A0A5K4FCP4_SCHMA Loading...

SSD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCP4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,149 aa.

						>A0A5K4FCP4_SCHMA|A0A5K4FCP4
MGHPCDSCSCSMKLHTLRSLSRHLVHWKYLVATSSLSFILSTSIICIVFFHVPDLSNPFVDFVAIGTSLSARTQQFQALLTETSSSPEYFTKSNLTWNKEFGSNSAEVENHAFNFHKTAIDRFRRNKNVDYFEREYCLQETANEMTKPVNSLWSIYAKYSRVVFSINYNQIIEIPHKSLFMKNLTNSKKNLTYFSEPSLLYIILFDLCKLKLRITHLSTYQELCYRKSSKLYNNTHLLTVDNKIIIDRTKHNSCCSIWCLPSMIASIFNKQSCEQLEYIDAKQASELISTCYPAFLSGHLRRSCWDNYGTDPGLLCPLVYPSQCLYSPLLPIILAALLPNDSNNFNNWGKSLMVLPIHATGSHLFFNEIENEYKSGRLTEGLHIPFHFDGIYIQEYDEIVTQLLYRDTSWLFISLICLLILLTIWTRTIFIPILTVLAIIWSLLTAYTVYTIVLKIPHFPVINLLAIVLVTGLGADDLLVFYQIWKQKRFMLAQTTVIEHVDHDNNLNTTPNFKTQELISTDQNNLLSISSSLNNRTNIISNKCFNTDEIHSISMNHLQNDQLTNEQQLTECLYYTLLHAIPSMTLTTISTICGLLVNLFSSIIAIKRFTIFASFVIIFNYIFIILMIIPMIIIFELNYFSLYKNFMNLLFYKYYQSFIKLINQLILLFNKLIIKFNLIFPFIIIITLLFTCYQLLWLRKFNIPSNHYHSSTFLPINHPLEQFTHKYINHSFWTESNLHYYQNLLKINFIWGPKPYDERNIFNYNDDIYIHSKLLLYSSNMINFTSIHSRLWLLKFCNELKRMPFLFQSFPIKYQQTLNSLELSLLNPLINIPVWCPFGRYINSIDNYIFSLNCSMDNSTCCYHGKPLQIYNSSVLSFISCLNEYISYENQYGYMTGFRFIHKSDINEPVGLIINALTNISLISSSHYDIEKFMNKITIWFNNLLLTAPNLLNHGFLVVNELEKFEITLNITQYIYPSVMIAVIIASLLIFLISKNILLSLLSLICLTCCLLSSITLLTCIDNWKLGIIEGLVISLAAGLAIDPCIHLAYAVSDKCNTGGWRCQQSVCSRNNLLIVLNSLGPAISGSAWTSAITGLPMLFSNLLCFHQIGAFLLTLMFCSWFFCYIVLTGILAFADQVFGYFKSNRVYL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	33.9	Very low	254 Å²	254	120.4 Å²	120.4	100%	1.251	74%	0.737	S	S	*	*				0	109.9	0	-61.6	179.9	178.9	0	0	106.4
2	G	33.7	Very low	34.1	Very low	64 Å²	64	122.5 Å²	122.5	66%	0.66	74%	0.735	S	S	*	*			cis	148.6	93	9.3	0	0	0	0	0	106.1
3	H	34.5	Very low	35.5	Very low	190 Å²	190	124.8 Å²	124.8	88%	0.88	73%	0.73	S	S	*	*			trans	-157.7	117.9	151.6	-93.5	-64.2	0	0	0	108.2
4	P	37	Very low	37.3	Very low	118 Å²	118	122 Å²	122	77%	0.766	71%	0.71	S	S	*	*			trans	-74.1	150.6	175.4	33.1	-32.2	0	0	0	110
5	C	32.2	Very low	39.2	Very low	109 Å²	109	123.5 Å²	123.5	74%	0.736	71%	0.707	S	S	*	*			trans	-60.2	135.9	-168.3	-55.9	0	0	0	0	115.4	S7	C5-S7 PolarHBondContact O-N 3.2Å
6	D	31.4	Very low	41.5	Very low	160 Å²	160	121.4 Å²	121.4	86%	0.856	70%	0.697	S	S	*	*			trans	-70.3	41.2	160.9	-71.3	-40.5	0	0	0	113	C8	D6-C8 VanDerWaalsContact C-N 3.35Å
7	S	36.5	Very low	43.6	Very low	83 Å²	83	116.3 Å²	116.3	58%	0.58	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-6.8	-178.1	52.8	0	0	0	0	114.2	C5	C5-S7 PolarHBondContact O-N 3.2Å
8	C	29.9	Very low	45.5	Very low	104 Å²	104	116.2 Å²	116.2	70%	0.703	65%	0.654	S	S	*	*	H	α-helix	trans	-80.1	-18.1	-179.7	-79	0	0	0	0	115.2	D6 S11	D6-C8 VanDerWaalsContact C-N 3.35Å; C8-S11 PolarHBondContact O-OG 2.95Å
9	S	31.3	Very low	47.3	Very low	78 Å²	78	112.5 Å²	112.5	55%	0.545	64%	0.636	S	S	.	*	H	α-helix	trans	-82.5	-23.3	-178.1	84.7	0	0	0	0	114
10	C	35.7	Very low	49	Very low	87 Å²	87	111.2 Å²	111.2	59%	0.588	63%	0.627	S	S	*	*	H	α-helix	trans	-78.8	-32.4	178.6	-95.8	0	0	0	0	113.1	L14	C10-L14 WeakPolarHBondContact O-CD1 3.4Å; C10-L14 PolarHBondContact O-N 3.23Å
11	S	36.4	Very low	50.5	Low	77 Å²	77	105.9 Å²	105.9	54%	0.538	60%	0.597	S	S	.	*	H	α-helix	trans	-69.9	-33.9	179.6	66.8	0	0	0	0	112.3	C8 L14 H15	C8-S11 PolarHBondContact O-OG 2.95Å; S11-L14 PolarHBondContact O-N 3.4Å; S11-H15 PolarHBondContact O-N 3.38Å
12	M	35.7	Very low	52.7	Low	146 Å²	146	100.2 Å²	100.2	72%	0.719	56%	0.562	S	S	*	*	H	α-helix	trans	-71.2	-34.8	-178.5	-152.4	173.9	168.1	0	0	112.3	T16	M12-T16 PolarHBondContact O-N 3.29Å
13	K	52.6	Low	55	Low	152 Å²	152	102.1 Å²	102.1	66%	0.661	55%	0.553	S	S	*	*	H	α-helix	trans	-70.5	-31.8	175.1	-72	-177.6	178.9	179.5	0	113.4	T16 L17	K13-T16 PolarHBondContact O-OG1 3.33Å; K13-L17 PolarHBondContact O-N 3.29Å
14	L	60.3	Low	57.2	Low	86 Å²	86	94.5 Å²	94.5	45%	0.45	52%	0.519	S	S	.	.	H	α-helix	trans	-71.3	-38.7	177.1	-100.1	85.8	0	0	0	112.1	C10 S11 R18 Y574	C10-L14 WeakPolarHBondContact O-CD1 3.4Å; C10-L14 PolarHBondContact O-N 3.23Å; S11-L14 PolarHBondContact O-N 3.4Å; L14-R18 PolarHBondContact O-N 3.06Å; L14-R18 VanDerWaalsContact O-N 3.16Å; L14-Y574 VanDerWaalsContact CD2-OH 3.31Å; L14-Y574 WeakPolarHBondContact CD2-OH 3.16Å; L14-Y574 WeakPolarHBondContact CG-OH 3.28Å
15	H	65.7	Low	59.2	Low	144 Å²	144	89.2 Å²	89.2	67%	0.667	48%	0.484	S	S	*	.	H	α-helix	trans	-69.4	-36.2	-177.2	-159	-79.8	0	0	0	112.4	S11 S19	S11-H15 PolarHBondContact O-N 3.38Å; H15-S19 WeakPolarHBondContact O-CB 3.2Å; H15-S19 PolarHBondContact O-N 3.49Å
16	T	75.7	Confident	61.6	Low	91 Å²	91	90.3 Å²	90.3	56%	0.558	48%	0.479	S	S	*	.	H	α-helix	trans	-67.5	-41.6	177.1	53.4	0	0	0	0	112	M12 K13 S19 L20	M12-T16 PolarHBondContact O-N 3.29Å; K13-T16 PolarHBondContact O-OG1 3.33Å; T16-S19 WeakPolarHBondContact O-CB 3.42Å; T16-S19 PolarHBondContact O-N 3.39Å; T16-L20 WeakPolarHBondContact O-CB 3.17Å; T16-L20 PolarHBondContact O-N 2.97Å
17	L	78.1	Confident	64	Low	34 Å²	34	89.3 Å²	89.3	18%	0.178	46%	0.463	C	S	.	.	H	α-helix	trans	-66.6	-39.8	178.2	-167.6	76.2	0	0	0	112	K13 S19 L20 S21 Y574 L577 L578	K13-L17 PolarHBondContact O-N 3.29Å; L17-S19 VanDerWaalsContact C-N 3.33Å; L17-L20 HydrophobicContact CD1-CD2 4.44Å; L17-L20 WeakPolarHBondContact O-CB 3.45Å; L17-L20 PolarHBondContact O-N 3.48Å; L17-S21 PolarHBondContact O-N 3.31Å; L17-Y574 HydrophobicContact CB-CE2 4.16Å; L17-Y574 HydrophobicContact CD2-CD2 4.18Å; L17-Y574 HydrophobicContact CD2-CE2 3.96Å; L17-Y574 HydrophobicContact CG-CD2 4.28Å; L17-Y574 HydrophobicContact CG-CE2 4.25Å; L17-L577 HydrophobicContact CD1-CB 4.47Å; L17-L578 HydrophobicContact CD2-CB 3.88Å; L17-L578 HydrophobicContact CD2-CD1 3.75Å; L17-L578 HydrophobicContact CD2-CG 4.44Å
18	R	78.3	Confident	66	Low	115 Å²	115	86.6 Å²	86.6	43%	0.434	44%	0.44	S	S	.	.	H	α-helix	trans	-69	-33.9	175.6	-161.4	174.3	-170.6	178.2	3.6	112.1	L14 S21 R22 Y574	L14-R18 PolarHBondContact O-N 3.06Å; L14-R18 VanDerWaalsContact O-N 3.16Å; R18-S21 PolarHBondContact O-OG 2.96Å; R18-R22 WeakPolarHBondContact O-CG 3.41Å; R18-R22 PolarHBondContact O-N 2.77Å; R18-Y574 HydrophobicContact CB-CD2 3.78Å; R18-Y574 HydrophobicContact CB-CE2 3.73Å; R18-Y574 HydrophobicContact CG-CD2 4.05Å; R18-Y574 HydrophobicContact CG-CE2 4.29Å; R18-Y574 HydrophobicContact CG-CG 4.39Å
19	S	79.9	Confident	68.4	Low	45 Å²	45	87.5 Å²	87.5	32%	0.315	43%	0.43	S	S	.	.	H	α-helix	trans	-63.3	-49.4	169.3	-176	0	0	0	0	110.6	H15 T16 L17 S21 R22 H23	H15-S19 WeakPolarHBondContact O-CB 3.2Å; H15-S19 PolarHBondContact O-N 3.49Å; T16-S19 WeakPolarHBondContact O-CB 3.42Å; T16-S19 PolarHBondContact O-N 3.39Å; L17-S19 VanDerWaalsContact C-N 3.33Å; S19-S21 VanDerWaalsContact C-N 3.34Å; S19-S21 PolarHBondContact O-N 3.35Å; S19-R22 WeakPolarHBondContact O-CB 3.24Å; S19-R22 PolarHBondContact O-N 2.88Å; S19-R22 VanDerWaalsContact O-N 3.14Å; S19-H23 PolarHBondContact O-N 2.98Å; S19-H23 PolarHBondContact O-ND1 3.31Å; S19-H23 PolarHBondContact OG-CE1 3.07Å; S19-H23 PolarHBondContact OG-ND1 3.07Å
20	L	81	Confident	71	Confident	86 Å²	86	88.1 Å²	88.1	45%	0.45	43%	0.427	S	S	.	.	H	α-helix	trans	-56.8	-44.9	178.3	-176.4	72.1	0	0	0	111.8	T16 L17 R22 H23 L24	T16-L20 WeakPolarHBondContact O-CB 3.17Å; T16-L20 PolarHBondContact O-N 2.97Å; L17-L20 HydrophobicContact CD1-CD2 4.44Å; L17-L20 WeakPolarHBondContact O-CB 3.45Å; L17-L20 PolarHBondContact O-N 3.48Å; L20-R22 VanDerWaalsContact C-N 3.35Å; L20-R22 PolarHBondContact O-N 3.37Å; L20-H23 PolarHBondContact O-N 2.93Å; L20-L24 HydrophobicContact CG-CD1 4.06Å; L20-L24 HydrophobicContact CG-CG 4.4Å; L20-L24 WeakPolarHBondContact O-CB 3.49Å; L20-L24 WeakPolarHBondContact O-CG 3.46Å; L20-L24 PolarHBondContact O-N 2.98Å
21	S	80.7	Confident	73.2	Confident	1 Å²	1	85.6 Å²	85.6	1%	0.007	41%	0.408	C	S	.	.	H	α-helix	trans	-64	-38.7	178.2	70.1	0	0	0	0	112.4	L17 R18 S19 L24 V25	L17-S21 PolarHBondContact O-N 3.31Å; R18-S21 PolarHBondContact O-OG 2.96Å; S19-S21 VanDerWaalsContact C-N 3.34Å; S19-S21 PolarHBondContact O-N 3.35Å; S21-L24 PolarHBondContact O-N 3.47Å; S21-V25 WeakPolarHBondContact O-CG2 3.23Å; S21-V25 PolarHBondContact O-N 3.39Å; S21-V25 VanDerWaalsContact O-N 3.08Å
22	R	81.1	Confident	75.2	Confident	135 Å²	135	82.3 Å²	82.3	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-63	-44.4	172.7	-72.3	176.5	-173.5	178.1	2.5	111.9	R18 S19 L20 V25 H26 T570	R18-R22 WeakPolarHBondContact O-CG 3.41Å; R18-R22 PolarHBondContact O-N 2.77Å; S19-R22 WeakPolarHBondContact O-CB 3.24Å; S19-R22 PolarHBondContact O-N 2.88Å; S19-R22 VanDerWaalsContact O-N 3.14Å; L20-R22 VanDerWaalsContact C-N 3.35Å; L20-R22 PolarHBondContact O-N 3.37Å; R22-V25 PolarHBondContact O-N 3.03Å; R22-H26 VanDerWaalsContact O-CB 3.26Å; R22-H26 WeakPolarHBondContact O-CB 3.47Å; R22-H26 PolarHBondContact O-N 3.35Å; R22-T570 HydrophobicContact CG-CG2 4.42Å
23	H	81.5	Confident	77.5	Confident	104 Å²	104	79.7 Å²	79.7	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-63.8	-45	177.6	-73.1	82.9	0	0	0	111.6	S19 L20 V25 H26 W27	S19-H23 PolarHBondContact O-N 2.98Å; S19-H23 PolarHBondContact O-ND1 3.31Å; S19-H23 PolarHBondContact OG-CE1 3.07Å; S19-H23 PolarHBondContact OG-ND1 3.07Å; L20-H23 PolarHBondContact O-N 2.93Å; H23-V25 VanDerWaalsContact C-N 3.34Å; H23-V25 PolarHBondContact O-N 3.47Å; H23-H26 PolarHBondContact O-N 2.83Å; H23-W27 WeakPolarHBondContact O-CB 3.39Å; H23-W27 PolarHBondContact O-N 3.46Å
24	L	80.5	Confident	79	Confident	30 Å²	30	75 Å²	75	16%	0.157	37%	0.365	C	S	.	.	H	α-helix	trans	-60.4	-40.2	178	-75.3	172.2	0	0	0	112.6	L20 S21 K28 V31 L573 L577	L20-L24 HydrophobicContact CG-CD1 4.06Å; L20-L24 HydrophobicContact CG-CG 4.4Å; L20-L24 WeakPolarHBondContact O-CB 3.49Å; L20-L24 WeakPolarHBondContact O-CG 3.46Å; L20-L24 PolarHBondContact O-N 2.98Å; S21-L24 PolarHBondContact O-N 3.47Å; L24-K28 VanDerWaalsContact O-CA 3.28Å; L24-K28 WeakPolarHBondContact O-CA 3.31Å; L24-K28 WeakPolarHBondContact O-CB 3.26Å; L24-K28 PolarHBondContact O-N 2.83Å; L24-V31 HydrophobicContact CD2-CG1 3.94Å; L24-V31 HydrophobicContact CD2-CG2 4.17Å; L24-L573 HydrophobicContact CB-CD2 4.01Å; L24-L573 HydrophobicContact CD1-CD2 4.31Å; L24-L577 HydrophobicContact CD1-CD1 4.24Å
25	V	79.1	Confident	79.9	Confident	6 Å²	6	71.3 Å²	71.3	4%	0.036	35%	0.346	C	S	.	.	H	α-helix	trans	-73.5	-47.7	178.4	174	0	0	0	0	111.3	S21 R22 H23 L569 T570 L573	S21-V25 WeakPolarHBondContact O-CG2 3.23Å; S21-V25 PolarHBondContact O-N 3.39Å; S21-V25 VanDerWaalsContact O-N 3.08Å; R22-V25 PolarHBondContact O-N 3.03Å; H23-V25 VanDerWaalsContact C-N 3.34Å; H23-V25 PolarHBondContact O-N 3.47Å; V25-L569 HydrophobicContact CG1-CD2 4.15Å; V25-L569 HydrophobicContact CG2-CD2 4.42Å; V25-L569 HydrophobicContact CG2-CG 4.42Å; V25-T570 HydrophobicContact CB-CG2 3.78Å; V25-T570 HydrophobicContact CG1-CG2 3.9Å; V25-T570 HydrophobicContact CG2-CG2 3.89Å; V25-L573 HydrophobicContact CG2-CD2 3.73Å
26	H	81.4	Confident	80.5	Confident	133 Å²	133	68.7 Å²	68.7	62%	0.616	34%	0.337	S	S	*	.	H	α-helix	trans	-69.6	-37	-175.8	-172.4	-62.8	0	0	0	112.3	R22 H23	R22-H26 VanDerWaalsContact O-CB 3.26Å; R22-H26 WeakPolarHBondContact O-CB 3.47Å; R22-H26 PolarHBondContact O-N 3.35Å; H23-H26 PolarHBondContact O-N 2.83Å
27	W	82.3	Confident	81	Confident	138 Å²	138	67.5 Å²	67.5	52%	0.523	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	25.6	-178	-64.4	71.7	0	0	0	112.6	H23 Y29 L30 V31	H23-W27 WeakPolarHBondContact O-CB 3.39Å; H23-W27 PolarHBondContact O-N 3.46Å; W27-Y29 VanDerWaalsContact C-N 3.27Å; W27-Y29 PolarHBondContact O-N 2.87Å; W27-Y29 VanDerWaalsContact O-N 3.11Å; W27-L30 HydrophobicContact CB-CB 4.38Å; W27-L30 HydrophobicContact CE3-CB 4.09Å; W27-L30 HydrophobicContact CE3-CD1 3.54Å; W27-L30 HydrophobicContact CE3-CG 4.25Å; W27-L30 HydrophobicContact CZ3-CD1 3.66Å; W27-L30 WeakPolarHBondContact O-CA 3.03Å; W27-L30 PolarHBondContact O-N 3Å; W27-V31 WeakPolarHBondContact O-CG2 3.44Å; W27-V31 PolarHBondContact O-N 3.49Å
28	K	79.3	Confident	81.2	Confident	26 Å²	26	70.6 Å²	70.6	11%	0.113	34%	0.344	C	S	.	.	H	α-helix	trans	-49	-42.3	-173.8	66.5	-171	-179	-172.7	0	114.4	L24 A32 I633 I634 L637	L24-K28 VanDerWaalsContact O-CA 3.28Å; L24-K28 WeakPolarHBondContact O-CA 3.31Å; L24-K28 WeakPolarHBondContact O-CB 3.26Å; L24-K28 PolarHBondContact O-N 2.83Å; K28-A32 WeakPolarHBondContact O-CB 3.44Å; K28-A32 PolarHBondContact O-N 3.49Å; K28-I633 HydrophobicContact CB-CG2 4.25Å; K28-I633 HydrophobicContact CD-CG2 4.28Å; K28-I634 HydrophobicContact CB-CG1 4.35Å; K28-I634 HydrophobicContact CD-CG1 4.49Å; K28-I634 HydrophobicContact CG-CG1 4.39Å; K28-L637 HydrophobicContact CD-CD1 3.64Å
29	Y	80.9	Confident	81.3	Confident	123 Å²	123	65.4 Å²	65.4	48%	0.482	33%	0.325	S	S	.	.	H	α-helix	trans	-70.4	-39.1	179	-66.8	-66.4	0	0	0	112.1	W27 A32 T33 N638	W27-Y29 VanDerWaalsContact C-N 3.27Å; W27-Y29 PolarHBondContact O-N 2.87Å; W27-Y29 VanDerWaalsContact O-N 3.11Å; Y29-A32 PolarHBondContact O-N 3.21Å; Y29-T33 WeakPolarHBondContact O-CB 3.43Å; Y29-T33 VanDerWaalsContact O-CG2 3.29Å; Y29-T33 WeakPolarHBondContact O-CG2 3.35Å; Y29-T33 PolarHBondContact O-N 2.91Å; Y29-T33 PolarHBondContact O-OG1 3.14Å; Y29-T33 VanDerWaalsContact O-OG1 3.05Å; Y29-N638 PolarHBondContact OH-ND2 3.21Å
30	L	85.4	Confident	81.4	Confident	92 Å²	92	67.4 Å²	67.4	48%	0.482	33%	0.332	S	S	.	.	H	α-helix	trans	-66.6	-42.3	175.9	-174.3	148.6	0	0	0	110.9	W27 T33 S34	W27-L30 HydrophobicContact CB-CB 4.38Å; W27-L30 HydrophobicContact CE3-CB 4.09Å; W27-L30 HydrophobicContact CE3-CD1 3.54Å; W27-L30 HydrophobicContact CE3-CG 4.25Å; W27-L30 HydrophobicContact CZ3-CD1 3.66Å; W27-L30 WeakPolarHBondContact O-CA 3.03Å; W27-L30 PolarHBondContact O-N 3Å; L30-T33 WeakPolarHBondContact CA-OG1 3.31Å; L30-T33 PolarHBondContact O-N 3Å; L30-T33 PolarHBondContact O-OG1 3.34Å; L30-S34 VanDerWaalsContact O-CB 3.23Å; L30-S34 WeakPolarHBondContact O-CB 3.46Å; L30-S34 PolarHBondContact O-N 3.04Å; L30-S34 PolarHBondContact O-OG 3.43Å
31	V	82	Confident	81.6	Confident	33 Å²	33	65.9 Å²	65.9	20%	0.2	33%	0.328	C	S	.	.	H	α-helix	trans	-62.4	-46.1	177	177	0	0	0	0	109.9	L24 W27 S34 S35 P630	L24-V31 HydrophobicContact CD2-CG1 3.94Å; L24-V31 HydrophobicContact CD2-CG2 4.17Å; W27-V31 WeakPolarHBondContact O-CG2 3.44Å; W27-V31 PolarHBondContact O-N 3.49Å; V31-S34 WeakPolarHBondContact CA-OG 3.5Å; V31-S34 PolarHBondContact O-N 3.27Å; V31-S34 PolarHBondContact O-OG 3.37Å; V31-S35 WeakPolarHBondContact O-CB 3.48Å; V31-S35 PolarHBondContact O-N 2.99Å; V31-S35 PolarHBondContact O-OG 3.12Å; V31-P630 HydrophobicContact CG1-CB 4.11Å; V31-P630 HydrophobicContact CG1-CG 3.68Å
32	A	78.7	Confident	81.8	Confident	9 Å²	9	66.9 Å²	66.9	7%	0.074	33%	0.334	C	S	.	.	H	α-helix	trans	-65.9	-38.7	177.8	0	0	0	0	0	113.9	K28 Y29 S35 L36 M631 I634	K28-A32 WeakPolarHBondContact O-CB 3.44Å; K28-A32 PolarHBondContact O-N 3.49Å; Y29-A32 PolarHBondContact O-N 3.21Å; A32-S35 WeakPolarHBondContact CA-OG 3.47Å; A32-S35 PolarHBondContact O-OG 3.09Å; A32-S35 VanDerWaalsContact O-OG 3.08Å; A32-L36 WeakPolarHBondContact O-CB 3.42Å; A32-L36 PolarHBondContact O-N 3Å; A32-M631 HydrophobicContact CB-CE 3.87Å; A32-I634 HydrophobicContact CB-CD1 3.43Å; A32-I634 VanDerWaalsContact CB-CD1 3.43Å
33	T	83.4	Confident	81.7	Confident	90 Å²	90	61.1 Å²	61.1	55%	0.552	32%	0.315	S	S	*	.	H	α-helix	trans	-70.5	-37.8	175.1	54.8	0	0	0	0	111.4	Y29 L30 L36 S37	Y29-T33 WeakPolarHBondContact O-CB 3.43Å; Y29-T33 VanDerWaalsContact O-CG2 3.29Å; Y29-T33 WeakPolarHBondContact O-CG2 3.35Å; Y29-T33 PolarHBondContact O-N 2.91Å; Y29-T33 PolarHBondContact O-OG1 3.14Å; Y29-T33 VanDerWaalsContact O-OG1 3.05Å; L30-T33 WeakPolarHBondContact CA-OG1 3.31Å; L30-T33 PolarHBondContact O-N 3Å; L30-T33 PolarHBondContact O-OG1 3.34Å; T33-L36 PolarHBondContact O-N 3.02Å; T33-S37 VanDerWaalsContact O-CB 3.3Å; T33-S37 WeakPolarHBondContact O-CB 3.35Å; T33-S37 PolarHBondContact O-N 3.37Å; T33-S37 PolarHBondContact O-OG 3.39Å
34	S	83.9	Confident	81.9	Confident	55 Å²	55	61.1 Å²	61.1	39%	0.385	32%	0.317	S	S	.	.	H	α-helix	trans	-64.9	-44.2	175.2	74.8	0	0	0	0	111.6	L30 V31 S37 F38	L30-S34 VanDerWaalsContact O-CB 3.23Å; L30-S34 WeakPolarHBondContact O-CB 3.46Å; L30-S34 PolarHBondContact O-N 3.04Å; L30-S34 PolarHBondContact O-OG 3.43Å; V31-S34 WeakPolarHBondContact CA-OG 3.5Å; V31-S34 PolarHBondContact O-N 3.27Å; V31-S34 PolarHBondContact O-OG 3.37Å; S34-S37 WeakPolarHBondContact CA-OG 3.44Å; S34-S37 PolarHBondContact O-N 2.03Å; S34-S37 PolarHBondContact O-OG 2.92Å; S34-F38 WeakPolarHBondContact O-CB 3.39Å; S34-F38 PolarHBondContact O-N 3.45Å
35	S	78.8	Confident	82	Confident	8 Å²	8	63.7 Å²	63.7	6%	0.056	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-41.4	177.1	64.8	0	0	0	0	111.3	V31 A32 S37 F38 I39 L626	V31-S35 WeakPolarHBondContact O-CB 3.48Å; V31-S35 PolarHBondContact O-N 2.99Å; V31-S35 PolarHBondContact O-OG 3.12Å; A32-S35 WeakPolarHBondContact CA-OG 3.47Å; A32-S35 PolarHBondContact O-OG 3.09Å; A32-S35 VanDerWaalsContact O-OG 3.08Å; S35-S37 VanDerWaalsContact C-N 3.35Å; S35-S37 PolarHBondContact O-N 3.1Å; S35-F38 PolarHBondContact O-N 3.21Å; S35-I39 WeakPolarHBondContact O-CB 3.31Å; S35-I39 WeakPolarHBondContact O-CD1 3.47Å; S35-I39 WeakPolarHBondContact O-CG1 3.48Å; S35-I39 PolarHBondContact O-N 3.07Å; S35-L626 WeakPolarHBondContact CB-O 3.4Å
36	L	79.1	Confident	82.2	Confident	88 Å²	88	63.5 Å²	63.5	46%	0.461	33%	0.329	S	S	.	.	H	α-helix	trans	-61.9	-41.3	173.1	-170.9	70.1	0	0	0	111.8	A32 T33 F38 I39 L40	A32-L36 WeakPolarHBondContact O-CB 3.42Å; A32-L36 PolarHBondContact O-N 3Å; T33-L36 PolarHBondContact O-N 3.02Å; L36-F38 VanDerWaalsContact C-N 3.35Å; L36-I39 PolarHBondContact O-N 2.8Å; L36-L40 HydrophobicContact CG-CD1 4.1Å; L36-L40 HydrophobicContact CG-CG 4.49Å; L36-L40 WeakPolarHBondContact O-CB 3.33Å; L36-L40 VanDerWaalsContact O-CG 3.24Å; L36-L40 WeakPolarHBondContact O-CG 3.38Å; L36-L40 PolarHBondContact O-N 2.95Å
37	S	85	Confident	82.2	Confident	66 Å²	66	62.8 Å²	62.8	46%	0.462	33%	0.329	S	S	.	.	H	α-helix	trans	-65.3	-38.3	176.4	75.5	0	0	0	0	112.2	T33 S34 S35 L40 S41	T33-S37 VanDerWaalsContact O-CB 3.3Å; T33-S37 WeakPolarHBondContact O-CB 3.35Å; T33-S37 PolarHBondContact O-N 3.37Å; T33-S37 PolarHBondContact O-OG 3.39Å; S34-S37 WeakPolarHBondContact CA-OG 3.44Å; S34-S37 PolarHBondContact O-N 2.03Å; S34-S37 PolarHBondContact O-OG 2.92Å; S35-S37 VanDerWaalsContact C-N 3.35Å; S35-S37 PolarHBondContact O-N 3.1Å; S37-L40 PolarHBondContact O-N 3.48Å; S37-S41 WeakPolarHBondContact O-CB 3.45Å; S37-S41 PolarHBondContact O-N 3Å; S37-S41 PolarHBondContact O-OG 2.89Å
38	F	83.4	Confident	82.3	Confident	100 Å²	100	61.1 Å²	61.1	44%	0.439	33%	0.334	S	S	.	.	H	α-helix	trans	-64.7	-46.4	174.8	180	-100.2	0	0	0	110.6	S34 S35 L36 L40 S41 T42 F623	S34-F38 WeakPolarHBondContact O-CB 3.39Å; S34-F38 PolarHBondContact O-N 3.45Å; S35-F38 PolarHBondContact O-N 3.21Å; L36-F38 VanDerWaalsContact C-N 3.35Å; F38-L40 PolarHBondContact O-N 3.39Å; F38-S41 PolarHBondContact O-N 2.8Å; F38-S41 PolarHBondContact O-OG 3.17Å; F38-T42 HydrophobicContact CD1-CG2 4.38Å; F38-T42 HydrophobicContact CE1-CG2 4.02Å; F38-T42 HydrophobicContact CE2-CG2 4.16Å; F38-T42 HydrophobicContact CZ-CG2 3.9Å; F38-T42 WeakPolarHBondContact O-CB 3.4Å; F38-T42 WeakPolarHBondContact O-CG2 3.3Å; F38-T42 PolarHBondContact O-N 3.44Å; F38-T42 PolarHBondContact O-OG1 3.09Å; F38-F623 HydrophobicContact CD1-CE1 4.43Å; F38-F623 HydrophobicContact CE1-CE1 4.15Å
39	I	79.7	Confident	82.3	Confident	5 Å²	5	65.5 Å²	65.5	3%	0.026	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-43.7	175.1	-67.8	166	0	0	0	111	S35 L36 T42 S43 W441 F623 M627	S35-I39 WeakPolarHBondContact O-CB 3.31Å; S35-I39 WeakPolarHBondContact O-CD1 3.47Å; S35-I39 WeakPolarHBondContact O-CG1 3.48Å; S35-I39 PolarHBondContact O-N 3.07Å; L36-I39 PolarHBondContact O-N 2.8Å; I39-T42 WeakPolarHBondContact CA-OG1 3.45Å; I39-T42 PolarHBondContact O-OG1 3.03Å; I39-S43 WeakPolarHBondContact O-CB 3.41Å; I39-S43 PolarHBondContact O-N 3.37Å; I39-S43 PolarHBondContact O-OG 3.44Å; I39-W441 HydrophobicContact CG2-CD2 3.49Å; I39-W441 VanDerWaalsContact CG2-CD2 3.49Å; I39-W441 HydrophobicContact CG2-CE3 3.95Å; I39-W441 HydrophobicContact CG2-CG 3.97Å; I39-W441 HydrophobicContact CG2-CH2 3.92Å; I39-W441 HydrophobicContact CG2-CZ2 3.43Å; I39-W441 VanDerWaalsContact CG2-CZ2 3.43Å; I39-W441 HydrophobicContact CG2-CZ3 4.13Å; I39-F623 HydrophobicContact CG1-CD1 4.49Å; I39-F623 HydrophobicContact CG1-CE1 4.25Å; I39-M627 HydrophobicContact CD1-CB 4.24Å; I39-M627 HydrophobicContact CD1-CG 4.01Å; I39-M627 HydrophobicContact CD1-SD 3.73Å
40	L	82.9	Confident	82.2	Confident	88 Å²	88	64.7 Å²	64.7	46%	0.461	35%	0.352	S	S	.	.	H	α-helix	trans	-64.3	-46.7	177.3	-75.8	169.3	0	0	0	111.2	L36 S37 F38 T42 S43 I44	L36-L40 HydrophobicContact CG-CD1 4.1Å; L36-L40 HydrophobicContact CG-CG 4.49Å; L36-L40 WeakPolarHBondContact O-CB 3.33Å; L36-L40 VanDerWaalsContact O-CG 3.24Å; L36-L40 WeakPolarHBondContact O-CG 3.38Å; L36-L40 PolarHBondContact O-N 2.95Å; S37-L40 PolarHBondContact O-N 3.48Å; F38-L40 PolarHBondContact O-N 3.39Å; L40-T42 PolarHBondContact O-N 3.49Å; L40-S43 WeakPolarHBondContact CA-OG 3.48Å; L40-S43 PolarHBondContact O-N 2.84Å; L40-S43 PolarHBondContact O-OG 3.47Å; L40-I44 VanDerWaalsContact O-CG1 3.25Å; L40-I44 WeakPolarHBondContact O-CG1 3.26Å; L40-I44 PolarHBondContact O-N 3.33Å
41	S	85.1	Confident	82	Confident	53 Å²	53	67.1 Å²	67.1	37%	0.371	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-46.5	178.8	70.1	0	0	0	0	112	S37 F38 S43 I44 I45	S37-S41 WeakPolarHBondContact O-CB 3.45Å; S37-S41 PolarHBondContact O-N 3Å; S37-S41 PolarHBondContact O-OG 2.89Å; F38-S41 PolarHBondContact O-N 2.8Å; F38-S41 PolarHBondContact O-OG 3.17Å; S41-S43 VanDerWaalsContact C-N 3.35Å; S41-S43 PolarHBondContact O-N 3.42Å; S41-I44 PolarHBondContact O-N 3.44Å; S41-I45 VanDerWaalsContact O-CG1 3.28Å; S41-I45 WeakPolarHBondContact O-CG1 3.33Å; S41-I45 PolarHBondContact O-N 3.09Å
42	T	83.5	Confident	81.9	Confident	22 Å²	22	70.5 Å²	70.5	14%	0.135	38%	0.381	C	S	.	.	H	α-helix	trans	-63.6	-42.5	176	53.5	0	0	0	0	110.3	F38 I39 L40 I44 I45 C46	F38-T42 HydrophobicContact CD1-CG2 4.38Å; F38-T42 HydrophobicContact CE1-CG2 4.02Å; F38-T42 HydrophobicContact CE2-CG2 4.16Å; F38-T42 HydrophobicContact CZ-CG2 3.9Å; F38-T42 WeakPolarHBondContact O-CB 3.4Å; F38-T42 WeakPolarHBondContact O-CG2 3.3Å; F38-T42 PolarHBondContact O-N 3.44Å; F38-T42 PolarHBondContact O-OG1 3.09Å; I39-T42 WeakPolarHBondContact CA-OG1 3.45Å; I39-T42 PolarHBondContact O-OG1 3.03Å; L40-T42 PolarHBondContact O-N 3.49Å; T42-I44 PolarHBondContact O-N 3.25Å; T42-I45 PolarHBondContact O-N 2.96Å; T42-C46 VanDerWaalsContact O-CB 3.31Å; T42-C46 WeakPolarHBondContact O-CB 3.26Å; T42-C46 PolarHBondContact O-N 3.3Å; T42-C46 PolarHBondContact O-SG 3.04Å
43	S	80.6	Confident	82.1	Confident	14 Å²	14	71.6 Å²	71.6	10%	0.098	39%	0.388	C	S	.	.	H	α-helix	trans	-61.8	-40.2	176.9	77.3	0	0	0	0	113.2	I39 L40 S41 C46 I47	I39-S43 WeakPolarHBondContact O-CB 3.41Å; I39-S43 PolarHBondContact O-N 3.37Å; I39-S43 PolarHBondContact O-OG 3.44Å; L40-S43 WeakPolarHBondContact CA-OG 3.48Å; L40-S43 PolarHBondContact O-N 2.84Å; L40-S43 PolarHBondContact O-OG 3.47Å; S41-S43 VanDerWaalsContact C-N 3.35Å; S41-S43 PolarHBondContact O-N 3.42Å; S43-C46 WeakPolarHBondContact O-CB 3.44Å; S43-C46 PolarHBondContact O-N 3.42Å; S43-I47 WeakPolarHBondContact O-CB 3.16Å; S43-I47 WeakPolarHBondContact O-CD1 3.29Å; S43-I47 WeakPolarHBondContact O-CG1 3.42Å; S43-I47 PolarHBondContact O-N 3.33Å
44	I	85.2	Confident	82	Confident	104 Å²	104	72 Å²	72	53%	0.533	39%	0.386	S	S	.	.	H	α-helix	trans	-65.9	-48.1	178.1	-70	163.1	0	0	0	109.4	L40 S41 T42 C46 I47 V48	L40-I44 VanDerWaalsContact O-CG1 3.25Å; L40-I44 WeakPolarHBondContact O-CG1 3.26Å; L40-I44 PolarHBondContact O-N 3.33Å; S41-I44 PolarHBondContact O-N 3.44Å; T42-I44 PolarHBondContact O-N 3.25Å; I44-C46 PolarHBondContact O-N 3.32Å; I44-I47 PolarHBondContact O-N 3.09Å; I44-V48 HydrophobicContact CG2-CG2 4.33Å; I44-V48 WeakPolarHBondContact O-CB 3.36Å; I44-V48 WeakPolarHBondContact O-CG2 3.32Å; I44-V48 PolarHBondContact O-N 3.37Å
45	I	83.4	Confident	81.9	Confident	85 Å²	85	70.8 Å²	70.8	44%	0.436	38%	0.375	S	S	.	.	H	α-helix	trans	-55.9	-45.9	174.7	-67.8	165.3	0	0	0	109.4	S41 T42 I47 V48 F49	S41-I45 VanDerWaalsContact O-CG1 3.28Å; S41-I45 WeakPolarHBondContact O-CG1 3.33Å; S41-I45 PolarHBondContact O-N 3.09Å; T42-I45 PolarHBondContact O-N 2.96Å; I45-I47 PolarHBondContact O-N 2.98Å; I45-V48 PolarHBondContact O-N 3.45Å; I45-F49 HydrophobicContact CG2-CD2 3.97Å; I45-F49 HydrophobicContact CG2-CE2 4.31Å; I45-F49 VanDerWaalsContact O-CD2 3.24Å; I45-F49 WeakPolarHBondContact O-CD2 3.3Å; I45-F49 PolarHBondContact O-N 2.73Å; I45-F49 VanDerWaalsContact O-N 3.17Å
