low	106 Å²	106	136 Å²	136	74%	0.741	76%	0.755	S	S	*	*				-169.3	103.5	123	64.4	0	0	0	0	110.9
764	F	33.1	Very low	33	Very low	173 Å²	173	133 Å²	133	76%	0.759	75%	0.745	S	S	*	*				70.2	118.9	96.7	-75.9	-66.3	0	0	0	116.3
765	I	36.8	Very low	33.3	Very low	167 Å²	167	137.9 Å²	137.9	86%	0.856	76%	0.755	S	S	*	*			trans	-122.4	121.3	155.9	-60.9	176.8	0	0	0	106.9
766	P	31.2	Very low	33.8	Very low	109 Å²	109	140.2 Å²	140.2	71%	0.708	76%	0.762	S	S	*	*			trans	-121.3	126.8	177.5	36.2	-23.7	0	0	0	114.3
767	C	33.1	Very low	33.8	Very low	129 Å²	129	144 Å²	144	87%	0.872	78%	0.777	S	S	*	*			trans	-147.3	148.7	164.6	-75.5	0	0	0	0	108
768	A	36.3	Very low	34	Very low	92 Å²	92	143.5 Å²	143.5	76%	0.76	79%	0.791	S	S	*	*			cis	-154.3	157.9	-20.3	0	0	0	0	0	108.3
769	P	34.1	Very low	34.4	Very low	124 Å²	124	140.9 Å²	140.9	81%	0.805	79%	0.786	S	S	*	*			trans	-107	155.5	-170.7	38.7	-33.1	0	0	0	115.1
770	T	31.8	Very low	34.7	Very low	135 Å²	135	147.2 Å²	147.2	83%	0.828	79%	0.794	S	S	*	*			trans	-151	156.7	171.5	0.6	0	0	0	0	113.8
771	L	37.1	Very low	34.5	Very low	141 Å²	141	145.3 Å²	145.3	74%	0.738	80%	0.799	S	S	*	*			trans	75.5	98.9	164.5	-63.7	161	0	0	0	120.2
772	N	35.7	Very low	34.7	Very low	150 Å²	150	142.4 Å²	142.4	80%	0.802	80%	0.795	S	S	*	*			trans	69.5	149.6	136.5	-51	-18.9	0	0	0	118.7
773	S	36.9	Very low	35	Very low	114 Å²	114	146.3 Å²	146.3	80%	0.797	80%	0.803	S	S	*	*			cis	-148.4	160	0.4	-157	0	0	0	0	110
774	P	37.1	Very low	35	Very low	102 Å²	102	149.2 Å²	149.2	66%	0.662	80%	0.803	S	S	*	*			trans	-109.4	176.5	-158.5	40.1	-35	0	0	0	117.7
775	K	36.4	Very low	34.9	Very low	194 Å²	194	151 Å²	151	84%	0.843	80%	0.804	S	S	*	*			trans	95.1	101.8	160.7	-54.8	162.2	-175.9	172.8	0	118.3
776	K	37.4	Very low	34.6	Very low	213 Å²	213	152.1 Å²	152.1	93%	0.926	80%	0.804	S	S	*	*				-169.9	155.6	104.3	-99.7	165.8	-175.8	177.2	0	111.3
777	K	33.8	Very low	34.8	Very low	210 Å²	210	151.3 Å²	151.3	91%	0.913	80%	0.796	S	S	*	*			trans	-95.5	128.9	-178.3	-60.2	175.9	-177.9	176.7	0	110.2
778	V	36.7	Very low	34.8	Very low	146 Å²	146	150.4 Å²	150.4	89%	0.885	78%	0.782	S	S	*	*			trans	-134.9	141.2	158.4	-177.6	0	0	0	0	108.3
779	S	35.2	Very low	34.5	Very low	100 Å²	100	154.9 Å²	154.9	70%	0.699	78%	0.784	S	S	*	*			trans	-86.9	154.7	-173.7	52.4	0	0	0	0	112.8
780	R	33.1	Very low	34.4	Very low	239 Å²	239	155.6 Å²	155.6	90%	0.902	78%	0.781	S	S	*	*	S	Bend	trans	42.6	136.2	152.3	-66.8	171	65.1	102.2	-6.6	118.9
781	A	30	Very low	34.4	Very low	108 Å²	108	156.9 Å²	156.9	89%	0.893	78%	0.777	S	S	*	*			trans	80.5	54.5	172.8	0	0	0	0	0	117.3
782	S	34.3	Very low	34.1	Very low	83 Å²	83	156 Å²	156	58%	0.58	77%	0.774	S	S	*	*			trans	-144.5	103	140.7	-171.2	0	0	0	0	112.3	F784	S782-F784 WeakPolarHBondContact OG-CB 3.4Å; S782-F784 PolarHBondContact OG-N 3.45Å; S782-F784 VanDerWaalsContact OG-N 3.08Å
783	R	39.1	Very low	34.5	Very low	237 Å²	237	152.1 Å²	152.1	89%	0.894	76%	0.758	S	S	*	*			trans	-93.5	17.7	148.2	-69	-170.7	179.3	113.4	-1.9	110.4
784	F	35.5	Very low	34.6	Very low	167 Å²	167	150.7 Å²	150.7	73%	0.732	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-8.8	-162.2	-143.7	-100.2	0	0	0	113.4	S782	S782-F784 WeakPolarHBondContact OG-CB 3.4Å; S782-F784 PolarHBondContact OG-N 3.45Å; S782-F784 VanDerWaalsContact OG-N 3.08Å
785	W	32.5	Very low	35.4	Very low	210 Å²	210	148 Å²	148	80%	0.795	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-10	174.8	-102	71.3	0	0	0	114.7	V787	W785-V787 VanDerWaalsContact C-N 3.34Å
786	F	29.1	Very low	36.6	Very low	191 Å²	191	143.5 Å²	143.5	84%	0.838	71%	0.713	S	S	*	*	S	Bend	trans	-92.6	7.3	173.2	-157.4	-104.8	0	0	0	113.1
787	V	36.3	Very low	38.2	Very low	92 Å²	92	137.7 Å²	137.7	56%	0.558	69%	0.692	S	S	*	*	S	Bend	trans	-117.2	7.5	178.4	-159.6	0	0	0	0	111.6	W785 F789 L790	W785-V787 VanDerWaalsContact C-N 3.34Å; V787-F789 PolarHBondContact O-N 3.34Å; V787-L790 HydrophobicContact CG1-CD1 4.36Å
788	I	31.9	Very low	40.3	Very low	111 Å²	111	132.5 Å²	132.5	57%	0.569	68%	0.675	S	S	*	*			trans	-96.5	43.3	171.3	-42.2	-176.9	0	0	0	110.2
789	F	31.6	Very low	42.3	Very low	185 Å²	185	128 Å²	128	81%	0.811	65%	0.647	S	S	*	*	S	Bend	trans	-128	36.9	164.7	-83.5	-79.5	0	0	0	110	V787	V787-F789 PolarHBondContact O-N 3.34Å
790	L	31.9	Very low	44.5	Very low	140 Å²	140	123.6 Å²	123.6	73%	0.733	62%	0.616	S	S	*	*			trans	-137.5	63.4	-179.6	-89.7	172.1	0	0	0	110.9	V787	V787-L790 HydrophobicContact CG1-CD1 4.36Å
791	Q	31.9	Very low	46.9	Very low	161 Å²	161	116.7 Å²	116.7	75%	0.752	59%	0.59	S	S	*	*	S	Bend	trans	-153.3	126.3	159.8	-158.2	70.7	40.2	0	0	109.5
792	D	29.9	Very low	49.5	Very low	123 Å²	123	117.9 Å²	117.9	66%	0.658	58%	0.577	S	S	*	*			trans	26.1	104.2	161.9	-53.8	-45.5	0	0	0	119.6
793	S	43.2	Very low	51.6	Low	68 Å²	68	116.1 Å²	116.1	48%	0.476	56%	0.561	S	S	.	*			trans	-112.4	99.7	147.2	61.8	0	0	0	0	108.7
794	V	40	Very low	53.8	Low	84 Å²	84	105 Å²	105	51%	0.509	52%	0.519	S	S	.	.			trans	-51.2	140.3	-178.5	173.3	0	0	0	0	111.4	D796 T799	V794-D796 HydrophobicContact CG1-CB 4Å; V794-D796 VanDerWaalsContact CG1-OD2 3.32Å; V794-D796 WeakPolarHBondContact CG1-OD2 3.49Å; V794-T799 HydrophobicContact CG1-CG2 4.37Å
795	S	53.8	Low	56.2	Low	45 Å²	45	101.5 Å²	101.5	32%	0.315	51%	0.507	S	S	.	.			trans	-141.9	61.9	166.1	-64.4	0	0	0	0	107.1	N840	S795-N840 PolarHBondContact OG-ND2 2.83Å
796	D	61.5	Low	58.7	Low	101 Å²	101	96.1 Å²	96.1	54%	0.54	50%	0.502	S	S	.	.			trans	-81.3	124.7	163.2	-66.1	-41	0	0	0	106.4	V794 D798 T799	V794-D796 HydrophobicContact CG1-CB 4Å; V794-D796 VanDerWaalsContact CG1-OD2 3.32Å; V794-D796 WeakPolarHBondContact CG1-OD2 3.49Å; D796-D798 PolarHBondContact O-N 3.28Å; D796-T799 HydrophobicContact CB-CG2 4.41Å; D796-T799 PolarHBondContact O-N 2.77Å; D796-T799 PolarHBondContact O-OG1 3.38Å
797	D	70.8	Confident	61.4	Low	90 Å²	90	88.9 Å²	88.9	48%	0.481	47%	0.472	S	S	.	.	H	α-helix	trans	-55.2	-30	-172.3	-61.8	-49.5	0	0	0	112.1	T799 L800 R801 Y844	D797-T799 VanDerWaalsContact C-N 3.34Å; D797-T799 PolarHBondContact O-N 3.22Å; D797-L800 PolarHBondContact O-N 3.16Å; D797-R801 WeakPolarHBondContact O-CG 3.46Å; D797-R801 PolarHBondContact O-N 3.03Å; D797-Y844 HydrophobicContact CB-CD2 4.13Å; D797-Y844 HydrophobicContact CB-CE2 4.02Å; D797-Y844 WeakPolarHBondContact O-CE2 3.47Å
798	D	77.1	Confident	63.7	Low	102 Å²	102	88 Å²	88	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-67.2	-30.2	177.5	-54.7	-47.9	0	0	0	113.5	D796 R801 Q802	D796-D798 PolarHBondContact O-N 3.28Å; D798-R801 PolarHBondContact O-N 2.92Å; D798-R801 IonicContact OD1-NE 3.25Å; D798-Q802 WeakPolarHBondContact O-CB 3.4Å; D798-Q802 VanDerWaalsContact O-CG 3.3Å; D798-Q802 WeakPolarHBondContact O-CG 3.37Å; D798-Q802 PolarHBondContact O-N 2.87Å
799	T	79.5	Confident	66.2	Low	51 Å²	51	85.5 Å²	85.5	31%	0.313	46%	0.462	S	S	.	.	H	α-helix	trans	-70.9	-36.9	172.5	62.2	0	0	0	0	111.2	V794 D796 D797 L803	V794-T799 HydrophobicContact CG1-CG2 4.37Å; D796-T799 HydrophobicContact CB-CG2 4.41Å; D796-T799 PolarHBondContact O-N 2.77Å; D796-T799 PolarHBondContact O-OG1 3.38Å; D797-T799 VanDerWaalsContact C-N 3.34Å; D797-T799 PolarHBondContact O-N 3.22Å; T799-L803 WeakPolarHBondContact O-CB 3.42Å; T799-L803 WeakPolarHBondContact O-CD1 3.3Å; T799-L803 VanDerWaalsContact O-CG 3.28Å; T799-L803 WeakPolarHBondContact O-CG 3.37Å; T799-L803 PolarHBondContact O-N 3.49Å
800	L	82.4	Confident	68.9	Low	7 Å²	7	76.7 Å²	76.7	4%	0.037	42%	0.423	C	S	.	.	H	α-helix	trans	-69	-39	172.2	-75.7	172.3	0	0	0	111.6	D797 L803 L804 L829 C836 Y844	D797-L800 PolarHBondContact O-N 3.16Å; L800-L803 PolarHBondContact O-N 2.99Å; L800-L804 VanDerWaalsContact O-CB 3.32Å; L800-L804 WeakPolarHBondContact O-CB 3.44Å; L800-L804 WeakPolarHBondContact O-CD1 3.3Å; L800-L804 VanDerWaalsContact O-CG 3.22Å; L800-L804 WeakPolarHBondContact O-CG 3.46Å; L800-L804 PolarHBondContact O-N 3.37Å; L800-L829 HydrophobicContact CD2-CD1 4.48Å; L800-C836 HydrophobicContact CD2-CB 4.09Å; L800-Y844 HydrophobicContact CB-CD1 4.47Å; L800-Y844 HydrophobicContact CB-CD2 3.96Å; L800-Y844 HydrophobicContact CB-CE1 4.43Å; L800-Y844 HydrophobicContact CB-CE2 3.86Å; L800-Y844 HydrophobicContact CB-CG 4.27Å; L800-Y844 HydrophobicContact CD1-CD1 4.48Å; L800-Y844 HydrophobicContact CD1-CD2 3.87Å; L800-Y844 HydrophobicContact CD1-CG 3.8Å
801	R	83.5	Confident	71.6	Confident	95 Å²	95	74.5 Å²	74.5	36%	0.358	41%	0.406	S	S	.	.	H	α-helix	trans	-55.7	-55.1	170.2	-72.3	-179.4	-169.1	-65.1	-5.7	111.3	D797 D798 L803 L804 I805 Y844 Q848	D797-R801 WeakPolarHBondContact O-CG 3.46Å; D797-R801 PolarHBondContact O-N 3.03Å; D798-R801 PolarHBondContact O-N 2.92Å; D798-R801 IonicContact OD1-NE 3.25Å; R801-L803 VanDerWaalsContact C-N 3.34Å; R801-L803 PolarHBondContact O-N 3.47Å; R801-L804 PolarHBondContact O-N 3.47Å; R801-I805 HydrophobicContact CB-CD1 4.5Å; R801-I805 WeakPolarHBondContact O-CB 3.41Å; R801-I805 WeakPolarHBondContact O-CD1 3.25Å; R801-I805 VanDerWaalsContact O-CG1 3.23Å; R801-I805 WeakPolarHBondContact O-CG1 3.15Å; R801-I805 PolarHBondContact O-N 3.17Å; R801-Y844 HydrophobicContact CG-CE2 4.34Å; R801-Y844 WeakPolarHBondContact CG-OH 3.36Å; R801-Q848 VanDerWaalsContact CZ-OE1 3.25Å; R801-Q848 VanDerWaalsContact NH2-CD 3.34Å
802	Q	82.7	Confident	74.3	Confident	132 Å²	132	71.9 Å²	71.9	62%	0.617	39%	0.393	S	S	*	.	H	α-helix	trans	-57.9	-46.1	-179.1	-74.8	173.6	0.8	0	0	111.3	D798 L804 I805 S806	D798-Q802 WeakPolarHBondContact O-CB 3.4Å; D798-Q802 VanDerWaalsContact O-CG 3.3Å; D798-Q802 WeakPolarHBondContact O-CG 3.37Å; D798-Q802 PolarHBondContact O-N 2.87Å; Q802-L804 PolarHBondContact O-N 3.43Å; Q802-I805 PolarHBondContact O-N 2.83Å; Q802-S806 WeakPolarHBondContact O-CB 3.33Å; Q802-S806 PolarHBondContact O-N 3.01Å; Q802-S806 PolarHBondContact O-OG 3.5Å
803	L	80.3	Confident	77.1	Confident	46 Å²	46	68.2 Å²	68.2	24%	0.241	37%	0.374	C	S	.	.	H	α-helix	trans	-68	-34.1	179.4	-71.3	162.6	0	0	0	113.3	T799 L800 R801 N807 L829 A834	T799-L803 WeakPolarHBondContact O-CB 3.42Å; T799-L803 WeakPolarHBondContact O-CD1 3.3Å; T799-L803 VanDerWaalsContact O-CG 3.28Å; T799-L803 WeakPolarHBondContact O-CG 3.37Å; T799-L803 PolarHBondContact O-N 3.49Å; L800-L803 PolarHBondContact O-N 2.99Å; R801-L803 VanDerWaalsContact C-N 3.34Å; R801-L803 PolarHBondContact O-N 3.47Å; L803-N807 PolarHBondContact O-N 3.34Å; L803-N807 PolarHBondContact O-ND2 3.48Å; L803-L829 HydrophobicContact CB-CD2 3.77Å; L803-A834 HydrophobicContact CD1-CB 3.78Å
804	L	84.7	Confident	79.3	Confident	4 Å²	4	66.7 Å²	66.7	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-72.1	-34.1	174.4	-72.3	166.7	0	0	0	112.5	L800 R801 Q802 I810 I814 V825 L829 Y844 L845	L800-L804 VanDerWaalsContact O-CB 3.32Å; L800-L804 WeakPolarHBondContact O-CB 3.44Å; L800-L804 WeakPolarHBondContact O-CD1 3.3Å; L800-L804 VanDerWaalsContact O-CG 3.22Å; L800-L804 WeakPolarHBondContact O-CG 3.46Å; L800-L804 PolarHBondContact O-N 3.37Å; R801-L804 PolarHBondContact O-N 3.47Å; Q802-L804 PolarHBondContact O-N 3.43Å; L804-I810 HydrophobicContact CD2-CG2 3.66Å; L804-I814 HydrophobicContact CB-CD1 4.38Å; L804-I814 HydrophobicContact CD2-CD1 4.35Å; L804-V825 HydrophobicContact CD2-CG1 4.16Å; L804-L829 HydrophobicContact CD2-CD1 4.18Å; L804-L829 HydrophobicContact CD2-CD2 4.22Å; L804-L829 HydrophobicContact CG-CD2 4.45Å; L804-Y844 HydrophobicContact CD1-CD1 4.07Å; L804-Y844 HydrophobicContact CD1-CE1 3.3Å; L804-L845 HydrophobicContact CD1-CD2 4.41Å