46	C	82.5	Confident	81.8	Confident	2 Å²	2	73 Å²	73	1%	0.014	39%	0.391	C	S	.	.	H	α-helix	trans	-62.7	-46.5	-177.8	-67.4	0	0	0	0	112.7	T42 S43 I44 F49 F50 L444 T448	T42-C46 VanDerWaalsContact O-CB 3.31Å; T42-C46 WeakPolarHBondContact O-CB 3.26Å; T42-C46 PolarHBondContact O-N 3.3Å; T42-C46 PolarHBondContact O-SG 3.04Å; S43-C46 WeakPolarHBondContact O-CB 3.44Å; S43-C46 PolarHBondContact O-N 3.42Å; I44-C46 PolarHBondContact O-N 3.32Å; C46-F49 PolarHBondContact O-N 2.73Å; C46-F50 VanDerWaalsContact O-CB 3.3Å; C46-F50 WeakPolarHBondContact O-CB 3.47Å; C46-F50 PolarHBondContact O-N 2.92Å; C46-L444 HydrophobicContact CB-CD1 3.81Å; C46-L444 HydrophobicContact CB-CD2 3.47Å; C46-L444 VanDerWaalsContact CB-CD2 3.47Å; C46-L444 HydrophobicContact CB-CG 3.35Å; C46-T448 VanDerWaalsContact CA-CG2 3.48Å; C46-T448 HydrophobicContact CB-CG2 3.68Å; C46-T448 VanDerWaalsContact SG-CG2 3.59Å; C46-T448 PolarHBondContact SG-OG1 3.44Å
47	I	82	Confident	81.7	Confident	118 Å²	118	69.9 Å²	69.9	61%	0.605	38%	0.375	S	S	*	.	H	α-helix	trans	-65.4	-40.4	-179.9	-69.3	163.7	0	0	0	110.9	S43 I44 I45 F49 F50	S43-I47 WeakPolarHBondContact O-CB 3.16Å; S43-I47 WeakPolarHBondContact O-CD1 3.29Å; S43-I47 WeakPolarHBondContact O-CG1 3.42Å; S43-I47 PolarHBondContact O-N 3.33Å; I44-I47 PolarHBondContact O-N 3.09Å; I45-I47 PolarHBondContact O-N 2.98Å; I47-F49 VanDerWaalsContact C-N 3.31Å; I47-F49 PolarHBondContact O-N 3.48Å; I47-F50 PolarHBondContact O-N 3.38Å
48	V	84.3	Confident	81.4	Confident	103 Å²	103	67 Å²	67	62%	0.624	36%	0.355	S	S	*	.	H	α-helix	trans	-64.5	-36.4	-179.1	168.8	0	0	0	0	112	I44 I45	I44-V48 HydrophobicContact CG2-CG2 4.33Å; I44-V48 WeakPolarHBondContact O-CB 3.36Å; I44-V48 WeakPolarHBondContact O-CG2 3.32Å; I44-V48 PolarHBondContact O-N 3.37Å; I45-V48 PolarHBondContact O-N 3.45Å
49	F	78.8	Confident	81.1	Confident	117 Å²	117	65 Å²	65	51%	0.513	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	10.8	-178.1	-66.9	-70.1	0	0	0	113.4	I45 C46 I47 H51 I452	I45-F49 HydrophobicContact CG2-CD2 3.97Å; I45-F49 HydrophobicContact CG2-CE2 4.31Å; I45-F49 VanDerWaalsContact O-CD2 3.24Å; I45-F49 WeakPolarHBondContact O-CD2 3.3Å; I45-F49 PolarHBondContact O-N 2.73Å; I45-F49 VanDerWaalsContact O-N 3.17Å; C46-F49 PolarHBondContact O-N 2.73Å; I47-F49 VanDerWaalsContact C-N 3.31Å; I47-F49 PolarHBondContact O-N 3.48Å; F49-H51 PolarHBondContact O-N 3.24Å; F49-H51 VanDerWaalsContact O-N 3.15Å; F49-I452 HydrophobicContact CB-CD1 3.31Å; F49-I452 HydrophobicContact CB-CG1 4.04Å; F49-I452 HydrophobicContact CD1-CD1 4.36Å; F49-I452 HydrophobicContact CD2-CD1 3.69Å; F49-I452 HydrophobicContact CG-CD1 3.55Å; F49-I452 HydrophobicContact CG-CG1 4.36Å
50	F	78.7	Confident	81.1	Confident	106 Å²	106	65.3 Å²	65.3	47%	0.465	35%	0.348	S	S	.	.			trans	-73.2	109.4	179.1	-171.3	-100.1	0	0	0	109.8	C46 I47 V52 L444 Y447	C46-F50 VanDerWaalsContact O-CB 3.3Å; C46-F50 WeakPolarHBondContact O-CB 3.47Å; C46-F50 PolarHBondContact O-N 2.92Å; I47-F50 PolarHBondContact O-N 3.38Å; F50-V52 HydrophobicContact CE1-CG2 4.13Å; F50-L444 HydrophobicContact CD2-CD1 4.26Å; F50-Y447 AromaticContact CD2-CD1 3.78Å; F50-Y447 HydrophobicContact CD2-CD1 3.78Å; F50-Y447 AromaticContact CD2-CE1 3.68Å; F50-Y447 HydrophobicContact CD2-CE1 3.68Å; F50-Y447 AromaticContact CE2-CD1 3.84Å; F50-Y447 HydrophobicContact CE2-CD1 3.84Å; F50-Y447 AromaticContact CE2-CE1 3.74Å; F50-Y447 HydrophobicContact CE2-CE1 3.74Å
51	H	81.4	Confident	81	Confident	143 Å²	143	61.2 Å²	61.2	66%	0.662	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-98.1	141.7	164.6	-165.7	-81.6	0	0	0	108.6	F49 P53 Y447	F49-H51 PolarHBondContact O-N 3.24Å; F49-H51 VanDerWaalsContact O-N 3.15Å; H51-P53 WeakPolarHBondContact O-CD 3.4Å; H51-Y447 PolarHBondContact O-OH 3.29Å
52	V	80.1	Confident	80.9	Confident	105 Å²	105	59.5 Å²	59.5	64%	0.636	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-72.4	123.3	173.2	-179.2	0	0	0	0	107.6	F50 D54	F50-V52 HydrophobicContact CE1-CG2 4.13Å; V52-D54 PolarHBondContact O-N 3.15Å
53	P	83.3	Confident	81	Confident	32 Å²	32	59 Å²	59	21%	0.208	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-63.4	136.5	176.8	26.3	-32.9	0	0	0	110	H51 F459	H51-P53 WeakPolarHBondContact O-CD 3.4Å; P53-F459 HydrophobicContact CB-CB 3.66Å; P53-F459 HydrophobicContact CB-CD1 3.82Å; P53-F459 HydrophobicContact CB-CG 3.95Å; P53-F459 HydrophobicContact CG-CD1 4Å; P53-F459 HydrophobicContact CG-CG 4.45Å
54	D	80.6	Confident	81.3	Confident	97 Å²	97	58.5 Å²	58.5	52%	0.519	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-73.7	130.9	168.9	-167	0.4	0	0	0	109	V52 S56	V52-D54 PolarHBondContact O-N 3.15Å; D54-S56 VanDerWaalsContact OD1-CB 3.24Å; D54-S56 WeakPolarHBondContact OD1-CB 3.37Å; D54-S56 PolarHBondContact OD1-N 2.93Å; D54-S56 PolarHBondContact OD1-OG 3.18Å; D54-S56 PolarHBondContact OD2-OG 3.13Å
55	L	81	Confident	81.4	Confident	30 Å²	30	54.3 Å²	54.3	16%	0.157	28%	0.284	C	S	.	.			trans	-126.6	12.8	-178.4	-63.8	170.6	0	0	0	111.1	N57 T401 L404 F459 V461	L55-N57 VanDerWaalsContact C-N 3.34Å; L55-N57 PolarHBondContact O-N 2.97Å; L55-T401 PolarHBondContact O-OG1 3.22Å; L55-L404 HydrophobicContact CD1-CD1 4.27Å; L55-L404 HydrophobicContact CD1-CD2 3.91Å; L55-F459 HydrophobicContact CD2-CD1 4.31Å; L55-V461 HydrophobicContact CD2-CG2 3.95Å
56	S	77.5	Confident	81.4	Confident	56 Å²	56	53.5 Å²	53.5	39%	0.392	30%	0.297	S	S	.	.	S	Bend	trans	-56.5	-42.6	-174.7	54.7	0	0	0	0	113.4	D54 T401	D54-S56 VanDerWaalsContact OD1-CB 3.24Å; D54-S56 WeakPolarHBondContact OD1-CB 3.37Å; D54-S56 PolarHBondContact OD1-N 2.93Å; D54-S56 PolarHBondContact OD1-OG 3.18Å; D54-S56 PolarHBondContact OD2-OG 3.13Å; S56-T401 PolarHBondContact O-OG1 3.22Å
57	N	77.3	Confident	81.7	Confident	22 Å²	22	54.6 Å²	54.6	12%	0.118	30%	0.303	C	S	.	.			trans	-111.7	107.6	174.8	-179.7	0.3	0	0	0	110.8	L55 F59 V60 S105	L55-N57 VanDerWaalsContact C-N 3.34Å; L55-N57 PolarHBondContact O-N 2.97Å; N57-F59 PolarHBondContact O-N 3.41Å; N57-F59 WeakPolarHBondContact OD1-CB 3.41Å; N57-F59 PolarHBondContact OD1-N 3.4Å; N57-V60 HydrophobicContact CB-CG2 3.6Å; N57-V60 WeakPolarHBondContact ND2-CG2 3.37Å; N57-V60 WeakPolarHBondContact O-CG2 3.38Å; N57-S105 PolarHBondContact ND2-OG 3.16Å
58	P	78.1	Confident	82	Confident	6 Å²	6	52.9 Å²	52.9	4%	0.039	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-13.4	-178	33	-37.4	0	0	0	112.8	F62 V400 V461 F713	P58-F62 WeakPolarHBondContact O-CD2 3.47Å; P58-F62 WeakPolarHBondContact O-CE2 3.44Å; P58-V400 HydrophobicContact CB-CG1 4.25Å; P58-V400 HydrophobicContact CG-CB 4.36Å; P58-V400 HydrophobicContact CG-CG1 4.03Å; P58-V461 HydrophobicContact CB-CG2 3.92Å; P58-F713 HydrophobicContact CB-CD2 4.11Å; P58-F713 HydrophobicContact CB-CE1 4.34Å; P58-F713 HydrophobicContact CB-CE2 3.54Å; P58-F713 HydrophobicContact CB-CZ 3.68Å; P58-F713 HydrophobicContact CG-CD2 4.06Å; P58-F713 HydrophobicContact CG-CE2 3.76Å; P58-F713 HydrophobicContact CG-CZ 4.41Å; P58-F713 WeakPolarHBondContact O-CZ 3.4Å
59	F	76.9	Confident	82.2	Confident	58 Å²	58	50 Å²	50	25%	0.254	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-14.6	-174.2	-65.2	-72.7	0	0	0	115.6	N57 D61 F62 Y396 D397 S711 F713	N57-F59 PolarHBondContact O-N 3.41Å; N57-F59 WeakPolarHBondContact OD1-CB 3.41Å; N57-F59 PolarHBondContact OD1-N 3.4Å; F59-D61 VanDerWaalsContact C-N 3.3Å; F59-D61 PolarHBondContact O-N 3.5Å; F59-D61 VanDerWaalsContact O-N 3.11Å; F59-F62 WeakPolarHBondContact O-CB 3.34Å; F59-F62 PolarHBondContact O-N 3.19Å; F59-Y396 AromaticContact CE2-CD1 3.88Å; F59-Y396 HydrophobicContact CE2-CD1 3.88Å; F59-Y396 AromaticContact CE2-CE1 3.85Å; F59-Y396 HydrophobicContact CE2-CE1 3.85Å; F59-Y396 HydrophobicContact CZ-CD1 4.21Å; F59-Y396 AromaticContact CZ-CE1 3.73Å; F59-Y396 HydrophobicContact CZ-CE1 3.73Å; F59-D397 WeakPolarHBondContact CD2-OD1 3.34Å; F59-D397 VanDerWaalsContact CE2-OD1 3.24Å; F59-D397 WeakPolarHBondContact CE2-OD1 3.5Å; F59-S711 WeakPolarHBondContact CE1-O 3.47Å; F59-F713 AromaticContact CD1-CE2 3.73Å; F59-F713 HydrophobicContact CD1-CE2 3.73Å; F59-F713 HydrophobicContact CD2-CE2 4.44Å; F59-F713 AromaticContact CE1-CD2 3.79Å; F59-F713 HydrophobicContact CE1-CD2 3.79Å; F59-F713 AromaticContact CE1-CE2 3.34Å; F59-F713 HydrophobicContact CE1-CE2 3.34Å; F59-F713 HydrophobicContact CE1-CZ 4.43Å; F59-F713 HydrophobicContact CE2-CD2 4.28Å; F59-F713 HydrophobicContact CE2-CE2 4.13Å; F59-F713 HydrophobicContact CG-CE2 4.27Å; F59-F713 AromaticContact CZ-CD2 3.62Å; F59-F713 HydrophobicContact CZ-CD2 3.62Å; F59-F713 AromaticContact CZ-CE2 3.57Å; F59-F713 HydrophobicContact CZ-CE2 3.57Å
60	V	79	Confident	82.6	Confident	11 Å²	11	44.5 Å²	44.5	7%	0.067	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.2	-49	-172.2	165.2	0	0	0	0	113.7	N57 F62 Y764 D766	N57-V60 HydrophobicContact CB-CG2 3.6Å; N57-V60 WeakPolarHBondContact ND2-CG2 3.37Å; N57-V60 WeakPolarHBondContact O-CG2 3.38Å; V60-F62 PolarHBondContact O-N 2.98Å; V60-Y764 PolarHBondContact O-OH 2.92Å; V60-D766 VanDerWaalsContact CA-OD2 3.29Å; V60-D766 WeakPolarHBondContact CA-OD2 3.46Å; V60-D766 VanDerWaalsContact CB-OD2 3.3Å; V60-D766 WeakPolarHBondContact CB-OD2 3.5Å; V60-D766 HydrophobicContact CG1-CB 3.82Å; V60-D766 WeakPolarHBondContact CG1-OD2 3.41Å; V60-D766 HydrophobicContact CG2-CB 4.47Å; V60-D766 VanDerWaalsContact CG2-OD2 3.31Å; V60-D766 WeakPolarHBondContact CG2-OD2 3.29Å
61	D	81.8	Confident	83.1	Confident	2 Å²	2	40 Å²	40	1%	0.011	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	3.5	-172	-74.6	-21.6	0	0	0	114.4	F59 V63 H458 P460 A605 R608	F59-D61 VanDerWaalsContact C-N 3.3Å; F59-D61 PolarHBondContact O-N 3.5Å; F59-D61 VanDerWaalsContact O-N 3.11Å; D61-V63 PolarHBondContact O-N 3.18Å; D61-H458 IonicContact OD1-ND1 3.53Å; D61-H458 IonicContact OD2-CE1 2.95Å; D61-H458 IonicContact OD2-CG 3.31Å; D61-H458 IonicContact OD2-ND1 2.86Å; D61-H458 PolarHBondContact OD2-ND1 3.4Å; D61-P460 HydrophobicContact CB-CB 4Å; D61-P460 VanDerWaalsContact OD2-CB 3.31Å; D61-P460 WeakPolarHBondContact OD2-CB 3.41Å; D61-P460 VanDerWaalsContact OD2-CD 3.29Å; D61-P460 WeakPolarHBondContact OD2-CD 3.47Å; D61-A605 HydrophobicContact CB-CB 3.96Å; D61-A605 WeakPolarHBondContact O-CB 3.34Å; D61-A605 PolarHBondContact O-N 3.11Å; D61-R608 IonicContact OD1-CZ 3.93Å; D61-R608 IonicContact OD1-NH1 3.89Å; D61-R608 PolarHBondContact OD1-NH1 2.94Å; D61-R608 IonicContact OD2-CZ 3.92Å; D61-R608 IonicContact OD2-NH1 3.92Å; D61-R608 PolarHBondContact OD2-NH1 2.63Å
62	F	83.2	Confident	83.5	Confident	17 Å²	17	36 Å²	36	8%	0.075	22%	0.221	C	C	.	.			trans	-86.9	52.1	179.6	-68.8	-84.2	0	0	0	111.8	P58 F59 V60 I462 A605 F713 I967 I1028	P58-F62 WeakPolarHBondContact O-CD2 3.47Å; P58-F62 WeakPolarHBondContact O-CE2 3.44Å; F59-F62 WeakPolarHBondContact O-CB 3.34Å; F59-F62 PolarHBondContact O-N 3.19Å; V60-F62 PolarHBondContact O-N 2.98Å; F62-I462 HydrophobicContact CE1-CD1 3.37Å; F62-I462 HydrophobicContact CE1-CG1 4.35Å; F62-I462 HydrophobicContact CE2-CD1 4.41Å; F62-I462 HydrophobicContact CZ-CD1 3.3Å; F62-I462 HydrophobicContact CZ-CG1 3.79Å; F62-A605 HydrophobicContact CD1-CB 4.36Å; F62-A605 HydrophobicContact CE1-CB 4.43Å; F62-F713 HydrophobicContact CD2-CZ 4.41Å; F62-F713 HydrophobicContact CE2-CE1 4.25Å; F62-F713 HydrophobicContact CE2-CE2 4.5Å; F62-F713 AromaticContact CE2-CZ 3.53Å; F62-F713 HydrophobicContact CE2-CZ 3.53Å; F62-F713 HydrophobicContact CZ-CE1 4.15Å; F62-F713 AromaticContact CZ-CZ 3.8Å; F62-F713 HydrophobicContact CZ-CZ 3.8Å; F62-I967 WeakPolarHBondContact O-CD1 3.37Å; F62-I1028 HydrophobicContact CD1-CD1 3.31Å; F62-I1028 HydrophobicContact CD1-CG1 4.42Å; F62-I1028 HydrophobicContact CD1-CG2 4.17Å; F62-I1028 HydrophobicContact CE1-CB 4.23Å; F62-I1028 HydrophobicContact CE1-CD1 3.68Å; F62-I1028 HydrophobicContact CE1-CG2 3.8Å; F62-I1028 HydrophobicContact CG-CD1 4.35Å
63	V	84.7	Confident	83.9	Confident	12 Å²	12	32 Å²	32	7%	0.073	20%	0.196	C	C	.	.			trans	-120.8	143.8	177.7	178.8	0	0	0	0	109.5	D61 I65 I604 Y764	D61-V63 PolarHBondContact O-N 3.18Å; V63-I65 HydrophobicContact CG1-CG1 4.47Å; V63-I604 HydrophobicContact CB-CD1 4.25Å; V63-I604 PolarHBondContact O-N 3.32Å; V63-Y764 WeakPolarHBondContact CG2-OH 3.5Å
64	A	87.4	Confident	84.1	Confident	3 Å²	3	30.9 Å²	30.9	3%	0.025	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-90.3	129.1	170.9	0	0	0	0	0	110.6	T67 S70 E966 N970	A64-T67 HydrophobicContact CB-CG2 4.38Å; A64-S70 WeakPolarHBondContact O-CB 3.47Å; A64-E966 HydrophobicContact CB-CG 3.99Å; A64-N970 WeakPolarHBondContact CB-ND2 3.06Å
65	I	87.1	Confident	84.4	Confident	15 Å²	15	26.3 Å²	26.3	8%	0.077	16%	0.164	C	C	.	.			trans	-120.2	147.9	-179.8	-66.8	-172.6	0	0	0	110.3	V63 T67 S602 I604 R759 Y764	V63-I65 HydrophobicContact CG1-CG1 4.47Å; I65-T67 VanDerWaalsContact C-N 3.31Å; I65-S602 PolarHBondContact N-O 2.95Å; I65-I604 HydrophobicContact CB-CG1 4.42Å; I65-I604 HydrophobicContact CD1-CD1 3.09Å; I65-I604 HydrophobicContact CD1-CG1 3.54Å; I65-I604 HydrophobicContact CG1-CD1 3.62Å; I65-I604 HydrophobicContact CG1-CG1 3.81Å; I65-R759 HydrophobicContact CD1-CB 3.71Å; I65-R759 HydrophobicContact CG2-CB 4.16Å; I65-R759 WeakPolarHBondContact CG2-O 3.42Å; I65-Y764 HydrophobicContact CD1-CD2 3.64Å; I65-Y764 HydrophobicContact CD1-CE2 4.24Å; I65-Y764 HydrophobicContact CD1-CG 3.98Å
66	G	84.3	Confident	84.8	Confident	68 Å²	68	25.4 Å²	25.4	70%	0.701	16%	0.159	S	C	*	.	S	Bend	trans	80.2	15.5	174	0	0	0	0	0	113.5	S70	G66-S70 PolarHBondContact N-OG 2.92Å
67	T	88.7	Confident	85.2	Confident	25 Å²	25	25.1 Å²	25.1	15%	0.153	15%	0.151	C	C	.	.	S	Bend	trans	-95.7	162.9	173.9	64.7	0	0	0	0	110.6	A64 I65 L69 S70 A71 E966	A64-T67 HydrophobicContact CB-CG2 4.38Å; I65-T67 VanDerWaalsContact C-N 3.31Å; T67-L69 VanDerWaalsContact C-N 3.28Å; T67-L69 PolarHBondContact O-N 3.33Å; T67-S70 PolarHBondContact N-OG 3.09Å; T67-S70 PolarHBondContact O-OG 3Å; T67-S70 VanDerWaalsContact OG1-CB 3.26Å; T67-S70 WeakPolarHBondContact OG1-CB 3.26Å; T67-S70 PolarHBondContact OG1-N 2.96Å; T67-S70 VanDerWaalsContact OG1-N 3.11Å; T67-S70 PolarHBondContact OG1-OG 2.92Å; T67-A71 WeakPolarHBondContact O-CB 3.13Å; T67-A71 PolarHBondContact O-N 3.15Å; T67-E966 WeakPolarHBondContact CB-OE1 3.3Å; T67-E966 WeakPolarHBondContact CG2-OE1 3.42Å; T67-E966 PolarHBondContact OG1-OE1 3.38Å
68	S	88	Confident	85.5	Confident	82 Å²	82	24.1 Å²	24.1	57%	0.573	15%	0.146	S	C	*	.	H	α-helix	trans	-66.9	-28.2	176.7	68.2	0	0	0	0	113.5	R72	S68-R72 WeakPolarHBondContact O-CD 3.17Å; S68-R72 WeakPolarHBondContact O-CG 2.99Å; S68-R72 PolarHBondContact O-N 3.22Å
69	L	88.2	Confident	85.8	Confident	43 Å²	43	23.8 Å²	23.8	23%	0.225	14%	0.144	C	C	.	.	H	α-helix	trans	-75.2	-49.9	177.7	-70.4	173	0	0	0	110.7	T67 A71 R72 T73 E966	T67-L69 VanDerWaalsContact C-N 3.28Å; T67-L69 PolarHBondContact O-N 3.33Å; L69-A71 VanDerWaalsContact C-N 3.31Å; L69-A71 PolarHBondContact O-N 3.49Å; L69-R72 WeakPolarHBondContact O-CB 3.42Å; L69-R72 PolarHBondContact O-N 3.37Å; L69-T73 PolarHBondContact O-N 3.41Å; L69-T73 PolarHBondContact O-OG1 3.05Å; L69-E966 WeakPolarHBondContact CB-OE2 3.36Å; L69-E966 HydrophobicContact CD1-CB 4.5Å; L69-E966 HydrophobicContact CD1-CG 4.45Å
70	S	87.6	Confident	86.2	Confident	2 Å²	2	23 Å²	23	1%	0.014	14%	0.142	C	C	.	.	H	α-helix	trans	-56.6	-42.3	174.6	60.8	0	0	0	0	112.6	A64 G66 T67 R72 T73 Q74	A64-S70 WeakPolarHBondContact O-CB 3.47Å; G66-S70 PolarHBondContact N-OG 2.92Å; T67-S70 PolarHBondContact N-OG 3.09Å; T67-S70 PolarHBondContact O-OG 3Å; T67-S70 VanDerWaalsContact OG1-CB 3.26Å; T67-S70 WeakPolarHBondContact OG1-CB 3.26Å; T67-S70 PolarHBondContact OG1-N 2.96Å; T67-S70 VanDerWaalsContact OG1-N 3.11Å; T67-S70 PolarHBondContact OG1-OG 2.92Å; S70-R72 VanDerWaalsContact C-N 3.26Å; S70-R72 PolarHBondContact O-N 2.95Å; S70-T73 WeakPolarHBondContact CA-OG1 3.33Å; S70-T73 PolarHBondContact O-N 3.5Å; S70-T73 PolarHBondContact O-OG1 3.29Å; S70-Q74 WeakPolarHBondContact O-CB 3.44Å; S70-Q74 VanDerWaalsContact O-CG 3.28Å; S70-Q74 WeakPolarHBondContact O-CG 3.43Å; S70-Q74 PolarHBondContact O-N 2.94Å
71	A	88.6	Confident	86.2	Confident	12 Å²	12	26 Å²	26	10%	0.099	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-31.8	176.2	0	0	0	0	0	113.5	T67 L69 Q75 P755 Y756 D757	T67-A71 WeakPolarHBondContact O-CB 3.13Å; T67-A71 PolarHBondContact O-N 3.15Å; L69-A71 VanDerWaalsContact C-N 3.31Å; L69-A71 PolarHBondContact O-N 3.49Å; A71-Q75 WeakPolarHBondContact O-CG 3.39Å; A71-Q75 PolarHBondContact O-N 3.46Å; A71-P755 HydrophobicContact CB-CB 4.42Å; A71-Y756 PolarHBondContact O-N 3.32Å; A71-D757 HydrophobicContact CB-CB 4.17Å
72	R	90.5	Very high	86	Confident	59 Å²	59	30.1 Å²	30.1	22%	0.223	18%	0.18	C	C	.	.	H	α-helix	trans	-79.4	-41.2	176.9	-67.9	169.8	-173.5	-177.5	5.2	111.7	S68 L69 S70 F76 P755 F956 L957 V958	S68-R72 WeakPolarHBondContact O-CD 3.17Å; S68-R72 WeakPolarHBondContact O-CG 2.99Å; S68-R72 PolarHBondContact O-N 3.22Å; L69-R72 WeakPolarHBondContact O-CB 3.42Å; L69-R72 PolarHBondContact O-N 3.37Å; S70-R72 VanDerWaalsContact C-N 3.26Å; S70-R72 PolarHBondContact O-N 2.95Å; R72-F76 WeakPolarHBondContact O-CB 3.47Å; R72-F76 PolarHBondContact O-N 2.95Å; R72-P755 HydrophobicContact CG-CB 3.88Å; R72-F956 HydrophobicContact CB-CD2 3.67Å; R72-F956 HydrophobicContact CB-CE2 3.74Å; R72-F956 HydrophobicContact CG-CB 4.41Å; R72-F956 HydrophobicContact CG-CD2 3.55Å; R72-F956 HydrophobicContact CG-CE2 4.02Å; R72-F956 HydrophobicContact CG-CG 4.11Å; R72-L957 WeakPolarHBondContact CD-O 3.35Å; R72-V958 HydrophobicContact CB-CG2 3.64Å; R72-V958 WeakPolarHBondContact O-CG2 3.15Å
73	T	87.9	Confident	85.7	Confident	19 Å²	19	29.7 Å²	29.7	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-66.5	-41.1	177.8	56.1	0	0	0	0	111.2	L69 S70 F76 Q77 V958	L69-T73 PolarHBondContact O-N 3.41Å; L69-T73 PolarHBondContact O-OG1 3.05Å; S70-T73 WeakPolarHBondContact CA-OG1 3.33Å; S70-T73 PolarHBondContact O-N 3.5Å; S70-T73 PolarHBondContact O-OG1 3.29Å; T73-F76 WeakPolarHBondContact O-CB 3.43Å; T73-F76 PolarHBondContact O-N 3.42Å; T73-Q77 WeakPolarHBondContact O-CG 3.09Å; T73-Q77 PolarHBondContact O-N 3.18Å; T73-V958 HydrophobicContact CG2-CG1 4.03Å
74	Q	87.1	Confident	85.4	Confident	10 Å²	10	30.3 Å²	30.3	5%	0.047	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-45.7	177	-74.1	-57.3	-51.4	0	0	112.5	S70 F76 Q77 A78 R759	S70-Q74 WeakPolarHBondContact O-CB 3.44Å; S70-Q74 VanDerWaalsContact O-CG 3.28Å; S70-Q74 WeakPolarHBondContact O-CG 3.43Å; S70-Q74 PolarHBondContact O-N 2.94Å; Q74-F76 VanDerWaalsContact C-N 3.29Å; Q74-F76 PolarHBondContact O-N 2.95Å; Q74-Q77 PolarHBondContact O-N 3.49Å; Q74-A78 WeakPolarHBondContact O-CB 3.34Å; Q74-A78 PolarHBondContact O-N 3.35Å; Q74-R759 VanDerWaalsContact CG-CZ 3.49Å; Q74-R759 VanDerWaalsContact NE2-CZ 3.35Å; Q74-R759 VanDerWaalsContact NE2-NH1 3.17Å
75	Q	88.5	Confident	84.8	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-70.3	-27.5	177.2	-69.9	-69.5	-37.7	0	0	112.7	A71 L79 P753 K754 Y756 S772 K773	A71-Q75 WeakPolarHBondContact O-CG 3.39Å; A71-Q75 PolarHBondContact O-N 3.46Å; Q75-L79 VanDerWaalsContact O-CB 3.26Å; Q75-L79 WeakPolarHBondContact O-CB 3.22Å; Q75-L79 PolarHBondContact O-N 3.04Å; Q75-P753 HydrophobicContact CB-CB 4.24Å; Q75-K754 VanDerWaalsContact CG-O 3.3Å; Q75-K754 WeakPolarHBondContact CG-O 3.21Å; Q75-Y756 WeakPolarHBondContact CG-O 3.32Å; Q75-Y756 PolarHBondContact NE2-O 3.14Å; Q75-S772 PolarHBondContact NE2-OG 3.02Å; Q75-K773 PolarHBondContact NE2-O 3.15Å
76	F	88.8	Confident	84	Confident	12 Å²	12	31.3 Å²	31.3	5%	0.053	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-46.4	169	174.4	-116	0	0	0	111.8	R72 T73 Q74 L79 L80 N748 I750 I913 V958	R72-F76 WeakPolarHBondContact O-CB 3.47Å; R72-F76 PolarHBondContact O-N 2.95Å; T73-F76 WeakPolarHBondContact O-CB 3.43Å; T73-F76 PolarHBondContact O-N 3.42Å; Q74-F76 VanDerWaalsContact C-N 3.29Å; Q74-F76 PolarHBondContact O-N 2.95Å; F76-L79 WeakPolarHBondContact O-CB 2.99Å; F76-L79 PolarHBondContact O-N 3.39Å; F76-L80 HydrophobicContact CD1-CD1 4.32Å; F76-L80 HydrophobicContact CE1-CD1 3.73Å; F76-L80 HydrophobicContact CE2-CD1 4.16Å; F76-L80 HydrophobicContact CE2-CD2 4.3Å; F76-L80 HydrophobicContact CE2-CG 4.21Å; F76-L80 HydrophobicContact CZ-CD1 3.65Å; F76-L80 HydrophobicContact CZ-CD2 4.4Å; F76-L80 HydrophobicContact CZ-CG 4.2Å; F76-L80 WeakPolarHBondContact O-CG 3.24Å; F76-L80 PolarHBondContact O-N 3.41Å; F76-N748 WeakPolarHBondContact CE1-ND2 3.23Å; F76-N748 HydrophobicContact CE2-CB 4.25Å; F76-N748 HydrophobicContact CZ-CB 4.35Å; F76-N748 WeakPolarHBondContact CZ-ND2 3.27Å; F76-I750 HydrophobicContact CB-CD1 3.71Å; F76-I750 HydrophobicContact CD2-CD1 3.22Å; F76-I750 HydrophobicContact CD2-CG1 3.86Å; F76-I750 HydrophobicContact CE2-CD1 4.01Å; F76-I750 HydrophobicContact CE2-CG1 4.33Å; F76-I750 HydrophobicContact CG-CD1 3.67Å; F76-I913 HydrophobicContact CE2-CD1 4.03Å; F76-I913 HydrophobicContact CE2-CG1 4.42Å; F76-I913 HydrophobicContact CE2-CG2 4.12Å; F76-V958 HydrophobicContact CB-CG1 4.11Å; F76-V958 HydrophobicContact CB-CG2 4.14Å; F76-V958 HydrophobicContact CD1-CG1 3.9Å; F76-V958 HydrophobicContact CG-CG1 4.07Å
77	Q	86.2	Confident	83.1	Confident	50 Å²	50	31 Å²	31	23%	0.234	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-44.3	176.1	-71.8	175.3	-5.9	0	0	111.4	T73 Q74 L79 L80 T81	T73-Q77 WeakPolarHBondContact O-CG 3.09Å; T73-Q77 PolarHBondContact O-N 3.18Å; Q74-Q77 PolarHBondContact O-N 3.49Å; Q77-L79 VanDerWaalsContact C-N 3.31Å; Q77-L79 PolarHBondContact O-N 2.99Å; Q77-L80 WeakPolarHBondContact O-CB 3.38Å; Q77-L80 PolarHBondContact O-N 3.16Å; Q77-L80 VanDerWaalsContact O-N 3.1Å; Q77-T81 VanDerWaalsContact O-CG2 3.25Å; Q77-T81 WeakPolarHBondContact O-CG2 3.25Å; Q77-T81 PolarHBondContact O-N 3.31Å; Q77-T81 PolarHBondContact O-OG1 3.11Å
78	A	83.3	Confident	81.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-39.2	174.2	0	0	0	0	0	112.3	Q74 L80 T81 E82 S772 L774	Q74-A78 WeakPolarHBondContact O-CB 3.34Å; Q74-A78 PolarHBondContact O-N 3.35Å; A78-L80 VanDerWaalsContact C-N 3.35Å; A78-T81 WeakPolarHBondContact CA-OG1 3.3Å; A78-T81 PolarHBondContact O-N 2.9Å; A78-T81 PolarHBondContact O-OG1 3.49Å; A78-E82 WeakPolarHBondContact O-CB 3.37Å; A78-E82 PolarHBondContact O-N 3.33Å; A78-S772 WeakPolarHBondContact CB-O 3.08Å; A78-L774 HydrophobicContact CB-CB 4.45Å; A78-L774 HydrophobicContact CB-CD1 4.37Å
79	L	85	Confident	80	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-44.7	173.7	-176.9	70.6	0	0	0	110.3	Q75 F76 Q77 T81 T83 I750 P753 L774 R899 I913	Q75-L79 VanDerWaalsContact O-CB 3.26Å; Q75-L79 WeakPolarHBondContact O-CB 3.22Å; Q75-L79 PolarHBondContact O-N 3.04Å; F76-L79 WeakPolarHBondContact O-CB 2.99Å; F76-L79 PolarHBondContact O-N 3.39Å; Q77-L79 VanDerWaalsContact C-N 3.31Å; Q77-L79 PolarHBondContact O-N 2.99Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-T81 PolarHBondContact O-N 3.18Å; L79-T83 HydrophobicContact CD1-CG2 3.79Å; L79-T83 VanDerWaalsContact O-CB 3.31Å; L79-T83 WeakPolarHBondContact O-CB 3.15Å; L79-T83 WeakPolarHBondContact O-CG2 3.34Å; L79-T83 PolarHBondContact O-N 3.47Å; L79-T83 VanDerWaalsContact O-N 3.15Å; L79-T83 PolarHBondContact O-OG1 3.43Å; L79-I750 HydrophobicContact CD2-CG2 3.93Å; L79-P753 HydrophobicContact CD2-CG 4.29Å; L79-L774 HydrophobicContact CB-CD1 3.97Å; L79-L774 HydrophobicContact CD1-CD1 4.12Å; L79-L774 HydrophobicContact CD1-CD2 4.09Å; L79-R899 HydrophobicContact CD1-CB 4.35Å; L79-R899 HydrophobicContact CG-CG 4.42Å; L79-I913 HydrophobicContact CD2-CD1 3.9Å; L79-I913 HydrophobicContact CD2-CG1 3.89Å
80	L	84.1	Confident	78.2	Confident	41 Å²	41	46 Å²	46	22%	0.215	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-33.6	179.1	-66.6	178.3	0	0	0	113.4	F76 Q77 A78 M895 I913	F76-L80 HydrophobicContact CD1-CD1 4.32Å; F76-L80 HydrophobicContact CE1-CD1 3.73Å; F76-L80 HydrophobicContact CE2-CD1 4.16Å; F76-L80 HydrophobicContact CE2-CD2 4.3Å; F76-L80 HydrophobicContact CE2-CG 4.21Å; F76-L80 HydrophobicContact CZ-CD1 3.65Å; F76-L80 HydrophobicContact CZ-CD2 4.4Å; F76-L80 HydrophobicContact CZ-CG 4.2Å; F76-L80 WeakPolarHBondContact O-CG 3.24Å; F76-L80 PolarHBondContact O-N 3.41Å; Q77-L80 WeakPolarHBondContact O-CB 3.38Å; Q77-L80 PolarHBondContact O-N 3.16Å; Q77-L80 VanDerWaalsContact O-N 3.1Å; A78-L80 VanDerWaalsContact C-N 3.35Å; L80-M895 HydrophobicContact CD1-SD 4.44Å; L80-I913 HydrophobicContact CD2-CD1 3.84Å
81	T	79.5	Confident	76.1	Confident	73 Å²	73	51.8 Å²	51.8	45%	0.448	26%	0.262	S	S	.	.	H	α-helix	trans	-86.9	-37.4	-174.5	58.1	0	0	0	0	112.7	Q77 A78 L79 H771	Q77-T81 VanDerWaalsContact O-CG2 3.25Å; Q77-T81 WeakPolarHBondContact O-CG2 3.25Å; Q77-T81 PolarHBondContact O-N 3.31Å; Q77-T81 PolarHBondContact O-OG1 3.11Å; A78-T81 WeakPolarHBondContact CA-OG1 3.3Å; A78-T81 PolarHBondContact O-N 2.9Å; A78-T81 PolarHBondContact O-OG1 3.49Å; L79-T81 VanDerWaalsContact C-N 3.34Å; L79-T81 PolarHBondContact O-N 3.18Å; T81-H771 WeakPolarHBondContact CG2-NE2 3.47Å
82	E	77.1	Confident	73.7	Confident	90 Å²	90	60.9 Å²	60.9	42%	0.421	30%	0.3	S	S	.	.	H	α-helix	trans	-88.8	-15.2	-179.4	-64.7	-170.6	-159.8	0	0	113.7	A78 K773 L774	A78-E82 WeakPolarHBondContact O-CB 3.37Å; A78-E82 PolarHBondContact O-N 3.33Å; E82-K773 WeakPolarHBondContact OE1-CA 3.1Å; E82-L774 HydrophobicContact CB-CB 4.42Å; E82-L774 HydrophobicContact CB-CD2 4.42Å; E82-L774 HydrophobicContact CG-CB 4.42Å; E82-L774 PolarHBondContact OE1-N 3.45Å; E82-L774 WeakPolarHBondContact OE2-CB 3.17Å