805	I	85.8	Confident	81.6	Confident	94 Å²	94	67.5 Å²	67.5	48%	0.482	36%	0.361	S	S	.	.	H	α-helix	trans	-73.7	-35.5	175.2	-66.3	163.4	0	0	0	111.1	R801 Q802 N807 Y811	R801-I805 HydrophobicContact CB-CD1 4.5Å; R801-I805 WeakPolarHBondContact O-CB 3.41Å; R801-I805 WeakPolarHBondContact O-CD1 3.25Å; R801-I805 VanDerWaalsContact O-CG1 3.23Å; R801-I805 WeakPolarHBondContact O-CG1 3.15Å; R801-I805 PolarHBondContact O-N 3.17Å; Q802-I805 PolarHBondContact O-N 2.83Å; I805-N807 VanDerWaalsContact C-N 3.29Å; I805-N807 PolarHBondContact O-N 2.99Å; I805-Y811 HydrophobicContact CB-CD2 4.48Å; I805-Y811 HydrophobicContact CG1-CD2 4.03Å; I805-Y811 HydrophobicContact CG1-CE2 3.9Å
806	S	85.6	Confident	83.2	Confident	97 Å²	97	66.4 Å²	66.4	68%	0.678	35%	0.352	S	S	*	.	H	α-helix	trans	-69.8	-20.4	178.4	-65.7	0	0	0	0	114.4	Q802	Q802-S806 WeakPolarHBondContact O-CB 3.33Å; Q802-S806 PolarHBondContact O-N 3.01Å; Q802-S806 PolarHBondContact O-OG 3.5Å
807	N	84	Confident	84.4	Confident	39 Å²	39	70.5 Å²	70.5	21%	0.209	36%	0.362	C	S	.	.	S	Bend	trans	-95.4	93.1	174.2	-74.3	-86.6	0	0	0	108.2	L803 I805 D809 I810 Y811	L803-N807 PolarHBondContact O-N 3.34Å; L803-N807 PolarHBondContact O-ND2 3.48Å; I805-N807 VanDerWaalsContact C-N 3.29Å; I805-N807 PolarHBondContact O-N 2.99Å; N807-D809 WeakPolarHBondContact CB-OD1 3.25Å; N807-D809 PolarHBondContact O-N 3.43Å; N807-I810 HydrophobicContact CB-CB 4.02Å; N807-I810 HydrophobicContact CB-CD1 3.76Å; N807-I810 HydrophobicContact CB-CG1 3.92Å; N807-I810 PolarHBondContact O-N 2.85Å; N807-Y811 WeakPolarHBondContact O-CB 3.35Å; N807-Y811 PolarHBondContact O-N 2.9Å
808	A	85	Confident	85.1	Confident	74 Å²	74	70 Å²	70	61%	0.612	36%	0.355	S	S	*	.	H	α-helix	trans	-56.9	-34.7	-171.1	0	0	0	0	0	113.6	Y811 E812	A808-Y811 PolarHBondContact O-N 3.37Å; A808-E812 WeakPolarHBondContact O-CB 3.43Å; A808-E812 PolarHBondContact O-N 3.19Å
809	D	85.9	Confident	85.5	Confident	57 Å²	57	69.2 Å²	69.2	31%	0.305	36%	0.355	S	S	.	.	H	α-helix	trans	-64.1	-46.3	174.2	61.2	-39.5	0	0	0	112.6	N807 Y811 D813 R828	N807-D809 WeakPolarHBondContact CB-OD1 3.25Å; N807-D809 PolarHBondContact O-N 3.43Å; D809-Y811 VanDerWaalsContact C-N 3.33Å; D809-D813 WeakPolarHBondContact O-CB 3.37Å; D809-D813 PolarHBondContact O-N 3.49Å; D809-R828 WeakPolarHBondContact OD2-CD 3.43Å; D809-R828 IonicContact OD2-CZ 3.84Å; D809-R828 IonicContact OD2-NE 2.68Å; D809-R828 PolarHBondContact OD2-NE 3.45Å; D809-R828 IonicContact OD2-NH1 3.73Å; D809-R828 PolarHBondContact OD2-NH1 3.21Å; D809-R828 IonicContact OD2-NH2 3.52Å
810	I	86.4	Confident	85.7	Confident	1 Å²	1	67 Å²	67	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-70.1	-35.7	177.3	-55.6	177.2	0	0	0	110	L804 N807 I814 L820 V825 R828	L804-I810 HydrophobicContact CD2-CG2 3.66Å; N807-I810 HydrophobicContact CB-CB 4.02Å; N807-I810 HydrophobicContact CB-CD1 3.76Å; N807-I810 HydrophobicContact CB-CG1 3.92Å; N807-I810 PolarHBondContact O-N 2.85Å; I810-I814 HydrophobicContact CG2-CD1 4.09Å; I810-I814 WeakPolarHBondContact O-CD1 3.33Å; I810-I814 WeakPolarHBondContact O-CG1 3.34Å; I810-I814 PolarHBondContact O-N 3.01Å; I810-L820 HydrophobicContact CG2-CD1 4.28Å; I810-L820 HydrophobicContact CG2-CD2 4.04Å; I810-V825 HydrophobicContact CD1-CG1 4.31Å; I810-V825 HydrophobicContact CD1-CG2 4.29Å; I810-V825 HydrophobicContact CG1-CG2 4.47Å; I810-V825 HydrophobicContact CG2-CG1 4.39Å; I810-V825 HydrophobicContact CG2-CG2 4.19Å; I810-R828 HydrophobicContact CD1-CB 3.97Å
811	Y	89.1	Confident	85.8	Confident	93 Å²	93	68.3 Å²	68.3	37%	0.365	35%	0.349	S	S	.	.	H	α-helix	trans	-67.9	-42.2	176.7	-170.2	-121.9	0	0	0	112.1	I805 N807 A808 D809 I814 L815	I805-Y811 HydrophobicContact CB-CD2 4.48Å; I805-Y811 HydrophobicContact CG1-CD2 4.03Å; I805-Y811 HydrophobicContact CG1-CE2 3.9Å; N807-Y811 WeakPolarHBondContact O-CB 3.35Å; N807-Y811 PolarHBondContact O-N 2.9Å; A808-Y811 PolarHBondContact O-N 3.37Å; D809-Y811 VanDerWaalsContact C-N 3.33Å; Y811-I814 WeakPolarHBondContact O-CB 3.23Å; Y811-I814 PolarHBondContact O-N 2.95Å; Y811-L815 HydrophobicContact CD1-CD1 3.9Å; Y811-L815 HydrophobicContact CE1-CD1 3.61Å; Y811-L815 HydrophobicContact CE1-CG 4.34Å; Y811-L815 HydrophobicContact CE2-CG 4.43Å; Y811-L815 HydrophobicContact CG-CD1 4.49Å; Y811-L815 WeakPolarHBondContact O-CG 3.47Å; Y811-L815 PolarHBondContact O-N 3.22Å
812	E	88.6	Confident	86	Confident	106 Å²	106	64.1 Å²	64.1	50%	0.495	33%	0.333	S	S	.	.	H	α-helix	trans	-63	-44.1	173.1	-167.9	-153.9	120	0	0	111.6	A808 I814 L815 T816 K818	A808-E812 WeakPolarHBondContact O-CB 3.43Å; A808-E812 PolarHBondContact O-N 3.19Å; E812-I814 VanDerWaalsContact C-N 3.28Å; E812-I814 PolarHBondContact O-N 3.26Å; E812-L815 PolarHBondContact O-N 3.05Å; E812-T816 HydrophobicContact CG-CG2 4.4Å; E812-T816 WeakPolarHBondContact O-CB 3.5Å; E812-T816 WeakPolarHBondContact O-CG2 3.31Å; E812-T816 PolarHBondContact O-N 3.35Å; E812-T816 PolarHBondContact O-OG1 3.07Å; E812-K818 IonicContact OE1-NZ 2.66Å; E812-K818 PolarHBondContact OE1-NZ 3.46Å
813	D	89.4	Confident	86.1	Confident	47 Å²	47	61.7 Å²	61.7	25%	0.251	32%	0.321	S	S	.	.	H	α-helix	trans	-62.1	-35	175.4	-80.3	-0	0	0	0	112.3	D809 T816 Y817 K818 L820	D809-D813 WeakPolarHBondContact O-CB 3.37Å; D809-D813 PolarHBondContact O-N 3.49Å; D813-T816 PolarHBondContact O-OG1 2.98Å; D813-Y817 PolarHBondContact O-N 2.85Å; D813-K818 HydrophobicContact CB-CB 4.25Å; D813-K818 HydrophobicContact CB-CD 4.31Å; D813-K818 PolarHBondContact O-N 3.06Å; D813-K818 WeakPolarHBondContact OD1-CD 3.42Å; D813-K818 IonicContact OD1-NZ 3.54Å; D813-K818 PolarHBondContact OD1-NZ 2.82Å; D813-L820 HydrophobicContact CB-CD2 3.61Å
814	I	88.7	Confident	86.3	Confident	35 Å²	35	62 Å²	62	18%	0.179	32%	0.323	C	S	.	.	H	α-helix	trans	-66.4	-49.4	172	-71.7	163.8	0	0	0	111	L804 I810 Y811 E812 T816 Y817 L820 I850	L804-I814 HydrophobicContact CB-CD1 4.38Å; L804-I814 HydrophobicContact CD2-CD1 4.35Å; I810-I814 HydrophobicContact CG2-CD1 4.09Å; I810-I814 WeakPolarHBondContact O-CD1 3.33Å; I810-I814 WeakPolarHBondContact O-CG1 3.34Å; I810-I814 PolarHBondContact O-N 3.01Å; Y811-I814 WeakPolarHBondContact O-CB 3.23Å; Y811-I814 PolarHBondContact O-N 2.95Å; E812-I814 VanDerWaalsContact C-N 3.28Å; E812-I814 PolarHBondContact O-N 3.26Å; I814-T816 VanDerWaalsContact C-N 3.33Å; I814-T816 PolarHBondContact O-N 3Å; I814-Y817 PolarHBondContact O-N 2.84Å; I814-Y817 VanDerWaalsContact O-N 3.16Å; I814-L820 HydrophobicContact CD1-CD1 4.18Å; I814-L820 HydrophobicContact CG1-CD1 3.81Å; I814-L820 HydrophobicContact CG1-CD2 4.42Å; I814-L820 HydrophobicContact CG1-CG 4.4Å; I814-I850 HydrophobicContact CD1-CD1 4.18Å; I814-I850 HydrophobicContact CG1-CD1 4.43Å; I814-I850 HydrophobicContact CG1-CG2 4Å; I814-I850 HydrophobicContact CG2-CD1 4.39Å; I814-I850 HydrophobicContact CG2-CG1 4.46Å
815	L	88	Confident	86.4	Confident	102 Å²	102	62.1 Å²	62.1	53%	0.534	32%	0.323	S	S	.	.	H	α-helix	trans	-63.7	-36.3	-178.5	-72.8	174.5	0	0	0	112.6	Y811 E812 Y817	Y811-L815 HydrophobicContact CD1-CD1 3.9Å; Y811-L815 HydrophobicContact CE1-CD1 3.61Å; Y811-L815 HydrophobicContact CE1-CG 4.34Å; Y811-L815 HydrophobicContact CE2-CG 4.43Å; Y811-L815 HydrophobicContact CG-CD1 4.49Å; Y811-L815 WeakPolarHBondContact O-CG 3.47Å; Y811-L815 PolarHBondContact O-N 3.22Å; E812-L815 PolarHBondContact O-N 3.05Å; L815-Y817 VanDerWaalsContact C-N 3.25Å; L815-Y817 WeakPolarHBondContact O-CD2 3.47Å; L815-Y817 PolarHBondContact O-N 3.35Å
816	T	88.3	Confident	86.5	Confident	21 Å²	21	59.1 Å²	59.1	13%	0.129	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.8	178.3	54.2	0	0	0	0	113.8	K344 E812 D813 I814 K818	K344-T816 PolarHBondContact NZ-O 2.9Å; E812-T816 HydrophobicContact CG-CG2 4.4Å; E812-T816 WeakPolarHBondContact O-CB 3.5Å; E812-T816 WeakPolarHBondContact O-CG2 3.31Å; E812-T816 PolarHBondContact O-N 3.35Å; E812-T816 PolarHBondContact O-OG1 3.07Å; D813-T816 PolarHBondContact O-OG1 2.98Å; I814-T816 VanDerWaalsContact C-N 3.33Å; I814-T816 PolarHBondContact O-N 3Å; T816-K818 VanDerWaalsContact C-N 3.26Å; T816-K818 PolarHBondContact O-N 3.03Å; T816-K818 WeakPolarHBondContact OG1-CD 3.44Å; T816-K818 WeakPolarHBondContact OG1-CE 3.32Å; T816-K818 WeakPolarHBondContact OG1-CG 3.26Å
817	Y	86.5	Confident	86.5	Confident	188 Å²	188	61.2 Å²	61.2	74%	0.737	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	31.8	-176.5	-63.8	-95	0	0	0	114.1	D813 I814 L815	D813-Y817 PolarHBondContact O-N 2.85Å; I814-Y817 PolarHBondContact O-N 2.84Å; I814-Y817 VanDerWaalsContact O-N 3.16Å; L815-Y817 VanDerWaalsContact C-N 3.25Å; L815-Y817 WeakPolarHBondContact O-CD2 3.47Å; L815-Y817 PolarHBondContact O-N 3.35Å
818	K	85.4	Confident	86.5	Confident	80 Å²	80	64.7 Å²	64.7	35%	0.348	31%	0.311	S	S	.	.			trans	-73.4	145.7	173.8	-65.2	167.3	-161.2	159.2	0	109.8	E812 D813 T816 L820	E812-K818 IonicContact OE1-NZ 2.66Å; E812-K818 PolarHBondContact OE1-NZ 3.46Å; D813-K818 HydrophobicContact CB-CB 4.25Å; D813-K818 HydrophobicContact CB-CD 4.31Å; D813-K818 PolarHBondContact O-N 3.06Å; D813-K818 WeakPolarHBondContact OD1-CD 3.42Å; D813-K818 IonicContact OD1-NZ 3.54Å; D813-K818 PolarHBondContact OD1-NZ 2.82Å; T816-K818 VanDerWaalsContact C-N 3.26Å; T816-K818 PolarHBondContact O-N 3.03Å; T816-K818 WeakPolarHBondContact OG1-CD 3.44Å; T816-K818 WeakPolarHBondContact OG1-CE 3.32Å; T816-K818 WeakPolarHBondContact OG1-CG 3.26Å; K818-L820 PolarHBondContact O-N 2.81Å; K818-L820 VanDerWaalsContact O-N 3.08Å
819	P	84.9	Confident	86.5	Confident	84 Å²	84	61.1 Å²	61.1	55%	0.545	28%	0.281	S	S	.	.			trans	-79.2	94.7	-176.9	31.2	-34.7	0	0	0	112	N821 T851	P819-N821 PolarHBondContact O-N 2.93Å; P819-T851 WeakPolarHBondContact CA-O 3.38Å
820	L	85	Confident	86.4	Confident	4 Å²	4	67.1 Å²	67.1	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.5	126.4	-178.6	-67.6	-178.5	0	0	0	113.4	I810 D813 I814 K818 L822 V825 L845 I850 T851 F852 S853	I810-L820 HydrophobicContact CG2-CD1 4.28Å; I810-L820 HydrophobicContact CG2-CD2 4.04Å; D813-L820 HydrophobicContact CB-CD2 3.61Å; I814-L820 HydrophobicContact CD1-CD1 4.18Å; I814-L820 HydrophobicContact CG1-CD1 3.81Å; I814-L820 HydrophobicContact CG1-CD2 4.42Å; I814-L820 HydrophobicContact CG1-CG 4.4Å; K818-L820 PolarHBondContact O-N 2.81Å; K818-L820 VanDerWaalsContact O-N 3.08Å; L820-L822 PolarHBondContact O-N 3.35Å; L820-L822 VanDerWaalsContact O-N 3.15Å; L820-V825 HydrophobicContact CB-CG2 4.07Å; L820-V825 HydrophobicContact CD1-CG2 4.31Å; L820-V825 HydrophobicContact CD2-CG2 4.12Å; L820-V825 HydrophobicContact CG-CG2 4.41Å; L820-L845 HydrophobicContact CD1-CD2 4.23Å; L820-I850 HydrophobicContact CD1-CG2 3.68Å; L820-I850 HydrophobicContact CG-CG2 4.37Å; L820-T851 PolarHBondContact N-O 3.36Å; L820-F852 HydrophobicContact CB-CB 4.34Å; L820-F852 CarbonylContact O-C 3.48Å; L820-F852 WeakPolarHBondContact O-CA 3.35Å; L820-F852 WeakPolarHBondContact O-CB 3.34Å; L820-S853 PolarHBondContact O-N 2.8Å
821	N	84.8	Confident	86.1	Confident	36 Å²	36	74 Å²	74	19%	0.193	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	111.3	170.8	178.9	-22.4	0	0	0	109.9	P819 K823 N824 V825	P819-N821 PolarHBondContact O-N 2.93Å; N821-K823 VanDerWaalsContact C-N 3.31Å; N821-K823 PolarHBondContact O-N 3.46Å; N821-K823 WeakPolarHBondContact OD1-CB 3.32Å; N821-K823 PolarHBondContact OD1-N 3.31Å; N821-N824 HydrophobicContact CB-CB 4.11Å; N821-N824 PolarHBondContact ND2-ND2 2.84Å; N821-N824 PolarHBondContact O-N 3.4Å; N821-N824 VanDerWaalsContact O-N 3.07Å; N821-N824 PolarHBondContact OD1-N 2.95Å; N821-V825 PolarHBondContact O-N 2.9Å