83	T	78.3	Confident	71.1	Confident	8 Å²	8	62 Å²	62	5%	0.049	32%	0.317	C	S	.	.			trans	-121.1	144.6	-178.4	76.8	0	0	0	0	113	L79 L774 R899 F900 I901	L79-T83 HydrophobicContact CD1-CG2 3.79Å; L79-T83 VanDerWaalsContact O-CB 3.31Å; L79-T83 WeakPolarHBondContact O-CB 3.15Å; L79-T83 WeakPolarHBondContact O-CG2 3.34Å; L79-T83 PolarHBondContact O-N 3.47Å; L79-T83 VanDerWaalsContact O-N 3.15Å; L79-T83 PolarHBondContact O-OG1 3.43Å; T83-L774 HydrophobicContact CG2-CD2 3.79Å; T83-R899 PolarHBondContact O-NH1 2.99Å; T83-R899 WeakPolarHBondContact OG1-CB 3.44Å; T83-R899 WeakPolarHBondContact OG1-CD 3.45Å; T83-R899 WeakPolarHBondContact OG1-CG 3.49Å; T83-F900 WeakPolarHBondContact CA-O 3.04Å; T83-F900 WeakPolarHBondContact CB-O 3.32Å; T83-I901 HydrophobicContact CG2-CG1 3.79Å
84	S	77.5	Confident	68.5	Low	24 Å²	24	68.8 Å²	68.8	17%	0.168	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-101.3	154.4	172.3	52.6	0	0	0	0	111.2	S86 F900	S84-S86 VanDerWaalsContact C-N 3.27Å; S84-S86 WeakPolarHBondContact CB-O 3.41Å; S84-S86 PolarHBondContact OG-O 3.3Å; S84-F900 PolarHBondContact N-O 3.32Å; S84-F900 PolarHBondContact O-N 3.25Å
85	S	74.7	Confident	65.8	Low	29 Å²	29	74.7 Å²	74.7	20%	0.203	38%	0.383	C	S	.	.	S	Bend	trans	-76.8	-13.3	171.3	51.2	0	0	0	0	112.6	I886 N890	S85-I886 WeakPolarHBondContact O-CG2 3.27Å; S85-N890 WeakPolarHBondContact CB-OD1 3.37Å; S85-N890 PolarHBondContact O-ND2 2.96Å; S85-N890 PolarHBondContact OG-OD1 3.41Å
86	S	70.7	Confident	63	Low	10 Å²	10	80.7 Å²	80.7	7%	0.07	42%	0.42	C	S	.	.	S	Bend	trans	-119.4	144.9	172	59.8	0	0	0	0	111.2	S84 E88 Y89 N890	S84-S86 VanDerWaalsContact C-N 3.27Å; S84-S86 WeakPolarHBondContact CB-O 3.41Å; S84-S86 PolarHBondContact OG-O 3.3Å; S86-E88 VanDerWaalsContact C-N 3.27Å; S86-E88 PolarHBondContact O-N 3.19Å; S86-Y89 VanDerWaalsContact OG-CB 3.27Å; S86-Y89 WeakPolarHBondContact OG-CB 3.18Å; S86-Y89 WeakPolarHBondContact OG-CD2 3.37Å; S86-N890 WeakPolarHBondContact CB-ND2 3.42Å
87	P	64.9	Low	60.1	Low	63 Å²	63	91.3 Å²	91.3	41%	0.409	46%	0.46	S	S	.	.	S	Bend	trans	-70.8	-17.8	174.8	25.4	-31.1	0	0	0	113.7
88	E	61.1	Low	57.5	Low	154 Å²	154	95.4 Å²	95.4	72%	0.72	48%	0.484	S	S	*	.	S	Bend	trans	-105.5	-12.1	-167.3	-65.7	-176.8	176.9	0	0	116.3	S86 F90 T91	S86-E88 VanDerWaalsContact C-N 3.27Å; S86-E88 PolarHBondContact O-N 3.19Å; E88-F90 PolarHBondContact O-N 3.01Å; E88-F90 VanDerWaalsContact O-N 3.12Å; E88-T91 PolarHBondContact O-N 2.73Å; E88-T91 PolarHBondContact O-OG1 3.35Å; E88-T91 VanDerWaalsContact O-OG1 3.13Å
89	Y	51.4	Low	54.9	Low	179 Å²	179	104.4 Å²	104.4	70%	0.702	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.6	-160.2	-113.8	-104.6	0	0	0	117.9	S86	S86-Y89 VanDerWaalsContact OG-CB 3.27Å; S86-Y89 WeakPolarHBondContact OG-CB 3.18Å; S86-Y89 WeakPolarHBondContact OG-CD2 3.37Å
90	F	48.8	Very low	52.2	Low	131 Å²	131	113.2 Å²	113.2	58%	0.575	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-5	-178.9	-83.9	-79.3	0	0	0	114.9	E88 K92 H902	E88-F90 PolarHBondContact O-N 3.01Å; E88-F90 VanDerWaalsContact O-N 3.12Å; F90-K92 VanDerWaalsContact C-N 3.28Å; F90-K92 PolarHBondContact O-N 3.16Å; F90-H902 VanDerWaalsContact CB-CD2 3.49Å; F90-H902 WeakPolarHBondContact CB-CD2 3.21Å; F90-H902 WeakPolarHBondContact CB-NE2 3.43Å; F90-H902 AromaticContact CG-CD2 3.96Å
91	T	43.4	Very low	49.6	Very low	124 Å²	124	121.8 Å²	121.8	76%	0.761	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-0.2	-178.6	59.3	0	0	0	0	114.3	E88	E88-T91 PolarHBondContact O-N 2.73Å; E88-T91 PolarHBondContact O-OG1 3.35Å; E88-T91 VanDerWaalsContact O-OG1 3.13Å
92	K	38.2	Very low	47.2	Very low	203 Å²	203	121.3 Å²	121.3	88%	0.883	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	0.1	-175.4	-98.6	177.2	180	171.5	0	117.7	F90	F90-K92 VanDerWaalsContact C-N 3.28Å; F90-K92 PolarHBondContact O-N 3.16Å
93	S	36	Very low	44.9	Very low	83 Å²	83	121.6 Å²	121.6	58%	0.58	62%	0.621	S	S	*	*			trans	-129.3	94.9	174.7	60.2	0	0	0	0	111.7	L95	S93-L95 PolarHBondContact O-N 3.23Å
94	N	34.1	Very low	42.5	Very low	160 Å²	160	128 Å²	128	86%	0.856	66%	0.655	S	S	*	*			trans	-58.6	105.7	158.2	-82.1	-22.9	0	0	0	108.8
95	L	30.6	Very low	40.1	Very low	135 Å²	135	130.1 Å²	130.1	71%	0.707	67%	0.67	S	S	*	*			trans	28.3	103.5	141.9	-66.7	159.9	0	0	0	117.1	S93	S93-L95 PolarHBondContact O-N 3.23Å
96	T	29.1	Very low	37.9	Very low	126 Å²	126	133.5 Å²	133.5	77%	0.773	70%	0.7	S	S	*	*			trans	-129.5	85.7	139.5	52.5	0	0	0	0	108.5	N98	T96-N98 VanDerWaalsContact C-N 3.26Å; T96-N98 PolarHBondContact O-N 3.11Å; T96-N98 VanDerWaalsContact O-N 3.11Å
97	W	28.8	Very low	35.8	Very low	234 Å²	234	141.4 Å²	141.4	89%	0.886	74%	0.736	S	S	*	*			trans	-75.8	82.3	161.5	-82.8	86.9	0	0	0	108.3
98	N	31.4	Very low	34.1	Very low	137 Å²	137	143.4 Å²	143.4	73%	0.733	75%	0.746	S	S	*	*			trans	-105.7	100.8	161.5	-74.3	-17.6	0	0	0	105.6	T96	T96-N98 VanDerWaalsContact C-N 3.26Å; T96-N98 PolarHBondContact O-N 3.11Å; T96-N98 VanDerWaalsContact O-N 3.11Å
99	K	29.2	Very low	32.5	Very low	189 Å²	189	142.3 Å²	142.3	82%	0.822	74%	0.742	S	S	*	*				57.3	119.3	104.3	-85.2	-175.1	174.8	-178.4	0	112.9
100	E	28.6	Very low	31.4	Very low	184 Å²	184	139.5 Å²	139.5	86%	0.86	74%	0.739	S	S	*	*			trans	83.7	71.3	169.2	-58	171.5	-171	0	0	116.2
101	F	29.4	Very low	30.6	Very low	221 Å²	221	137.8 Å²	137.8	97%	0.969	73%	0.732	S	S	*	*			trans	-102.6	93.6	144	-96.5	-84.5	0	0	0	107.3
102	G	29.4	Very low	29.9	Very low	64 Å²	64	134.9 Å²	134.9	66%	0.66	72%	0.721	S	S	*	*			trans	-63.6	142.7	175	0	0	0	0	0	111.4	N104	G102-N104 PolarHBondContact O-N 2.97Å
103	S	27.3	Very low	29.5	Very low	95 Å²	95	127.4 Å²	127.4	66%	0.664	69%	0.688	S	S	*	*			trans	-35.5	113.2	166.1	51.3	0	0	0	0	113.3
104	N	28.1	Very low	29	Very low	142 Å²	142	127.7 Å²	127.7	76%	0.759	68%	0.683	S	S	*	*			trans	-153.2	87.2	151.5	-90.8	-17.8	0	0	0	107.3	G102 A106	G102-N104 PolarHBondContact O-N 2.97Å; N104-A106 PolarHBondContact O-N 2.86Å
105	S	27.3	Very low	28.7	Very low	69 Å²	69	127.3 Å²	127.3	48%	0.483	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.6	106	173.3	45.5	0	0	0	0	110.7	N57	N57-S105 PolarHBondContact ND2-OG 3.16Å
106	A	27.4	Very low	28.6	Very low	100 Å²	100	128.8 Å²	128.8	83%	0.826	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	162.1	5.2	150.8	0	0	0	0	0	112.9	N104 V108	N104-A106 PolarHBondContact O-N 2.86Å; A106-V108 PolarHBondContact O-N 3.11Å
107	E	27	Very low	28.6	Very low	176 Å²	176	130.5 Å²	130.5	82%	0.822	67%	0.674	S	S	*	*			trans	-91.7	87.4	170.7	-69.2	-170.2	160.4	0	0	109.9	E109	E107-E109 VanDerWaalsContact C-N 3.31Å; E107-E109 PolarHBondContact O-N 3.05Å
108	V	29.5	Very low	28.6	Very low	105 Å²	105	124.1 Å²	124.1	64%	0.636	66%	0.661	S	S	*	*			trans	-58.3	106.6	153.3	173.3	0	0	0	0	105.4	A106 N110	A106-V108 PolarHBondContact O-N 3.11Å; V108-N110 VanDerWaalsContact C-N 3.3Å; V108-N110 PolarHBondContact O-N 3.25Å
109	E	26.9	Very low	28.5	Very low	132 Å²	132	122.7 Å²	122.7	62%	0.617	67%	0.668	S	S	*	*			trans	-51.7	95.7	173.7	-74.8	-174.9	126.2	0	0	109.4	E107 H111	E107-E109 VanDerWaalsContact C-N 3.31Å; E107-E109 PolarHBondContact O-N 3.05Å; E109-H111 PolarHBondContact O-N 3.07Å; E109-H111 IonicContact OE1-CE1 3.18Å; E109-H111 PolarHBondContact OE1-CE1 3.47Å; E109-H111 IonicContact OE1-NE2 2.85Å; E109-H111 IonicContact OE2-CE1 2.78Å; E109-H111 IonicContact OE2-NE2 3.5Å
110	N	30.3	Very low	28.7	Very low	120 Å²	120	119 Å²	119	64%	0.642	66%	0.657	S	S	*	*			trans	-67.8	82.3	152.5	-81.7	-22.5	0	0	0	105.8	V108 A112	V108-N110 VanDerWaalsContact C-N 3.3Å; V108-N110 PolarHBondContact O-N 3.25Å; N110-A112 PolarHBondContact O-N 3.43Å
111	H	30.5	Very low	28.9	Very low	94 Å²	94	116 Å²	116	44%	0.435	65%	0.646	S	S	.	*			trans	-62.9	85.4	156.2	-82.5	-9.1	0	0	0	107.5	E109 F113 K147	E109-H111 PolarHBondContact O-N 3.07Å; E109-H111 IonicContact OE1-CE1 3.18Å; E109-H111 PolarHBondContact OE1-CE1 3.47Å; E109-H111 IonicContact OE1-NE2 2.85Å; E109-H111 IonicContact OE2-CE1 2.78Å; E109-H111 IonicContact OE2-NE2 3.5Å; H111-F113 PolarHBondContact O-N 3.43Å; H111-K147 PolarHBondContact ND1-NZ 3.36Å
112	A	29.2	Very low	29	Very low	63 Å²	63	116.9 Å²	116.9	52%	0.521	64%	0.643	S	S	.	*			trans	-58.2	126.2	174	0	0	0	0	0	109	N110	N110-A112 PolarHBondContact O-N 3.43Å
113	F	30	Very low	29.3	Very low	47 Å²	47	120.8 Å²	120.8	21%	0.206	64%	0.642	C	S	.	*			trans	-69.4	126.5	-174.4	-64.2	-49.3	0	0	0	111.9	H111 F115 P828 Y892 G893 Y894	H111-F113 PolarHBondContact O-N 3.43Å; F113-F115 PolarHBondContact O-N 3.02Å; F113-P828 HydrophobicContact CD2-CB 4.37Å; F113-P828 HydrophobicContact CD2-CG 4.35Å; F113-P828 HydrophobicContact CE2-CG 4.22Å; F113-Y892 VanDerWaalsContact CD1-C 3.45Å; F113-Y892 WeakPolarHBondContact CD1-O 3.48Å; F113-Y892 WeakPolarHBondContact CE1-O 3.44Å; F113-Y892 WeakPolarHBondContact CG-O 3.29Å; F113-G893 WeakPolarHBondContact CE1-O 3.22Å; F113-G893 WeakPolarHBondContact CZ-O 3.38Å; F113-Y894 HydrophobicContact CD2-CD1 4.25Å; F113-Y894 HydrophobicContact CD2-CE1 4.03Å; F113-Y894 AromaticContact CE2-CD1 3.65Å; F113-Y894 HydrophobicContact CE2-CD1 3.65Å; F113-Y894 AromaticContact CE2-CE1 3.84Å; F113-Y894 HydrophobicContact CE2-CE1 3.84Å; F113-Y894 AromaticContact CZ-CD1 3.95Å; F113-Y894 HydrophobicContact CZ-CD1 3.95Å
114	N	25.6	Very low	29.9	Very low	88 Å²	88	127.1 Å²	127.1	47%	0.471	65%	0.652	S	S	.	*			trans	-67.1	94.3	171.3	-84.4	-21.5	0	0	0	109.1	H116	N114-H116 PolarHBondContact O-N 3.03Å
115	F	28.3	Very low	30.8	Very low	153 Å²	153	126.6 Å²	126.6	67%	0.671	64%	0.639	S	S	*	*			trans	-67.1	113.6	157.9	-100.7	-84.4	0	0	0	108.1	F113 K117	F113-F115 PolarHBondContact O-N 3.02Å; F115-K117 PolarHBondContact O-N 3.33Å
116	H	27.3	Very low	31.8	Very low	166 Å²	166	128.5 Å²	128.5	77%	0.769	64%	0.644	S	S	*	*			trans	-60.9	83.1	168.3	-117.7	-66.9	0	0	0	109.4	N114 T118	N114-H116 PolarHBondContact O-N 3.03Å; H116-T118 PolarHBondContact O-N 3.47Å
117	K	30	Very low	32.9	Very low	161 Å²	161	132 Å²	132	70%	0.7	64%	0.64	S	S	*	*			trans	-87.5	96.6	159.5	-112.8	-173.6	170.1	-159.3	0	107.4	F115 A119 D121	F115-K117 PolarHBondContact O-N 3.33Å; K117-A119 PolarHBondContact O-N 3.36Å; K117-D121 IonicContact NZ-OD2 3.51Å; K117-D121 PolarHBondContact NZ-OD2 3.32Å
118	T	28.6	Very low	34.2	Very low	100 Å²	100	128.4 Å²	128.4	61%	0.613	63%	0.627	S	S	*	*			trans	-44.1	109.6	165.6	46.4	0	0	0	0	110.7	H116 I120	H116-T118 PolarHBondContact O-N 3.47Å; T118-I120 PolarHBondContact O-N 3.49Å
119	A	29.4	Very low	35.7	Very low	107 Å²	107	124.4 Å²	124.4	88%	0.884	60%	0.603	S	S	*	*	S	Bend	trans	33.5	11.8	140	0	0	0	0	0	122.4	K117	K117-A119 PolarHBondContact O-N 3.36Å
120	I	32.2	Very low	37.4	Very low	113 Å²	113	119 Å²	119	58%	0.579	58%	0.578	S	S	*	*			trans	-107.5	-14.4	-169.7	-63	174.6	0	0	0	113	T118 R122 F123	T118-I120 PolarHBondContact O-N 3.49Å; I120-R122 VanDerWaalsContact C-N 3.27Å; I120-R122 PolarHBondContact O-N 3.04Å; I120-F123 HydrophobicContact CG2-CE2 4.48Å; I120-F123 WeakPolarHBondContact O-CD2 3.47Å; I120-F123 WeakPolarHBondContact O-CE2 3.39Å
121	D	32.9	Very low	39.2	Very low	121 Å²	121	118.5 Å²	118.5	65%	0.647	57%	0.568	S	S	*	*			trans	-84.4	27.2	-173.5	-73.4	-16.3	0	0	0	115.3	K117 F123	K117-D121 IonicContact NZ-OD2 3.51Å; K117-D121 PolarHBondContact NZ-OD2 3.32Å; D121-F123 PolarHBondContact O-N 3.19Å
122	R	32.9	Very low	41.2	Very low	239 Å²	239	114.7 Å²	114.7	90%	0.902	55%	0.55	S	S	*	.			trans	-90.7	69.1	168.3	-77.3	-172	-167.7	157.2	4.5	111.2	I120	I120-R122 VanDerWaalsContact C-N 3.27Å; I120-R122 PolarHBondContact O-N 3.04Å
123	F	34.9	Very low	43.2	Very low	145 Å²	145	113.3 Å²	113.3	64%	0.636	53%	0.533	S	S	*	.			trans	-117.7	161.6	165.7	-69.1	-77.9	0	0	0	110.2	I120 D121 Y308	I120-F123 HydrophobicContact CG2-CE2 4.48Å; I120-F123 WeakPolarHBondContact O-CD2 3.47Å; I120-F123 WeakPolarHBondContact O-CE2 3.39Å; D121-F123 PolarHBondContact O-N 3.19Å; F123-Y308 HydrophobicContact CB-CD2 3.67Å; F123-Y308 HydrophobicContact CB-CE2 3.44Å; F123-Y308 VanDerWaalsContact CB-CE2 3.44Å; F123-Y308 WeakPolarHBondContact O-CE2 3.35Å; F123-Y308 VanDerWaalsContact O-CZ 3.3Å; F123-Y308 PolarHBondContact O-OH 3.06Å
124	R	39.8	Very low	45.2	Very low	229 Å²	229	116.7 Å²	116.7	86%	0.864	54%	0.544	S	S	*	.			trans	-94.5	87.9	-139.1	-163.6	-174.7	-149.4	168.5	4.8	119.7	Y308	R124-Y308 VanDerWaalsContact CA-CZ 3.44Å; R124-Y308 WeakPolarHBondContact CA-OH 3.35Å; R124-Y308 HydrophobicContact CB-CE1 4.4Å; R124-Y308 PolarHBondContact N-OH 3.26Å; R124-Y308 VanDerWaalsContact N-OH 3.11Å; R124-Y308 VanDerWaalsContact O-CD1 3.23Å; R124-Y308 WeakPolarHBondContact O-CD1 3.49Å; R124-Y308 WeakPolarHBondContact O-CE1 3.24Å; R124-Y308 VanDerWaalsContact O-CZ 3.3Å
125	R	46.4	Very low	47.8	Very low	131 Å²	131	113.4 Å²	113.4	49%	0.494	53%	0.526	S	S	.	.			trans	-58.1	147.1	-156.1	-69.5	-174.8	-157	162.2	6.4	117.2	K127 D130 E133 Y308	R125-K127 PolarHBondContact O-N 3.48Å; R125-D130 WeakPolarHBondContact CB-OD1 3.49Å; R125-D130 WeakPolarHBondContact CD-OD1 3.29Å; R125-E133 IonicContact NH1-OE2 2.69Å; R125-Y308 VanDerWaalsContact CA-CZ 3.5Å; R125-Y308 WeakPolarHBondContact CA-OH 3.32Å; R125-Y308 WeakPolarHBondContact CB-OH 3.5Å; R125-Y308 WeakPolarHBondContact CG-OH 3.34Å; R125-Y308 VanDerWaalsContact N-CE1 3.33Å; R125-Y308 VanDerWaalsContact N-CZ 3.26Å; R125-Y308 PolarHBondContact N-OH 3.01Å
126	N	49.7	Very low	50.2	Low	108 Å²	108	106.1 Å²	106.1	58%	0.578	49%	0.494	S	S	*	.			trans	-68.2	126.3	173.3	-162.1	-1.9	0	0	0	109.9	N128 V129 D130	N126-N128 PolarHBondContact O-N 3.25Å; N126-N128 VanDerWaalsContact O-N 3.12Å; N126-V129 HydrophobicContact CB-CG2 4.32Å; N126-V129 PolarHBondContact O-N 3.49Å; N126-V129 VanDerWaalsContact O-N 3.15Å; N126-D130 PolarHBondContact O-N 3.25Å
127	K	50.5	Low	52.7	Low	174 Å²	174	99.1 Å²	99.1	76%	0.757	46%	0.464	S	S	*	.	H	α-helix	trans	-57.7	-30.8	-171.2	-76.5	-178.3	178.3	177.3	0	113.8	R125 D130 Y131	R125-K127 PolarHBondContact O-N 3.48Å; K127-D130 WeakPolarHBondContact O-CB 3.35Å; K127-Y131 PolarHBondContact O-N 2.98Å
128	N	54.3	Low	54.7	Low	100 Å²	100	92.4 Å²	92.4	54%	0.535	44%	0.435	S	S	.	.	H	α-helix	trans	-72.8	-37.9	-178.8	-65.1	-2.5	0	0	0	112.2	N126 Y131 F132	N126-N128 PolarHBondContact O-N 3.25Å; N126-N128 VanDerWaalsContact O-N 3.12Å; N128-Y131 WeakPolarHBondContact O-CB 3.38Å; N128-Y131 PolarHBondContact O-N 3.35Å; N128-F132 HydrophobicContact CB-CE2 4.44Å; N128-F132 WeakPolarHBondContact O-CD2 3.47Å; N128-F132 WeakPolarHBondContact O-CE2 3.47Å; N128-F132 PolarHBondContact O-N 3.33Å
129	V	59.6	Low	56.5	Low	22 Å²	22	92.6 Å²	92.6	13%	0.133	43%	0.429	C	S	.	.	H	α-helix	trans	-66.3	-43.4	175.8	-178.5	0	0	0	0	110.1	N126 Y131 F132 E133	N126-V129 HydrophobicContact CB-CG2 4.32Å; N126-V129 PolarHBondContact O-N 3.49Å; N126-V129 VanDerWaalsContact O-N 3.15Å; V129-Y131 PolarHBondContact O-N 3.02Å; V129-F132 PolarHBondContact O-N 3.32Å; V129-E133 HydrophobicContact CG1-CG 4.49Å; V129-E133 WeakPolarHBondContact O-CG 3.45Å; V129-E133 PolarHBondContact O-N 2.92Å; V129-E133 VanDerWaalsContact O-N 3.12Å
130	D	63.5	Low	57.6	Low	19 Å²	19	91.2 Å²	91.2	10%	0.102	40%	0.404	C	S	.	.	H	α-helix	trans	-58.6	-26.4	175	-110.3	41.4	0	0	0	113.2	R125 N126 K127 R134 K230	R125-D130 WeakPolarHBondContact CB-OD1 3.49Å; R125-D130 WeakPolarHBondContact CD-OD1 3.29Å; N126-D130 PolarHBondContact O-N 3.25Å; K127-D130 WeakPolarHBondContact O-CB 3.35Å; D130-R134 WeakPolarHBondContact O-CG 3.49Å; D130-R134 PolarHBondContact O-NE 2.95Å; D130-R134 IonicContact OD2-NH2 3.7Å; D130-K230 IonicContact OD2-NZ 3Å; D130-K230 PolarHBondContact OD2-NZ 3.13Å
131	Y	68.6	Low	58.1	Low	108 Å²	108	89.7 Å²	89.7	42%	0.424	40%	0.4	S	S	.	.	H	α-helix	trans	-75.2	-53.1	176.8	175.9	-95.8	0	0	0	111	K127 N128 V129 E133 R134 E135	K127-Y131 PolarHBondContact O-N 2.98Å; N128-Y131 WeakPolarHBondContact O-CB 3.38Å; N128-Y131 PolarHBondContact O-N 3.35Å; V129-Y131 PolarHBondContact O-N 3.02Å; Y131-E133 VanDerWaalsContact C-N 3.31Å; Y131-E133 PolarHBondContact O-N 3.3Å; Y131-R134 PolarHBondContact O-N 3.44Å; Y131-R134 VanDerWaalsContact O-N 3.13Å; Y131-E135 VanDerWaalsContact CE1-OE2 3.26Å; Y131-E135 WeakPolarHBondContact CE1-OE2 3.32Å; Y131-E135 PolarHBondContact O-N 3Å
132	F	72.1	Confident	58.4	Low	14 Å²	14	87.6 Å²	87.6	6%	0.061	40%	0.4	C	S	.	.	H	α-helix	trans	-61.7	-39	-178.8	-56.9	-55.1	0	0	0	112.3	N128 V129 R134 E135 Y136 S266 P328 L329	N128-F132 HydrophobicContact CB-CE2 4.44Å; N128-F132 WeakPolarHBondContact O-CD2 3.47Å; N128-F132 WeakPolarHBondContact O-CE2 3.47Å; N128-F132 PolarHBondContact O-N 3.33Å; V129-F132 PolarHBondContact O-N 3.32Å; F132-R134 VanDerWaalsContact C-N 3.27Å; F132-R134 PolarHBondContact O-N 3.15Å; F132-E135 PolarHBondContact O-N 3.48Å; F132-Y136 WeakPolarHBondContact O-CD2 3.26Å; F132-Y136 PolarHBondContact O-N 3.33Å; F132-Y136 VanDerWaalsContact O-N 3.09Å; F132-S266 WeakPolarHBondContact CD1-OG 3.31Å; F132-S266 WeakPolarHBondContact CE1-OG 3.27Å; F132-P328 HydrophobicContact CD2-CG 3.97Å; F132-P328 HydrophobicContact CE2-CG 4.36Å; F132-L329 HydrophobicContact CB-CD2 4.31Å; F132-L329 HydrophobicContact CB-CG 4.47Å; F132-L329 HydrophobicContact CD1-CD1 3.77Å; F132-L329 HydrophobicContact CD1-CG 4.45Å; F132-L329 HydrophobicContact CE1-CD1 4.16Å; F132-L329 HydrophobicContact CG-CD1 4.15Å; F132-L329 HydrophobicContact CG-CG 4.33Å
133	E	70.7	Confident	58.6	Low	35 Å²	35	83.2 Å²	83.2	16%	0.164	39%	0.394	C	S	.	.	H	α-helix	trans	-63.8	-33.8	178.1	-71.2	179	176.2	0	0	112.7	R125 V129 Y131 C137 L138 R302	R125-E133 IonicContact NH1-OE2 2.69Å; V129-E133 HydrophobicContact CG1-CG 4.49Å; V129-E133 WeakPolarHBondContact O-CG 3.45Å; V129-E133 PolarHBondContact O-N 2.92Å; V129-E133 VanDerWaalsContact O-N 3.12Å; Y131-E133 VanDerWaalsContact C-N 3.31Å; Y131-E133 PolarHBondContact O-N 3.3Å; E133-C137 VanDerWaalsContact O-CA 3.31Å; E133-C137 WeakPolarHBondContact O-CA 3.47Å; E133-C137 PolarHBondContact O-N 3.49Å; E133-C137 VanDerWaalsContact O-N 3.13Å; E133-L138 HydrophobicContact CB-CB 4.34Å; E133-L138 HydrophobicContact CG-CB 4.19Å; E133-L138 HydrophobicContact CG-CD1 4.33Å; E133-L138 PolarHBondContact O-N 3.18Å; E133-R302 IonicContact OE1-NH2 3.9Å; E133-R302 PolarHBondContact OE1-NH2 3.44Å
134	R	72.7	Confident	58.5	Low	117 Å²	117	84.7 Å²	84.7	44%	0.442	40%	0.403	S	S	.	.	H	α-helix	trans	-79.4	-34.4	174.8	-77.6	-176.8	-84.6	177.5	-6.2	113	D130 Y131 F132	D130-R134 WeakPolarHBondContact O-CG 3.49Å; D130-R134 PolarHBondContact O-NE 2.95Å; D130-R134 IonicContact OD2-NH2 3.7Å; Y131-R134 PolarHBondContact O-N 3.44Å; Y131-R134 VanDerWaalsContact O-N 3.13Å; F132-R134 VanDerWaalsContact C-N 3.27Å; F132-R134 PolarHBondContact O-N 3.15Å
135	E	79.3	Confident	57.9	Low	20 Å²	20	82.4 Å²	82.4	9%	0.093	41%	0.405	C	S	.	.	H	α-helix	trans	-67.8	-45	-178.9	-170.6	-178.5	-172.4	0	0	112	Y131 F132 K227 S256 S266	Y131-E135 VanDerWaalsContact CE1-OE2 3.26Å; Y131-E135 WeakPolarHBondContact CE1-OE2 3.32Å; Y131-E135 PolarHBondContact O-N 3Å; F132-E135 PolarHBondContact O-N 3.48Å; E135-K227 VanDerWaalsContact O-CE 3.29Å; E135-K227 WeakPolarHBondContact O-CE 3.23Å; E135-S256 PolarHBondContact O-N 2.87Å; E135-S256 VanDerWaalsContact O-N 3.11Å; E135-S266 PolarHBondContact OE2-OG 3.23Å
136	Y	80	Confident	57.3	Low	0 Å²	0	82.1 Å²	82.1	0%	0	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	2.4	-176.2	-66	-74.6	0	0	0	113.9	F132 W258 S262 M263 S266 L329	F132-Y136 WeakPolarHBondContact O-CD2 3.26Å; F132-Y136 PolarHBondContact O-N 3.33Å; F132-Y136 VanDerWaalsContact O-N 3.09Å; Y136-W258 AromaticContact CD1-CD1 3.61Å; Y136-W258 HydrophobicContact CD1-CG 4.4Å; Y136-W258 PolarHBondContact O-NE1 2.8Å; Y136-S262 VanDerWaalsContact OH-C 3.24Å; Y136-S262 PolarHBondContact OH-O 3.14Å; Y136-M263 HydrophobicContact CD1-CE 4.08Å; Y136-M263 HydrophobicContact CE1-CE 4.21Å; Y136-M263 HydrophobicContact CE1-CG 3.95Å; Y136-M263 HydrophobicContact CG-CE 4.49Å; Y136-M263 PolarHBondContact OH-N 2.93Å; Y136-S266 WeakPolarHBondContact OH-CB 3.44Å; Y136-L329 HydrophobicContact CD2-CD2 4.11Å; Y136-L329 HydrophobicContact CE2-CD1 3.99Å; Y136-L329 HydrophobicContact CE2-CD2 4.28Å
137	C	78.5	Confident	56.5	Low	19 Å²	19	82.6 Å²	82.6	13%	0.128	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	55.4	178.8	-60.3	0	0	0	0	112.3	E133 Q139 Y159 C255	E133-C137 VanDerWaalsContact O-CA 3.31Å; E133-C137 WeakPolarHBondContact O-CA 3.47Å; E133-C137 PolarHBondContact O-N 3.49Å; E133-C137 VanDerWaalsContact O-N 3.13Å; C137-Q139 VanDerWaalsContact C-N 3.31Å; C137-Y159 WeakPolarHBondContact CB-OH 3.22Å; C137-Y159 PolarHBondContact O-OH 2.84Å; C137-C255 HydrophobicContact CB-CB 3.83Å; C137-C255 WeakPolarHBondContact CB-SG 3.26Å; C137-C255 WeakPolarHBondContact SG-CB 3.08Å; C137-C255 CovalentContact SG-SG 2.01Å; C137-C255 PolarHBondContact SG-SG 3.32Å
138	L	72.9	Confident	55.9	Low	20 Å²	20	78.9 Å²	78.9	11%	0.105	41%	0.408	C	S	.	.			trans	-86.3	-1.2	178.8	-61.6	170.9	0	0	0	112.8	E133 L152 I155 W258 I332	E133-L138 HydrophobicContact CB-CB 4.34Å; E133-L138 HydrophobicContact CG-CB 4.19Å; E133-L138 HydrophobicContact CG-CD1 4.33Å; E133-L138 PolarHBondContact O-N 3.18Å; L138-L152 HydrophobicContact CD2-CD1 4.03Å; L138-I155 VanDerWaalsContact C-CD1 3.49Å; L138-I155 WeakPolarHBondContact O-CD1 3.4Å; L138-W258 HydrophobicContact CD2-CH2 3.64Å; L138-W258 HydrophobicContact CD2-CZ2 3.35Å; L138-I332 HydrophobicContact CD1-CD1 4.04Å; L138-I332 HydrophobicContact CD2-CD1 4.25Å
139	Q	65.1	Low	55.5	Low	103 Å²	103	77.9 Å²	77.9	48%	0.481	41%	0.405	S	S	.	.	S	Bend	trans	-144.8	117.5	179.3	-171.4	163.2	50.6	0	0	110.2	C137	C137-Q139 VanDerWaalsContact C-N 3.31Å
140	E	52.3	Low	55.2	Low	79 Å²	79	80.5 Å²	80.5	37%	0.369	42%	0.419	S	S	.	.			trans	-75.7	128.5	168	-79.7	172.7	174.7	0	0	108.8	N150 K158	E140-N150 PolarHBondContact OE2-ND2 2.99Å; E140-K158 IonicContact OE1-NZ 3.54Å; E140-K158 PolarHBondContact OE1-NZ 3.49Å; E140-K158 IonicContact OE2-NZ 3.92Å; E140-K158 PolarHBondContact OE2-NZ 3.39Å
141	T	44	Very low	55.2	Low	80 Å²	80	80.3 Å²	80.3	49%	0.491	42%	0.419	S	S	.	.			trans	-79.5	135.9	-179.3	44	0	0	0	0	110.5	N143 S228	T141-N143 PolarHBondContact O-N 3.47Å; T141-S228 PolarHBondContact OG1-OG 2.96Å
142	A	38.6	Very low	55.3	Low	77 Å²	77	76.1 Å²	76.1	64%	0.636	40%	0.403	S	S	*	.	S	Bend	trans	-65.3	38.1	-167.5	0	0	0	0	0	117.3	E144	A142-E144 VanDerWaalsContact C-N 3.27Å; A142-E144 PolarHBondContact O-N 3.27Å
143	N	36.6	Very low	55.3	Low	147 Å²	147	75.6 Å²	75.6	79%	0.786	40%	0.401	S	S	*	.			trans	-79.7	-0.5	-179.2	-88.7	4.5	0	0	0	114.6	T141	T141-N143 PolarHBondContact O-N 3.47Å
144	E	32.8	Very low	55.3	Low	176 Å²	176	75.6 Å²	75.6	82%	0.822	41%	0.405	S	S	*	.	S	Bend	trans	-102.4	102.2	162.9	-73.5	179.4	178.6	0	0	108.6	A142 T146	A142-E144 VanDerWaalsContact C-N 3.27Å; A142-E144 PolarHBondContact O-N 3.27Å; E144-T146 VanDerWaalsContact C-N 3.29Å; E144-T146 PolarHBondContact O-N 3.06Å
145	M	27.2	Very low	55.5	Low	182 Å²	182	70.2 Å²	70.2	90%	0.897	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	90.4	172.8	-68.8	-178.6	-175.2	0	0	108.9
146	T	33.7	Very low	55.7	Low	125 Å²	125	69.4 Å²	69.4	77%	0.767	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	174.1	-7.2	142.1	33.3	0	0	0	0	116.6	E144	E144-T146 VanDerWaalsContact C-N 3.29Å; E144-T146 PolarHBondContact O-N 3.06Å
147	K	33	Very low	55.6	Low	118 Å²	118	70.9 Å²	70.9	51%	0.513	39%	0.393	S	S	.	.			trans	-152.4	104.8	-179.6	-78.6	171.9	176.5	169.8	0	114	H111	H111-K147 PolarHBondContact ND1-NZ 3.36Å
148	P	37.7	Very low	55.6	Low	96 Å²	96	73.3 Å²	73.3	62%	0.623	40%	0.402	S	S	*	.			trans	-121.6	90.9	168.8	35.9	-20.2	0	0	0	111.8
149	V	47	Very low	56.3	Low	78 Å²	78	72.8 Å²	72.8	47%	0.473	40%	0.398	S	S	.	.			trans	-141.6	64.6	157.6	-166.3	0	0	0	0	108.6	S151 L825	V149-S151 PolarHBondContact O-N 3.48Å; V149-L825 HydrophobicContact CG1-CD2 4.39Å
150	N	52.6	Low	57.4	Low	78 Å²	78	68.1 Å²	68.1	42%	0.417	38%	0.377	S	S	.	.			trans	-87.9	107.9	178.9	-66.3	-1.2	0	0	0	108.7	E140 S154	E140-N150 PolarHBondContact OE2-ND2 2.99Å; N150-S154 WeakPolarHBondContact CA-OG 3.18Å
151	S	62.9	Low	59.3	Low	15 Å²	15	64.4 Å²	64.4	11%	0.105	36%	0.36	C	S	.	.			trans	-72.1	157.2	176.7	63.4	0	0	0	0	110.3	V149 W153 S154 I155	V149-S151 PolarHBondContact O-N 3.48Å; S151-W153 PolarHBondContact O-N 3Å; S151-W153 VanDerWaalsContact O-N 3.16Å; S151-S154 PolarHBondContact N-OG 3.39Å; S151-S154 VanDerWaalsContact N-OG 3.09Å; S151-S154 PolarHBondContact O-N 2.72Å; S151-S154 PolarHBondContact O-OG 2.73Å; S151-S154 PolarHBondContact OG-N 3.3Å; S151-S154 VanDerWaalsContact OG-N 3.14Å; S151-I155 PolarHBondContact O-N 2.98Å; S151-I155 VanDerWaalsContact O-N 3.16Å
152	L	72.2	Confident	61.5	Low	19 Å²	19	60.6 Å²	60.6	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-59.9	-28.2	174.1	-168.1	139.2	0	0	0	111	L138 I155 Y156 I332 S820 L821	L138-L152 HydrophobicContact CD2-CD1 4.03Å; L152-I155 PolarHBondContact O-N 2.96Å; L152-Y156 VanDerWaalsContact O-CB 3.31Å; L152-Y156 WeakPolarHBondContact O-CB 3.36Å; L152-Y156 PolarHBondContact O-N 3.43Å; L152-I332 HydrophobicContact CD1-CD1 3.97Å; L152-I332 HydrophobicContact CD1-CG1 4.33Å; L152-S820 VanDerWaalsContact CB-O 3.3Å; L152-S820 WeakPolarHBondContact CB-O 3.1Å; L152-S820 PolarHBondContact N-O 3.19Å; L152-L821 HydrophobicContact CB-CD2 4.41Å; L152-L821 HydrophobicContact CB-CG 4.43Å; L152-L821 HydrophobicContact CD2-CD1 4.2Å; L152-L821 HydrophobicContact CD2-CD2 3.59Å; L152-L821 HydrophobicContact CD2-CG 3.92Å