822	L	87.3	Confident	85.3	Confident	7 Å²	7	71.8 Å²	71.8	4%	0.037	34%	0.337	C	S	.	.	H	α-helix	trans	-62.2	-34.6	-173.2	-169.8	74	0	0	0	112.9	L820 H826 L838 L841 L842 L845 F852 S853 M854	L820-L822 PolarHBondContact O-N 3.35Å; L820-L822 VanDerWaalsContact O-N 3.15Å; L822-H826 VanDerWaalsContact O-CB 3.24Å; L822-H826 WeakPolarHBondContact O-CB 3.3Å; L822-H826 PolarHBondContact O-N 2.71Å; L822-L838 HydrophobicContact CD2-CD1 3.98Å; L822-L838 HydrophobicContact CD2-CG 4.27Å; L822-L838 HydrophobicContact CG-CD1 3.83Å; L822-L841 HydrophobicContact CD1-CD2 4.04Å; L822-L841 HydrophobicContact CD1-CG 4.09Å; L822-L842 HydrophobicContact CD2-CB 4.31Å; L822-L842 HydrophobicContact CD2-CD1 3.9Å; L822-L845 HydrophobicContact CD1-CD1 3.65Å; L822-F852 HydrophobicContact CB-CD2 4.45Å; L822-F852 HydrophobicContact CD1-CD2 4.33Å; L822-F852 HydrophobicContact CD1-CG 4.39Å; L822-F852 HydrophobicContact CD2-CD2 4.36Å; L822-S853 PolarHBondContact N-O 3Å; L822-M854 HydrophobicContact CD2-CG 4.03Å; L822-M854 HydrophobicContact CD2-SD 4.13Å
823	K	84.7	Confident	84.6	Confident	81 Å²	81	69.6 Å²	69.6	35%	0.352	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-45.3	174.3	-68.7	-175.8	-175.3	172.3	0	110.7	N821 H826 R827 D858	N821-K823 VanDerWaalsContact C-N 3.31Å; N821-K823 PolarHBondContact O-N 3.46Å; N821-K823 WeakPolarHBondContact OD1-CB 3.32Å; N821-K823 PolarHBondContact OD1-N 3.31Å; K823-H826 PolarHBondContact O-N 3.47Å; K823-R827 WeakPolarHBondContact O-CB 3.33Å; K823-R827 PolarHBondContact O-N 2.92Å; K823-D858 IonicContact NZ-OD1 2.67Å; K823-D858 PolarHBondContact NZ-OD1 2.96Å; K823-D858 IonicContact NZ-OD2 2.73Å; K823-D858 PolarHBondContact NZ-OD2 3.43Å
824	N	84.6	Confident	83.7	Confident	52 Å²	52	67.7 Å²	67.7	28%	0.278	33%	0.334	S	S	.	.	H	α-helix	trans	-76.1	-39.1	-171.7	-66.1	10	0	0	0	111.3	N821 R827 R828	N821-N824 HydrophobicContact CB-CB 4.11Å; N821-N824 PolarHBondContact ND2-ND2 2.84Å; N821-N824 PolarHBondContact O-N 3.4Å; N821-N824 VanDerWaalsContact O-N 3.07Å; N821-N824 PolarHBondContact OD1-N 2.95Å; N824-R827 WeakPolarHBondContact O-CB 3.47Å; N824-R827 PolarHBondContact O-N 3.03Å; N824-R828 PolarHBondContact O-N 3.39Å
825	V	87	Confident	83	Confident	6 Å²	6	74.6 Å²	74.6	4%	0.036	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-42	170.8	173.1	0	0	0	0	111	L804 I810 L820 N821 R827 R828 L829 L841	L804-V825 HydrophobicContact CD2-CG1 4.16Å; I810-V825 HydrophobicContact CD1-CG1 4.31Å; I810-V825 HydrophobicContact CD1-CG2 4.29Å; I810-V825 HydrophobicContact CG1-CG2 4.47Å; I810-V825 HydrophobicContact CG2-CG1 4.39Å; I810-V825 HydrophobicContact CG2-CG2 4.19Å; L820-V825 HydrophobicContact CB-CG2 4.07Å; L820-V825 HydrophobicContact CD1-CG2 4.31Å; L820-V825 HydrophobicContact CD2-CG2 4.12Å; L820-V825 HydrophobicContact CG-CG2 4.41Å; N821-V825 PolarHBondContact O-N 2.9Å; V825-R827 VanDerWaalsContact C-N 3.31Å; V825-R827 PolarHBondContact O-N 3.45Å; V825-R828 PolarHBondContact O-N 3.45Å; V825-L829 HydrophobicContact CG1-CD1 3.74Å; V825-L829 HydrophobicContact CG1-CG 4.17Å; V825-L829 VanDerWaalsContact O-CB 3.31Å; V825-L829 WeakPolarHBondContact O-CB 3.27Å; V825-L829 VanDerWaalsContact O-CG 3.27Å; V825-L829 WeakPolarHBondContact O-CG 3.15Å; V825-L829 PolarHBondContact O-N 2.92Å; V825-L841 HydrophobicContact CG1-CD1 4.47Å; V825-L841 HydrophobicContact CG1-CD2 4.11Å
826	H	87.2	Confident	82.4	Confident	31 Å²	31	70.3 Å²	70.3	14%	0.144	34%	0.336	C	S	.	.	H	α-helix	trans	-61.9	-38.8	173.8	-169.5	-108.7	0	0	0	112.3	L822 K823 R830 C836 L838 L841	L822-H826 VanDerWaalsContact O-CB 3.24Å; L822-H826 WeakPolarHBondContact O-CB 3.3Å; L822-H826 PolarHBondContact O-N 2.71Å; K823-H826 PolarHBondContact O-N 3.47Å; H826-R830 WeakPolarHBondContact O-CB 3.41Å; H826-R830 PolarHBondContact O-N 3.23Å; H826-C836 PolarHBondContact NE2-O 2.86Å; H826-L838 HydrophobicContact CB-CD1 3.77Å; H826-L841 HydrophobicContact CB-CD2 3.83Å
827	R	85.7	Confident	82.2	Confident	141 Å²	141	71.7 Å²	71.7	53%	0.532	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-52.1	174.8	-166.3	-172.4	-66.5	178.3	1.6	111.6	K823 N824 V825 R830 Q831	K823-R827 WeakPolarHBondContact O-CB 3.33Å; K823-R827 PolarHBondContact O-N 2.92Å; N824-R827 WeakPolarHBondContact O-CB 3.47Å; N824-R827 PolarHBondContact O-N 3.03Å; V825-R827 VanDerWaalsContact C-N 3.31Å; V825-R827 PolarHBondContact O-N 3.45Å; R827-R830 PolarHBondContact O-N 3.44Å; R827-Q831 WeakPolarHBondContact O-CG 3.39Å; R827-Q831 PolarHBondContact O-N 2.87Å; R827-Q831 PolarHBondContact O-OE1 3.2Å
828	R	83.8	Confident	82.2	Confident	112 Å²	112	66.7 Å²	66.7	42%	0.423	33%	0.332	S	S	.	.	H	α-helix	trans	-62	-47.9	179.1	-76.1	-174.4	178.9	146.8	1.5	112.3	D809 I810 N824 V825 R830 Q831 G832	D809-R828 WeakPolarHBondContact OD2-CD 3.43Å; D809-R828 IonicContact OD2-CZ 3.84Å; D809-R828 IonicContact OD2-NE 2.68Å; D809-R828 PolarHBondContact OD2-NE 3.45Å; D809-R828 IonicContact OD2-NH1 3.73Å; D809-R828 PolarHBondContact OD2-NH1 3.21Å; D809-R828 IonicContact OD2-NH2 3.52Å; I810-R828 HydrophobicContact CD1-CB 3.97Å; N824-R828 PolarHBondContact O-N 3.39Å; V825-R828 PolarHBondContact O-N 3.45Å; R828-R830 VanDerWaalsContact C-N 3.29Å; R828-R830 PolarHBondContact O-N 2.92Å; R828-Q831 WeakPolarHBondContact O-CB 3.49Å; R828-Q831 PolarHBondContact O-N 3.44Å; R828-Q831 VanDerWaalsContact O-N 3.12Å; R828-G832 PolarHBondContact O-N 3.44Å
829	L	84.4	Confident	82.1	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-57.9	-42.7	175.5	-72.1	174.2	0	0	0	111.5	L800 L803 L804 V825 Q831 G832 G833 A834 L841	L800-L829 HydrophobicContact CD2-CD1 4.48Å; L803-L829 HydrophobicContact CB-CD2 3.77Å; L804-L829 HydrophobicContact CD2-CD1 4.18Å; L804-L829 HydrophobicContact CD2-CD2 4.22Å; L804-L829 HydrophobicContact CG-CD2 4.45Å; V825-L829 HydrophobicContact CG1-CD1 3.74Å; V825-L829 HydrophobicContact CG1-CG 4.17Å; V825-L829 VanDerWaalsContact O-CB 3.31Å; V825-L829 WeakPolarHBondContact O-CB 3.27Å; V825-L829 VanDerWaalsContact O-CG 3.27Å; V825-L829 WeakPolarHBondContact O-CG 3.15Å; V825-L829 PolarHBondContact O-N 2.92Å; L829-Q831 VanDerWaalsContact C-N 3.33Å; L829-Q831 PolarHBondContact O-N 3.35Å; L829-G832 CarbonylContact O-C 3.57Å; L829-G832 VanDerWaalsContact O-C 3.31Å; L829-G832 WeakPolarHBondContact O-CA 3.15Å; L829-G832 PolarHBondContact O-N 2.98Å; L829-G832 VanDerWaalsContact O-N 3.16Å; L829-G833 PolarHBondContact O-N 2.88Å; L829-A834 HydrophobicContact CB-CB 3.82Å; L829-A834 WeakPolarHBondContact O-CA 3.3Å; L829-A834 WeakPolarHBondContact O-CB 3.47Å; L829-A834 PolarHBondContact O-N 2.92Å; L829-L841 HydrophobicContact CD1-CD1 3.61Å; L829-L841 HydrophobicContact CD1-CD2 4.11Å; L829-L841 HydrophobicContact CD1-CG 4.5Å