153	W	72.5	Confident	63.9	Low	3 Å²	3	57 Å²	57	1%	0.011	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-47.2	169.7	-72	121.5	0	0	0	113.1	S151 I155 Y156 A157 W733 T734 N737 L738 L821 L826	S151-W153 PolarHBondContact O-N 3Å; S151-W153 VanDerWaalsContact O-N 3.16Å; W153-I155 VanDerWaalsContact C-N 3.3Å; W153-I155 PolarHBondContact O-N 3.1Å; W153-Y156 PolarHBondContact O-N 3.15Å; W153-A157 VanDerWaalsContact O-CB 3.26Å; W153-A157 WeakPolarHBondContact O-CB 3.2Å; W153-A157 PolarHBondContact O-N 3.43Å; W153-W733 HydrophobicContact CH2-CZ3 4.08Å; W153-W733 HydrophobicContact CZ2-CH2 4.37Å; W153-W733 HydrophobicContact CZ2-CZ3 4.27Å; W153-T734 HydrophobicContact CZ3-CG2 4.34Å; W153-T734 WeakPolarHBondContact CZ3-O 3.48Å; W153-N737 HydrophobicContact CH2-CB 4.03Å; W153-L738 HydrophobicContact CE3-CB 4.05Å; W153-L738 HydrophobicContact CE3-CD1 3.82Å; W153-L738 HydrophobicContact CE3-CG 4.4Å; W153-L738 HydrophobicContact CH2-CB 4.41Å; W153-L738 HydrophobicContact CZ3-CB 3.64Å; W153-L738 HydrophobicContact CZ3-CD1 4.16Å; W153-L738 HydrophobicContact CZ3-CG 4.45Å; W153-L821 HydrophobicContact CD2-CD2 3.51Å; W153-L821 HydrophobicContact CE3-CD2 3.99Å; W153-L821 HydrophobicContact CG-CD2 3.94Å; W153-L821 HydrophobicContact CH2-CD2 4.16Å; W153-L821 HydrophobicContact CZ2-CB 4.46Å; W153-L821 HydrophobicContact CZ2-CD2 3.67Å; W153-L821 HydrophobicContact CZ3-CD2 4.27Å; W153-L821 PolarHBondContact NE1-O 3.11Å; W153-L826 HydrophobicContact CB-CD2 3.7Å; W153-L826 HydrophobicContact CB-CG 4.19Å; W153-L826 HydrophobicContact CD2-CD1 3.79Å; W153-L826 HydrophobicContact CD2-CD2 3.74Å; W153-L826 HydrophobicContact CD2-CG 3.83Å; W153-L826 HydrophobicContact CE3-CD1 4.3Å; W153-L826 HydrophobicContact CE3-CD2 4.05Å; W153-L826 HydrophobicContact CG-CD1 4.18Å; W153-L826 HydrophobicContact CG-CD2 3.64Å; W153-L826 HydrophobicContact CG-CG 3.69Å; W153-L826 HydrophobicContact CH2-CD1 4.29Å; W153-L826 HydrophobicContact CZ2-CD1 3.8Å
154	S	70.5	Confident	66.4	Low	36 Å²	36	50 Å²	50	25%	0.252	27%	0.269	S	S	.	.	H	α-helix	trans	-65	-36.2	179	63.2	0	0	0	0	111.9	N150 S151 K158	N150-S154 WeakPolarHBondContact CA-OG 3.18Å; S151-S154 PolarHBondContact N-OG 3.39Å; S151-S154 VanDerWaalsContact N-OG 3.09Å; S151-S154 PolarHBondContact O-N 2.72Å; S151-S154 PolarHBondContact O-OG 2.73Å; S151-S154 PolarHBondContact OG-N 3.3Å; S151-S154 VanDerWaalsContact OG-N 3.14Å; S154-K158 VanDerWaalsContact O-CG 3.3Å; S154-K158 WeakPolarHBondContact O-CG 3.35Å; S154-K158 PolarHBondContact O-N 2.82Å
155	I	76.7	Confident	68.8	Low	4 Å²	4	42.4 Å²	42.4	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-48.7	176.2	-62.4	173.3	0	0	0	110.4	L138 S151 L152 W153 A157 K158 Y159 W258	L138-I155 VanDerWaalsContact C-CD1 3.49Å; L138-I155 WeakPolarHBondContact O-CD1 3.4Å; S151-I155 PolarHBondContact O-N 2.98Å; S151-I155 VanDerWaalsContact O-N 3.16Å; L152-I155 PolarHBondContact O-N 2.96Å; W153-I155 VanDerWaalsContact C-N 3.3Å; W153-I155 PolarHBondContact O-N 3.1Å; I155-A157 VanDerWaalsContact C-N 3.32Å; I155-A157 PolarHBondContact O-N 3.32Å; I155-K158 PolarHBondContact O-N 3.25Å; I155-Y159 HydrophobicContact CG2-CD2 4.22Å; I155-Y159 HydrophobicContact CG2-CE1 4.2Å; I155-Y159 HydrophobicContact CG2-CE2 3.53Å; I155-Y159 PolarHBondContact O-N 3.48Å; I155-W258 HydrophobicContact CG2-CZ2 4.44Å
156	Y	82.8	Confident	71.3	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-40.7	178.2	-177.7	-97	0	0	0	112.2	L152 W153 K158 Y159 R161 W258 A336 V354 T734 E735 L738	L152-Y156 VanDerWaalsContact O-CB 3.31Å; L152-Y156 WeakPolarHBondContact O-CB 3.36Å; L152-Y156 PolarHBondContact O-N 3.43Å; W153-Y156 PolarHBondContact O-N 3.15Å; Y156-K158 VanDerWaalsContact C-N 3.28Å; Y156-K158 PolarHBondContact O-N 3.41Å; Y156-Y159 PolarHBondContact O-N 3.06Å; Y156-R161 PolarHBondContact O-NH1 3.42Å; Y156-W258 HydrophobicContact CD2-CE3 4.42Å; Y156-W258 AromaticContact CD2-CZ3 3.88Å; Y156-W258 HydrophobicContact CD2-CZ3 3.88Å; Y156-A336 HydrophobicContact CE2-CB 4.08Å; Y156-V354 HydrophobicContact CD2-CG1 4.29Å; Y156-V354 HydrophobicContact CD2-CG2 4.21Å; Y156-V354 HydrophobicContact CE2-CG1 4.35Å; Y156-V354 HydrophobicContact CE2-CG2 3.63Å; Y156-T734 PolarHBondContact OH-OG1 3.1Å; Y156-E735 HydrophobicContact CE1-CG 4.49Å; Y156-E735 WeakPolarHBondContact CE1-OE1 3.48Å; Y156-E735 PolarHBondContact OH-OE1 3.48Å; Y156-L738 HydrophobicContact CD1-CD1 3.93Å; Y156-L738 HydrophobicContact CE1-CD1 4.44Å
157	A	78.5	Confident	73	Confident	31 Å²	31	31.3 Å²	31.3	26%	0.256	18%	0.175	S	C	.	.	H	α-helix	trans	-61	-36.6	177.5	0	0	0	0	0	112.6	W153 I155 R161 Q394 L738	W153-A157 VanDerWaalsContact O-CB 3.26Å; W153-A157 WeakPolarHBondContact O-CB 3.2Å; W153-A157 PolarHBondContact O-N 3.43Å; I155-A157 VanDerWaalsContact C-N 3.32Å; I155-A157 PolarHBondContact O-N 3.32Å; A157-R161 PolarHBondContact O-NH1 3.18Å; A157-Q394 PolarHBondContact O-NE2 2.97Å; A157-Q394 VanDerWaalsContact O-NE2 3.14Å; A157-L738 HydrophobicContact CB-CD1 4.14Å
158	K	78.5	Confident	74.5	Confident	71 Å²	71	29.1 Å²	29.1	31%	0.309	16%	0.164	S	C	.	.	H	α-helix	trans	-70.4	-28.6	177.9	-75.3	179.5	-175.1	-172	0	113.9	E140 S154 I155 Y156 Q394	E140-K158 IonicContact OE1-NZ 3.54Å; E140-K158 PolarHBondContact OE1-NZ 3.49Å; E140-K158 IonicContact OE2-NZ 3.92Å; E140-K158 PolarHBondContact OE2-NZ 3.39Å; S154-K158 VanDerWaalsContact O-CG 3.3Å; S154-K158 WeakPolarHBondContact O-CG 3.35Å; S154-K158 PolarHBondContact O-N 2.82Å; I155-K158 PolarHBondContact O-N 3.25Å; Y156-K158 VanDerWaalsContact C-N 3.28Å; Y156-K158 PolarHBondContact O-N 3.41Å; K158-Q394 PolarHBondContact O-NE2 3.44Å
159	Y	86.8	Confident	75.6	Confident	8 Å²	8	30.3 Å²	30.3	3%	0.031	17%	0.165	C	C	.	.	S	Bend	trans	-81.5	152	-175.2	-68.1	-13.4	0	0	0	112.6	C137 I155 Y156 R161 Y225 W258 V354 L355 P356	C137-Y159 WeakPolarHBondContact CB-OH 3.22Å; C137-Y159 PolarHBondContact O-OH 2.84Å; I155-Y159 HydrophobicContact CG2-CD2 4.22Å; I155-Y159 HydrophobicContact CG2-CE1 4.2Å; I155-Y159 HydrophobicContact CG2-CE2 3.53Å; I155-Y159 PolarHBondContact O-N 3.48Å; Y156-Y159 PolarHBondContact O-N 3.06Å; Y159-R161 WeakPolarHBondContact O-CD 3.31Å; Y159-R161 PolarHBondContact O-NH1 3.32Å; Y159-Y225 HydrophobicContact CD1-CD2 4.11Å; Y159-Y225 AromaticContact CD1-CE2 3.82Å; Y159-Y225 HydrophobicContact CD1-CE2 3.82Å; Y159-Y225 AromaticContact CE1-CD2 3.53Å; Y159-Y225 HydrophobicContact CE1-CD2 3.53Å; Y159-Y225 AromaticContact CE1-CE2 3.52Å; Y159-Y225 HydrophobicContact CE1-CE2 3.52Å; Y159-Y225 HydrophobicContact CE1-CG 4.34Å; Y159-W258 HydrophobicContact CD2-CH2 4.5Å; Y159-W258 HydrophobicContact CD2-CZ2 4.09Å; Y159-W258 AromaticContact CE2-CE2 3.93Å; Y159-W258 HydrophobicContact CE2-CH2 4.35Å; Y159-W258 AromaticContact CE2-CZ2 3.63Å; Y159-W258 HydrophobicContact CE2-CZ2 3.63Å; Y159-V354 VanDerWaalsContact CB-CG1 3.49Å; Y159-V354 HydrophobicContact CD2-CG1 3.85Å; Y159-V354 HydrophobicContact CG-CG1 4.18Å; Y159-L355 WeakPolarHBondContact CB-O 3.36Å; Y159-P356 HydrophobicContact CD1-CB 4.22Å; Y159-P356 HydrophobicContact CD2-CB 4.26Å; Y159-P356 HydrophobicContact CE1-CB 3.89Å; Y159-P356 HydrophobicContact CE2-CB 3.94Å; Y159-P356 HydrophobicContact CG-CB 4.4Å
160	S	89.4	Confident	76	Confident	5 Å²	5	31.4 Å²	31.4	4%	0.035	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	158.7	173.8	71.9	0	0	0	0	110.6	L355 I357 Y392	S160-L355 PolarHBondContact N-O 3.43Å; S160-L355 VanDerWaalsContact N-O 3.13Å; S160-L355 PolarHBondContact O-N 3.16Å; S160-L355 WeakPolarHBondContact OG-CB 3.42Å; S160-I357 WeakPolarHBondContact OG-CD1 3.4Å; S160-I357 WeakPolarHBondContact OG-CG1 3.44Å; S160-Y392 VanDerWaalsContact CA-O 3.3Å; S160-Y392 WeakPolarHBondContact CA-O 3.42Å; S160-Y392 WeakPolarHBondContact CB-O 3.49Å
161	R	90.4	Very high	76.2	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	141.3	-177.9	-56	85.4	152.6	162.5	-16.4	110.9	Y156 A157 Y159 M353 I391 Y392 F723 E735	Y156-R161 PolarHBondContact O-NH1 3.42Å; A157-R161 PolarHBondContact O-NH1 3.18Å; Y159-R161 WeakPolarHBondContact O-CD 3.31Å; Y159-R161 PolarHBondContact O-NH1 3.32Å; R161-M353 WeakPolarHBondContact CA-O 3.41Å; R161-I391 CarbonylContact O-C 3.58Å; R161-I391 VanDerWaalsContact O-CA 3.29Å; R161-I391 WeakPolarHBondContact O-CA 3.34Å; R161-I391 WeakPolarHBondContact O-CG1 3.3Å; R161-Y392 PolarHBondContact N-O 3.44Å; R161-Y392 PolarHBondContact O-N 2.99Å; R161-F723 HydrophobicContact CB-CE2 3.76Å; R161-F723 HydrophobicContact CB-CZ 3.84Å; R161-F723 HydrophobicContact CG-CZ 4.22Å; R161-E735 IonicContact CZ-OE1 2.83Å; R161-E735 IonicContact NE-OE1 4Å; R161-E735 PolarHBondContact NE-OE1 3.14Å; R161-E735 IonicContact NH2-OE1 3.68Å; R161-E735 PolarHBondContact NH2-OE1 3.27Å; R161-E735 IonicContact NH2-OE2 2.66Å
162	V	91	Very high	75.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.8	171.9	174.6	0	0	0	0	109.3	F164 M353 L355 F388 I391	V162-F164 HydrophobicContact CB-CE2 4.34Å; V162-F164 HydrophobicContact CG1-CD2 3.94Å; V162-F164 HydrophobicContact CG1-CE1 4.27Å; V162-F164 HydrophobicContact CG1-CE2 3.34Å; V162-F164 HydrophobicContact CG1-CZ 3.52Å; V162-M353 PolarHBondContact N-O 3.05Å; V162-M353 PolarHBondContact O-N 3.41Å; V162-L355 HydrophobicContact CB-CD1 3.96Å; V162-L355 HydrophobicContact CG2-CD1 3.47Å; V162-L355 VanDerWaalsContact CG2-CD1 3.47Å; V162-L355 HydrophobicContact CG2-CD2 4.39Å; V162-F388 HydrophobicContact CG1-CD2 4.04Å; V162-F388 HydrophobicContact CG1-CE2 3.73Å; V162-I391 HydrophobicContact CG2-CB 4.41Å; V162-I391 HydrophobicContact CG2-CD1 3.6Å; V162-I391 HydrophobicContact CG2-CG1 3.65Å
163	V	88.9	Confident	74.4	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.9	177.3	-176.6	0	0	0	0	109.9	S351 L352 D389 G390 F723 Y727 F732	V163-S351 WeakPolarHBondContact CA-O 3.2Å; V163-L352 HydrophobicContact CG2-CD1 4.25Å; V163-L352 HydrophobicContact CG2-CG 4.45Å; V163-D389 PolarHBondContact O-N 3.16Å; V163-G390 PolarHBondContact N-O 2.83Å; V163-G390 PolarHBondContact O-N 3Å; V163-F723 HydrophobicContact CG2-CD2 3.83Å; V163-F723 HydrophobicContact CG2-CE2 3.7Å; V163-Y727 HydrophobicContact CB-CD2 4.02Å; V163-Y727 HydrophobicContact CB-CE2 3.84Å; V163-Y727 HydrophobicContact CG1-CD1 4.46Å; V163-Y727 HydrophobicContact CG1-CD2 4.04Å; V163-Y727 HydrophobicContact CG1-CE1 4.04Å; V163-Y727 HydrophobicContact CG1-CE2 3.6Å; V163-Y727 HydrophobicContact CG1-CG 4.48Å; V163-Y727 HydrophobicContact CG2-CD2 3.87Å; V163-Y727 HydrophobicContact CG2-CE2 4.23Å; V163-Y727 HydrophobicContact CG2-CG 4.27Å; V163-F732 HydrophobicContact CG1-CE2 4.41Å; V163-F732 HydrophobicContact CG1-CZ 4.41Å; V163-F732 HydrophobicContact CG2-CE2 4.03Å
164	F	88.2	Confident	73.4	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.6	171.1	-66.4	-77.3	0	0	0	109.8	V162 L210 I214 K350 S351 M353 F386 H387 F388	V162-F164 HydrophobicContact CB-CE2 4.34Å; V162-F164 HydrophobicContact CG1-CD2 3.94Å; V162-F164 HydrophobicContact CG1-CE1 4.27Å; V162-F164 HydrophobicContact CG1-CE2 3.34Å; V162-F164 HydrophobicContact CG1-CZ 3.52Å; F164-L210 HydrophobicContact CD1-CD1 4.1Å; F164-L210 HydrophobicContact CD2-CD1 4.27Å; F164-L210 HydrophobicContact CD2-CD2 4.44Å; F164-L210 HydrophobicContact CE1-CD1 4.03Å; F164-L210 HydrophobicContact CE1-CD2 4.1Å; F164-L210 HydrophobicContact CE2-CD1 4.19Å; F164-L210 HydrophobicContact CE2-CD2 3.61Å; F164-L210 HydrophobicContact CG-CD1 4.22Å; F164-L210 HydrophobicContact CZ-CD1 4.09Å; F164-L210 HydrophobicContact CZ-CD2 3.43Å; F164-L210 VanDerWaalsContact CZ-CD2 3.43Å; F164-L210 HydrophobicContact CZ-CG 4.41Å; F164-I214 HydrophobicContact CE2-CD1 4.28Å; F164-I214 HydrophobicContact CZ-CD1 4.25Å; F164-K350 CarbonylContact O-C 3.15Å; F164-K350 WeakPolarHBondContact O-CA 3.29Å; F164-S351 PolarHBondContact N-O 3.37Å; F164-S351 PolarHBondContact O-N 3.49Å; F164-M353 HydrophobicContact CD2-CE 4.05Å; F164-M353 HydrophobicContact CD2-SD 4.27Å; F164-M353 HydrophobicContact CE2-CE 4.09Å; F164-M353 HydrophobicContact CE2-SD 3.91Å; F164-F386 HydrophobicContact CB-CD1 4.04Å; F164-H387 WeakPolarHBondContact CA-O 3.28Å; F164-F388 HydrophobicContact CE1-CB 4.36Å; F164-F388 AromaticContact CE1-CD2 3.9Å; F164-F388 HydrophobicContact CE1-CD2 3.9Å; F164-F388 HydrophobicContact CZ-CD2 4.32Å
165	S	84	Confident	71.8	Confident	17 Å²	17	48.3 Å²	48.3	12%	0.119	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	153.8	172.1	79.7	0	0	0	0	111.2	G349 F386 H387 D389	S165-G349 CarbonylContact C-O 3.59Å; S165-G349 WeakPolarHBondContact CA-O 3.37Å; S165-F386 WeakPolarHBondContact O-CA 3.09Å; S165-H387 PolarHBondContact N-O 3.43Å; S165-H387 PolarHBondContact O-N 3.28Å; S165-D389 WeakPolarHBondContact CB-OD1 3.49Å; S165-D389 WeakPolarHBondContact CB-OD2 3.27Å; S165-D389 PolarHBondContact OG-OD1 3.32Å; S165-D389 PolarHBondContact OG-OD2 3.18Å
166	I	79.2	Confident	70.4	Confident	12 Å²	12	56.9 Å²	56.9	6%	0.062	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.5	178.8	-59.4	167.9	0	0	0	107.8	Y168 I171 I203 G349 I384 F386	I166-Y168 HydrophobicContact CB-CE1 4.21Å; I166-Y168 HydrophobicContact CB-CE2 4.36Å; I166-Y168 HydrophobicContact CG2-CD1 4.1Å; I166-Y168 HydrophobicContact CG2-CE1 3.46Å; I166-Y168 VanDerWaalsContact CG2-CE1 3.46Å; I166-Y168 HydrophobicContact CG2-CE2 4.36Å; I166-Y168 PolarHBondContact O-N 3.17Å; I166-I171 HydrophobicContact CG2-CD1 4.14Å; I166-I203 HydrophobicContact CD1-CD1 4.41Å; I166-I203 HydrophobicContact CD1-CG1 4.44Å; I166-G349 PolarHBondContact N-O 3.42Å; I166-I384 HydrophobicContact CB-CG2 4.5Å; I166-I384 HydrophobicContact CG1-CG2 4.33Å; I166-I384 HydrophobicContact CG2-CG2 3.52Å; I166-F386 HydrophobicContact CD1-CE1 3.87Å; I166-F386 HydrophobicContact CD1-CZ 4.41Å; I166-F386 HydrophobicContact CG1-CD1 3.86Å; I166-F386 HydrophobicContact CG1-CE1 3.55Å; I166-F386 HydrophobicContact CG1-CZ 4.35Å
167	N	69.3	Low	68.5	Low	61 Å²	61	61.4 Å²	61.4	33%	0.326	31%	0.31	S	S	.	.			trans	-90.5	97.6	176	-169.7	-5.5	0	0	0	111	N169 Q170	N167-N169 PolarHBondContact O-N 3.11Å; N167-N169 PolarHBondContact OD1-N 2.83Å; N167-Q170 PolarHBondContact O-N 2.77Å
168	Y	64.7	Low	67.2	Low	72 Å²	72	63.5 Å²	63.5	28%	0.282	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-27.3	-178.7	-63.7	-65.3	0	0	0	114.5	I166 Q170 I171 Y193 W348 G349	I166-Y168 HydrophobicContact CB-CE1 4.21Å; I166-Y168 HydrophobicContact CB-CE2 4.36Å; I166-Y168 HydrophobicContact CG2-CD1 4.1Å; I166-Y168 HydrophobicContact CG2-CE1 3.46Å; I166-Y168 VanDerWaalsContact CG2-CE1 3.46Å; I166-Y168 HydrophobicContact CG2-CE2 4.36Å; I166-Y168 PolarHBondContact O-N 3.17Å; Y168-Q170 VanDerWaalsContact C-N 3.27Å; Y168-Q170 PolarHBondContact O-N 3.31Å; Y168-I171 HydrophobicContact CD1-CD1 3.84Å; Y168-I171 HydrophobicContact CE1-CD1 4.24Å; Y168-I171 PolarHBondContact O-N 3.28Å; Y168-Y193 WeakPolarHBondContact CD1-OH 3.41Å; Y168-Y193 AromaticContact CE1-CE1 3.93Å; Y168-Y193 HydrophobicContact CE1-CE1 3.93Å; Y168-Y193 AromaticContact CE1-CZ 3.59Å; Y168-Y193 WeakPolarHBondContact CE1-OH 3.48Å; Y168-Y193 AromaticContact CZ-CE1 3.94Å; Y168-Y193 AromaticContact CZ-CZ 3.4Å; Y168-Y193 VanDerWaalsContact CZ-CZ 3.4Å; Y168-Y193 VanDerWaalsContact OH-CE1 3.26Å; Y168-Y193 WeakPolarHBondContact OH-CE1 3.45Å; Y168-Y193 PolarHBondContact OH-OH 3.25Å; Y168-W348 PolarHBondContact OH-O 3.32Å; Y168-G349 VanDerWaalsContact OH-CA 3.29Å; Y168-G349 WeakPolarHBondContact OH-CA 3.35Å
169	N	60.7	Low	65.6	Low	122 Å²	122	67.4 Å²	67.4	65%	0.652	35%	0.346	S	S	*	.	H	α-helix	trans	-67.1	-32	-176.9	-67.2	-17.7	0	0	0	111.6	N167 I172	N167-N169 PolarHBondContact O-N 3.11Å; N167-N169 PolarHBondContact OD1-N 2.83Å; N169-I172 PolarHBondContact O-N 3.4Å
170	Q	57.3	Low	63.7	Low	101 Å²	101	72.8 Å²	72.8	47%	0.472	37%	0.37	S	S	.	.	H	α-helix	trans	-77.8	-23.1	178.7	-74.6	177.2	-26.8	0	0	113.2	N167 Y168 I172 E173 P385	N167-Q170 PolarHBondContact O-N 2.77Å; Y168-Q170 VanDerWaalsContact C-N 3.27Å; Y168-Q170 PolarHBondContact O-N 3.31Å; Q170-I172 PolarHBondContact O-N 2.89Å; Q170-E173 PolarHBondContact O-N 3.47Å; Q170-P385 HydrophobicContact CB-CG 3.87Å
171	I	55.6	Low	61.6	Low	37 Å²	37	75.4 Å²	75.4	19%	0.19	38%	0.382	C	S	.	.	H	α-helix	trans	-64.4	-24.2	175.5	-58.5	178.2	0	0	0	110.9	I166 Y168 M181 I384 P385	I166-I171 HydrophobicContact CG2-CD1 4.14Å; Y168-I171 HydrophobicContact CD1-CD1 3.84Å; Y168-I171 HydrophobicContact CE1-CD1 4.24Å; Y168-I171 PolarHBondContact O-N 3.28Å; I171-M181 HydrophobicContact CG2-CE 3.89Å; I171-I384 HydrophobicContact CD1-CG2 4.25Å; I171-P385 HydrophobicContact CG1-CG 4.17Å
172	I	48.4	Very low	59.5	Low	117 Å²	117	81.5 Å²	81.5	60%	0.6	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-22.7	-178	-58.4	172.1	0	0	0	112.2	N169 Q170	N169-I172 PolarHBondContact O-N 3.4Å; Q170-I172 PolarHBondContact O-N 2.89Å
173	E	48.9	Very low	57.4	Low	159 Å²	159	87.4 Å²	87.4	74%	0.743	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-0.6	-171.8	-71.8	-175.8	160.3	0	0	115.2	Q170 P175	Q170-E173 PolarHBondContact O-N 3.47Å; E173-P175 WeakPolarHBondContact O-CD 3.49Å
174	I	51	Low	55.4	Low	81 Å²	81	88.6 Å²	88.6	42%	0.415	45%	0.446	S	S	.	.			trans	-71.6	118.4	-174.5	-54.9	172.4	0	0	0	111.3	H176	I174-H176 PolarHBondContact O-N 3.26Å
175	P	37.8	Very low	53.5	Low	112 Å²	112	90.9 Å²	90.9	73%	0.727	46%	0.461	S	S	*	.	S	Bend	trans	-95	49.4	-169	39.1	-35.4	0	0	0	112.9	E173	E173-P175 WeakPolarHBondContact O-CD 3.49Å
176	H	46.9	Very low	51.7	Low	183 Å²	183	97 Å²	97	85%	0.847	49%	0.492	S	S	*	.			trans	-155.2	78	166.5	-88.1	-67.6	0	0	0	109.6	I174 S178	I174-H176 PolarHBondContact O-N 3.26Å; H176-S178 PolarHBondContact O-N 3.39Å
177	K	43.4	Very low	50.1	Low	97 Å²	97	99.7 Å²	99.7	42%	0.422	51%	0.512	S	S	.	.			trans	-76	117.4	-178.2	-77.9	-174.9	177.3	179.3	0	111.3	M181 K182 T185	K177-M181 HydrophobicContact CG-CB 4.4Å; K177-K182 HydrophobicContact CD-CB 3.82Å; K177-K182 HydrophobicContact CD-CD 4.16Å; K177-K182 HydrophobicContact CD-CG 3.66Å; K177-T185 PolarHBondContact NZ-OG1 3.22Å
178	S	50.8	Low	48.5	Very low	75 Å²	75	105.9 Å²	105.9	52%	0.524	54%	0.536	S	S	.	.			trans	-59.2	144.5	146.1	61.7	0	0	0	0	108.3	H176 F180 M181	H176-S178 PolarHBondContact O-N 3.39Å; S178-F180 PolarHBondContact O-N 3.15Å; S178-M181 PolarHBondContact O-N 3.46Å
179	L	44.2	Very low	47.5	Very low	153 Å²	153	111.8 Å²	111.8	80%	0.801	56%	0.563	S	S	*	*	H	α-helix	trans	-49.5	-25.7	-177.5	-151.5	111.6	0	0	0	112.9
180	F	47	Very low	46.7	Very low	121 Å²	121	112.8 Å²	112.8	53%	0.531	57%	0.569	S	S	.	*	H	α-helix	trans	-62.7	-47.3	178.2	-160.7	-97.4	0	0	0	114.1	S178 K182 L184	S178-F180 PolarHBondContact O-N 3.15Å; F180-K182 VanDerWaalsContact C-N 3.3Å; F180-K182 PolarHBondContact O-N 3.4Å; F180-L184 HydrophobicContact CD1-CD1 4.2Å; F180-L184 HydrophobicContact CE1-CD1 4.2Å
181	M	46.6	Very low	45.9	Very low	61 Å²	61	110.5 Å²	110.5	30%	0.3	56%	0.559	S	S	.	*	H	α-helix	trans	-75	-17.6	-178.7	-87	-80.6	-114.3	0	0	113.4	I171 K177 S178 L184 T185	I171-M181 HydrophobicContact CG2-CE 3.89Å; K177-M181 HydrophobicContact CG-CB 4.4Å; S178-M181 PolarHBondContact O-N 3.46Å; M181-L184 HydrophobicContact SD-CD1 4.29Å; M181-T185 PolarHBondContact O-N 3.13Å; M181-T185 PolarHBondContact O-OG1 3.21Å
182	K	45	Very low	45.7	Very low	129 Å²	129	110 Å²	110	56%	0.561	56%	0.558	S	S	*	*	H	α-helix	trans	-75	-31.7	179.1	-145.7	167.2	-174.3	-178.4	0	111.9	K177 F180 T185	K177-K182 HydrophobicContact CD-CB 3.82Å; K177-K182 HydrophobicContact CD-CD 4.16Å; K177-K182 HydrophobicContact CD-CG 3.66Å; F180-K182 VanDerWaalsContact C-N 3.3Å; F180-K182 PolarHBondContact O-N 3.4Å; K182-T185 PolarHBondContact O-OG1 3.38Å
183	N	47.5	Very low	45.9	Very low	124 Å²	124	105.3 Å²	105.3	66%	0.663	53%	0.533	S	S	*	.	H	α-helix	trans	-72.5	-34.6	173	-75.9	-8.2	0	0	0	112.3	T185 N186	N183-T185 VanDerWaalsContact C-N 3.3Å; N183-T185 PolarHBondContact O-N 2.85Å; N183-N186 PolarHBondContact O-N 3.27Å
184	L	47.2	Very low	46.2	Very low	25 Å²	25	99.3 Å²	99.3	13%	0.131	51%	0.505	C	S	.	.	H	α-helix	trans	-59.2	-37.8	172.6	-99.8	123.4	0	0	0	112.8	F180 M181 N186 S187 L191 E196 L199	F180-L184 HydrophobicContact CD1-CD1 4.2Å; F180-L184 HydrophobicContact CE1-CD1 4.2Å; M181-L184 HydrophobicContact SD-CD1 4.29Å; L184-N186 PolarHBondContact O-N 2.98Å; L184-S187 PolarHBondContact O-N 2.94Å; L184-L191 HydrophobicContact CD2-CD1 4.43Å; L184-L191 HydrophobicContact CD2-CD2 3.75Å; L184-E196 VanDerWaalsContact CD2-OE2 3.31Å; L184-E196 WeakPolarHBondContact CD2-OE2 3.38Å; L184-E196 WeakPolarHBondContact CG-OE2 3.39Å; L184-L199 HydrophobicContact CD2-CD1 4.31Å
185	T	49.1	Very low	46.4	Very low	50 Å²	50	98.9 Å²	98.9	31%	0.307	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-17.3	-175.1	47.1	0	0	0	0	115.9	K177 M181 K182 N183	K177-T185 PolarHBondContact NZ-OG1 3.22Å; M181-T185 PolarHBondContact O-N 3.13Å; M181-T185 PolarHBondContact O-OG1 3.21Å; K182-T185 PolarHBondContact O-OG1 3.38Å; N183-T185 VanDerWaalsContact C-N 3.3Å; N183-T185 PolarHBondContact O-N 2.85Å
186	N	45.1	Very low	47.8	Very low	145 Å²	145	96.2 Å²	96.2	78%	0.775	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-10.3	178.6	-79.7	-9.9	0	0	0	113.1	N183 L184 K188	N183-N186 PolarHBondContact O-N 3.27Å; L184-N186 PolarHBondContact O-N 2.98Å; N186-K188 VanDerWaalsContact C-N 3.34Å; N186-K188 PolarHBondContact O-N 2.97Å
187	S	44.7	Very low	49	Very low	69 Å²	69	88.4 Å²	88.4	48%	0.483	45%	0.452	S	S	.	.			trans	-89.8	62.7	177.1	-176.3	0	0	0	0	111.2	L184 K189	L184-S187 PolarHBondContact O-N 2.94Å; S187-K189 PolarHBondContact O-N 3.3Å; S187-K189 VanDerWaalsContact O-N 3.11Å
188	K	37.3	Very low	50.4	Low	191 Å²	191	84.6 Å²	84.6	83%	0.83	44%	0.437	S	S	*	.			trans	-72.7	98.1	173.1	-87	-178.5	174.9	175.9	0	110.1	N186	N186-K188 VanDerWaalsContact C-N 3.34Å; N186-K188 PolarHBondContact O-N 2.97Å
189	K	43.6	Very low	51.6	Low	195 Å²	195	82.3 Å²	82.3	85%	0.848	42%	0.419	S	S	*	.	S	Bend		161.6	-10.1	129.5	-91.2	178.2	174.4	179.8	0	116.8	S187	S187-K189 PolarHBondContact O-N 3.3Å; S187-K189 VanDerWaalsContact O-N 3.11Å
190	N	42.5	Very low	53.3	Low	144 Å²	144	75.2 Å²	75.2	77%	0.77	38%	0.382	S	S	*	.			trans	-140.6	46	-174.3	-76	-18.2	0	0	0	113.8	T192	N190-T192 PolarHBondContact O-N 2.9Å
191	L	41.8	Very low	55.2	Low	52 Å²	52	73.1 Å²	73.1	27%	0.272	37%	0.371	S	S	.	.			trans	-76	107	178	-112.4	128	0	0	0	110.3	L184	L184-L191 HydrophobicContact CD2-CD1 4.43Å; L184-L191 HydrophobicContact CD2-CD2 3.75Å
192	T	50.5	Low	57	Low	28 Å²	28	72.9 Å²	72.9	17%	0.172	37%	0.371	C	S	.	.			trans	-98.1	126	178.3	73.8	0	0	0	0	109.1	N190 F194 S195 N346	N190-T192 PolarHBondContact O-N 2.9Å; T192-F194 PolarHBondContact O-N 3.06Å; T192-F194 VanDerWaalsContact O-N 3.07Å; T192-S195 PolarHBondContact O-N 2.94Å; T192-S195 PolarHBondContact O-OG 3.11Å; T192-S195 WeakPolarHBondContact OG1-CB 3.38Å; T192-S195 PolarHBondContact OG1-OG 3.15Å; T192-N346 WeakPolarHBondContact CB-OD1 3.35Å; T192-N346 HydrophobicContact CG2-CB 3.57Å; T192-N346 WeakPolarHBondContact CG2-ND2 3.35Å; T192-N346 WeakPolarHBondContact CG2-OD1 3.48Å
193	Y	52.5	Low	58.9	Low	17 Å²	17	66.9 Å²	66.9	7%	0.067	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.8	-175.5	-69.9	-92.6	0	0	0	114.1	Y168 L199 I203 N346 W348	Y168-Y193 WeakPolarHBondContact CD1-OH 3.41Å; Y168-Y193 AromaticContact CE1-CE1 3.93Å; Y168-Y193 HydrophobicContact CE1-CE1 3.93Å; Y168-Y193 AromaticContact CE1-CZ 3.59Å; Y168-Y193 WeakPolarHBondContact CE1-OH 3.48Å; Y168-Y193 AromaticContact CZ-CE1 3.94Å; Y168-Y193 AromaticContact CZ-CZ 3.4Å; Y168-Y193 VanDerWaalsContact CZ-CZ 3.4Å; Y168-Y193 VanDerWaalsContact OH-CE1 3.26Å; Y168-Y193 WeakPolarHBondContact OH-CE1 3.45Å; Y168-Y193 PolarHBondContact OH-OH 3.25Å; Y193-L199 HydrophobicContact CD1-CD2 3.42Å; Y193-L199 VanDerWaalsContact CD1-CD2 3.42Å; Y193-L199 HydrophobicContact CE1-CD2 3.28Å; Y193-L199 HydrophobicContact CG-CD2 4.45Å; Y193-I203 HydrophobicContact CD1-CD1 3.67Å; Y193-I203 HydrophobicContact CE1-CD1 3.81Å; Y193-N346 VanDerWaalsContact CD2-O 3.22Å; Y193-N346 WeakPolarHBondContact CD2-O 3.48Å; Y193-N346 WeakPolarHBondContact CE2-O 3.48Å; Y193-W348 HydrophobicContact CD1-CB 4.39Å; Y193-W348 HydrophobicContact CD2-CB 3.65Å; Y193-W348 HydrophobicContact CE2-CB 4.32Å; Y193-W348 VanDerWaalsContact CE2-N 3.33Å; Y193-W348 HydrophobicContact CG-CB 3.79Å; Y193-W348 HydrophobicContact CG-CE3 4.47Å
194	F	56.1	Low	60.9	Low	34 Å²	34	61.1 Å²	61.1	15%	0.149	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-11.3	179.1	-68.7	-79.6	0	0	0	113.6	T192 S285 I288 F345	T192-F194 PolarHBondContact O-N 3.06Å; T192-F194 VanDerWaalsContact O-N 3.07Å; F194-S285 WeakPolarHBondContact CD1-O 3.24Å; F194-I288 HydrophobicContact CE1-CB 3.89Å; F194-I288 HydrophobicContact CE1-CG2 3.63Å; F194-I288 HydrophobicContact CZ-CB 4.44Å; F194-I288 HydrophobicContact CZ-CG2 3.67Å; F194-F345 AromaticContact CD2-CD1 3.91Å; F194-F345 HydrophobicContact CD2-CD1 3.91Å; F194-F345 HydrophobicContact CD2-CE1 4.35Å; F194-F345 AromaticContact CE2-CD1 3.39Å; F194-F345 HydrophobicContact CE2-CD1 3.39Å; F194-F345 AromaticContact CE2-CE1 3.46Å; F194-F345 HydrophobicContact CE2-CE1 3.46Å; F194-F345 VanDerWaalsContact CE2-CE1 3.46Å; F194-F345 HydrophobicContact CZ-CD1 4.1Å; F194-F345 AromaticContact CZ-CE1 3.69Å; F194-F345 HydrophobicContact CZ-CE1 3.69Å
195	S	55.6	Low	62.9	Low	72 Å²	72	63 Å²	63	50%	0.503	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-28.8	176.1	63.7	0	0	0	0	113.4	T192 P197	T192-S195 PolarHBondContact O-N 2.94Å; T192-S195 PolarHBondContact O-OG 3.11Å; T192-S195 WeakPolarHBondContact OG1-CB 3.38Å; T192-S195 PolarHBondContact OG1-OG 3.15Å; S195-P197 WeakPolarHBondContact O-CD 3.44Å
196	E	66.5	Low	64.7	Low	55 Å²	55	60.7 Å²	60.7	26%	0.257	31%	0.307	S	S	.	.			trans	-114.4	93.6	179.7	-76.6	-160.2	-171.3	0	0	112.8	L184 S198 L199 L200	L184-E196 VanDerWaalsContact CD2-OE2 3.31Å; L184-E196 WeakPolarHBondContact CD2-OE2 3.38Å; L184-E196 WeakPolarHBondContact CG-OE2 3.39Å; E196-S198 PolarHBondContact O-N 2.74Å; E196-S198 VanDerWaalsContact O-N 3.09Å; E196-L199 HydrophobicContact CB-CB 4.49Å; E196-L199 PolarHBondContact O-N 2.83Å; E196-L199 VanDerWaalsContact O-N 3.16Å; E196-L200 PolarHBondContact O-N 3.45Å
197	P	71.3	Confident	66.9	Low	20 Å²	20	53.8 Å²	53.8	13%	0.13	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-20	-179.4	23.4	-34.8	0	0	0	114.2	S195 Y201 Y278 K282	S195-P197 WeakPolarHBondContact O-CD 3.44Å; P197-Y201 WeakPolarHBondContact O-CB 3.39Å; P197-Y201 PolarHBondContact O-N 2.84Å; P197-Y278 HydrophobicContact CB-CE2 4.08Å; P197-Y278 HydrophobicContact CG-CE2 4.1Å; P197-Y278 WeakPolarHBondContact CG-OH 3.25Å; P197-K282 HydrophobicContact CB-CB 3.8Å; P197-K282 HydrophobicContact CB-CG 4.13Å; P197-K282 HydrophobicContact CG-CB 4.38Å; P197-K282 HydrophobicContact CG-CG 4.24Å
198	S	74	Confident	69.1	Low	16 Å²	16	50.6 Å²	50.6	11%	0.112	25%	0.247	C	C	.	.	H	α-helix	trans	-67.5	-41	176.2	38.5	0	0	0	0	112.6	E196 Y201 I202	E196-S198 PolarHBondContact O-N 2.74Å; E196-S198 VanDerWaalsContact O-N 3.09Å; S198-Y201 PolarHBondContact O-N 3.29Å; S198-I202 WeakPolarHBondContact O-CG1 3.49Å; S198-I202 PolarHBondContact O-N 3.36Å
199	L	75.4	Confident	71.7	Confident	28 Å²	28	44.6 Å²	44.6	15%	0.147	22%	0.222	C	C	.	.	H	α-helix	trans	-70.8	-40.9	178.7	-169.2	111.3	0	0	0	110.4	L184 Y193 E196 Y201 I202 I203	L184-L199 HydrophobicContact CD2-CD1 4.31Å; Y193-L199 HydrophobicContact CD1-CD2 3.42Å; Y193-L199 VanDerWaalsContact CD1-CD2 3.42Å; Y193-L199 HydrophobicContact CE1-CD2 3.28Å; Y193-L199 HydrophobicContact CG-CD2 4.45Å; E196-L199 HydrophobicContact CB-CB 4.49Å; E196-L199 PolarHBondContact O-N 2.83Å; E196-L199 VanDerWaalsContact O-N 3.16Å; L199-Y201 VanDerWaalsContact C-N 3.34Å; L199-Y201 PolarHBondContact O-N 3.23Å; L199-I202 PolarHBondContact O-N 2.92Å; L199-I203 HydrophobicContact CD2-CD1 3.83Å; L199-I203 HydrophobicContact CG-CD1 4.28Å; L199-I203 WeakPolarHBondContact O-CG1 3.39Å; L199-I203 PolarHBondContact O-N 2.95Å
200	L	81.1	Confident	73.9	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-58.7	-44.7	174.1	179.3	60.2	0	0	0	112.2	E196 I202 I203 L204 A281 W348	E196-L200 PolarHBondContact O-N 3.45Å; L200-I202 VanDerWaalsContact C-N 3.34Å; L200-I202 PolarHBondContact O-N 3.14Å; L200-I203 PolarHBondContact O-N 3.44Å; L200-L204 HydrophobicContact CD1-CD1 4.17Å; L200-L204 HydrophobicContact CD1-CG 4.1Å; L200-L204 HydrophobicContact CG-CD1 3.95Å; L200-L204 HydrophobicContact CG-CG 4.32Å; L200-L204 WeakPolarHBondContact O-CB 3.32Å; L200-L204 VanDerWaalsContact O-CG 3.31Å; L200-L204 WeakPolarHBondContact O-CG 3.32Å; L200-L204 PolarHBondContact O-N 2.87Å; L200-A281 HydrophobicContact CD2-CB 4.44Å; L200-A281 VanDerWaalsContact CD2-O 3.31Å; L200-A281 WeakPolarHBondContact CD2-O 3.47Å; L200-A281 HydrophobicContact CG-CB 4.37Å; L200-W348 HydrophobicContact CD1-CE3 4.42Å; L200-W348 HydrophobicContact CD1-CH2 3.89Å; L200-W348 HydrophobicContact CD1-CZ3 3.37Å
201	Y	86.4	Confident	76.3	Confident	77 Å²	77	29.7 Å²	29.7	30%	0.302	15%	0.15	S	C	.	.	H	α-helix	trans	-57.6	-45.6	176.6	172	-102.2	0	0	0	111.9	P197 S198 L199 I203 L204 F205 L276 A281	P197-Y201 WeakPolarHBondContact O-CB 3.39Å; P197-Y201 PolarHBondContact O-N 2.84Å; S198-Y201 PolarHBondContact O-N 3.29Å; L199-Y201 VanDerWaalsContact C-N 3.34Å; L199-Y201 PolarHBondContact O-N 3.23Å; Y201-I203 PolarHBondContact O-N 2.91Å; Y201-L204 PolarHBondContact O-N 3.08Å; Y201-F205 VanDerWaalsContact O-CB 3.32Å; Y201-F205 WeakPolarHBondContact O-CB 3.4Å; Y201-F205 PolarHBondContact O-N 3.25Å; Y201-L276 WeakPolarHBondContact CE2-O 3.38Å; Y201-A281 HydrophobicContact CD2-CB 4.44Å
202	I	84.5	Confident	78.6	Confident	56 Å²	56	29.5 Å²	29.5	29%	0.287	15%	0.149	S	C	.	.	H	α-helix	trans	-62.6	-44	177.7	-62.4	164.9	0	0	0	110.8	S198 L199 L200 F205 D206 H383 I384	S198-I202 WeakPolarHBondContact O-CG1 3.49Å; S198-I202 PolarHBondContact O-N 3.36Å; L199-I202 PolarHBondContact O-N 2.92Å; L200-I202 VanDerWaalsContact C-N 3.34Å; L200-I202 PolarHBondContact O-N 3.14Å; I202-F205 PolarHBondContact O-N 3.41Å; I202-D206 PolarHBondContact O-N 3.39Å; I202-H383 HydrophobicContact CG2-CB 3.79Å; I202-I384 HydrophobicContact CB-CD1 4.43Å; I202-I384 HydrophobicContact CG2-CD1 3.79Å; I202-I384 HydrophobicContact CG2-CG1 3.99Å
203	I	85	Confident	80.5	Confident	2 Å²	2	32 Å²	32	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-60.3	-48.1	176.9	-68.9	162.1	0	0	0	111.1	I166 Y193 L199 L200 Y201 F205 D206 L207 W348 I384 F386	I166-I203 HydrophobicContact CD1-CD1 4.41Å; I166-I203 HydrophobicContact CD1-CG1 4.44Å; Y193-I203 HydrophobicContact CD1-CD1 3.67Å; Y193-I203 HydrophobicContact CE1-CD1 3.81Å; L199-I203 HydrophobicContact CD2-CD1 3.83Å; L199-I203 HydrophobicContact CG-CD1 4.28Å; L199-I203 WeakPolarHBondContact O-CG1 3.39Å; L199-I203 PolarHBondContact O-N 2.95Å; L200-I203 PolarHBondContact O-N 3.44Å; Y201-I203 PolarHBondContact O-N 2.91Å; I203-F205 VanDerWaalsContact C-N 3.3Å; I203-F205 PolarHBondContact O-N 3.14Å; I203-D206 PolarHBondContact O-N 2.91Å; I203-L207 HydrophobicContact CG2-CD1 3.68Å; I203-L207 HydrophobicContact CG2-CG 4.22Å; I203-L207 VanDerWaalsContact O-CB 3.29Å; I203-L207 WeakPolarHBondContact O-CB 3.31Å; I203-L207 VanDerWaalsContact O-CG 3.23Å; I203-L207 WeakPolarHBondContact O-CG 3.31Å; I203-L207 PolarHBondContact O-N 2.85Å; I203-W348 HydrophobicContact CG2-CH2 4.48Å; I203-I384 HydrophobicContact CB-CD1 4.19Å; I203-I384 HydrophobicContact CD1-CD1 4.42Å; I203-I384 HydrophobicContact CG1-CD1 3.28Å; I203-F386 HydrophobicContact CG2-CZ 4.46Å
204	L	88.2	Confident	82.3	Confident	3 Å²	3	31.2 Å²	31.2	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-62.4	-40.1	179.7	-71.1	173.6	0	0	0	111.6	L200 Y201 C208 L260 P261 I264 A281	L200-L204 HydrophobicContact CD1-CD1 4.17Å; L200-L204 HydrophobicContact CD1-CG 4.1Å; L200-L204 HydrophobicContact CG-CD1 3.95Å; L200-L204 HydrophobicContact CG-CG 4.32Å; L200-L204 WeakPolarHBondContact O-CB 3.32Å; L200-L204 VanDerWaalsContact O-CG 3.31Å; L200-L204 WeakPolarHBondContact O-CG 3.32Å; L200-L204 PolarHBondContact O-N 2.87Å; Y201-L204 PolarHBondContact O-N 3.08Å; L204-C208 WeakPolarHBondContact O-CB 3.23Å; L204-C208 PolarHBondContact O-N 3.21Å; L204-L260 HydrophobicContact CD2-CB 4.49Å; L204-L260 HydrophobicContact CD2-CD2 3.73Å; L204-L260 HydrophobicContact CD2-CG 3.98Å; L204-P261 HydrophobicContact CB-CB 4.37Å; L204-P261 HydrophobicContact CD2-CB 4.05Å; L204-P261 WeakPolarHBondContact O-CB 3.37Å; L204-I264 HydrophobicContact CD1-CD1 4.09Å; L204-I264 HydrophobicContact CD2-CD1 3.79Å; L204-A281 HydrophobicContact CD1-CB 4.1Å
205	F	89.2	Confident	83.8	Confident	66 Å²	66	31.2 Å²	31.2	29%	0.289	16%	0.155	S	C	.	.	H	α-helix	trans	-65.4	-49.2	177.9	-176.6	-103.9	0	0	0	112.1	Y201 I202 I203 C208 K209	Y201-F205 VanDerWaalsContact O-CB 3.32Å; Y201-F205 WeakPolarHBondContact O-CB 3.4Å; Y201-F205 PolarHBondContact O-N 3.25Å; I202-F205 PolarHBondContact O-N 3.41Å; I203-F205 VanDerWaalsContact C-N 3.3Å; I203-F205 PolarHBondContact O-N 3.14Å; F205-C208 WeakPolarHBondContact O-CB 3.24Å; F205-C208 PolarHBondContact O-N 2.94Å; F205-K209 HydrophobicContact CD1-CD 4.5Å; F205-K209 HydrophobicContact CE1-CD 4.07Å; F205-K209 PolarHBondContact O-N 2.77Å
206	D	88.7	Confident	85.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.7	-38.3	178.6	-76.5	-7.2	0	0	0	111.7	I202 I203 C208 K209 L210 L382 H383 I384 F386	I202-D206 PolarHBondContact O-N 3.39Å; I203-D206 PolarHBondContact O-N 2.91Å; D206-C208 VanDerWaalsContact C-N 3.32Å; D206-C208 PolarHBondContact O-N 3.11Å; D206-K209 WeakPolarHBondContact O-CB 3.36Å; D206-K209 PolarHBondContact O-N 3.08Å; D206-L210 WeakPolarHBondContact O-CB 3.4Å; D206-L210 PolarHBondContact O-N 3.41Å; D206-L382 HydrophobicContact CB-CD2 3.99Å; D206-H383 IonicContact OD1-CE1 2.93Å; D206-H383 IonicContact OD1-CG 3.77Å; D206-H383 IonicContact OD1-ND1 2.88Å; D206-H383 PolarHBondContact OD1-ND1 2.88Å; D206-H383 WeakPolarHBondContact OD2-CA 3.09Å; D206-H383 WeakPolarHBondContact OD2-CB 3.39Å; D206-H383 IonicContact OD2-CG 2.98Å; D206-H383 PolarHBondContact OD2-N 3.46Å; D206-H383 IonicContact OD2-ND1 3.95Å; D206-I384 PolarHBondContact OD2-N 2.96Å; D206-F386 HydrophobicContact CB-CE2 3.65Å; D206-F386 HydrophobicContact CB-CZ 4.4Å
207	L	89.6	Confident	86.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.4	-34.4	172.7	-74.3	174.1	0	0	0	112.4	I203 L210 K211 P261 M353 F386	I203-L207 HydrophobicContact CG2-CD1 3.68Å; I203-L207 HydrophobicContact CG2-CG 4.22Å; I203-L207 VanDerWaalsContact O-CB 3.29Å; I203-L207 WeakPolarHBondContact O-CB 3.31Å; I203-L207 VanDerWaalsContact O-CG 3.23Å; I203-L207 WeakPolarHBondContact O-CG 3.31Å; I203-L207 PolarHBondContact O-N 2.85Å; L207-L210 PolarHBondContact O-N 3.27Å; L207-K211 WeakPolarHBondContact O-CB 3.47Å; L207-K211 PolarHBondContact O-N 2.87Å; L207-P261 HydrophobicContact CB-CG 3.91Å; L207-M353 HydrophobicContact CB-CE 4.43Å; L207-M353 HydrophobicContact CD2-CE 3.65Å; L207-F386 HydrophobicContact CD2-CD1 4.34Å; L207-F386 HydrophobicContact CD2-CE1 3.67Å; L207-F386 HydrophobicContact CD2-CZ 3.89Å; L207-F386 HydrophobicContact CG-CE1 4.12Å; L207-F386 HydrophobicContact CG-CZ 3.89Å
208	C	92.3	Very high	87.3	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-65.8	-44.7	174.4	178.4	0	0	0	0	111.2	L204 F205 D206 L210 K211 L212 P261 C273 E274	L204-C208 WeakPolarHBondContact O-CB 3.23Å; L204-C208 PolarHBondContact O-N 3.21Å; F205-C208 WeakPolarHBondContact O-CB 3.24Å; F205-C208 PolarHBondContact O-N 2.94Å; D206-C208 VanDerWaalsContact C-N 3.32Å; D206-C208 PolarHBondContact O-N 3.11Å; C208-L210 VanDerWaalsContact C-N 3.3Å; C208-L210 PolarHBondContact O-N 3.23Å; C208-K211 WeakPolarHBondContact O-CB 3.38Å; C208-K211 PolarHBondContact O-N 3.2Å; C208-L212 WeakPolarHBondContact O-CG 3.31Å; C208-L212 PolarHBondContact O-N 2.97Å; C208-P261 HydrophobicContact CB-CB 4.22Å; C208-P261 HydrophobicContact CB-CG 4.32Å; C208-C273 HydrophobicContact CB-CB 3.74Å; C208-C273 WeakPolarHBondContact CB-SG 3.47Å; C208-C273 WeakPolarHBondContact SG-CB 3.31Å; C208-C273 CovalentContact SG-SG 2.03Å; C208-C273 PolarHBondContact SG-SG 2.9Å; C208-E274 PolarHBondContact SG-N 3.18Å; C208-E274 VanDerWaalsContact SG-N 3.44Å
209	K	91.3	Very high	87.9	Confident	66 Å²	66	34.7 Å²	34.7	29%	0.287	17%	0.168	S	C	.	.	H	α-helix	trans	-58.2	-43.2	172.4	-76.1	-178.3	172	178.3	0	112	F205 D206 L212 R213 L382	F205-K209 HydrophobicContact CD1-CD 4.5Å; F205-K209 HydrophobicContact CE1-CD 4.07Å; F205-K209 PolarHBondContact O-N 2.77Å; D206-K209 WeakPolarHBondContact O-CB 3.36Å; D206-K209 PolarHBondContact O-N 3.08Å; K209-L212 PolarHBondContact O-N 2.86Å; K209-R213 WeakPolarHBondContact O-CG 3.43Å; K209-R213 PolarHBondContact O-N 3.42Å; K209-L382 HydrophobicContact CB-CD2 4.03Å; K209-L382 HydrophobicContact CD-CD2 4.13Å
210	L	90.2	Very high	88.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.8	-45.9	178.7	-151.3	167.8	0	0	0	110.8	F164 D206 L207 C208 L212 R213 I214 M353 L378 L382 F386	F164-L210 HydrophobicContact CD1-CD1 4.1Å; F164-L210 HydrophobicContact CD2-CD1 4.27Å; F164-L210 HydrophobicContact CD2-CD2 4.44Å; F164-L210 HydrophobicContact CE1-CD1 4.03Å; F164-L210 HydrophobicContact CE1-CD2 4.1Å; F164-L210 HydrophobicContact CE2-CD1 4.19Å; F164-L210 HydrophobicContact CE2-CD2 3.61Å; F164-L210 HydrophobicContact CG-CD1 4.22Å; F164-L210 HydrophobicContact CZ-CD1 4.09Å; F164-L210 HydrophobicContact CZ-CD2 3.43Å; F164-L210 VanDerWaalsContact CZ-CD2 3.43Å; F164-L210 HydrophobicContact CZ-CG 4.41Å; D206-L210 WeakPolarHBondContact O-CB 3.4Å; D206-L210 PolarHBondContact O-N 3.41Å; L207-L210 PolarHBondContact O-N 3.27Å; C208-L210 VanDerWaalsContact C-N 3.3Å; C208-L210 PolarHBondContact O-N 3.23Å; L210-L212 VanDerWaalsContact C-N 3.33Å; L210-L212 PolarHBondContact O-N 3.16Å; L210-R213 PolarHBondContact O-N 2.69Å; L210-I214 HydrophobicContact CD2-CD1 3.41Å; L210-I214 VanDerWaalsContact CD2-CD1 3.41Å; L210-I214 HydrophobicContact CD2-CG1 3.99Å; L210-I214 WeakPolarHBondContact O-CG1 3.44Å; L210-I214 PolarHBondContact O-N 2.91Å; L210-M353 HydrophobicContact CB-CE 4.4Å; L210-M353 HydrophobicContact CD2-CE 4.3Å; L210-L378 HydrophobicContact CD2-CD1 4.42Å; L210-L382 HydrophobicContact CD1-CD1 4.47Å; L210-F386 HydrophobicContact CD1-CB 4.3Å; L210-F386 HydrophobicContact CD1-CG 4.31Å
211	K	91.9	Very high	88.7	Confident	25 Å²	25	38.4 Å²	38.4	11%	0.109	18%	0.184	C	C	.	.	H	α-helix	trans	-53.6	-49.4	172.4	-178.3	-150.5	175.5	174.3	0	111.4	L207 C208 R213 I214 T215 I257 S262	L207-K211 WeakPolarHBondContact O-CB 3.47Å; L207-K211 PolarHBondContact O-N 2.87Å; C208-K211 WeakPolarHBondContact O-CB 3.38Å; C208-K211 PolarHBondContact O-N 3.2Å; K211-R213 PolarHBondContact O-N 3.2Å; K211-I214 PolarHBondContact O-N 2.95Å; K211-T215 WeakPolarHBondContact O-CG2 3.39Å; K211-T215 PolarHBondContact O-N 3.39Å; K211-T215 PolarHBondContact O-OG1 2.82Å; K211-I257 HydrophobicContact CG-CB 4.28Å; K211-I257 HydrophobicContact CG-CD1 4.18Å; K211-S262 VanDerWaalsContact NZ-CB 3.31Å
212	L	90.8	Very high	88.6	Confident	48 Å²	48	41.3 Å²	41.3	25%	0.251	20%	0.201	S	C	.	.	H	α-helix	trans	-60.4	-45.6	-178.3	-72.6	165.1	0	0	0	111.4	C208 K209 L210 I214 T215 H216 E274	C208-L212 WeakPolarHBondContact O-CG 3.31Å; C208-L212 PolarHBondContact O-N 2.97Å; K209-L212 PolarHBondContact O-N 2.86Å; L210-L212 VanDerWaalsContact C-N 3.33Å; L210-L212 PolarHBondContact O-N 3.16Å; L212-I214 VanDerWaalsContact C-N 3.33Å; L212-I214 PolarHBondContact O-N 3.46Å; L212-T215 WeakPolarHBondContact CA-OG1 3.13Å; L212-T215 PolarHBondContact O-N 3.38Å; L212-T215 VanDerWaalsContact O-N 3.15Å; L212-T215 PolarHBondContact O-OG1 2.72Å; L212-H216 PolarHBondContact O-CD2 2.91Å; L212-H216 PolarHBondContact O-N 3.3Å; L212-E274 HydrophobicContact CD1-CG 3.83Å; L212-E274 WeakPolarHBondContact CD1-OE1 3.24Å
213	R	90.8	Very high	88.6	Confident	81 Å²	81	39.8 Å²	39.8	31%	0.306	19%	0.193	S	C	.	.	H	α-helix	trans	-57.1	-45.4	175.6	-71.2	175.9	-179.9	176.3	-3.9	112	K209 L210 K211 T215 H216 L217 R377 L378 E380	K209-R213 WeakPolarHBondContact O-CG 3.43Å; K209-R213 PolarHBondContact O-N 3.42Å; L210-R213 PolarHBondContact O-N 2.69Å; K211-R213 PolarHBondContact O-N 3.2Å; R213-T215 PolarHBondContact O-N 3.26Å; R213-H216 PolarHBondContact O-N 3.47Å; R213-L217 PolarHBondContact O-N 3.47Å; R213-R377 PolarHBondContact NH1-O 3.44Å; R213-L378 HydrophobicContact CB-CD1 4.04Å; R213-L378 PolarHBondContact NH1-O 3.39Å; R213-E380 VanDerWaalsContact CZ-O 3.26Å; R213-E380 PolarHBondContact NH1-O 3.49Å; R213-E380 PolarHBondContact NH2-O 3.4Å
214	I	89.4	Confident	88.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-42.8	176.6	-65.7	170.3	0	0	0	111.2	F164 L210 K211 L212 H216 L217 Y220 I257 M353 L355 F365 I369 L378	F164-I214 HydrophobicContact CE2-CD1 4.28Å; F164-I214 HydrophobicContact CZ-CD1 4.25Å; L210-I214 HydrophobicContact CD2-CD1 3.41Å; L210-I214 VanDerWaalsContact CD2-CD1 3.41Å; L210-I214 HydrophobicContact CD2-CG1 3.99Å; L210-I214 WeakPolarHBondContact O-CG1 3.44Å; L210-I214 PolarHBondContact O-N 2.91Å; K211-I214 PolarHBondContact O-N 2.95Å; L212-I214 VanDerWaalsContact C-N 3.33Å; L212-I214 PolarHBondContact O-N 3.46Å; I214-H216 PolarHBondContact O-N 3.36Å; I214-L217 WeakPolarHBondContact O-CB 3.29Å; I214-L217 PolarHBondContact O-N 3.33Å; I214-L217 VanDerWaalsContact O-N 3.17Å; I214-Y220 HydrophobicContact CG2-CD2 4.34Å; I214-I257 HydrophobicContact CB-CD1 4.25Å; I214-I257 HydrophobicContact CG2-CD1 3.8Å; I214-M353 HydrophobicContact CD1-SD 4.21Å; I214-L355 HydrophobicContact CG2-CD2 3.92Å; I214-F365 HydrophobicContact CG2-CE2 4.19Å; I214-F365 HydrophobicContact CG2-CZ 4.03Å; I214-I369 HydrophobicContact CD1-CD1 4.45Å; I214-I369 HydrophobicContact CG1-CD1 4.45Å; I214-L378 HydrophobicContact CG1-CD1 4.29Å
215	T	88.7	Confident	88.5	Confident	34 Å²	34	41.7 Å²	41.7	21%	0.209	20%	0.201	C	C	.	.	H	α-helix	trans	-68.9	-18.2	179.2	54.5	0	0	0	0	114.2	K211 L212 R213 Y220 Q221 I257	K211-T215 WeakPolarHBondContact O-CG2 3.39Å; K211-T215 PolarHBondContact O-N 3.39Å; K211-T215 PolarHBondContact O-OG1 2.82Å; L212-T215 WeakPolarHBondContact CA-OG1 3.13Å; L212-T215 PolarHBondContact O-N 3.38Å; L212-T215 VanDerWaalsContact O-N 3.15Å; L212-T215 PolarHBondContact O-OG1 2.72Å; R213-T215 PolarHBondContact O-N 3.26Å; T215-Y220 HydrophobicContact CG2-CD1 4.45Å; T215-Y220 HydrophobicContact CG2-CE1 3.97Å; T215-Q221 PolarHBondContact O-NE2 3.42Å; T215-I257 HydrophobicContact CG2-CD1 3.59Å; T215-I257 HydrophobicContact CG2-CG1 4.08Å
216	H	89.5	Confident	87.9	Confident	140 Å²	140	45.5 Å²	45.5	65%	0.648	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-11.4	175	-78.9	-64	0	0	0	113.5	L212 R213 I214	L212-H216 PolarHBondContact O-CD2 2.91Å; L212-H216 PolarHBondContact O-N 3.3Å; R213-H216 PolarHBondContact O-N 3.47Å; I214-H216 PolarHBondContact O-N 3.36Å
217	L	89.2	Confident	87.1	Confident	15 Å²	15	48.1 Å²	48.1	8%	0.079	22%	0.224	C	C	.	.	S	Bend	trans	-63.1	138.6	175.3	-64.7	175.5	0	0	0	110.5	R213 I214 Y220 Q221 F365 E368 E372	R213-L217 PolarHBondContact O-N 3.47Å; I214-L217 WeakPolarHBondContact O-CB 3.29Å; I214-L217 PolarHBondContact O-N 3.33Å; I214-L217 VanDerWaalsContact O-N 3.17Å; L217-Y220 PolarHBondContact O-N 3.44Å; L217-Q221 PolarHBondContact O-N 3.2Å; L217-F365 HydrophobicContact CD1-CE2 3.99Å; L217-E368 HydrophobicContact CD2-CG 4.16Å; L217-E372 HydrophobicContact CD2-CG 4.06Å
218	S	87.8	Confident	85.7	Confident	66 Å²	66	51.1 Å²	51.1	46%	0.462	25%	0.246	S	C	.	.	H	α-helix	trans	-63.4	-46.8	-175.6	59.4	0	0	0	0	111.3	Y220 Q221 E222 E368	S218-Y220 VanDerWaalsContact C-N 3.3Å; S218-Y220 PolarHBondContact O-N 3.35Å; S218-Q221 PolarHBondContact O-N 3.02Å; S218-Q221 VanDerWaalsContact O-N 3.14Å; S218-E222 PolarHBondContact O-N 3.11Å; S218-E368 PolarHBondContact N-OE1 3.01Å; S218-E368 PolarHBondContact OG-OE1 2.91Å; S218-E368 PolarHBondContact OG-OE2 3.17Å
219	T	85.8	Confident	83.6	Confident	16 Å²	16	56 Å²	56	10%	0.098	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-34	178.7	58.6	0	0	0	0	112.6	Q221 E222 L223 L364 F365 E368	T219-Q221 VanDerWaalsContact C-N 3.34Å; T219-Q221 PolarHBondContact O-N 2.98Å; T219-E222 PolarHBondContact O-N 3.4Å; T219-L223 WeakPolarHBondContact O-CB 3.38Å; T219-L223 VanDerWaalsContact O-CG 3.3Å; T219-L223 WeakPolarHBondContact O-CG 3.29Å; T219-L223 PolarHBondContact O-N 3.06Å; T219-L364 HydrophobicContact CG2-CB 4.12Å; T219-F365 WeakPolarHBondContact OG1-CA 3.27Å; T219-F365 WeakPolarHBondContact OG1-CD2 3.39Å; T219-E368 WeakPolarHBondContact CB-OE2 3.12Å; T219-E368 HydrophobicContact CG2-CB 4.45Å; T219-E368 WeakPolarHBondContact CG2-OE2 3.48Å; T219-E368 PolarHBondContact N-OE2 3.38Å; T219-E368 VanDerWaalsContact N-OE2 3.14Å; T219-E368 PolarHBondContact OG1-OE2 3.13Å
220	Y	87.8	Confident	81.3	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-42.2	175.8	-179	-90.1	0	0	0	111.2	I214 T215 L217 S218 E222 L223 C224 C255 I257 L355 I357 F365	I214-Y220 HydrophobicContact CG2-CD2 4.34Å; T215-Y220 HydrophobicContact CG2-CD1 4.45Å; T215-Y220 HydrophobicContact CG2-CE1 3.97Å; L217-Y220 PolarHBondContact O-N 3.44Å; S218-Y220 VanDerWaalsContact C-N 3.3Å; S218-Y220 PolarHBondContact O-N 3.35Å; Y220-E222 VanDerWaalsContact C-N 3.28Å; Y220-E222 PolarHBondContact O-N 3.38Å; Y220-L223 PolarHBondContact O-N 2.92Å; Y220-C224 HydrophobicContact CD1-CB 4.5Å; Y220-C224 HydrophobicContact CE1-CB 4.1Å; Y220-C224 VanDerWaalsContact O-CB 3.23Å; Y220-C224 WeakPolarHBondContact O-CB 3.26Å; Y220-C224 PolarHBondContact O-N 2.98Å; Y220-C255 PolarHBondContact OH-O 3.39Å; Y220-I257 HydrophobicContact CE2-CD1 3.98Å; Y220-I257 HydrophobicContact CE2-CG1 3.94Å; Y220-I257 WeakPolarHBondContact OH-CG1 3.45Å; Y220-L355 HydrophobicContact CE2-CB 4.38Å; Y220-L355 HydrophobicContact CE2-CD2 4.42Å; Y220-I357 HydrophobicContact CD2-CG2 3.75Å; Y220-I357 HydrophobicContact CE2-CG2 3.75Å; Y220-F365 HydrophobicContact CD2-CE2 4.18Å
221	Q	86	Confident	78.7	Confident	105 Å²	105	66 Å²	66	49%	0.491	33%	0.33	S	S	.	.	H	α-helix	trans	-67.6	-29.9	-179.7	-66.6	-178.4	2.1	0	0	112.8	T215 L217 S218 T219	T215-Q221 PolarHBondContact O-NE2 3.42Å; L217-Q221 PolarHBondContact O-N 3.2Å; S218-Q221 PolarHBondContact O-N 3.02Å; S218-Q221 VanDerWaalsContact O-N 3.14Å; T219-Q221 VanDerWaalsContact C-N 3.34Å; T219-Q221 PolarHBondContact O-N 2.98Å
222	E	84.4	Confident	75.9	Confident	139 Å²	139	74.9 Å²	74.9	65%	0.65	36%	0.364	S	S	*	.	H	α-helix	trans	-75.4	-42.3	176.2	-68.5	-177.8	170.2	0	0	112	S218 T219 Y220	S218-E222 PolarHBondContact O-N 3.11Å; T219-E222 PolarHBondContact O-N 3.4Å; Y220-E222 VanDerWaalsContact C-N 3.28Å; Y220-E222 PolarHBondContact O-N 3.38Å
223	L	85.2	Confident	72.9	Confident	24 Å²	24	79.5 Å²	79.5	13%	0.126	39%	0.389	C	S	.	.	H	α-helix	trans	-92.4	-9.4	-172.3	-62.1	174.7	0	0	0	114.4	T219 Y220 I357 H358 T360 G361 F365	T219-L223 WeakPolarHBondContact O-CB 3.38Å; T219-L223 VanDerWaalsContact O-CG 3.3Å; T219-L223 WeakPolarHBondContact O-CG 3.29Å; T219-L223 PolarHBondContact O-N 3.06Å; Y220-L223 PolarHBondContact O-N 2.92Å; L223-I357 HydrophobicContact CB-CB 4.23Å; L223-I357 HydrophobicContact CB-CG2 4.46Å; L223-I357 CarbonylContact O-C 3.55Å; L223-I357 WeakPolarHBondContact O-CA 3.44Å; L223-H358 PolarHBondContact O-CD2 2.94Å; L223-H358 PolarHBondContact O-N 3.41Å; L223-T360 VanDerWaalsContact CD2-O 3.27Å; L223-T360 WeakPolarHBondContact CD2-O 3.49Å; L223-G361 WeakPolarHBondContact CD1-O 3.39Å; L223-F365 HydrophobicContact CD1-CB 4.07Å
224	C	87.6	Confident	70.2	Confident	3 Å²	3	82.1 Å²	82.1	2%	0.02	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-63.8	143.3	-177.3	74	0	0	0	0	112.2	Y220 R226 C254 P356	Y220-C224 HydrophobicContact CD1-CB 4.5Å; Y220-C224 HydrophobicContact CE1-CB 4.1Å; Y220-C224 VanDerWaalsContact O-CB 3.23Å; Y220-C224 WeakPolarHBondContact O-CB 3.26Å; Y220-C224 PolarHBondContact O-N 2.98Å; C224-R226 PolarHBondContact O-N 2.91Å; C224-C254 HydrophobicContact CB-CB 3.6Å; C224-C254 WeakPolarHBondContact CB-SG 3.2Å; C224-C254 VanDerWaalsContact SG-CA 3.58Å; C224-C254 WeakPolarHBondContact SG-CB 3.5Å; C224-C254 CovalentContact SG-SG 2.03Å; C224-C254 PolarHBondContact SG-SG 2.89Å; C224-P356 WeakPolarHBondContact CA-O 3.21Å
225	Y	81.7	Confident	67.3	Low	42 Å²	42	88.3 Å²	88.3	17%	0.165	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-62.3	139.1	164	-77.4	-85.2	0	0	0	109.9	Y159 C254 C255 P356 I357 H358	Y159-Y225 HydrophobicContact CD1-CD2 4.11Å; Y159-Y225 AromaticContact CD1-CE2 3.82Å; Y159-Y225 HydrophobicContact CD1-CE2 3.82Å; Y159-Y225 AromaticContact CE1-CD2 3.53Å; Y159-Y225 HydrophobicContact CE1-CD2 3.53Å; Y159-Y225 AromaticContact CE1-CE2 3.52Å; Y159-Y225 HydrophobicContact CE1-CE2 3.52Å; Y159-Y225 HydrophobicContact CE1-CG 4.34Å; Y225-C254 CarbonylContact O-C 3.5Å; Y225-C254 WeakPolarHBondContact O-CA 3.44Å; Y225-C255 VanDerWaalsContact C-SG 3.52Å; Y225-C255 WeakPolarHBondContact CB-SG 3.35Å; Y225-C255 PolarHBondContact O-N 3.06Å; Y225-C255 PolarHBondContact O-SG 2.9Å; Y225-P356 HydrophobicContact CD2-CB 4.18Å; Y225-P356 WeakPolarHBondContact CD2-O 3.4Å; Y225-P356 PolarHBondContact N-O 3.37Å; Y225-I357 VanDerWaalsContact CE2-O 3.31Å; Y225-I357 WeakPolarHBondContact CE2-O 3.27Å; Y225-H358 AromaticContact CD1-CE1 3.45Å; Y225-H358 VanDerWaalsContact CD1-CE1 3.45Å; Y225-H358 WeakPolarHBondContact CD1-CE1 3.45Å; Y225-H358 AromaticContact CD1-NE2 3.85Å; Y225-H358 AromaticContact CE1-CE1 3.16Å; Y225-H358 WeakPolarHBondContact CE1-CE1 3.47Å; Y225-H358 AromaticContact CE1-ND1 3.46Å; Y225-H358 WeakPolarHBondContact CE1-ND1 3.48Å; Y225-H358 AromaticContact CE1-NE2 4Å; Y225-H358 AromaticContact CZ-CE1 3.67Å; Y225-H358 AromaticContact CZ-ND1 3.44Å
226	R	77.8	Confident	64.8	Low	145 Å²	145	94 Å²	94	55%	0.547	47%	0.471	S	S	.	.	B	Isolated β-bridge	trans	-98.6	140.5	-178.4	-64.7	-179	179.2	170.8	4.6	111.3	C224 S228 N252	C224-R226 PolarHBondContact O-N 2.91Å; R226-S228 PolarHBondContact O-N 3.2Å; R226-N252 PolarHBondContact NH1-ND2 3.02Å