830	R	84.8	Confident	82.2	Confident	182 Å²	182	67.8 Å²	67.8	69%	0.687	33%	0.331	S	S	*	.	H	α-helix	trans	-68.7	-28.9	178.2	-168.7	176.2	-176	-174.4	0.5	113.3	H826 R827 R828 G833	H826-R830 WeakPolarHBondContact O-CB 3.41Å; H826-R830 PolarHBondContact O-N 3.23Å; R827-R830 PolarHBondContact O-N 3.44Å; R828-R830 VanDerWaalsContact C-N 3.29Å; R828-R830 PolarHBondContact O-N 2.92Å; R830-G833 PolarHBondContact O-N 3.32Å
831	Q	80.3	Confident	82.3	Confident	147 Å²	147	67.6 Å²	67.6	69%	0.687	33%	0.33	S	S	*	.	H	α-helix	trans	-69.5	-40.6	168.9	-71.5	166	-49.9	0	0	110.9	R827 R828 L829 G833	R827-Q831 WeakPolarHBondContact O-CG 3.39Å; R827-Q831 PolarHBondContact O-N 2.87Å; R827-Q831 PolarHBondContact O-OE1 3.2Å; R828-Q831 WeakPolarHBondContact O-CB 3.49Å; R828-Q831 PolarHBondContact O-N 3.44Å; R828-Q831 VanDerWaalsContact O-N 3.12Å; L829-Q831 VanDerWaalsContact C-N 3.33Å; L829-Q831 PolarHBondContact O-N 3.35Å; Q831-G833 PolarHBondContact O-N 3.25Å
832	G	72.5	Confident	82.5	Confident	45 Å²	45	67.8 Å²	67.8	46%	0.464	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	21.6	170.2	0	0	0	0	0	115.5	R828 L829 A834	R828-G832 PolarHBondContact O-N 3.44Å; L829-G832 CarbonylContact O-C 3.57Å; L829-G832 VanDerWaalsContact O-C 3.31Å; L829-G832 WeakPolarHBondContact O-CA 3.15Å; L829-G832 PolarHBondContact O-N 2.98Å; L829-G832 VanDerWaalsContact O-N 3.16Å; G832-A834 VanDerWaalsContact C-N 3.33Å; G832-A834 PolarHBondContact O-N 3.17Å
833	G	74.3	Confident	82.5	Confident	60 Å²	60	71.9 Å²	71.9	62%	0.619	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	-1.5	176	0	0	0	0	0	116.5	L829 R830 Q831 R835	L829-G833 PolarHBondContact O-N 2.88Å; R830-G833 PolarHBondContact O-N 3.32Å; Q831-G833 PolarHBondContact O-N 3.25Å; G833-R835 PolarHBondContact O-N 2.77Å
834	A	70.5	Confident	82.7	Confident	8 Å²	8	68.6 Å²	68.6	7%	0.066	34%	0.338	C	S	.	.			trans	-67.4	119.8	-178.5	0	0	0	0	0	111.9	L803 L829 G832 C836	L803-A834 HydrophobicContact CD1-CB 3.78Å; L829-A834 HydrophobicContact CB-CB 3.82Å; L829-A834 WeakPolarHBondContact O-CA 3.3Å; L829-A834 WeakPolarHBondContact O-CB 3.47Å; L829-A834 PolarHBondContact O-N 2.92Å; G832-A834 VanDerWaalsContact C-N 3.33Å; G832-A834 PolarHBondContact O-N 3.17Å; A834-C836 VanDerWaalsContact C-N 3.27Å; A834-C836 PolarHBondContact O-N 3.38Å
835	R	73.5	Confident	82.8	Confident	180 Å²	180	66.1 Å²	66.1	68%	0.679	33%	0.325	S	S	*	.			trans	-92.6	34	173.8	-62.3	-170.6	68.4	-179.5	0.1	113	G833	G833-R835 PolarHBondContact O-N 2.77Å
836	C	74.1	Confident	83	Confident	12 Å²	12	70 Å²	70	8%	0.081	35%	0.346	C	S	.	.			trans	-72.7	140.4	174.1	56.4	0	0	0	0	111.7	L800 H826 A834	L800-C836 HydrophobicContact CD2-CB 4.09Å; H826-C836 PolarHBondContact NE2-O 2.86Å; A834-C836 VanDerWaalsContact C-N 3.27Å; A834-C836 PolarHBondContact O-N 3.38Å
837	S	84.7	Confident	83	Confident	50 Å²	50	71.9 Å²	71.9	35%	0.35	37%	0.367	S	S	.	.			trans	-74.6	154.8	164.9	85.8	0	0	0	0	110.1	K839 N840 L841	S837-K839 PolarHBondContact O-N 3.34Å; S837-K839 PolarHBondContact OG-N 3.14Å; S837-N840 PolarHBondContact O-N 3.17Å; S837-N840 VanDerWaalsContact O-N 3.11Å; S837-N840 VanDerWaalsContact OG-CG 3.22Å; S837-N840 PolarHBondContact OG-N 3.17Å; S837-N840 PolarHBondContact OG-OD1 2.98Å; S837-L841 PolarHBondContact O-N 3.25Å
838	L	85.8	Confident	83.1	Confident	83 Å²	83	68.3 Å²	68.3	44%	0.435	36%	0.356	S	S	.	.	H	α-helix	trans	-57.1	-34.3	174.9	-171.5	69	0	0	0	111.6	L822 H826 L842	L822-L838 HydrophobicContact CD2-CD1 3.98Å; L822-L838 HydrophobicContact CD2-CG 4.27Å; L822-L838 HydrophobicContact CG-CD1 3.83Å; H826-L838 HydrophobicContact CB-CD1 3.77Å; L838-L842 WeakPolarHBondContact O-CB 3.29Å; L838-L842 PolarHBondContact O-N 2.88Å
839	K	84.9	Confident	83.1	Confident	124 Å²	124	68.6 Å²	68.6	54%	0.539	37%	0.374	S	S	.	.	H	α-helix	trans	-71.8	-36.6	177.9	-156.4	164.2	-166.1	154.9	0	112.1	E761 S837 N843	E761-K839 IonicContact OE2-NZ 3.37Å; E761-K839 PolarHBondContact OE2-NZ 3.47Å; S837-K839 PolarHBondContact O-N 3.34Å; S837-K839 PolarHBondContact OG-N 3.14Å; K839-N843 WeakPolarHBondContact O-CB 3.44Å; K839-N843 PolarHBondContact O-N 3.29Å; K839-N843 PolarHBondContact O-ND2 3.21Å; K839-N843 PolarHBondContact O-OD1 2.86Å
840	N	86.2	Confident	83.3	Confident	62 Å²	62	70 Å²	70	33%	0.332	38%	0.381	S	S	.	.	H	α-helix	trans	-69.4	-41.8	174.1	-67.7	22.6	0	0	0	110.7	S795 S837 N843 Y844	S795-N840 PolarHBondContact OG-ND2 2.83Å; S837-N840 PolarHBondContact O-N 3.17Å; S837-N840 VanDerWaalsContact O-N 3.11Å; S837-N840 VanDerWaalsContact OG-CG 3.22Å; S837-N840 PolarHBondContact OG-N 3.17Å; S837-N840 PolarHBondContact OG-OD1 2.98Å; N840-N843 PolarHBondContact O-N 2.84Å; N840-Y844 WeakPolarHBondContact O-CB 3.26Å; N840-Y844 PolarHBondContact O-N 2.71Å
841	L	87.7	Confident	83.3	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-61.9	-47.8	175.2	178.2	63	0	0	0	111.3	L822 V825 H826 L829 S837 Y844 L845	L822-L841 HydrophobicContact CD1-CD2 4.04Å; L822-L841 HydrophobicContact CD1-CG 4.09Å; V825-L841 HydrophobicContact CG1-CD1 4.47Å; V825-L841 HydrophobicContact CG1-CD2 4.11Å; H826-L841 HydrophobicContact CB-CD2 3.83Å; L829-L841 HydrophobicContact CD1-CD1 3.61Å; L829-L841 HydrophobicContact CD1-CD2 4.11Å; L829-L841 HydrophobicContact CD1-CG 4.5Å; S837-L841 PolarHBondContact O-N 3.25Å; L841-Y844 PolarHBondContact O-N 2.98Å; L841-L845 HydrophobicContact CD1-CD1 4.08Å; L841-L845 HydrophobicContact CD1-CG 4.12Å; L841-L845 HydrophobicContact CG-CD1 4.03Å; L841-L845 HydrophobicContact CG-CG 4.44Å; L841-L845 WeakPolarHBondContact O-CG 3.48Å; L841-L845 PolarHBondContact O-N 3.1Å