227	K	71.2	Confident	62.1	Low	55 Å²	55	94.8 Å²	94.8	24%	0.239	48%	0.479	C	S	.	.			trans	-69.6	113.4	172.8	-64	-178.8	-175.9	167.3	0	109.2	E135 S229 S253 C254	E135-K227 VanDerWaalsContact O-CE 3.29Å; E135-K227 WeakPolarHBondContact O-CE 3.23Å; K227-S229 PolarHBondContact O-N 3.3Å; K227-S253 WeakPolarHBondContact CB-O 3.44Å; K227-S253 WeakPolarHBondContact CD-OG 3.33Å; K227-S253 WeakPolarHBondContact CG-O 3.28Å; K227-S253 PolarHBondContact N-O 2.83Å; K227-C254 WeakPolarHBondContact CE-O 3.31Å
228	S	61.1	Low	59.3	Low	64 Å²	64	100 Å²	100	45%	0.448	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-70.5	126.9	174.7	73.9	0	0	0	0	110.4	T141 R226 K230	T141-S228 PolarHBondContact OG1-OG 2.96Å; R226-S228 PolarHBondContact O-N 3.2Å; S228-K230 PolarHBondContact O-N 3.09Å
229	S	47.3	Very low	56.7	Low	103 Å²	103	102.4 Å²	102.4	72%	0.72	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-69	124.4	167.1	59.4	0	0	0	0	108.8	K227 L231	K227-S229 PolarHBondContact O-N 3.3Å; S229-L231 PolarHBondContact O-N 2.89Å; S229-L231 VanDerWaalsContact O-N 3.13Å
230	K	42.5	Very low	54.4	Low	118 Å²	118	106.4 Å²	106.4	51%	0.513	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-51.3	124.5	169.6	-102.5	175.7	177.3	174.4	0	107.6	D130 S228 Y232	D130-K230 IonicContact OD2-NZ 3Å; D130-K230 PolarHBondContact OD2-NZ 3.13Å; S228-K230 PolarHBondContact O-N 3.09Å; K230-Y232 PolarHBondContact O-N 3.06Å
231	L	35.7	Very low	52.2	Low	158 Å²	158	112.9 Å²	112.9	83%	0.827	58%	0.578	S	S	*	*			trans	-56.7	80.5	165.7	-143.2	110.8	0	0	0	108.7	S229	S229-L231 PolarHBondContact O-N 2.89Å; S229-L231 VanDerWaalsContact O-N 3.13Å
232	Y	33.5	Very low	50.3	Low	212 Å²	212	116.2 Å²	116.2	83%	0.831	60%	0.599	S	S	*	*			trans	-119.5	66.4	161.9	-113.1	-79.1	0	0	0	106	K230	K230-Y232 PolarHBondContact O-N 3.06Å
233	N	28.9	Very low	48	Very low	145 Å²	145	117.9 Å²	117.9	78%	0.775	60%	0.604	S	S	*	*	S	Bend	trans	-140	116.7	141.5	-89.8	-22.4	0	0	0	104.1	T235	N233-T235 PolarHBondContact O-N 3.04Å
234	N	32.5	Very low	46	Very low	136 Å²	136	124.5 Å²	124.5	73%	0.727	64%	0.638	S	S	*	*			trans	-39.4	137	156.7	-73.9	-25	0	0	0	107.7	H236	N234-H236 PolarHBondContact O-N 2.95Å
235	T	29.7	Very low	43.3	Very low	130 Å²	130	131 Å²	131	80%	0.798	67%	0.671	S	S	*	*			trans	-25.8	85	149.1	48	0	0	0	0	112.1	N233	N233-T235 PolarHBondContact O-N 3.04Å
236	H	36.3	Very low	41.3	Very low	155 Å²	155	134.6 Å²	134.6	72%	0.718	69%	0.691	S	S	*	*			trans	-106.1	75.4	149.7	-86.3	-69.3	0	0	0	105.1	N234 L238	N234-H236 PolarHBondContact O-N 2.95Å; H236-L238 HydrophobicContact CB-CD1 4.21Å; H236-L238 HydrophobicContact CB-CG 4.38Å; H236-L238 PolarHBondContact O-N 2.92Å
237	L	32.3	Very low	39.1	Very low	155 Å²	155	134.3 Å²	134.3	81%	0.812	70%	0.701	S	S	*	*			trans	-63.1	72.1	151.7	-144.2	127.1	0	0	0	105.8	T239	L237-T239 VanDerWaalsContact C-N 3.33Å; L237-T239 HydrophobicContact CD2-CG2 4.2Å; L237-T239 PolarHBondContact O-N 2.95Å
238	L	30.7	Very low	37.8	Very low	125 Å²	125	142 Å²	142	65%	0.654	73%	0.729	S	S	*	*			trans	-83	89.9	170.9	-92.4	161.5	0	0	0	106.3	H236 V240	H236-L238 HydrophobicContact CB-CD1 4.21Å; H236-L238 HydrophobicContact CB-CG 4.38Å; H236-L238 PolarHBondContact O-N 2.92Å; L238-V240 VanDerWaalsContact C-N 3.29Å; L238-V240 HydrophobicContact CD2-CG2 4.26Å; L238-V240 PolarHBondContact O-N 3.37Å
239	T	32.3	Very low	36.6	Very low	117 Å²	117	144.1 Å²	144.1	72%	0.718	74%	0.739	S	S	*	*			trans	-61.9	94.7	157.2	49.3	0	0	0	0	107.8	L237	L237-T239 VanDerWaalsContact C-N 3.33Å; L237-T239 HydrophobicContact CD2-CG2 4.2Å; L237-T239 PolarHBondContact O-N 2.95Å
240	V	37.3	Very low	36.2	Very low	99 Å²	99	148 Å²	148	60%	0.6	74%	0.743	S	S	*	*			trans	-121.2	112.7	160.9	-175.8	0	0	0	0	105.2	L238	L238-V240 VanDerWaalsContact C-N 3.29Å; L238-V240 HydrophobicContact CD2-CG2 4.26Å; L238-V240 PolarHBondContact O-N 3.37Å
241	D	42.6	Very low	36.6	Very low	141 Å²	141	149.8 Å²	149.8	75%	0.754	75%	0.752	S	S	*	*	S	Bend	trans	63.2	52.7	172	-55.9	-19.5	0	0	0	119	K243	D241-K243 PolarHBondContact O-N 3.32Å
242	N	45.3	Very low	37.5	Very low	174 Å²	174	148 Å²	148	93%	0.93	74%	0.744	S	S	*	*	S	Bend	trans	45.9	18.5	158.3	-80.3	-6.8	0	0	0	118.4
243	K	37.4	Very low	39.3	Very low	175 Å²	175	140.2 Å²	140.2	76%	0.761	72%	0.721	S	S	*	*			trans	-122.8	107.4	177.6	-87.4	180	175.7	174.6	0	109.1	D241 I245	D241-K243 PolarHBondContact O-N 3.32Å; K243-I245 PolarHBondContact O-N 2.86Å
244	I	41.5	Very low	41.9	Very low	162 Å²	162	135.1 Å²	135.1	83%	0.831	70%	0.696	S	S	*	*			trans	-69.8	98	170.8	-58	169.5	0	0	0	107.2	I246	I244-I246 HydrophobicContact CG2-CG1 4.13Å
245	I	32.5	Very low	44.5	Very low	140 Å²	140	128.8 Å²	128.8	72%	0.718	66%	0.662	S	S	*	*			trans	-95.4	106.3	169.5	-58.4	175.6	0	0	0	106.9	K243 D247	K243-I245 PolarHBondContact O-N 2.86Å; I245-D247 PolarHBondContact O-N 3.42Å
246	I	39.4	Very low	47.2	Very low	117 Å²	117	123.8 Å²	123.8	60%	0.6	63%	0.632	S	S	*	*			trans	-77.3	105	171.7	-55.3	172.3	0	0	0	106.9	I244 R248	I244-I246 HydrophobicContact CG2-CG1 4.13Å; I246-R248 VanDerWaalsContact C-N 3.32Å; I246-R248 HydrophobicContact CB-CG 4.38Å; I246-R248 HydrophobicContact CG2-CG 3.72Å; I246-R248 PolarHBondContact O-N 3.38Å
247	D	31.8	Very low	49.8	Very low	139 Å²	139	116.4 Å²	116.4	74%	0.743	60%	0.598	S	S	*	*			trans	-69	90.8	169.9	-117.4	-2	0	0	0	109	I245 T249	I245-D247 PolarHBondContact O-N 3.42Å; D247-T249 PolarHBondContact O-N 3.48Å
248	R	42.4	Very low	52.5	Low	218 Å²	218	109 Å²	109	82%	0.823	56%	0.559	S	S	*	*			trans	-77.6	12	-178.7	-73	-174.8	176.6	175.7	-1.3	114.2	I246	I246-R248 VanDerWaalsContact C-N 3.32Å; I246-R248 HydrophobicContact CB-CG 4.38Å; I246-R248 HydrophobicContact CG2-CG 3.72Å; I246-R248 PolarHBondContact O-N 3.38Å
249	T	36.8	Very low	55.4	Low	108 Å²	108	103 Å²	103	66%	0.663	53%	0.528	S	S	*	.			trans	-110.4	7.6	-156.4	52.2	0	0	0	0	117.5	D247	D247-T249 PolarHBondContact O-N 3.48Å
250	K	39.4	Very low	58.1	Low	184 Å²	184	97.6 Å²	97.6	80%	0.8	50%	0.495	S	S	*	.	S	Bend	trans	-127.3	94.3	-179.3	-80.3	176.4	177.6	170	0	115.4
251	H	49.8	Very low	60.7	Low	155 Å²	155	92.9 Å²	92.9	72%	0.718	47%	0.466	S	S	*	.			trans	71.8	60.7	154.1	-59.8	-64.1	0	0	0	121.2	S253	H251-S253 VanDerWaalsContact C-N 3.25Å; H251-S253 PolarHBondContact O-N 3.48Å
252	N	54.7	Low	63	Low	121 Å²	121	86.4 Å²	86.4	65%	0.647	43%	0.432	S	S	*	.			trans	-74.9	73.1	154.1	-83.6	-12	0	0	0	110.5	R226	R226-N252 PolarHBondContact NH1-ND2 3.02Å
253	S	72.5	Confident	65.1	Low	49 Å²	49	78.1 Å²	78.1	34%	0.343	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-89.3	137.1	177.1	53.9	0	0	0	0	111.3	K227 H251	K227-S253 WeakPolarHBondContact CB-O 3.44Å; K227-S253 WeakPolarHBondContact CD-OG 3.33Å; K227-S253 WeakPolarHBondContact CG-O 3.28Å; K227-S253 PolarHBondContact N-O 2.83Å; H251-S253 VanDerWaalsContact C-N 3.25Å; H251-S253 PolarHBondContact O-N 3.48Å
254	C	83.3	Confident	67.6	Low	38 Å²	38	69.9 Å²	69.9	26%	0.257	35%	0.352	S	S	.	.	B	Isolated β-bridge	trans	-63	147.9	174.8	-66.2	0	0	0	0	111.7	C224 Y225 K227	C224-C254 HydrophobicContact CB-CB 3.6Å; C224-C254 WeakPolarHBondContact CB-SG 3.2Å; C224-C254 VanDerWaalsContact SG-CA 3.58Å; C224-C254 WeakPolarHBondContact SG-CB 3.5Å; C224-C254 CovalentContact SG-SG 2.03Å; C224-C254 PolarHBondContact SG-SG 2.89Å; Y225-C254 CarbonylContact O-C 3.5Å; Y225-C254 WeakPolarHBondContact O-CA 3.44Å; K227-C254 WeakPolarHBondContact CE-O 3.31Å
255	C	85.8	Confident	69.9	Low	2 Å²	2	62.3 Å²	62.3	1%	0.014	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-58.1	143.5	163.9	-55.6	0	0	0	0	110	C137 Y220 Y225 P356	C137-C255 HydrophobicContact CB-CB 3.83Å; C137-C255 WeakPolarHBondContact CB-SG 3.26Å; C137-C255 WeakPolarHBondContact SG-CB 3.08Å; C137-C255 CovalentContact SG-SG 2.01Å; C137-C255 PolarHBondContact SG-SG 3.32Å; Y220-C255 PolarHBondContact OH-O 3.39Å; Y225-C255 VanDerWaalsContact C-SG 3.52Å; Y225-C255 WeakPolarHBondContact CB-SG 3.35Å; Y225-C255 PolarHBondContact O-N 3.06Å; Y225-C255 PolarHBondContact O-SG 2.9Å; C255-P356 HydrophobicContact CB-CB 3.86Å; C255-P356 HydrophobicContact CB-CG 3.62Å
256	S	87.8	Confident	72.5	Confident	25 Å²	25	55.8 Å²	55.8	18%	0.175	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-78.6	136.2	178.3	-68.8	0	0	0	0	111.3	E135 W258	E135-S256 PolarHBondContact O-N 2.87Å; E135-S256 VanDerWaalsContact O-N 3.11Å; S256-W258 PolarHBondContact O-N 2.89Å
257	I	89.4	Confident	74.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-54.6	133.6	172.6	-58.9	178.1	0	0	0	109.2	K211 I214 T215 Y220 C259 S262 M353 V354 L355	K211-I257 HydrophobicContact CG-CB 4.28Å; K211-I257 HydrophobicContact CG-CD1 4.18Å; I214-I257 HydrophobicContact CB-CD1 4.25Å; I214-I257 HydrophobicContact CG2-CD1 3.8Å; T215-I257 HydrophobicContact CG2-CD1 3.59Å; T215-I257 HydrophobicContact CG2-CG1 4.08Å; Y220-I257 HydrophobicContact CE2-CD1 3.98Å; Y220-I257 HydrophobicContact CE2-CG1 3.94Å; Y220-I257 WeakPolarHBondContact OH-CG1 3.45Å; I257-C259 HydrophobicContact CG2-CB 4.43Å; I257-C259 PolarHBondContact O-N 3.24Å; I257-C259 VanDerWaalsContact O-N 3.09Å; I257-S262 PolarHBondContact O-OG 2.8Å; I257-S262 VanDerWaalsContact O-OG 3.13Å; I257-M353 HydrophobicContact CG2-CB 4.15Å; I257-V354 WeakPolarHBondContact CG2-O 3.44Å; I257-L355 HydrophobicContact CD1-CD2 4.5Å; I257-L355 HydrophobicContact CG2-CG 4.46Å
258	W	90.1	Very high	77.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-79.1	98.2	173.7	-54.2	5.2	0	0	0	107.4	Y136 L138 I155 Y156 Y159 S256 M263 I332 L337 M353 V354	Y136-W258 AromaticContact CD1-CD1 3.61Å; Y136-W258 HydrophobicContact CD1-CG 4.4Å; Y136-W258 PolarHBondContact O-NE1 2.8Å; L138-W258 HydrophobicContact CD2-CH2 3.64Å; L138-W258 HydrophobicContact CD2-CZ2 3.35Å; I155-W258 HydrophobicContact CG2-CZ2 4.44Å; Y156-W258 HydrophobicContact CD2-CE3 4.42Å; Y156-W258 AromaticContact CD2-CZ3 3.88Å; Y156-W258 HydrophobicContact CD2-CZ3 3.88Å; Y159-W258 HydrophobicContact CD2-CH2 4.5Å; Y159-W258 HydrophobicContact CD2-CZ2 4.09Å; Y159-W258 AromaticContact CE2-CE2 3.93Å; Y159-W258 HydrophobicContact CE2-CH2 4.35Å; Y159-W258 AromaticContact CE2-CZ2 3.63Å; Y159-W258 HydrophobicContact CE2-CZ2 3.63Å; S256-W258 PolarHBondContact O-N 2.89Å; W258-M263 HydrophobicContact CB-CE 3.54Å; W258-M263 HydrophobicContact CD2-CE 3.91Å; W258-M263 HydrophobicContact CE3-CE 4.3Å; W258-M263 HydrophobicContact CG-CE 3.58Å; W258-I332 HydrophobicContact CE3-CG2 4.3Å; W258-I332 HydrophobicContact CZ3-CG2 4.3Å; W258-L337 HydrophobicContact CB-CD2 4.38Å; W258-L337 WeakPolarHBondContact O-CD2 3.36Å; W258-M353 WeakPolarHBondContact O-CA 3.48Å; W258-V354 HydrophobicContact CB-CB 3.82Å; W258-V354 HydrophobicContact CB-CG2 4.15Å; W258-V354 HydrophobicContact CD2-CB 4.17Å; W258-V354 HydrophobicContact CD2-CG1 4.47Å; W258-V354 HydrophobicContact CD2-CG2 4.49Å; W258-V354 HydrophobicContact CE3-CB 4.09Å; W258-V354 HydrophobicContact CE3-CG1 4.31Å; W258-V354 HydrophobicContact CE3-CG2 3.97Å; W258-V354 HydrophobicContact CG-CB 4.1Å; W258-V354 PolarHBondContact N-O 3.46Å; W258-V354 PolarHBondContact O-N 3.21Å
259	C	91.1	Very high	79.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.			trans	-132.8	153.2	171.3	70.6	0	0	0	0	109.7	I257 S262 M263 M353	I257-C259 HydrophobicContact CG2-CB 4.43Å; I257-C259 PolarHBondContact O-N 3.24Å; I257-C259 VanDerWaalsContact O-N 3.09Å; C259-S262 PolarHBondContact N-OG 3.17Å; C259-S262 PolarHBondContact O-N 3.4Å; C259-S262 VanDerWaalsContact O-N 3.1Å; C259-S262 PolarHBondContact O-OG 3Å; C259-S262 PolarHBondContact SG-OG 3.46Å; C259-M263 PolarHBondContact O-N 2.98Å; C259-M353 HydrophobicContact CB-CG 3.94Å; C259-M353 HydrophobicContact CB-SD 4.34Å
260	L	90.2	Very high	81.9	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-51.2	-49.4	-176.5	-171.9	74.1	0	0	0	113.9	L204 S262 M263 I264 I288 I333 W348	L204-L260 HydrophobicContact CD2-CB 4.49Å; L204-L260 HydrophobicContact CD2-CD2 3.73Å; L204-L260 HydrophobicContact CD2-CG 3.98Å; L260-S262 VanDerWaalsContact C-N 3.31Å; L260-S262 PolarHBondContact O-N 3.35Å; L260-M263 PolarHBondContact O-N 3.47Å; L260-I264 HydrophobicContact CD1-CD1 3.91Å; L260-I264 HydrophobicContact CD1-CG1 4.27Å; L260-I264 HydrophobicContact CD2-CD1 4.16Å; L260-I264 HydrophobicContact CG-CD1 3.63Å; L260-I264 HydrophobicContact CG-CG1 4.29Å; L260-I264 WeakPolarHBondContact O-CB 3.38Å; L260-I264 VanDerWaalsContact O-CG1 3.27Å; L260-I264 WeakPolarHBondContact O-CG1 3.28Å; L260-I264 PolarHBondContact O-N 2.88Å; L260-I288 HydrophobicContact CD1-CD1 4.46Å; L260-I333 HydrophobicContact CD1-CG2 3.46Å; L260-I333 VanDerWaalsContact CD1-CG2 3.46Å; L260-W348 HydrophobicContact CD2-CH2 3.01Å; L260-W348 HydrophobicContact CD2-CZ2 3.38Å; L260-W348 HydrophobicContact CD2-CZ3 4.03Å
261	P	91.2	Very high	83.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.7	-32.7	-178.8	25.5	-34.8	0	0	0	113	L204 L207 C208 A265 C273 L276	L204-P261 HydrophobicContact CB-CB 4.37Å; L204-P261 HydrophobicContact CD2-CB 4.05Å; L204-P261 WeakPolarHBondContact O-CB 3.37Å; L207-P261 HydrophobicContact CB-CG 3.91Å; C208-P261 HydrophobicContact CB-CB 4.22Å; C208-P261 HydrophobicContact CB-CG 4.32Å; P261-A265 VanDerWaalsContact O-CB 3.29Å; P261-A265 WeakPolarHBondContact O-CB 2.91Å; P261-A265 PolarHBondContact O-N 2.8Å; P261-C273 HydrophobicContact CB-CB 3.98Å; P261-L276 HydrophobicContact CB-CD1 3.97Å
262	S	90.1	Very high	85.5	Confident	5 Å²	5	31.2 Å²	31.2	4%	0.035	17%	0.171	C	C	.	.	H	α-helix	trans	-69.3	-43.2	176.7	67.1	0	0	0	0	112.7	Y136 K211 I257 C259 L260 A265 S266	Y136-S262 VanDerWaalsContact OH-C 3.24Å; Y136-S262 PolarHBondContact OH-O 3.14Å; K211-S262 VanDerWaalsContact NZ-CB 3.31Å; I257-S262 PolarHBondContact O-OG 2.8Å; I257-S262 VanDerWaalsContact O-OG 3.13Å; C259-S262 PolarHBondContact N-OG 3.17Å; C259-S262 PolarHBondContact O-N 3.4Å; C259-S262 VanDerWaalsContact O-N 3.1Å; C259-S262 PolarHBondContact O-OG 3Å; C259-S262 PolarHBondContact SG-OG 3.46Å; L260-S262 VanDerWaalsContact C-N 3.31Å; L260-S262 PolarHBondContact O-N 3.35Å; S262-A265 PolarHBondContact O-N 3.39Å; S262-S266 WeakPolarHBondContact O-CB 3.09Å; S262-S266 PolarHBondContact O-N 3.25Å
263	M	89.4	Confident	87.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-70.3	-38.6	178.9	-69.3	-169.1	168.7	0	0	111.2	Y136 W258 C259 L260 S266 I267 I332 I333 L337	Y136-M263 HydrophobicContact CD1-CE 4.08Å; Y136-M263 HydrophobicContact CE1-CE 4.21Å; Y136-M263 HydrophobicContact CE1-CG 3.95Å; Y136-M263 HydrophobicContact CG-CE 4.49Å; Y136-M263 PolarHBondContact OH-N 2.93Å; W258-M263 HydrophobicContact CB-CE 3.54Å; W258-M263 HydrophobicContact CD2-CE 3.91Å; W258-M263 HydrophobicContact CE3-CE 4.3Å; W258-M263 HydrophobicContact CG-CE 3.58Å; C259-M263 PolarHBondContact O-N 2.98Å; L260-M263 PolarHBondContact O-N 3.47Å; M263-S266 WeakPolarHBondContact O-CB 3.39Å; M263-S266 PolarHBondContact O-N 2.84Å; M263-I267 WeakPolarHBondContact O-CG1 3.31Å; M263-I267 PolarHBondContact O-N 3.47Å; M263-I332 HydrophobicContact CE-CG2 3.98Å; M263-I332 HydrophobicContact SD-CG2 4.33Å; M263-I333 HydrophobicContact CB-CD1 3.66Å; M263-I333 HydrophobicContact CB-CG1 3.74Å; M263-I333 HydrophobicContact CG-CG1 4.33Å; M263-I333 HydrophobicContact SD-CG1 3.62Å; M263-L337 HydrophobicContact CE-CD1 4.45Å; M263-L337 HydrophobicContact CG-CD1 4.29Å; M263-L337 HydrophobicContact SD-CD1 3.48Å; M263-L337 WeakPolarHBondContact SD-CD1 3.33Å
264	I	90.2	Very high	87.9	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.015	15%	0.153	C	C	.	.	H	α-helix	trans	-62	-44.6	173.5	-69	173.7	0	0	0	111.1	L204 L260 S266 I267 F268 L276 A284 I288	L204-I264 HydrophobicContact CD1-CD1 4.09Å; L204-I264 HydrophobicContact CD2-CD1 3.79Å; L260-I264 HydrophobicContact CD1-CD1 3.91Å; L260-I264 HydrophobicContact CD1-CG1 4.27Å; L260-I264 HydrophobicContact CD2-CD1 4.16Å; L260-I264 HydrophobicContact CG-CD1 3.63Å; L260-I264 HydrophobicContact CG-CG1 4.29Å; L260-I264 WeakPolarHBondContact O-CB 3.38Å; L260-I264 VanDerWaalsContact O-CG1 3.27Å; L260-I264 WeakPolarHBondContact O-CG1 3.28Å; L260-I264 PolarHBondContact O-N 2.88Å; I264-S266 VanDerWaalsContact C-N 3.26Å; I264-S266 PolarHBondContact O-N 2.74Å; I264-I267 WeakPolarHBondContact O-CB 3.33Å; I264-I267 PolarHBondContact O-N 2.99Å; I264-F268 HydrophobicContact CG2-CD2 3.84Å; I264-F268 HydrophobicContact CG2-CE2 3.7Å; I264-F268 VanDerWaalsContact O-CD2 3.24Å; I264-F268 WeakPolarHBondContact O-CD2 3.3Å; I264-F268 PolarHBondContact O-N 3.17Å; I264-L276 HydrophobicContact CG2-CD2 3.94Å; I264-A284 HydrophobicContact CD1-CB 3.98Å; I264-A284 HydrophobicContact CG1-CB 4.39Å; I264-A284 HydrophobicContact CG2-CB 3.91Å; I264-I288 HydrophobicContact CD1-CD1 4.47Å
265	A	90.2	Very high	88.2	Confident	2 Å²	2	32 Å²	32	2%	0.017	16%	0.162	C	C	.	.	H	α-helix	trans	-57.5	-43.3	175.1	0	0	0	0	0	111.2	P261 S262 I267 F268 N269 K270 C273 L276	P261-A265 VanDerWaalsContact O-CB 3.29Å; P261-A265 WeakPolarHBondContact O-CB 2.91Å; P261-A265 PolarHBondContact O-N 2.8Å; S262-A265 PolarHBondContact O-N 3.39Å; A265-I267 PolarHBondContact O-N 2.95Å; A265-F268 CarbonylContact O-C 3.47Å; A265-F268 PolarHBondContact O-N 2.91Å; A265-N269 PolarHBondContact O-N 2.93Å; A265-K270 HydrophobicContact CB-CB 4.09Å; A265-K270 WeakPolarHBondContact O-CA 3.29Å; A265-K270 WeakPolarHBondContact O-CB 3.09Å; A265-K270 PolarHBondContact O-N 3.47Å; A265-C273 HydrophobicContact CB-CB 4.44Å; A265-L276 HydrophobicContact CB-CD2 4.24Å; A265-L276 HydrophobicContact CB-CG 4.3Å
266	S	87.4	Confident	88.3	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-65.7	-35.8	177.5	-162.8	0	0	0	0	112.8	F132 E135 Y136 S262 M263 I264 F268 N269	F132-S266 WeakPolarHBondContact CD1-OG 3.31Å; F132-S266 WeakPolarHBondContact CE1-OG 3.27Å; E135-S266 PolarHBondContact OE2-OG 3.23Å; Y136-S266 WeakPolarHBondContact OH-CB 3.44Å; S262-S266 WeakPolarHBondContact O-CB 3.09Å; S262-S266 PolarHBondContact O-N 3.25Å; M263-S266 WeakPolarHBondContact O-CB 3.39Å; M263-S266 PolarHBondContact O-N 2.84Å; I264-S266 VanDerWaalsContact C-N 3.26Å; I264-S266 PolarHBondContact O-N 2.74Å; S266-F268 VanDerWaalsContact C-N 3.31Å; S266-F268 PolarHBondContact O-N 2.97Å; S266-N269 PolarHBondContact O-N 3.04Å; S266-N269 VanDerWaalsContact O-N 3.16Å
267	I	87.3	Confident	88.3	Confident	8 Å²	8	36.7 Å²	36.7	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-57.3	-46.1	171.4	-69.5	177.2	0	0	0	110.4	M263 I264 A265 N269 L287 Y326 S327 L330 I333	M263-I267 WeakPolarHBondContact O-CG1 3.31Å; M263-I267 PolarHBondContact O-N 3.47Å; I264-I267 WeakPolarHBondContact O-CB 3.33Å; I264-I267 PolarHBondContact O-N 2.99Å; A265-I267 PolarHBondContact O-N 2.95Å; I267-N269 PolarHBondContact O-N 3.44Å; I267-L287 HydrophobicContact CG2-CD2 4.47Å; I267-Y326 HydrophobicContact CG2-CD1 3.78Å; I267-Y326 HydrophobicContact CG2-CE1 3.81Å; I267-Y326 VanDerWaalsContact O-CE1 3.3Å; I267-Y326 WeakPolarHBondContact O-CE1 3.47Å; I267-S327 WeakPolarHBondContact CG1-OG 3.5Å; I267-L330 HydrophobicContact CD1-CD1 4.35Å; I267-I333 HydrophobicContact CD1-CD1 3.44Å; I267-I333 VanDerWaalsContact CD1-CD1 3.44Å; I267-I333 HydrophobicContact CG1-CD1 4.38Å
268	F	88.3	Confident	88.2	Confident	41 Å²	41	41.9 Å²	41.9	18%	0.18	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	17.8	-179.4	-62.6	-66	0	0	0	113.7	I264 A265 S266 K270 D280 Q283 A284	I264-F268 HydrophobicContact CG2-CD2 3.84Å; I264-F268 HydrophobicContact CG2-CE2 3.7Å; I264-F268 VanDerWaalsContact O-CD2 3.24Å; I264-F268 WeakPolarHBondContact O-CD2 3.3Å; I264-F268 PolarHBondContact O-N 3.17Å; A265-F268 CarbonylContact O-C 3.47Å; A265-F268 PolarHBondContact O-N 2.91Å; S266-F268 VanDerWaalsContact C-N 3.31Å; S266-F268 PolarHBondContact O-N 2.97Å; F268-K270 HydrophobicContact CB-CG 4.38Å; F268-K270 PolarHBondContact O-N 2.78Å; F268-D280 HydrophobicContact CD2-CB 4Å; F268-D280 HydrophobicContact CE2-CB 4.01Å; F268-Q283 HydrophobicContact CE1-CB 4.15Å; F268-Q283 HydrophobicContact CZ-CB 3.76Å; F268-A284 HydrophobicContact CE2-CB 4.17Å
269	N	84.1	Confident	88.1	Confident	117 Å²	117	46.5 Å²	46.5	63%	0.626	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	28.6	-178.5	-68.1	-35.1	0	0	0	114.5	A265 S266 I267	A265-N269 PolarHBondContact O-N 2.93Å; S266-N269 PolarHBondContact O-N 3.04Å; S266-N269 VanDerWaalsContact O-N 3.16Å; I267-N269 PolarHBondContact O-N 3.44Å
270	K	87.3	Confident	88.1	Confident	40 Å²	40	47.2 Å²	47.2	17%	0.174	23%	0.229	C	C	.	.			trans	-88	141.6	172.8	-59.9	-168.9	171.9	-166.3	0	109.8	A265 F268 Q275 D280	A265-K270 HydrophobicContact CB-CB 4.09Å; A265-K270 WeakPolarHBondContact O-CA 3.29Å; A265-K270 WeakPolarHBondContact O-CB 3.09Å; A265-K270 PolarHBondContact O-N 3.47Å; F268-K270 HydrophobicContact CB-CG 4.38Å; F268-K270 PolarHBondContact O-N 2.78Å; K270-Q275 HydrophobicContact CB-CB 4.3Å; K270-Q275 HydrophobicContact CD-CB 3.92Å; K270-Q275 WeakPolarHBondContact CD-O 3.43Å; K270-Q275 PolarHBondContact NZ-O 3.32Å; K270-D280 WeakPolarHBondContact CE-OD2 3.43Å; K270-D280 IonicContact NZ-OD1 2.61Å; K270-D280 IonicContact NZ-OD2 2.77Å; K270-D280 PolarHBondContact NZ-OD2 2.88Å
271	Q	81	Confident	87.8	Confident	159 Å²	159	47.2 Å²	47.2	74%	0.743	23%	0.229	S	C	*	.	S	Bend	trans	-81.5	-27.4	-175.6	-68.7	-174.5	-7.7	0	0	112.9	Q275	Q271-Q275 VanDerWaalsContact N-OE1 3.14Å
272	S	84.5	Confident	87.6	Confident	41 Å²	41	52.6 Å²	52.6	29%	0.287	25%	0.253	S	S	.	.	S	Bend	trans	-133.6	154.5	177.7	77.8	0	0	0	0	111	E274 Q275	S272-E274 PolarHBondContact O-N 2.84Å; S272-Q275 PolarHBondContact O-N 2.87Å
273	C	89.4	Confident	87.5	Confident	6 Å²	6	57 Å²	57	4%	0.041	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-72.2	-13.7	175.4	56.7	0	0	0	0	113.4	C208 P261 A265 Q275 L276	C208-C273 HydrophobicContact CB-CB 3.74Å; C208-C273 WeakPolarHBondContact CB-SG 3.47Å; C208-C273 WeakPolarHBondContact SG-CB 3.31Å; C208-C273 CovalentContact SG-SG 2.03Å; C208-C273 PolarHBondContact SG-SG 2.9Å; P261-C273 HydrophobicContact CB-CB 3.98Å; A265-C273 HydrophobicContact CB-CB 4.44Å; C273-Q275 PolarHBondContact O-N 3.38Å; C273-L276 HydrophobicContact CB-CD1 4.21Å; C273-L276 WeakPolarHBondContact O-CB 3.4Å; C273-L276 WeakPolarHBondContact O-CD1 3.34Å; C273-L276 WeakPolarHBondContact O-CG 3.43Å; C273-L276 PolarHBondContact O-N 2.99Å
274	E	88.3	Confident	87.4	Confident	125 Å²	125	57.1 Å²	57.1	58%	0.584	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-70.1	-22.3	175	-61.1	-179.7	149.1	0	0	112.2	C208 L212 S272 L276	C208-E274 PolarHBondContact SG-N 3.18Å; C208-E274 VanDerWaalsContact SG-N 3.44Å; L212-E274 HydrophobicContact CD1-CG 3.83Å; L212-E274 WeakPolarHBondContact CD1-OE1 3.24Å; S272-E274 PolarHBondContact O-N 2.84Å; E274-L276 PolarHBondContact O-N 3.5Å
275	Q	89.5	Confident	87.1	Confident	93 Å²	93	57.3 Å²	57.3	44%	0.435	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-79.8	-0.7	178.2	-65.8	172.6	-16.2	0	0	113	K270 Q271 S272 C273	K270-Q275 HydrophobicContact CB-CB 4.3Å; K270-Q275 HydrophobicContact CD-CB 3.92Å; K270-Q275 WeakPolarHBondContact CD-O 3.43Å; K270-Q275 PolarHBondContact NZ-O 3.32Å; Q271-Q275 VanDerWaalsContact N-OE1 3.14Å; S272-Q275 PolarHBondContact O-N 2.87Å; C273-Q275 PolarHBondContact O-N 3.38Å
276	L	87.6	Confident	86.8	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.073	30%	0.3	C	S	.	.			trans	-67.8	131.5	179.6	-73.7	169.9	0	0	0	110.9	Y201 P261 I264 A265 C273 E274 D280	Y201-L276 WeakPolarHBondContact CE2-O 3.38Å; P261-L276 HydrophobicContact CB-CD1 3.97Å; I264-L276 HydrophobicContact CG2-CD2 3.94Å; A265-L276 HydrophobicContact CB-CD2 4.24Å; A265-L276 HydrophobicContact CB-CG 4.3Å; C273-L276 HydrophobicContact CB-CD1 4.21Å; C273-L276 WeakPolarHBondContact O-CB 3.4Å; C273-L276 WeakPolarHBondContact O-CD1 3.34Å; C273-L276 WeakPolarHBondContact O-CG 3.43Å; C273-L276 PolarHBondContact O-N 2.99Å; E274-L276 PolarHBondContact O-N 3.5Å; L276-D280 WeakPolarHBondContact CA-OD2 3.2Å; L276-D280 HydrophobicContact CD2-CB 4.01Å
277	E	88.6	Confident	86.8	Confident	111 Å²	111	63.4 Å²	63.4	52%	0.519	30%	0.304	S	S	.	.			trans	-108.2	165.8	176	-66.5	-177.9	-171.7	0	0	110.8	I279 D280 A281	E277-I279 PolarHBondContact O-N 2.87Å; E277-D280 PolarHBondContact N-OD2 3.47Å; E277-D280 PolarHBondContact O-N 3.45Å; E277-D280 VanDerWaalsContact O-N 3.11Å; E277-A281 PolarHBondContact O-N 3.18Å
278	Y	86.8	Confident	86.7	Confident	110 Å²	110	63.3 Å²	63.3	43%	0.431	30%	0.303	S	S	.	.	H	α-helix	trans	-55.5	-34.3	175.1	171.9	-95.5	0	0	0	112.9	P197 A281 K282	P197-Y278 HydrophobicContact CB-CE2 4.08Å; P197-Y278 HydrophobicContact CG-CE2 4.1Å; P197-Y278 WeakPolarHBondContact CG-OH 3.25Å; Y278-A281 PolarHBondContact O-N 2.84Å; Y278-K282 PolarHBondContact O-N 2.89Å; Y278-K282 VanDerWaalsContact O-N 3.11Å
279	I	88.6	Confident	86.3	Confident	96 Å²	96	63.9 Å²	63.9	49%	0.492	31%	0.312	S	S	.	.	H	α-helix	trans	-65.6	-41.3	179.4	-59.7	169.3	0	0	0	110.7	E277 A281 K282 Q283	E277-I279 PolarHBondContact O-N 2.87Å; I279-A281 VanDerWaalsContact C-N 3.34Å; I279-A281 PolarHBondContact O-N 3.45Å; I279-K282 PolarHBondContact O-N 2.76Å; I279-Q283 WeakPolarHBondContact O-CG 3.32Å; I279-Q283 PolarHBondContact O-N 3.17Å
280	D	89.5	Confident	86.4	Confident	16 Å²	16	60.6 Å²	60.6	9%	0.086	30%	0.297	C	S	.	.	H	α-helix	trans	-66	-39.2	178.2	-50	-43.7	0	0	0	111.2	F268 K270 L276 E277 K282 Q283 A284	F268-D280 HydrophobicContact CD2-CB 4Å; F268-D280 HydrophobicContact CE2-CB 4.01Å; K270-D280 WeakPolarHBondContact CE-OD2 3.43Å; K270-D280 IonicContact NZ-OD1 2.61Å; K270-D280 IonicContact NZ-OD2 2.77Å; K270-D280 PolarHBondContact NZ-OD2 2.88Å; L276-D280 WeakPolarHBondContact CA-OD2 3.2Å; L276-D280 HydrophobicContact CD2-CB 4.01Å; E277-D280 PolarHBondContact N-OD2 3.47Å; E277-D280 PolarHBondContact O-N 3.45Å; E277-D280 VanDerWaalsContact O-N 3.11Å; D280-K282 VanDerWaalsContact C-N 3.32Å; D280-K282 PolarHBondContact O-N 3.41Å; D280-Q283 PolarHBondContact O-N 3.11Å; D280-A284 VanDerWaalsContact O-CB 3.23Å; D280-A284 WeakPolarHBondContact O-CB 3.29Å; D280-A284 PolarHBondContact O-N 3.2Å
281	A	85.3	Confident	86.4	Confident	2 Å²	2	58.7 Å²	58.7	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-61.7	-42.8	176.8	0	0	0	0	0	111	L200 Y201 L204 E277 Y278 I279 A284 S285	L200-A281 HydrophobicContact CD2-CB 4.44Å; L200-A281 VanDerWaalsContact CD2-O 3.31Å; L200-A281 WeakPolarHBondContact CD2-O 3.47Å; L200-A281 HydrophobicContact CG-CB 4.37Å; Y201-A281 HydrophobicContact CD2-CB 4.44Å; L204-A281 HydrophobicContact CD1-CB 4.1Å; E277-A281 PolarHBondContact O-N 3.18Å; Y278-A281 PolarHBondContact O-N 2.84Å; I279-A281 VanDerWaalsContact C-N 3.34Å; I279-A281 PolarHBondContact O-N 3.45Å; A281-A284 PolarHBondContact O-N 3.49Å; A281-S285 PolarHBondContact O-N 3.34Å; A281-S285 PolarHBondContact O-OG 2.99Å
282	K	86.5	Confident	86.3	Confident	113 Å²	113	52.3 Å²	52.3	49%	0.491	26%	0.258	S	S	.	.	H	α-helix	trans	-63.8	-42.4	175.6	-174.2	-178.4	176.2	-175.9	0	112.5	P197 Y278 I279 D280 S285 E286	P197-K282 HydrophobicContact CB-CB 3.8Å; P197-K282 HydrophobicContact CB-CG 4.13Å; P197-K282 HydrophobicContact CG-CB 4.38Å; P197-K282 HydrophobicContact CG-CG 4.24Å; Y278-K282 PolarHBondContact O-N 2.89Å; Y278-K282 VanDerWaalsContact O-N 3.11Å; I279-K282 PolarHBondContact O-N 2.76Å; D280-K282 VanDerWaalsContact C-N 3.32Å; D280-K282 PolarHBondContact O-N 3.41Å; K282-S285 PolarHBondContact O-OG 3.49Å; K282-E286 PolarHBondContact O-N 3.38Å
283	Q	87.8	Confident	86.1	Confident	97 Å²	97	54.1 Å²	54.1	45%	0.453	27%	0.268	S	S	.	.	H	α-helix	trans	-69	-40.2	176.7	-72.2	-178.3	-5.9	0	0	111.8	F268 I279 D280 S285 E286 L287	F268-Q283 HydrophobicContact CE1-CB 4.15Å; F268-Q283 HydrophobicContact CZ-CB 3.76Å; I279-Q283 WeakPolarHBondContact O-CG 3.32Å; I279-Q283 PolarHBondContact O-N 3.17Å; D280-Q283 PolarHBondContact O-N 3.11Å; Q283-S285 VanDerWaalsContact C-N 3.34Å; Q283-S285 PolarHBondContact O-N 2.94Å; Q283-E286 PolarHBondContact O-N 2.92Å; Q283-L287 VanDerWaalsContact O-CB 3.31Å; Q283-L287 WeakPolarHBondContact O-CB 3.42Å; Q283-L287 PolarHBondContact O-N 3.45Å
284	A	87.2	Confident	85.7	Confident	3 Å²	3	54.2 Å²	54.2	3%	0.025	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-39.7	175.8	0	0	0	0	0	112	I264 F268 D280 A281 L287 I288	I264-A284 HydrophobicContact CD1-CB 3.98Å; I264-A284 HydrophobicContact CG1-CB 4.39Å; I264-A284 HydrophobicContact CG2-CB 3.91Å; F268-A284 HydrophobicContact CE2-CB 4.17Å; D280-A284 VanDerWaalsContact O-CB 3.23Å; D280-A284 WeakPolarHBondContact O-CB 3.29Å; D280-A284 PolarHBondContact O-N 3.2Å; A281-A284 PolarHBondContact O-N 3.49Å; A284-L287 PolarHBondContact O-N 3.22Å; A284-I288 WeakPolarHBondContact O-CB 3.47Å; A284-I288 VanDerWaalsContact O-CG1 3.25Å; A284-I288 WeakPolarHBondContact O-CG1 3.5Å; A284-I288 PolarHBondContact O-N 2.91Å
285	S	83.4	Confident	85.3	Confident	7 Å²	7	48.9 Å²	48.9	5%	0.049	25%	0.245	C	C	.	.	H	α-helix	trans	-64.1	-42.4	177.5	64.5	0	0	0	0	112.1	F194 A281 K282 Q283 S289	F194-S285 WeakPolarHBondContact CD1-O 3.24Å; A281-S285 PolarHBondContact O-N 3.34Å; A281-S285 PolarHBondContact O-OG 2.99Å; K282-S285 PolarHBondContact O-OG 3.49Å; Q283-S285 VanDerWaalsContact C-N 3.34Å; Q283-S285 PolarHBondContact O-N 2.94Å; S285-S289 WeakPolarHBondContact O-CB 3.39Å; S285-S289 PolarHBondContact O-N 2.92Å; S285-S289 VanDerWaalsContact O-N 3.11Å; S285-S289 PolarHBondContact O-OG 3.47Å
286	E	84.7	Confident	84.6	Confident	112 Å²	112	48.8 Å²	48.8	52%	0.523	25%	0.247	S	C	.	.	H	α-helix	trans	-66.4	-43.4	176.2	-169.2	172.6	-175.4	0	0	111	K282 Q283 S289 T290	K282-E286 PolarHBondContact O-N 3.38Å; Q283-E286 PolarHBondContact O-N 2.92Å; E286-S289 PolarHBondContact O-OG 3.1Å; E286-S289 VanDerWaalsContact O-OG 3.07Å; E286-T290 HydrophobicContact CG-CG2 4.46Å; E286-T290 WeakPolarHBondContact O-CB 3.25Å; E286-T290 WeakPolarHBondContact O-CG2 3.06Å; E286-T290 PolarHBondContact O-N 3.02Å; E286-T290 PolarHBondContact O-OG1 3.39Å
287	L	87.3	Confident	84	Confident	21 Å²	21	50.6 Å²	50.6	11%	0.11	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-47.1	178.3	-170.1	71.4	0	0	0	112.4	I267 Q283 A284 T290 C291 Q323 L330	I267-L287 HydrophobicContact CG2-CD2 4.47Å; Q283-L287 VanDerWaalsContact O-CB 3.31Å; Q283-L287 WeakPolarHBondContact O-CB 3.42Å; Q283-L287 PolarHBondContact O-N 3.45Å; A284-L287 PolarHBondContact O-N 3.22Å; L287-T290 PolarHBondContact O-OG1 3.45Å; L287-T290 VanDerWaalsContact O-OG1 3.07Å; L287-C291 VanDerWaalsContact O-CB 3.23Å; L287-C291 WeakPolarHBondContact O-CB 3.31Å; L287-C291 PolarHBondContact O-N 3.09Å; L287-C291 PolarHBondContact O-SG 2.98Å; L287-Q323 HydrophobicContact CD1-CB 4.34Å; L287-L330 HydrophobicContact CD2-CD1 3.94Å; L287-L330 HydrophobicContact CG-CD1 4.18Å; L287-L330 HydrophobicContact CG-CD2 4.38Å
288	I	85.2	Confident	83.2	Confident	6 Å²	6	46.1 Å²	46.1	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-44.8	-178.7	-70.1	166.5	0	0	0	110.6	F194 L260 I264 A284 Y292 L334 L338 F345	F194-I288 HydrophobicContact CE1-CB 3.89Å; F194-I288 HydrophobicContact CE1-CG2 3.63Å; F194-I288 HydrophobicContact CZ-CB 4.44Å; F194-I288 HydrophobicContact CZ-CG2 3.67Å; L260-I288 HydrophobicContact CD1-CD1 4.46Å; I264-I288 HydrophobicContact CD1-CD1 4.47Å; A284-I288 WeakPolarHBondContact O-CB 3.47Å; A284-I288 VanDerWaalsContact O-CG1 3.25Å; A284-I288 WeakPolarHBondContact O-CG1 3.5Å; A284-I288 PolarHBondContact O-N 2.91Å; I288-Y292 VanDerWaalsContact O-CB 3.3Å; I288-Y292 WeakPolarHBondContact O-CB 3.29Å; I288-Y292 PolarHBondContact O-N 3.5Å; I288-L334 HydrophobicContact CG2-CD2 4Å; I288-L338 HydrophobicContact CG2-CD1 3.63Å; I288-F345 HydrophobicContact CG2-CE1 4.33Å
289	S	80.6	Confident	82.7	Confident	53 Å²	53	43.3 Å²	43.3	37%	0.371	24%	0.235	S	C	.	.	H	α-helix	trans	-67	-38.2	-179.1	57.9	0	0	0	0	113	S285 E286	S285-S289 WeakPolarHBondContact O-CB 3.39Å; S285-S289 PolarHBondContact O-N 2.92Å; S285-S289 VanDerWaalsContact O-N 3.11Å; S285-S289 PolarHBondContact O-OG 3.47Å; E286-S289 PolarHBondContact O-OG 3.1Å; E286-S289 VanDerWaalsContact O-OG 3.07Å
290	T	84.8	Confident	82.1	Confident	48 Å²	48	38.8 Å²	38.8	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-73	-36.2	177.8	52.6	0	0	0	0	113	E286 L287 P293	E286-T290 HydrophobicContact CG-CG2 4.46Å; E286-T290 WeakPolarHBondContact O-CB 3.25Å; E286-T290 WeakPolarHBondContact O-CG2 3.06Å; E286-T290 PolarHBondContact O-N 3.02Å; E286-T290 PolarHBondContact O-OG1 3.39Å; L287-T290 PolarHBondContact O-OG1 3.45Å; L287-T290 VanDerWaalsContact O-OG1 3.07Å; T290-P293 WeakPolarHBondContact O-CD 3.32Å
291	C	87.1	Confident	81.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-88.6	-15.6	-175.7	-59.1	0	0	0	0	114.4	L287 A294 F295 L300 C324 L330 L334	L287-C291 VanDerWaalsContact O-CB 3.23Å; L287-C291 WeakPolarHBondContact O-CB 3.31Å; L287-C291 PolarHBondContact O-N 3.09Å; L287-C291 PolarHBondContact O-SG 2.98Å; C291-A294 WeakPolarHBondContact O-CB 3.39Å; C291-A294 PolarHBondContact O-N 3.39Å; C291-A294 VanDerWaalsContact O-N 3.15Å; C291-F295 PolarHBondContact O-N 2.92Å; C291-L300 HydrophobicContact CB-CD2 4.4Å; C291-C324 WeakPolarHBondContact CA-SG 3.09Å; C291-C324 HydrophobicContact CB-CB 3.82Å; C291-C324 WeakPolarHBondContact CB-SG 3.33Å; C291-C324 WeakPolarHBondContact SG-CA 3.21Å; C291-C324 WeakPolarHBondContact SG-CB 3.3Å; C291-C324 CovalentContact SG-SG 2.03Å; C291-C324 PolarHBondContact SG-SG 3.01Å; C291-L330 HydrophobicContact CB-CD2 3.83Å; C291-L334 HydrophobicContact CB-CD1 4.38Å
292	Y	80.3	Confident	80.6	Confident	25 Å²	25	40 Å²	40	10%	0.098	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-44.5	179.5	-177.2	-109.1	0	0	0	114	I288 A294 F295 L296 L334 F345	I288-Y292 VanDerWaalsContact O-CB 3.3Å; I288-Y292 WeakPolarHBondContact O-CB 3.29Å; I288-Y292 PolarHBondContact O-N 3.5Å; Y292-A294 VanDerWaalsContact C-N 3.32Å; Y292-A294 PolarHBondContact O-N 2.83Å; Y292-F295 WeakPolarHBondContact O-CB 3.38Å; Y292-F295 PolarHBondContact O-N 3.33Å; Y292-F295 VanDerWaalsContact O-N 3.17Å; Y292-L296 HydrophobicContact CD1-CD1 3.93Å; Y292-L296 HydrophobicContact CD1-CG 4.41Å; Y292-L296 HydrophobicContact CE1-CD1 3.35Å; Y292-L296 HydrophobicContact CE1-CG 3.99Å; Y292-L296 HydrophobicContact CE2-CD1 4.46Å; Y292-L296 HydrophobicContact CE2-CD2 4.35Å; Y292-L296 HydrophobicContact CE2-CG 4.24Å; Y292-L296 PolarHBondContact O-N 3.41Å; Y292-L334 HydrophobicContact CD2-CD2 4.11Å; Y292-F345 AromaticContact CD1-CD2 3.96Å; Y292-F345 HydrophobicContact CD1-CD2 3.96Å; Y292-F345 AromaticContact CD1-CE2 3.74Å; Y292-F345 HydrophobicContact CD1-CE2 3.74Å; Y292-F345 HydrophobicContact CD1-CG 4.5Å; Y292-F345 HydrophobicContact CD1-CZ 4.04Å; Y292-F345 HydrophobicContact CD2-CE1 4.49Å; Y292-F345 AromaticContact CD2-CE2 3.61Å; Y292-F345 HydrophobicContact CD2-CE2 3.61Å; Y292-F345 AromaticContact CD2-CZ 3.51Å; Y292-F345 HydrophobicContact CD2-CZ 3.51Å; Y292-F345 AromaticContact CE1-CD2 3.47Å; Y292-F345 HydrophobicContact CE1-CD2 3.47Å; Y292-F345 VanDerWaalsContact CE1-CD2 3.47Å; Y292-F345 AromaticContact CE1-CE2 3.35Å; Y292-F345 HydrophobicContact CE1-CE2 3.35Å; Y292-F345 HydrophobicContact CE1-CG 4.36Å; Y292-F345 HydrophobicContact CE1-CZ 4.11Å; Y292-F345 HydrophobicContact CE2-CD2 4.21Å; Y292-F345 AromaticContact CE2-CE2 3.24Å; Y292-F345 HydrophobicContact CE2-CE2 3.24Å; Y292-F345 AromaticContact CE2-CZ 3.63Å; Y292-F345 HydrophobicContact CE2-CZ 3.63Å; Y292-F345 HydrophobicContact CG-CD2 4.48Å; Y292-F345 HydrophobicContact CG-CE1 4.34Å; Y292-F345 AromaticContact CG-CE2 3.84Å; Y292-F345 HydrophobicContact CG-CE2 3.84Å; Y292-F345 AromaticContact CG-CZ 3.73Å; Y292-F345 HydrophobicContact CG-CZ 3.73Å; Y292-F345 AromaticContact CZ-CD2 3.62Å; Y292-F345 AromaticContact CZ-CE2 3.09Å; Y292-F345 AromaticContact CZ-CZ 3.92Å
293	P	80.5	Confident	79.7	Confident	78 Å²	78	35.2 Å²	35.2	51%	0.506	20%	0.196	S	C	.	.	H	α-helix	trans	-62.2	-35.8	173.8	-22.7	34.2	0	0	0	113.6	T290 F295 L296 S297	T290-P293 WeakPolarHBondContact O-CD 3.32Å; P293-F295 VanDerWaalsContact C-N 3.29Å; P293-F295 PolarHBondContact O-N 3.39Å; P293-L296 PolarHBondContact O-N 3.41Å; P293-S297 WeakPolarHBondContact O-CB 3.41Å; P293-S297 PolarHBondContact O-N 2.99Å; P293-S297 PolarHBondContact O-OG 3.48Å
294	A	80.7	Confident	79	Confident	9 Å²	9	30.7 Å²	30.7	7%	0.074	17%	0.174	C	C	.	.	H	α-helix	trans	-68.1	-29.8	176.5	0	0	0	0	0	112.3	C291 Y292 S297 H299 L300	C291-A294 WeakPolarHBondContact O-CB 3.39Å; C291-A294 PolarHBondContact O-N 3.39Å; C291-A294 VanDerWaalsContact O-N 3.15Å; Y292-A294 VanDerWaalsContact C-N 3.32Å; Y292-A294 PolarHBondContact O-N 2.83Å; A294-S297 WeakPolarHBondContact CA-OG 2.85Å; A294-S297 PolarHBondContact O-OG 3.48Å; A294-S297 VanDerWaalsContact O-OG 3.09Å; A294-H299 PolarHBondContact O-N 2.88Å; A294-H299 VanDerWaalsContact O-N 3.09Å; A294-L300 HydrophobicContact CB-CB 4.29Å; A294-L300 PolarHBondContact O-N 3.28Å
295	F	79.4	Confident	78.4	Confident	13 Å²	13	32.7 Å²	32.7	6%	0.057	18%	0.181	C	C	.	.	H	α-helix	trans	-72.2	-48.4	170.9	172	-103.9	0	0	0	112	C291 Y292 P293 S297 G298 L300 L334 A335 W733	C291-F295 PolarHBondContact O-N 2.92Å; Y292-F295 WeakPolarHBondContact O-CB 3.38Å; Y292-F295 PolarHBondContact O-N 3.33Å; Y292-F295 VanDerWaalsContact O-N 3.17Å; P293-F295 VanDerWaalsContact C-N 3.29Å; P293-F295 PolarHBondContact O-N 3.39Å; F295-S297 VanDerWaalsContact C-N 3.31Å; F295-S297 PolarHBondContact O-N 3.31Å; F295-G298 WeakPolarHBondContact O-CA 3.42Å; F295-G298 PolarHBondContact O-N 2.94Å; F295-L300 HydrophobicContact CB-CD2 4.45Å; F295-L334 HydrophobicContact CB-CB 4.42Å; F295-L334 HydrophobicContact CB-CD1 3.82Å; F295-L334 HydrophobicContact CD1-CB 4.01Å; F295-L334 HydrophobicContact CD2-CB 4.17Å; F295-L334 HydrophobicContact CE1-CB 4.32Å; F295-L334 HydrophobicContact CE2-CB 4.47Å; F295-L334 HydrophobicContact CG-CB 3.93Å; F295-L334 HydrophobicContact CG-CD1 4.22Å; F295-A335 HydrophobicContact CE2-CB 3.97Å; F295-A335 HydrophobicContact CZ-CB 3.7Å; F295-W733 HydrophobicContact CE1-CD2 4.26Å; F295-W733 HydrophobicContact CE1-CG 4.21Å; F295-W733 AromaticContact CZ-CD2 3.77Å; F295-W733 HydrophobicContact CZ-CD2 3.77Å; F295-W733 AromaticContact CZ-CE2 3.92Å; F295-W733 AromaticContact CZ-CE3 3.98Å; F295-W733 HydrophobicContact CZ-CE3 3.98Å; F295-W733 HydrophobicContact CZ-CG 4.19Å; F295-W733 HydrophobicContact CZ-CZ2 4.31Å; F295-W733 HydrophobicContact CZ-CZ3 4.36Å
296	L	74.7	Confident	77.4	Confident	91 Å²	91	36.6 Å²	36.6	48%	0.476	20%	0.202	S	C	.	.	H	α-helix	trans	-62.7	-35.5	179.2	-73	-179.5	0	0	0	113.4	Y292 P293 G298	Y292-L296 HydrophobicContact CD1-CD1 3.93Å; Y292-L296 HydrophobicContact CD1-CG 4.41Å; Y292-L296 HydrophobicContact CE1-CD1 3.35Å; Y292-L296 HydrophobicContact CE1-CG 3.99Å; Y292-L296 HydrophobicContact CE2-CD1 4.46Å; Y292-L296 HydrophobicContact CE2-CD2 4.35Å; Y292-L296 HydrophobicContact CE2-CG 4.24Å; Y292-L296 PolarHBondContact O-N 3.41Å; P293-L296 PolarHBondContact O-N 3.41Å; L296-G298 PolarHBondContact O-N 3.41Å
297	S	75	Confident	76.1	Confident	51 Å²	51	36.4 Å²	36.4	36%	0.357	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.3	173.7	51.5	0	0	0	0	113.4	P293 A294 F295 H299	P293-S297 WeakPolarHBondContact O-CB 3.41Å; P293-S297 PolarHBondContact O-N 2.99Å; P293-S297 PolarHBondContact O-OG 3.48Å; A294-S297 WeakPolarHBondContact CA-OG 2.85Å; A294-S297 PolarHBondContact O-OG 3.48Å; A294-S297 VanDerWaalsContact O-OG 3.09Å; F295-S297 VanDerWaalsContact C-N 3.31Å; F295-S297 PolarHBondContact O-N 3.31Å; S297-H299 VanDerWaalsContact C-N 3.27Å; S297-H299 PolarHBondContact O-N 3.02Å; S297-H299 PolarHBondContact OG-CD2 3.11Å
298	G	71.2	Confident	74.3	Confident	18 Å²	18	39.7 Å²	39.7	19%	0.186	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	17.1	-179.1	0	0	0	0	0	113.9	F295 L296 R301	F295-G298 WeakPolarHBondContact O-CA 3.42Å; F295-G298 PolarHBondContact O-N 2.94Å; L296-G298 PolarHBondContact O-N 3.41Å; G298-R301 VanDerWaalsContact O-CZ 3.31Å; G298-R301 PolarHBondContact O-NE 3.46Å; G298-R301 PolarHBondContact O-NH2 3.47Å
299	H	77	Confident	72.9	Confident	50 Å²	50	43.6 Å²	43.6	23%	0.231	26%	0.257	C	S	.	.			trans	-79.8	-36.3	174.8	-66.4	-49.6	0	0	0	112	A294 S297 L318 V319	A294-H299 PolarHBondContact O-N 2.88Å; A294-H299 VanDerWaalsContact O-N 3.09Å; S297-H299 VanDerWaalsContact C-N 3.27Å; S297-H299 PolarHBondContact O-N 3.02Å; S297-H299 PolarHBondContact OG-CD2 3.11Å; H299-L318 HydrophobicContact CB-CB 4.35Å; H299-V319 HydrophobicContact CB-CG2 4.07Å; H299-V319 WeakPolarHBondContact O-CG2 3.02Å
300	L	76.7	Confident	71.7	Confident	1 Å²	1	44 Å²	44	1%	0.005	26%	0.257	C	S	.	.			trans	-83.9	116	179.6	-176.4	67.5	0	0	0	111.3	C291 A294 F295 W305 V319 C324 L325 L330 P331 L334	C291-L300 HydrophobicContact CB-CD2 4.4Å; A294-L300 HydrophobicContact CB-CB 4.29Å; A294-L300 PolarHBondContact O-N 3.28Å; F295-L300 HydrophobicContact CB-CD2 4.45Å; L300-W305 HydrophobicContact CD1-CH2 4.24Å; L300-V319 HydrophobicContact CD1-CG1 4.14Å; L300-C324 HydrophobicContact CD1-CB 4.14Å; L300-C324 WeakPolarHBondContact CD1-O 3.33Å; L300-L325 HydrophobicContact CD1-CD2 4.11Å; L300-L330 HydrophobicContact CD2-CD2 4.15Å; L300-L330 HydrophobicContact CD2-CG 4.48Å; L300-P331 HydrophobicContact CG-CG 4.25Å; L300-L334 HydrophobicContact CD2-CD1 3.91Å
301	R	71.7	Confident	70.9	Confident	33 Å²	33	47.5 Å²	47.5	13%	0.125	27%	0.274	C	S	.	.			trans	-139.3	150	-172.5	-58.4	166.9	-163.3	-179.2	-10.3	113.9	G298 S303 C304 W305 Q816 L818	G298-R301 VanDerWaalsContact O-CZ 3.31Å; G298-R301 PolarHBondContact O-NE 3.46Å; G298-R301 PolarHBondContact O-NH2 3.47Å; R301-S303 WeakPolarHBondContact CB-OG 3.36Å; R301-S303 PolarHBondContact O-N 2.97Å; R301-C304 VanDerWaalsContact O-CB 3.28Å; R301-C304 WeakPolarHBondContact O-CB 3.31Å; R301-C304 PolarHBondContact O-N 3.5Å; R301-C304 PolarHBondContact O-SG 2.89Å; R301-W305 WeakPolarHBondContact O-CZ3 3.45Å; R301-Q816 WeakPolarHBondContact CD-O 3.48Å; R301-Q816 PolarHBondContact NE-O 2.97Å; R301-Q816 PolarHBondContact NH1-O 3.37Å; R301-Q816 PolarHBondContact NH2-O 3.11Å; R301-L818 HydrophobicContact CB-CB 4.31Å; R301-L818 HydrophobicContact CB-CG 4.1Å; R301-L818 HydrophobicContact CG-CG 4.44Å
302	R	70.5	Confident	70.1	Confident	10 Å²	10	49.1 Å²	49.1	4%	0.038	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-60.6	-29.5	173.9	-176.8	76.1	-178.5	-170.2	2	111.8	E133 C304 W305 P328 L818 S820	E133-R302 IonicContact OE1-NH2 3.9Å; E133-R302 PolarHBondContact OE1-NH2 3.44Å; R302-C304 PolarHBondContact O-N 3Å; R302-C304 VanDerWaalsContact O-N 3.12Å; R302-W305 PolarHBondContact O-N 3.01Å; R302-W305 VanDerWaalsContact O-N 3.1Å; R302-P328 VanDerWaalsContact NH1-C 3.34Å; R302-P328 VanDerWaalsContact NH1-CB 3.32Å; R302-P328 PolarHBondContact NH1-O 2.92Å; R302-L818 HydrophobicContact CB-CB 4.15Å; R302-L818 HydrophobicContact CB-CD2 3.66Å; R302-L818 HydrophobicContact CB-CG 4.48Å; R302-S820 WeakPolarHBondContact CB-OG 3.05Å; R302-S820 WeakPolarHBondContact CG-OG 3.48Å
303	S	67.7	Low	69.7	Low	14 Å²	14	49.5 Å²	49.5	10%	0.098	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-63	-16	176.6	58.9	0	0	0	0	114.4	R301 W305 D306	R301-S303 WeakPolarHBondContact CB-OG 3.36Å; R301-S303 PolarHBondContact O-N 2.97Å; S303-W305 PolarHBondContact O-N 3.18Å; S303-W305 VanDerWaalsContact O-N 3.13Å; S303-D306 VanDerWaalsContact CA-OD2 3.31Å; S303-D306 WeakPolarHBondContact CA-OD2 3.38Å; S303-D306 PolarHBondContact O-N 3.44Å
304	C	74.1	Confident	69.4	Low	1 Å²	1	51.8 Å²	51.8	1%	0.007	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-63.4	-14.7	173.5	-51	0	0	0	0	112.5	R301 R302 P312 L315 C316 L325	R301-C304 VanDerWaalsContact O-CB 3.28Å; R301-C304 WeakPolarHBondContact O-CB 3.31Å; R301-C304 PolarHBondContact O-N 3.5Å; R301-C304 PolarHBondContact O-SG 2.89Å; R302-C304 PolarHBondContact O-N 3Å; R302-C304 VanDerWaalsContact O-N 3.12Å; C304-P312 HydrophobicContact CB-CB 4.42Å; C304-P312 WeakPolarHBondContact O-CA 3.29Å; C304-P312 WeakPolarHBondContact O-CB 3.44Å; C304-L315 WeakPolarHBondContact O-CD1 3.34Å; C304-C316 VanDerWaalsContact CA-SG 3.58Å; C304-C316 HydrophobicContact CB-CB 3.91Å; C304-C316 WeakPolarHBondContact CB-SG 3.29Å; C304-C316 WeakPolarHBondContact SG-CB 3.22Å; C304-C316 CovalentContact SG-SG 2.02Å; C304-C316 PolarHBondContact SG-SG 2.9Å; C304-L325 HydrophobicContact CB-CD2 4.07Å
305	W	74	Confident	68.9	Low	45 Å²	45	54.5 Å²	54.5	17%	0.17	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-111.8	4.1	179.6	-63.4	-87.4	0	0	0	114.1	L300 R301 R302 S303 N307 L325 S327 P328 P331	L300-W305 HydrophobicContact CD1-CH2 4.24Å; R301-W305 WeakPolarHBondContact O-CZ3 3.45Å; R302-W305 PolarHBondContact O-N 3.01Å; R302-W305 VanDerWaalsContact O-N 3.1Å; S303-W305 PolarHBondContact O-N 3.18Å; S303-W305 VanDerWaalsContact O-N 3.13Å; W305-N307 PolarHBondContact O-N 3.27Å; W305-L325 WeakPolarHBondContact CZ2-O 3.36Å; W305-L325 PolarHBondContact NE1-O 3.49Å; W305-S327 WeakPolarHBondContact CH2-O 3.5Å; W305-S327 WeakPolarHBondContact CZ2-O 3.28Å; W305-P328 HydrophobicContact CB-CB 4.28Å; W305-P328 HydrophobicContact CD2-CB 3.59Å; W305-P328 HydrophobicContact CE3-CB 3.83Å; W305-P328 HydrophobicContact CG-CB 3.79Å; W305-P328 HydrophobicContact CZ3-CB 4.39Å; W305-P331 HydrophobicContact CH2-CG 4.1Å; W305-P331 HydrophobicContact CZ3-CG 3.81Å
306	D	62	Low	68.8	Low	89 Å²	89	54.4 Å²	54.4	48%	0.476	32%	0.317	S	S	.	.	S	Bend	trans	-77.3	-17.6	-172.3	-73.3	-11.3	0	0	0	113.8	S303	S303-D306 VanDerWaalsContact CA-OD2 3.31Å; S303-D306 WeakPolarHBondContact CA-OD2 3.38Å; S303-D306 PolarHBondContact O-N 3.44Å
307	N	57.4	Low	68.9	Low	108 Å²	108	54.9 Å²	54.9	58%	0.578	33%	0.326	S	S	*	.	S	Bend	trans	-110.7	141.6	-172	-109.7	-3.8	0	0	0	114.2	W305 G309 L315	W305-N307 PolarHBondContact O-N 3.27Å; N307-G309 PolarHBondContact O-N 2.99Å; N307-L315 HydrophobicContact CB-CD1 3.79Å; N307-L315 HydrophobicContact CB-CD2 4.05Å; N307-L315 HydrophobicContact CB-CG 4.47Å
308	Y	50	Low	69	Low	91 Å²	91	57.9 Å²	57.9	36%	0.357	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	123.7	-173.5	-84.1	-60.7	0	0	0	115.8	F123 R124 R125 T310	F123-Y308 HydrophobicContact CB-CD2 3.67Å; F123-Y308 HydrophobicContact CB-CE2 3.44Å; F123-Y308 VanDerWaalsContact CB-CE2 3.44Å; F123-Y308 WeakPolarHBondContact O-CE2 3.35Å; F123-Y308 VanDerWaalsContact O-CZ 3.3Å; F123-Y308 PolarHBondContact O-OH 3.06Å; R124-Y308 VanDerWaalsContact CA-CZ 3.44Å; R124-Y308 WeakPolarHBondContact CA-OH 3.35Å; R124-Y308 HydrophobicContact CB-CE1 4.4Å; R124-Y308 PolarHBondContact N-OH 3.26Å; R124-Y308 VanDerWaalsContact N-OH 3.11Å; R124-Y308 VanDerWaalsContact O-CD1 3.23Å; R124-Y308 WeakPolarHBondContact O-CD1 3.49Å; R124-Y308 WeakPolarHBondContact O-CE1 3.24Å; R124-Y308 VanDerWaalsContact O-CZ 3.3Å; R125-Y308 VanDerWaalsContact CA-CZ 3.5Å; R125-Y308 WeakPolarHBondContact CA-OH 3.32Å; R125-Y308 WeakPolarHBondContact CB-OH 3.5Å; R125-Y308 WeakPolarHBondContact CG-OH 3.34Å; R125-Y308 VanDerWaalsContact N-CE1 3.33Å; R125-Y308 VanDerWaalsContact N-CZ 3.26Å; R125-Y308 PolarHBondContact N-OH 3.01Å; Y308-T310 PolarHBondContact O-N 3.04Å
309	G	54.9	Low	69.4	Low	87 Å²	87	57.5 Å²	57.5	90%	0.897	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	1	158.5	0	0	0	0	0	115.4	N307	N307-G309 PolarHBondContact O-N 2.99Å
310	T	57	Low	69.3	Low	61 Å²	61	65 Å²	65	37%	0.374	36%	0.359	S	S	.	.	S	Bend	trans	-85.7	132.7	172.2	48.8	0	0	0	0	109.1	Y308 L314 L315	Y308-T310 PolarHBondContact O-N 3.04Å; T310-L314 HydrophobicContact CG2-CD1 4.34Å; T310-L315 WeakPolarHBondContact OG1-CD1 3.49Å
311	D	66.9	Low	69.6	Low	122 Å²	122	66.4 Å²	66.4	65%	0.652	37%	0.369	S	S	*	.			trans	-48.8	131.4	166.7	-74.2	-31.7	0	0	0	109.2	G313 L314	D311-G313 PolarHBondContact O-N 3.24Å; D311-L314 HydrophobicContact CB-CD1 4.2Å; D311-L314 WeakPolarHBondContact O-CB 3.33Å; D311-L314 PolarHBondContact O-N 3.01Å
312	P	70	Confident	69.9	Low	34 Å²	34	69.2 Å²	69.2	22%	0.221	39%	0.394	C	S	.	.	H	α-helix	trans	-58.5	-20.7	-177.2	23.2	-33.9	0	0	0	112.5	C304 L314 L315 C316 L325	C304-P312 HydrophobicContact CB-CB 4.42Å; C304-P312 WeakPolarHBondContact O-CA 3.29Å; C304-P312 WeakPolarHBondContact O-CB 3.44Å; P312-L314 VanDerWaalsContact C-N 3.26Å; P312-L314 PolarHBondContact O-N 3.47Å; P312-L315 PolarHBondContact O-N 3.39Å; P312-C316 PolarHBondContact O-N 3.29Å; P312-L325 HydrophobicContact CB-CB 4.07Å; P312-L325 HydrophobicContact CB-CD1 4.34Å; P312-L325 HydrophobicContact CB-CD2 4.28Å; P312-L325 HydrophobicContact CB-CG 4.47Å; P312-L325 HydrophobicContact CG-CB 3.79Å; P312-L325 HydrophobicContact CG-CD1 4.47Å
313	G	72.7	Confident	70.5	Confident	33 Å²	33	74.1 Å²	74.1	34%	0.34	42%	0.417	S	S	.	.	H	α-helix	trans	-66	-21.9	173.1	0	0	0	0	0	114.3	D311 C316 P317	D311-G313 PolarHBondContact O-N 3.24Å; G313-C316 CarbonylContact O-C 3.44Å; G313-P317 VanDerWaalsContact O-CA 3.24Å; G313-P317 WeakPolarHBondContact O-CA 3.39Å
314	L	73.1	Confident	71.3	Confident	126 Å²	126	73.4 Å²	73.4	66%	0.66	41%	0.412	S	S	*	.	H	α-helix	trans	-74.9	-36.8	174.4	-72.5	157.3	0	0	0	111.9	T310 D311 P312	T310-L314 HydrophobicContact CG2-CD1 4.34Å; D311-L314 HydrophobicContact CB-CD1 4.2Å; D311-L314 WeakPolarHBondContact O-CB 3.33Å; D311-L314 PolarHBondContact O-N 3.01Å; P312-L314 VanDerWaalsContact C-N 3.26Å; P312-L314 PolarHBondContact O-N 3.47Å
315	L	70.9	Confident	71.7	Confident	66 Å²	66	74 Å²	74	35%	0.346	42%	0.415	S	S	.	.	H	α-helix	trans	-76.5	-32.9	176.5	-80	135.6	0	0	0	112	C304 N307 T310 P312	C304-L315 WeakPolarHBondContact O-CD1 3.34Å; N307-L315 HydrophobicContact CB-CD1 3.79Å; N307-L315 HydrophobicContact CB-CD2 4.05Å; N307-L315 HydrophobicContact CB-CG 4.47Å; T310-L315 WeakPolarHBondContact OG1-CD1 3.49Å; P312-L315 PolarHBondContact O-N 3.39Å
316	C	76.9	Confident	72	Confident	11 Å²	11	78.5 Å²	78.5	7%	0.074	43%	0.433	C	S	.	.			trans	-131.7	69.9	-175.3	-64.6	0	0	0	0	111.5	C304 P312 G313 L318 V319 L325	C304-C316 VanDerWaalsContact CA-SG 3.58Å; C304-C316 HydrophobicContact CB-CB 3.91Å; C304-C316 WeakPolarHBondContact CB-SG 3.29Å; C304-C316 WeakPolarHBondContact SG-CB 3.22Å; C304-C316 CovalentContact SG-SG 2.02Å; C304-C316 PolarHBondContact SG-SG 2.9Å; P312-C316 PolarHBondContact O-N 3.29Å; G313-C316 CarbonylContact O-C 3.44Å; C316-L318 PolarHBondContact O-N 2.97Å; C316-V319 HydrophobicContact CB-CG2 3.93Å; C316-V319 PolarHBondContact O-N 3.35Å; C316-L325 HydrophobicContact CB-CD2 4.36Å