842	L	87.9	Confident	83.7	Confident	41 Å²	41	59 Å²	59	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-57.6	-51	175.8	179.8	141.6	0	0	0	111.5	L822 L838 Y844 L845 D846 F852 M854	L822-L842 HydrophobicContact CD2-CB 4.31Å; L822-L842 HydrophobicContact CD2-CD1 3.9Å; L838-L842 WeakPolarHBondContact O-CB 3.29Å; L838-L842 PolarHBondContact O-N 2.88Å; L842-Y844 VanDerWaalsContact C-N 3.26Å; L842-Y844 PolarHBondContact O-N 3.5Å; L842-L845 PolarHBondContact O-N 3.02Å; L842-D846 VanDerWaalsContact CD2-OD2 3.31Å; L842-D846 WeakPolarHBondContact CD2-OD2 3.45Å; L842-D846 WeakPolarHBondContact O-CB 2.87Å; L842-D846 PolarHBondContact O-N 3.05Å; L842-F852 HydrophobicContact CD1-CE2 3.69Å; L842-F852 HydrophobicContact CD1-CZ 3.82Å; L842-F852 HydrophobicContact CG-CE1 4.48Å; L842-F852 HydrophobicContact CG-CE2 4.09Å; L842-F852 HydrophobicContact CG-CZ 3.73Å; L842-M854 HydrophobicContact CD1-SD 4.08Å
843	N	87.5	Confident	84.2	Confident	93 Å²	93	58.2 Å²	58.2	50%	0.497	33%	0.328	S	S	.	.	H	α-helix	trans	-57.9	-37.7	177	-69.7	-14.6	0	0	0	112.6	K839 N840 A847	K839-N843 WeakPolarHBondContact O-CB 3.44Å; K839-N843 PolarHBondContact O-N 3.29Å; K839-N843 PolarHBondContact O-ND2 3.21Å; K839-N843 PolarHBondContact O-OD1 2.86Å; N840-N843 PolarHBondContact O-N 2.84Å; N843-A847 WeakPolarHBondContact O-CB 3.39Å; N843-A847 PolarHBondContact O-N 3.24Å
844	Y	88.6	Confident	84.4	Confident	11 Å²	11	62.1 Å²	62.1	4%	0.043	33%	0.331	C	S	.	.	H	α-helix	trans	-68.1	-46.4	176.9	170.1	-82.8	0	0	0	111.4	D797 L800 R801 L804 N840 L841 L842 A847 Q848	D797-Y844 HydrophobicContact CB-CD2 4.13Å; D797-Y844 HydrophobicContact CB-CE2 4.02Å; D797-Y844 WeakPolarHBondContact O-CE2 3.47Å; L800-Y844 HydrophobicContact CB-CD1 4.47Å; L800-Y844 HydrophobicContact CB-CD2 3.96Å; L800-Y844 HydrophobicContact CB-CE1 4.43Å; L800-Y844 HydrophobicContact CB-CE2 3.86Å; L800-Y844 HydrophobicContact CB-CG 4.27Å; L800-Y844 HydrophobicContact CD1-CD1 4.48Å; L800-Y844 HydrophobicContact CD1-CD2 3.87Å; L800-Y844 HydrophobicContact CD1-CG 3.8Å; R801-Y844 HydrophobicContact CG-CE2 4.34Å; R801-Y844 WeakPolarHBondContact CG-OH 3.36Å; L804-Y844 HydrophobicContact CD1-CD1 4.07Å; L804-Y844 HydrophobicContact CD1-CE1 3.3Å; N840-Y844 WeakPolarHBondContact O-CB 3.26Å; N840-Y844 PolarHBondContact O-N 2.71Å; L841-Y844 PolarHBondContact O-N 2.98Å; L842-Y844 VanDerWaalsContact C-N 3.26Å; L842-Y844 PolarHBondContact O-N 3.5Å; Y844-A847 CarbonylContact O-C 3.31Å; Y844-A847 PolarHBondContact O-N 2.72Å; Y844-Q848 HydrophobicContact CD1-CG 4.34Å; Y844-Q848 HydrophobicContact CD2-CG 4.47Å; Y844-Q848 HydrophobicContact CE1-CG 3.78Å; Y844-Q848 HydrophobicContact CE2-CG 3.97Å; Y844-Q848 WeakPolarHBondContact O-CG 3.48Å; Y844-Q848 PolarHBondContact O-N 2.68Å
845	L	88.5	Confident	84.1	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-64.9	-43.1	179.8	-65.7	173.7	0	0	0	111.2	L804 L820 L822 L841 L842 A847 Q848 C849 I850 F852	L804-L845 HydrophobicContact CD1-CD2 4.41Å; L820-L845 HydrophobicContact CD1-CD2 4.23Å; L822-L845 HydrophobicContact CD1-CD1 3.65Å; L841-L845 HydrophobicContact CD1-CD1 4.08Å; L841-L845 HydrophobicContact CD1-CG 4.12Å; L841-L845 HydrophobicContact CG-CD1 4.03Å; L841-L845 HydrophobicContact CG-CG 4.44Å; L841-L845 WeakPolarHBondContact O-CG 3.48Å; L841-L845 PolarHBondContact O-N 3.1Å; L842-L845 PolarHBondContact O-N 3.02Å; L845-A847 PolarHBondContact O-N 2.87Å; L845-Q848 CarbonylContact O-C 3.52Å; L845-Q848 PolarHBondContact O-N 2.83Å; L845-C849 PolarHBondContact O-N 2.63Å; L845-I850 HydrophobicContact CB-CB 4.38Å; L845-I850 HydrophobicContact CD2-CB 3.95Å; L845-I850 HydrophobicContact CD2-CD1 3.85Å; L845-I850 HydrophobicContact CD2-CG1 4.5Å; L845-I850 HydrophobicContact CD2-CG2 3.9Å; L845-I850 PolarHBondContact O-N 3.1Å; L845-F852 HydrophobicContact CB-CD1 3.77Å; L845-F852 HydrophobicContact CB-CE1 4.14Å; L845-F852 HydrophobicContact CD1-CB 4.21Å; L845-F852 HydrophobicContact CD1-CD1 4.2Å; L845-F852 HydrophobicContact CD1-CG 4.39Å
846	D	89.4	Confident	83.2	Confident	89 Å²	89	67.9 Å²	67.9	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-57.2	-46.3	170.4	-81.6	-41.1	0	0	0	111.4	L842 Q848 C849 F852	L842-D846 VanDerWaalsContact CD2-OD2 3.31Å; L842-D846 WeakPolarHBondContact CD2-OD2 3.45Å; L842-D846 WeakPolarHBondContact O-CB 2.87Å; L842-D846 PolarHBondContact O-N 3.05Å; D846-Q848 VanDerWaalsContact C-N 3.27Å; D846-Q848 PolarHBondContact O-N 3.48Å; D846-C849 PolarHBondContact O-N 2.89Å; D846-F852 WeakPolarHBondContact OD1-CE1 3.3Å
847	A	88.6	Confident	81.7	Confident	70 Å²	70	73 Å²	73	58%	0.579	38%	0.381	S	S	*	.	H	α-helix	trans	-69.5	-19.6	179.6	0	0	0	0	0	114.2	N843 Y844 L845	N843-A847 WeakPolarHBondContact O-CB 3.39Å; N843-A847 PolarHBondContact O-N 3.24Å; Y844-A847 CarbonylContact O-C 3.31Å; Y844-A847 PolarHBondContact O-N 2.72Å; L845-A847 PolarHBondContact O-N 2.87Å
848	Q	86.6	Confident	79.8	Confident	66 Å²	66	75.7 Å²	75.7	31%	0.308	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	4.5	170.9	-62.8	-45.5	-76.9	0	0	113.1	R801 Y844 L845 D846 I850	R801-Q848 VanDerWaalsContact CZ-OE1 3.25Å; R801-Q848 VanDerWaalsContact NH2-CD 3.34Å; Y844-Q848 HydrophobicContact CD1-CG 4.34Å; Y844-Q848 HydrophobicContact CD2-CG 4.47Å; Y844-Q848 HydrophobicContact CE1-CG 3.78Å; Y844-Q848 HydrophobicContact CE2-CG 3.97Å; Y844-Q848 WeakPolarHBondContact O-CG 3.48Å; Y844-Q848 PolarHBondContact O-N 2.68Å; L845-Q848 CarbonylContact O-C 3.52Å; L845-Q848 PolarHBondContact O-N 2.83Å; D846-Q848 VanDerWaalsContact C-N 3.27Å; D846-Q848 PolarHBondContact O-N 3.48Å; Q848-I850 HydrophobicContact CB-CD1 3.73Å; Q848-I850 HydrophobicContact CB-CG1 3.85Å; Q848-I850 HydrophobicContact CG-CD1 4.47Å; Q848-I850 PolarHBondContact O-N 3.07Å; Q848-I850 VanDerWaalsContact O-N 3.17Å
849	C	85.4	Confident	77.6	Confident	118 Å²	118	80.6 Å²	80.6	80%	0.797	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	22.6	-174.6	-61.8	0	0	0	0	114.6	L845 D846	L845-C849 PolarHBondContact O-N 2.63Å; D846-C849 PolarHBondContact O-N 2.89Å
850	I	87.1	Confident	75.4	Confident	30 Å²	30	81.2 Å²	81.2	15%	0.154	42%	0.417	C	S	.	.			trans	-77.8	124.7	-180	-63.4	168.4	0	0	0	108.9	I814 L820 L845 Q848 F852	I814-I850 HydrophobicContact CD1-CD1 4.18Å; I814-I850 HydrophobicContact CG1-CD1 4.43Å; I814-I850 HydrophobicContact CG1-CG2 4Å; I814-I850 HydrophobicContact CG2-CD1 4.39Å; I814-I850 HydrophobicContact CG2-CG1 4.46Å; L820-I850 HydrophobicContact CD1-CG2 3.68Å; L820-I850 HydrophobicContact CG-CG2 4.37Å; L845-I850 HydrophobicContact CB-CB 4.38Å; L845-I850 HydrophobicContact CD2-CB 3.95Å; L845-I850 HydrophobicContact CD2-CD1 3.85Å; L845-I850 HydrophobicContact CD2-CG1 4.5Å; L845-I850 HydrophobicContact CD2-CG2 3.9Å; L845-I850 PolarHBondContact O-N 3.1Å; Q848-I850 HydrophobicContact CB-CD1 3.73Å; Q848-I850 HydrophobicContact CB-CG1 3.85Å; Q848-I850 HydrophobicContact CG-CD1 4.47Å; Q848-I850 PolarHBondContact O-N 3.07Å; Q848-I850 VanDerWaalsContact O-N 3.17Å; I850-F852 WeakPolarHBondContact O-CD1 3.28Å; I850-F852 PolarHBondContact O-N 3.17Å
851	T	85.8	Confident	72.9	Confident	49 Å²	49	91.1 Å²	91.1	30%	0.301	46%	0.461	S	S	.	.			trans	-68	123.4	177.5	39.5	0	0	0	0	112.2	P819 L820	P819-T851 WeakPolarHBondContact CA-O 3.38Å; L820-T851 PolarHBondContact N-O 3.36Å
852	F	87.6	Confident	72.2	Confident	49 Å²	49	95.7 Å²	95.7	22%	0.215	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	165.7	171.4	60.5	-90.8	0	0	0	112.5	L820 L822 L842 L845 D846 I850 M854	L820-F852 HydrophobicContact CB-CB 4.34Å; L820-F852 CarbonylContact O-C 3.48Å; L820-F852 WeakPolarHBondContact O-CA 3.35Å; L820-F852 WeakPolarHBondContact O-CB 3.34Å; L822-F852 HydrophobicContact CB-CD2 4.45Å; L822-F852 HydrophobicContact CD1-CD2 4.33Å; L822-F852 HydrophobicContact CD1-CG 4.39Å; L822-F852 HydrophobicContact CD2-CD2 4.36Å; L842-F852 HydrophobicContact CD1-CE2 3.69Å; L842-F852 HydrophobicContact CD1-CZ 3.82Å; L842-F852 HydrophobicContact CG-CE1 4.48Å; L842-F852 HydrophobicContact CG-CE2 4.09Å; L842-F852 HydrophobicContact CG-CZ 3.73Å; L845-F852 HydrophobicContact CB-CD1 3.77Å; L845-F852 HydrophobicContact CB-CE1 4.14Å; L845-F852 HydrophobicContact CD1-CB 4.21Å; L845-F852 HydrophobicContact CD1-CD1 4.2Å; L845-F852 HydrophobicContact CD1-CG 4.39Å; D846-F852 WeakPolarHBondContact OD1-CE1 3.3Å; I850-F852 WeakPolarHBondContact O-CD1 3.28Å; I850-F852 PolarHBondContact O-N 3.17Å; F852-M854 HydrophobicContact CD2-CG 4.28Å; F852-M854 HydrophobicContact CE2-CG 4.31Å
853	S	83.5	Confident	71.4	Confident	28 Å²	28	98.6 Å²	98.6	20%	0.196	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.6	-179.7	177.6	0	0	0	0	109.8	L820 L822 K855	L820-S853 PolarHBondContact O-N 2.8Å; L822-S853 PolarHBondContact N-O 3Å; S853-K855 PolarHBondContact OG-N 3.08Å
854	M	78.6	Confident	70.5	Confident	141 Å²	141	98.9 Å²	98.9	70%	0.695	50%	0.499	S	S	*	.			trans	-106.5	32.4	170.1	-60	-165.1	-59.1	0	0	111.6	L822 L842 F852 K856	L822-M854 HydrophobicContact CD2-CG 4.03Å; L822-M854 HydrophobicContact CD2-SD 4.13Å; L842-M854 HydrophobicContact CD1-SD 4.08Å; F852-M854 HydrophobicContact CD2-CG 4.28Å; F852-M854 HydrophobicContact CE2-CG 4.31Å; M854-K856 PolarHBondContact O-N 3.15Å
855	K	64.3	Low	69.4	Low	131 Å²	131	104.1 Å²	104.1	57%	0.57	53%	0.525	S	S	*	.			trans	-58.8	129	171	-82.2	-171.6	174.6	-171.5	0	109.8	S853 F857	S853-K855 PolarHBondContact OG-N 3.08Å; K855-F857 VanDerWaalsContact C-N 3.27Å; K855-F857 HydrophobicContact CB-CD2 3.98Å; K855-F857 HydrophobicContact CB-CE2 4.08Å; K855-F857 HydrophobicContact CD-CD2 4.36Å; K855-F857 HydrophobicContact CD-CE2 3.6Å; K855-F857 HydrophobicContact CD-CZ 4.16Å; K855-F857 HydrophobicContact CG-CE2 4.5Å; K855-F857 PolarHBondContact O-N 3.41Å
856	K	54.2	Low	68.2	Low	178 Å²	178	110.6 Å²	110.6	77%	0.774	56%	0.558	S	S	*	*			trans	-72.3	87.3	157.3	-70.7	-170.4	-178.6	-176.3	0	108.3	M854 D858	M854-K856 PolarHBondContact O-N 3.15Å; K856-D858 VanDerWaalsContact CB-OD2 3.24Å; K856-D858 WeakPolarHBondContact CB-OD2 3.28Å; K856-D858 VanDerWaalsContact CG-OD2 3.3Å; K856-D858 WeakPolarHBondContact CG-OD2 3.43Å; K856-D858 PolarHBondContact O-N 3.46Å
857	F	43	Very low	66.8	Low	119 Å²	119	112 Å²	112	52%	0.522	56%	0.564	S	S	.	*			trans	-80.5	101.4	144.1	-73.2	-78.9	0	0	0	104.8	K855	K855-F857 VanDerWaalsContact C-N 3.27Å; K855-F857 HydrophobicContact CB-CD2 3.98Å; K855-F857 HydrophobicContact CB-CE2 4.08Å; K855-F857 HydrophobicContact CD-CD2 4.36Å; K855-F857 HydrophobicContact CD-CE2 3.6Å; K855-F857 HydrophobicContact CD-CZ 4.16Å; K855-F857 HydrophobicContact CG-CE2 4.5Å; K855-F857 PolarHBondContact O-N 3.41Å
858	D	44.3	Very low	65.2	Low	107 Å²	107	115 Å²	115	57%	0.572	56%	0.563	S	S	*	*			trans	-132.1	42.8	174.5	-71.1	-59.2	0	0	0	107.5	K823 K856	K823-D858 IonicContact NZ-OD1 2.67Å; K823-D858 PolarHBondContact NZ-OD1 2.96Å; K823-D858 IonicContact NZ-OD2 2.73Å; K823-D858 PolarHBondContact NZ-OD2 3.43Å; K856-D858 VanDerWaalsContact CB-OD2 3.24Å; K856-D858 WeakPolarHBondContact CB-OD2 3.28Å; K856-D858 VanDerWaalsContact CG-OD2 3.3Å; K856-D858 WeakPolarHBondContact CG-OD2 3.43Å; K856-D858 PolarHBondContact O-N 3.46Å
859	E	40	Very low	63.6	Low	187 Å²	187	118.8 Å²	118.8	87%	0.874	58%	0.582	S	S	*	*			trans	-157.2	89.5	172.5	-106.2	154.8	-149	0	0	105
860	E	39.6	Very low	61.8	Low	137 Å²	137	118.8 Å²	118.8	64%	0.64	56%	0.564	S	S	*	*			trans	-121.9	99	177	-75.3	-178.8	146.1	0	0	108.1
861	Q	33.3	Very low	59.5	Low	270 Å²	270	126.9 Å²	126.9	100%	1.262	60%	0.602	S	S	*	*			trans	-153.6	0	150.8	-111.9	-178.8	18.8	0	0	109.1

Retrieved 861 of 861 residues in 1190.2 ms (Link to these results)

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