317	P	77.7	Confident	73	Confident	102 Å²	102	74.5 Å²	74.5	66%	0.662	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-16.9	-174.5	28	-35.9	0	0	0	114	G313 V319	G313-P317 VanDerWaalsContact O-CA 3.24Å; G313-P317 WeakPolarHBondContact O-CA 3.39Å; P317-V319 VanDerWaalsContact C-N 3.28Å; P317-V319 PolarHBondContact O-N 3.35Å
318	L	77.6	Confident	74	Confident	113 Å²	113	69.6 Å²	69.6	59%	0.592	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-1.7	-178.5	-65.4	166.6	0	0	0	113.3	H299 C316 Y320	H299-L318 HydrophobicContact CB-CB 4.35Å; C316-L318 PolarHBondContact O-N 2.97Å; L318-Y320 PolarHBondContact O-N 3.41Å
319	V	78.5	Confident	75.5	Confident	10 Å²	10	65.2 Å²	65.2	6%	0.061	37%	0.369	C	S	.	.			trans	-86	105.1	-179.7	-180	0	0	0	0	109.5	H299 L300 C316 P317 C324 L325	H299-V319 HydrophobicContact CB-CG2 4.07Å; H299-V319 WeakPolarHBondContact O-CG2 3.02Å; L300-V319 HydrophobicContact CD1-CG1 4.14Å; C316-V319 HydrophobicContact CB-CG2 3.93Å; C316-V319 PolarHBondContact O-N 3.35Å; P317-V319 VanDerWaalsContact C-N 3.28Å; P317-V319 PolarHBondContact O-N 3.35Å; V319-C324 HydrophobicContact CG1-CB 3.68Å; V319-L325 HydrophobicContact CB-CD1 4.32Å; V319-L325 HydrophobicContact CB-CD2 4.26Å; V319-L325 HydrophobicContact CB-CG 4.29Å; V319-L325 HydrophobicContact CG1-CD1 4.48Å; V319-L325 HydrophobicContact CG1-CD2 4.14Å; V319-L325 HydrophobicContact CG1-CG 4Å; V319-L325 HydrophobicContact CG2-CD2 4.25Å
320	Y	75.5	Confident	77	Confident	207 Å²	207	61.1 Å²	61.1	81%	0.812	33%	0.326	S	S	*	.	S	Bend	trans	-121.4	127	174.6	-172.2	-94.6	0	0	0	109.7	L318	L318-Y320 PolarHBondContact O-N 3.41Å
321	P	82.1	Confident	78	Confident	32 Å²	32	58.2 Å²	58.2	21%	0.208	31%	0.308	C	S	.	.	S	Bend	cis	-77.2	157	0.1	31.2	-34.8	0	0	0	114.2	Q323 C324	P321-Q323 PolarHBondContact O-N 3.27Å; P321-Q323 VanDerWaalsContact O-N 3.08Å; P321-C324 WeakPolarHBondContact O-CB 3.42Å; P321-C324 PolarHBondContact O-N 3.02Å; P321-C324 VanDerWaalsContact O-N 3.12Å; P321-C324 PolarHBondContact O-SG 2.79Å
322	S	79.3	Confident	78.8	Confident	92 Å²	92	52.6 Å²	52.6	64%	0.643	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-61.8	-17.6	178.6	57	0	0	0	0	114.1	C324 L325	S322-C324 PolarHBondContact O-N 3.47Å; S322-L325 WeakPolarHBondContact O-CB 3.41Å; S322-L325 PolarHBondContact O-N 3.29Å
323	Q	83.2	Confident	79.6	Confident	112 Å²	112	51 Å²	51	52%	0.523	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-55.5	-28.2	172.4	-66.1	173.7	-13.6	0	0	112.6	L287 P321 L325 Y326	L287-Q323 HydrophobicContact CD1-CB 4.34Å; P321-Q323 PolarHBondContact O-N 3.27Å; P321-Q323 VanDerWaalsContact O-N 3.08Å; Q323-L325 PolarHBondContact O-N 2.87Å; Q323-Y326 WeakPolarHBondContact O-CB 3.43Å; Q323-Y326 PolarHBondContact O-N 2.99Å
324	C	83.7	Confident	80.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-67.7	-14.6	177.4	-59.8	0	0	0	0	114.2	C291 L300 V319 P321 S322 Y326 L330	C291-C324 WeakPolarHBondContact CA-SG 3.09Å; C291-C324 HydrophobicContact CB-CB 3.82Å; C291-C324 WeakPolarHBondContact CB-SG 3.33Å; C291-C324 WeakPolarHBondContact SG-CA 3.21Å; C291-C324 WeakPolarHBondContact SG-CB 3.3Å; C291-C324 CovalentContact SG-SG 2.03Å; C291-C324 PolarHBondContact SG-SG 3.01Å; L300-C324 HydrophobicContact CD1-CB 4.14Å; L300-C324 WeakPolarHBondContact CD1-O 3.33Å; V319-C324 HydrophobicContact CG1-CB 3.68Å; P321-C324 WeakPolarHBondContact O-CB 3.42Å; P321-C324 PolarHBondContact O-N 3.02Å; P321-C324 VanDerWaalsContact O-N 3.12Å; P321-C324 PolarHBondContact O-SG 2.79Å; S322-C324 PolarHBondContact O-N 3.47Å; C324-Y326 VanDerWaalsContact C-N 3.31Å; C324-L330 HydrophobicContact CB-CD2 4.33Å; C324-L330 WeakPolarHBondContact O-CD2 3.31Å
325	L	82.3	Confident	80.4	Confident	12 Å²	12	43.7 Å²	43.7	6%	0.063	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-92.3	8.6	178.5	-61.4	169.8	0	0	0	112.9	L300 C304 W305 P312 C316 V319 S322 Q323 S327	L300-L325 HydrophobicContact CD1-CD2 4.11Å; C304-L325 HydrophobicContact CB-CD2 4.07Å; W305-L325 WeakPolarHBondContact CZ2-O 3.36Å; W305-L325 PolarHBondContact NE1-O 3.49Å; P312-L325 HydrophobicContact CB-CB 4.07Å; P312-L325 HydrophobicContact CB-CD1 4.34Å; P312-L325 HydrophobicContact CB-CD2 4.28Å; P312-L325 HydrophobicContact CB-CG 4.47Å; P312-L325 HydrophobicContact CG-CB 3.79Å; P312-L325 HydrophobicContact CG-CD1 4.47Å; C316-L325 HydrophobicContact CB-CD2 4.36Å; V319-L325 HydrophobicContact CB-CD1 4.32Å; V319-L325 HydrophobicContact CB-CD2 4.26Å; V319-L325 HydrophobicContact CB-CG 4.29Å; V319-L325 HydrophobicContact CG1-CD1 4.48Å; V319-L325 HydrophobicContact CG1-CD2 4.14Å; V319-L325 HydrophobicContact CG1-CG 4Å; V319-L325 HydrophobicContact CG2-CD2 4.25Å; S322-L325 WeakPolarHBondContact O-CB 3.41Å; S322-L325 PolarHBondContact O-N 3.29Å; Q323-L325 PolarHBondContact O-N 2.87Å; L325-S327 PolarHBondContact O-N 3.34Å
326	Y	81.4	Confident	80.9	Confident	140 Å²	140	40.6 Å²	40.6	55%	0.549	21%	0.206	S	C	.	.	S	Bend	trans	-64.4	-38.9	-176	-175.8	-102.1	0	0	0	113.8	I267 Q323 C324	I267-Y326 HydrophobicContact CG2-CD1 3.78Å; I267-Y326 HydrophobicContact CG2-CE1 3.81Å; I267-Y326 VanDerWaalsContact O-CE1 3.3Å; I267-Y326 WeakPolarHBondContact O-CE1 3.47Å; Q323-Y326 WeakPolarHBondContact O-CB 3.43Å; Q323-Y326 PolarHBondContact O-N 2.99Å; C324-Y326 VanDerWaalsContact C-N 3.31Å
327	S	82.4	Confident	81.2	Confident	5 Å²	5	40.1 Å²	40.1	4%	0.035	20%	0.203	C	C	.	.			trans	-139.1	144	-179.3	81.3	0	0	0	0	113.3	I267 W305 L325 L329 L330	I267-S327 WeakPolarHBondContact CG1-OG 3.5Å; W305-S327 WeakPolarHBondContact CH2-O 3.5Å; W305-S327 WeakPolarHBondContact CZ2-O 3.28Å; L325-S327 PolarHBondContact O-N 3.34Å; S327-L329 PolarHBondContact O-N 3.32Å; S327-L330 PolarHBondContact O-N 3.03Å; S327-L330 PolarHBondContact OG-N 3.3Å
328	P	78.2	Confident	81.4	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.032	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-3.3	178.2	38	-40.8	0	0	0	112.7	F132 R302 W305	F132-P328 HydrophobicContact CD2-CG 3.97Å; F132-P328 HydrophobicContact CE2-CG 4.36Å; R302-P328 VanDerWaalsContact NH1-C 3.34Å; R302-P328 VanDerWaalsContact NH1-CB 3.32Å; R302-P328 PolarHBondContact NH1-O 2.92Å; W305-P328 HydrophobicContact CB-CB 4.28Å; W305-P328 HydrophobicContact CD2-CB 3.59Å; W305-P328 HydrophobicContact CE3-CB 3.83Å; W305-P328 HydrophobicContact CG-CB 3.79Å; W305-P328 HydrophobicContact CZ3-CB 4.39Å
329	L	81.5	Confident	81.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-24.2	174.4	-68.5	175.1	0	0	0	112.3	F132 Y136 S327 P331 I332 I333	F132-L329 HydrophobicContact CB-CD2 4.31Å; F132-L329 HydrophobicContact CB-CG 4.47Å; F132-L329 HydrophobicContact CD1-CD1 3.77Å; F132-L329 HydrophobicContact CD1-CG 4.45Å; F132-L329 HydrophobicContact CE1-CD1 4.16Å; F132-L329 HydrophobicContact CG-CD1 4.15Å; F132-L329 HydrophobicContact CG-CG 4.33Å; Y136-L329 HydrophobicContact CD2-CD2 4.11Å; Y136-L329 HydrophobicContact CE2-CD1 3.99Å; Y136-L329 HydrophobicContact CE2-CD2 4.28Å; S327-L329 PolarHBondContact O-N 3.32Å; L329-P331 VanDerWaalsContact C-CD 3.49Å; L329-I332 HydrophobicContact CD2-CD1 4.33Å; L329-I332 WeakPolarHBondContact O-CA 3.33Å; L329-I332 WeakPolarHBondContact O-CB 3.4Å; L329-I332 PolarHBondContact O-N 3.34Å; L329-I333 WeakPolarHBondContact O-CG1 3.32Å; L329-I333 PolarHBondContact O-N 2.78Å
330	L	85.5	Confident	81.1	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-55.5	-43.7	-176.9	-167.2	69.2	0	0	0	113.3	I267 L287 C291 L300 C324 S327 I332 I333 L334	I267-L330 HydrophobicContact CD1-CD1 4.35Å; L287-L330 HydrophobicContact CD2-CD1 3.94Å; L287-L330 HydrophobicContact CG-CD1 4.18Å; L287-L330 HydrophobicContact CG-CD2 4.38Å; C291-L330 HydrophobicContact CB-CD2 3.83Å; L300-L330 HydrophobicContact CD2-CD2 4.15Å; L300-L330 HydrophobicContact CD2-CG 4.48Å; C324-L330 HydrophobicContact CB-CD2 4.33Å; C324-L330 WeakPolarHBondContact O-CD2 3.31Å; S327-L330 PolarHBondContact O-N 3.03Å; S327-L330 PolarHBondContact OG-N 3.3Å; L330-I332 VanDerWaalsContact C-N 3.29Å; L330-I332 PolarHBondContact O-N 3.29Å; L330-I333 PolarHBondContact O-N 2.93Å; L330-L334 HydrophobicContact CG-CD1 4.08Å; L330-L334 VanDerWaalsContact O-CG 3.31Å; L330-L334 WeakPolarHBondContact O-CG 3.49Å; L330-L334 PolarHBondContact O-N 3.43Å; L330-L334 VanDerWaalsContact O-N 3.09Å
331	P	79.4	Confident	80.5	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-32.7	175.1	-18.4	31	0	0	0	113.3	L300 W305 L329 A335 L818	L300-P331 HydrophobicContact CG-CG 4.25Å; W305-P331 HydrophobicContact CH2-CG 4.1Å; W305-P331 HydrophobicContact CZ3-CG 3.81Å; L329-P331 VanDerWaalsContact C-CD 3.49Å; P331-A335 WeakPolarHBondContact O-CB 3.35Å; P331-A335 PolarHBondContact O-N 2.94Å; P331-L818 HydrophobicContact CB-CD2 3.55Å; P331-L818 HydrophobicContact CG-CD2 4.31Å
332	I	83.3	Confident	79.1	Confident	4 Å²	4	29 Å²	29	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-70.9	-42.3	178.9	-59.4	172.7	0	0	0	110	L138 L152 W258 M263 L329 L330 A335 A336	L138-I332 HydrophobicContact CD1-CD1 4.04Å; L138-I332 HydrophobicContact CD2-CD1 4.25Å; L152-I332 HydrophobicContact CD1-CD1 3.97Å; L152-I332 HydrophobicContact CD1-CG1 4.33Å; W258-I332 HydrophobicContact CE3-CG2 4.3Å; W258-I332 HydrophobicContact CZ3-CG2 4.3Å; M263-I332 HydrophobicContact CE-CG2 3.98Å; M263-I332 HydrophobicContact SD-CG2 4.33Å; L329-I332 HydrophobicContact CD2-CD1 4.33Å; L329-I332 WeakPolarHBondContact O-CA 3.33Å; L329-I332 WeakPolarHBondContact O-CB 3.4Å; L329-I332 PolarHBondContact O-N 3.34Å; L330-I332 VanDerWaalsContact C-N 3.29Å; L330-I332 PolarHBondContact O-N 3.29Å; I332-A335 PolarHBondContact O-N 3.47Å; I332-A336 VanDerWaalsContact O-CB 3.31Å; I332-A336 WeakPolarHBondContact O-CB 3.32Å; I332-A336 PolarHBondContact O-N 3.46Å
333	I	86.2	Confident	77.8	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.164	C	C	.	.	I	π-helix	trans	-59.8	-48.8	176.4	-65.4	170.1	0	0	0	110.7	L260 M263 I267 L329 L330 A335 L337 L338	L260-I333 HydrophobicContact CD1-CG2 3.46Å; L260-I333 VanDerWaalsContact CD1-CG2 3.46Å; M263-I333 HydrophobicContact CB-CD1 3.66Å; M263-I333 HydrophobicContact CB-CG1 3.74Å; M263-I333 HydrophobicContact CG-CG1 4.33Å; M263-I333 HydrophobicContact SD-CG1 3.62Å; I267-I333 HydrophobicContact CD1-CD1 3.44Å; I267-I333 VanDerWaalsContact CD1-CD1 3.44Å; I267-I333 HydrophobicContact CG1-CD1 4.38Å; L329-I333 WeakPolarHBondContact O-CG1 3.32Å; L329-I333 PolarHBondContact O-N 2.78Å; L330-I333 PolarHBondContact O-N 2.93Å; I333-A335 VanDerWaalsContact C-N 3.33Å; I333-A335 PolarHBondContact O-N 2.85Å; I333-L337 HydrophobicContact CG1-CD1 4.34Å; I333-L337 PolarHBondContact O-N 3.26Å; I333-L338 HydrophobicContact CG2-CD1 4.14Å; I333-L338 PolarHBondContact O-N 3.33Å
334	L	83.5	Confident	76.3	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.016	16%	0.163	C	C	.	.	I	π-helix	trans	-66.5	-35.4	-178.8	-65.9	167.2	0	0	0	112.2	I288 C291 Y292 F295 L300 L330 L338	I288-L334 HydrophobicContact CG2-CD2 4Å; C291-L334 HydrophobicContact CB-CD1 4.38Å; Y292-L334 HydrophobicContact CD2-CD2 4.11Å; F295-L334 HydrophobicContact CB-CB 4.42Å; F295-L334 HydrophobicContact CB-CD1 3.82Å; F295-L334 HydrophobicContact CD1-CB 4.01Å; F295-L334 HydrophobicContact CD2-CB 4.17Å; F295-L334 HydrophobicContact CE1-CB 4.32Å; F295-L334 HydrophobicContact CE2-CB 4.47Å; F295-L334 HydrophobicContact CG-CB 3.93Å; F295-L334 HydrophobicContact CG-CD1 4.22Å; L300-L334 HydrophobicContact CD2-CD1 3.91Å; L330-L334 HydrophobicContact CG-CD1 4.08Å; L330-L334 VanDerWaalsContact O-CG 3.31Å; L330-L334 WeakPolarHBondContact O-CG 3.49Å; L330-L334 PolarHBondContact O-N 3.43Å; L330-L334 VanDerWaalsContact O-N 3.09Å; L334-L338 HydrophobicContact CD2-CD1 4Å
335	A	79.2	Confident	74.8	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.008	17%	0.172	C	C	.	.	I	π-helix	trans	-77.1	-47.3	-179.6	0	0	0	0	0	113.1	F295 P331 I332 I333 W733 T734	F295-A335 HydrophobicContact CE2-CB 3.97Å; F295-A335 HydrophobicContact CZ-CB 3.7Å; P331-A335 WeakPolarHBondContact O-CB 3.35Å; P331-A335 PolarHBondContact O-N 2.94Å; I332-A335 PolarHBondContact O-N 3.47Å; I333-A335 VanDerWaalsContact C-N 3.33Å; I333-A335 PolarHBondContact O-N 2.85Å; A335-W733 HydrophobicContact CB-CE3 3.56Å; A335-W733 HydrophobicContact CB-CZ3 3.78Å; A335-T734 HydrophobicContact CB-CG2 3.83Å; A335-T734 WeakPolarHBondContact O-CG2 3.24Å; A335-T734 PolarHBondContact O-N 3.45Å; A335-T734 PolarHBondContact O-OG1 3.47Å
336	A	82.2	Confident	73.2	Confident	2 Å²	2	35.1 Å²	35.1	2%	0.017	19%	0.186	C	C	.	.	I	π-helix	trans	-103.3	-36.9	-162.7	0	0	0	0	0	114.8	Y156 I332 T734	Y156-A336 HydrophobicContact CE2-CB 4.08Å; I332-A336 VanDerWaalsContact O-CB 3.31Å; I332-A336 WeakPolarHBondContact O-CB 3.32Å; I332-A336 PolarHBondContact O-N 3.46Å; A336-T734 WeakPolarHBondContact CA-OG1 3.16Å; A336-T734 HydrophobicContact CB-CG2 3.82Å
337	L	83.4	Confident	72	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	19%	0.187	C	C	.	.	I	π-helix	trans	-100.6	-21.9	-165.8	-60.2	176.7	0	0	0	113.4	W258 M263 I333 L352 V354	W258-L337 HydrophobicContact CB-CD2 4.38Å; W258-L337 WeakPolarHBondContact O-CD2 3.36Å; M263-L337 HydrophobicContact CE-CD1 4.45Å; M263-L337 HydrophobicContact CG-CD1 4.29Å; M263-L337 HydrophobicContact SD-CD1 3.48Å; M263-L337 WeakPolarHBondContact SD-CD1 3.33Å; I333-L337 HydrophobicContact CG1-CD1 4.34Å; I333-L337 PolarHBondContact O-N 3.26Å; L337-L352 HydrophobicContact CD2-CD2 4.26Å; L337-L352 VanDerWaalsContact CD2-O 3.25Å; L337-L352 WeakPolarHBondContact CD2-O 3.45Å; L337-V354 HydrophobicContact CD2-CG2 4.4Å
338	L	81	Confident	71.2	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.016	19%	0.186	C	C	.	.	S	Bend	trans	-101.5	144.5	-177.3	-70.5	168.4	0	0	0	111.7	I288 I333 L334 W348	I288-L338 HydrophobicContact CG2-CD1 3.63Å; I333-L338 HydrophobicContact CG2-CD1 4.14Å; I333-L338 PolarHBondContact O-N 3.33Å; L334-L338 HydrophobicContact CD2-CD1 4Å; L338-W348 HydrophobicContact CD2-CD2 4.41Å; L338-W348 HydrophobicContact CD2-CZ2 4.23Å
339	P	77.8	Confident	70.8	Confident	13 Å²	13	34.1 Å²	34.1	8%	0.084	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-72.1	145.7	178.2	29.3	-34.2	0	0	0	112.7	D341 W348 S731	P339-D341 PolarHBondContact O-N 2.91Å; P339-W348 HydrophobicContact CG-CG 4.49Å; P339-S731 CarbonylContact C-O 3.58Å; P339-S731 WeakPolarHBondContact CA-O 3.46Å
340	N	71.1	Confident	70.8	Confident	45 Å²	45	36.7 Å²	36.7	24%	0.241	20%	0.204	C	C	.	.			trans	-93.3	46.3	-177.5	-169.3	27.2	0	0	0	112.6	S342 S731 W733	N340-S342 PolarHBondContact O-N 2.98Å; N340-S731 PolarHBondContact N-O 3Å; N340-W733 HydrophobicContact CB-CB 4.37Å
341	D	63.9	Low	70.8	Confident	70 Å²	70	36.8 Å²	36.8	37%	0.374	20%	0.204	S	C	.	.			trans	-79.4	88.9	178.4	-78.7	-21.8	0	0	0	110.1	P339 N343 N344	P339-D341 PolarHBondContact O-N 2.91Å; D341-N343 PolarHBondContact O-N 3.11Å; D341-N344 CarbonylContact O-C 3.53Å; D341-N344 PolarHBondContact O-N 2.94Å
342	S	53.5	Low	71.2	Confident	99 Å²	99	36.8 Å²	36.8	69%	0.692	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-23.3	-173.2	68.6	0	0	0	0	115.2	N340	N340-S342 PolarHBondContact O-N 2.98Å
343	N	50.5	Low	71.6	Confident	142 Å²	142	36.6 Å²	36.6	76%	0.759	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-11.8	-173.2	-71.2	2	0	0	0	113.9	D341	D341-N343 PolarHBondContact O-N 3.11Å
344	N	51.4	Low	71.8	Confident	94 Å²	94	36.5 Å²	36.5	50%	0.503	20%	0.203	S	C	.	.			trans	-160.5	84.4	178.8	-90	-33.5	0	0	0	110.6	D341 N346 N347	D341-N344 CarbonylContact O-C 3.53Å; D341-N344 PolarHBondContact O-N 2.94Å; N344-N346 PolarHBondContact O-N 3.26Å; N344-N347 PolarHBondContact O-N 2.91Å
345	F	52.7	Low	72.2	Confident	44 Å²	44	36.4 Å²	36.4	19%	0.193	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-5.5	166.8	-137.6	-107	0	0	0	113.5	F194 I288 Y292	F194-F345 AromaticContact CD2-CD1 3.91Å; F194-F345 HydrophobicContact CD2-CD1 3.91Å; F194-F345 HydrophobicContact CD2-CE1 4.35Å; F194-F345 AromaticContact CE2-CD1 3.39Å; F194-F345 HydrophobicContact CE2-CD1 3.39Å; F194-F345 AromaticContact CE2-CE1 3.46Å; F194-F345 HydrophobicContact CE2-CE1 3.46Å; F194-F345 VanDerWaalsContact CE2-CE1 3.46Å; F194-F345 HydrophobicContact CZ-CD1 4.1Å; F194-F345 AromaticContact CZ-CE1 3.69Å; F194-F345 HydrophobicContact CZ-CE1 3.69Å; I288-F345 HydrophobicContact CG2-CE1 4.33Å; Y292-F345 AromaticContact CD1-CD2 3.96Å; Y292-F345 HydrophobicContact CD1-CD2 3.96Å; Y292-F345 AromaticContact CD1-CE2 3.74Å; Y292-F345 HydrophobicContact CD1-CE2 3.74Å; Y292-F345 HydrophobicContact CD1-CG 4.5Å; Y292-F345 HydrophobicContact CD1-CZ 4.04Å; Y292-F345 HydrophobicContact CD2-CE1 4.49Å; Y292-F345 AromaticContact CD2-CE2 3.61Å; Y292-F345 HydrophobicContact CD2-CE2 3.61Å; Y292-F345 AromaticContact CD2-CZ 3.51Å; Y292-F345 HydrophobicContact CD2-CZ 3.51Å; Y292-F345 AromaticContact CE1-CD2 3.47Å; Y292-F345 HydrophobicContact CE1-CD2 3.47Å; Y292-F345 VanDerWaalsContact CE1-CD2 3.47Å; Y292-F345 AromaticContact CE1-CE2 3.35Å; Y292-F345 HydrophobicContact CE1-CE2 3.35Å; Y292-F345 HydrophobicContact CE1-CG 4.36Å; Y292-F345 HydrophobicContact CE1-CZ 4.11Å; Y292-F345 HydrophobicContact CE2-CD2 4.21Å; Y292-F345 AromaticContact CE2-CE2 3.24Å; Y292-F345 HydrophobicContact CE2-CE2 3.24Å; Y292-F345 AromaticContact CE2-CZ 3.63Å; Y292-F345 HydrophobicContact CE2-CZ 3.63Å; Y292-F345 HydrophobicContact CG-CD2 4.48Å; Y292-F345 HydrophobicContact CG-CE1 4.34Å; Y292-F345 AromaticContact CG-CE2 3.84Å; Y292-F345 HydrophobicContact CG-CE2 3.84Å; Y292-F345 AromaticContact CG-CZ 3.73Å; Y292-F345 HydrophobicContact CG-CZ 3.73Å; Y292-F345 AromaticContact CZ-CD2 3.62Å; Y292-F345 AromaticContact CZ-CE2 3.09Å; Y292-F345 AromaticContact CZ-CZ 3.92Å
346	N	50	Low	72.6	Confident	64 Å²	64	36.3 Å²	36.3	34%	0.342	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-16.2	-174.9	-69.5	-16.7	0	0	0	114.5	T192 Y193 N344	T192-N346 WeakPolarHBondContact CB-OD1 3.35Å; T192-N346 HydrophobicContact CG2-CB 3.57Å; T192-N346 WeakPolarHBondContact CG2-ND2 3.35Å; T192-N346 WeakPolarHBondContact CG2-OD1 3.48Å; Y193-N346 VanDerWaalsContact CD2-O 3.22Å; Y193-N346 WeakPolarHBondContact CD2-O 3.48Å; Y193-N346 WeakPolarHBondContact CE2-O 3.48Å; N344-N346 PolarHBondContact O-N 3.26Å
347	N	56	Low	72.9	Confident	107 Å²	107	36.3 Å²	36.3	57%	0.572	20%	0.202	S	C	*	.			trans	-112.9	64.8	-177.7	-79.2	-4.1	0	0	0	112.1	N344 G349	N344-N347 PolarHBondContact O-N 2.91Å; N347-G349 VanDerWaalsContact C-N 3.33Å; N347-G349 PolarHBondContact O-N 3.3Å
348	W	64.3	Low	72.7	Confident	7 Å²	7	39.7 Å²	39.7	3%	0.027	22%	0.217	C	C	.	.			trans	-76.9	82.3	177.8	-177.6	19.4	0	0	0	111.9	Y168 Y193 L200 I203 L260 L338 P339 K350	Y168-W348 PolarHBondContact OH-O 3.32Å; Y193-W348 HydrophobicContact CD1-CB 4.39Å; Y193-W348 HydrophobicContact CD2-CB 3.65Å; Y193-W348 HydrophobicContact CE2-CB 4.32Å; Y193-W348 VanDerWaalsContact CE2-N 3.33Å; Y193-W348 HydrophobicContact CG-CB 3.79Å; Y193-W348 HydrophobicContact CG-CE3 4.47Å; L200-W348 HydrophobicContact CD1-CE3 4.42Å; L200-W348 HydrophobicContact CD1-CH2 3.89Å; L200-W348 HydrophobicContact CD1-CZ3 3.37Å; I203-W348 HydrophobicContact CG2-CH2 4.48Å; L260-W348 HydrophobicContact CD2-CH2 3.01Å; L260-W348 HydrophobicContact CD2-CZ2 3.38Å; L260-W348 HydrophobicContact CD2-CZ3 4.03Å; L338-W348 HydrophobicContact CD2-CD2 4.41Å; L338-W348 HydrophobicContact CD2-CZ2 4.23Å; P339-W348 HydrophobicContact CG-CG 4.49Å; W348-K350 PolarHBondContact NE1-O 3.02Å
349	G	71.1	Confident	72.5	Confident	16 Å²	16	41.1 Å²	41.1	17%	0.165	23%	0.23	C	C	.	.			trans	-95.1	2.1	-178.7	0	0	0	0	0	116.7	S165 I166 Y168 N347	S165-G349 CarbonylContact C-O 3.59Å; S165-G349 WeakPolarHBondContact CA-O 3.37Å; I166-G349 PolarHBondContact N-O 3.42Å; Y168-G349 VanDerWaalsContact OH-CA 3.29Å; Y168-G349 WeakPolarHBondContact OH-CA 3.35Å; N347-G349 VanDerWaalsContact C-N 3.33Å; N347-G349 PolarHBondContact O-N 3.3Å
350	K	80.8	Confident	72.6	Confident	54 Å²	54	45 Å²	45	24%	0.235	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	137.3	-166.8	-65.6	159.2	178.1	173	0	111.3	F164 W348 Y727	F164-K350 CarbonylContact O-C 3.15Å; F164-K350 WeakPolarHBondContact O-CA 3.29Å; W348-K350 PolarHBondContact NE1-O 3.02Å; K350-Y727 HydrophobicContact CD-CE1 3.74Å; K350-Y727 HydrophobicContact CG-CE1 4.46Å
351	S	85.3	Confident	73	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.014	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.9	177.9	-175.6	0	0	0	0	110	V163 F164	V163-S351 WeakPolarHBondContact CA-O 3.2Å; F164-S351 PolarHBondContact N-O 3.37Å; F164-S351 PolarHBondContact O-N 3.49Å
352	L	89.1	Confident	73.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.4	175.6	-173.6	145.6	0	0	0	110	V163 L337 V354 F732	V163-L352 HydrophobicContact CG2-CD1 4.25Å; V163-L352 HydrophobicContact CG2-CG 4.45Å; L337-L352 HydrophobicContact CD2-CD2 4.26Å; L337-L352 VanDerWaalsContact CD2-O 3.25Å; L337-L352 WeakPolarHBondContact CD2-O 3.45Å; L352-V354 HydrophobicContact CD2-CG2 3.47Å; L352-V354 VanDerWaalsContact CD2-CG2 3.47Å; L352-F732 HydrophobicContact CB-CD1 4.17Å; L352-F732 HydrophobicContact CB-CE1 3.6Å; L352-F732 HydrophobicContact CB-CE2 4.15Å; L352-F732 HydrophobicContact CB-CZ 3.61Å; L352-F732 HydrophobicContact CD1-CD1 4.14Å; L352-F732 HydrophobicContact CD1-CD2 3.56Å; L352-F732 HydrophobicContact CD1-CE1 4.22Å; L352-F732 HydrophobicContact CD1-CE2 3.67Å; L352-F732 HydrophobicContact CD1-CG 3.84Å; L352-F732 HydrophobicContact CD1-CZ 4.02Å; L352-F732 HydrophobicContact CG-CZ 4.43Å
353	M	91.4	Very high	75.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.5	170	-60.8	-169.9	-176.3	0	0	109.1	R161 V162 F164 L207 L210 I214 I257 W258 C259 L355	R161-M353 WeakPolarHBondContact CA-O 3.41Å; V162-M353 PolarHBondContact N-O 3.05Å; V162-M353 PolarHBondContact O-N 3.41Å; F164-M353 HydrophobicContact CD2-CE 4.05Å; F164-M353 HydrophobicContact CD2-SD 4.27Å; F164-M353 HydrophobicContact CE2-CE 4.09Å; F164-M353 HydrophobicContact CE2-SD 3.91Å; L207-M353 HydrophobicContact CB-CE 4.43Å; L207-M353 HydrophobicContact CD2-CE 3.65Å; L210-M353 HydrophobicContact CB-CE 4.4Å; L210-M353 HydrophobicContact CD2-CE 4.3Å; I214-M353 HydrophobicContact CD1-SD 4.21Å; I257-M353 HydrophobicContact CG2-CB 4.15Å; W258-M353 WeakPolarHBondContact O-CA 3.48Å; C259-M353 HydrophobicContact CB-CG 3.94Å; C259-M353 HydrophobicContact CB-SD 4.34Å; M353-L355 WeakPolarHBondContact O-CD1 3.36Å
354	V	90.6	Very high	77	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	121.9	173.1	-167	0	0	0	0	108.4	Y156 Y159 I257 W258 L337 L352	Y156-V354 HydrophobicContact CD2-CG1 4.29Å; Y156-V354 HydrophobicContact CD2-CG2 4.21Å; Y156-V354 HydrophobicContact CE2-CG1 4.35Å; Y156-V354 HydrophobicContact CE2-CG2 3.63Å; Y159-V354 VanDerWaalsContact CB-CG1 3.49Å; Y159-V354 HydrophobicContact CD2-CG1 3.85Å; Y159-V354 HydrophobicContact CG-CG1 4.18Å; I257-V354 WeakPolarHBondContact CG2-O 3.44Å; W258-V354 HydrophobicContact CB-CB 3.82Å; W258-V354 HydrophobicContact CB-CG2 4.15Å; W258-V354 HydrophobicContact CD2-CB 4.17Å; W258-V354 HydrophobicContact CD2-CG1 4.47Å; W258-V354 HydrophobicContact CD2-CG2 4.49Å; W258-V354 HydrophobicContact CE3-CB 4.09Å; W258-V354 HydrophobicContact CE3-CG1 4.31Å; W258-V354 HydrophobicContact CE3-CG2 3.97Å; W258-V354 HydrophobicContact CG-CB 4.1Å; W258-V354 PolarHBondContact N-O 3.46Å; W258-V354 PolarHBondContact O-N 3.21Å; L337-V354 HydrophobicContact CD2-CG2 4.4Å; L352-V354 HydrophobicContact CD2-CG2 3.47Å; L352-V354 VanDerWaalsContact CD2-CG2 3.47Å
355	L	90.9	Very high	78.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	118.9	-175.6	-48.6	89.8	0	0	0	109.5	Y159 S160 V162 I214 Y220 I257 M353 I357 F365	Y159-L355 WeakPolarHBondContact CB-O 3.36Å; S160-L355 PolarHBondContact N-O 3.43Å; S160-L355 VanDerWaalsContact N-O 3.13Å; S160-L355 PolarHBondContact O-N 3.16Å; S160-L355 WeakPolarHBondContact OG-CB 3.42Å; V162-L355 HydrophobicContact CB-CD1 3.96Å; V162-L355 HydrophobicContact CG2-CD1 3.47Å; V162-L355 VanDerWaalsContact CG2-CD1 3.47Å; V162-L355 HydrophobicContact CG2-CD2 4.39Å; I214-L355 HydrophobicContact CG2-CD2 3.92Å; Y220-L355 HydrophobicContact CE2-CB 4.38Å; Y220-L355 HydrophobicContact CE2-CD2 4.42Å; I257-L355 HydrophobicContact CD1-CD2 4.5Å; I257-L355 HydrophobicContact CG2-CG 4.46Å; M353-L355 WeakPolarHBondContact O-CD1 3.36Å; L355-I357 HydrophobicContact CB-CG2 4.38Å; L355-I357 PolarHBondContact O-N 3.47Å; L355-F365 HydrophobicContact CD2-CE1 3.97Å; L355-F365 HydrophobicContact CD2-CZ 3.61Å
356	P	88.6	Confident	80.6	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.			trans	-78.5	75.7	176.6	33.4	-35.1	0	0	0	109.7	Y159 C224 Y225 C255	Y159-P356 HydrophobicContact CD1-CB 4.22Å; Y159-P356 HydrophobicContact CD2-CB 4.26Å; Y159-P356 HydrophobicContact CE1-CB 3.89Å; Y159-P356 HydrophobicContact CE2-CB 3.94Å; Y159-P356 HydrophobicContact CG-CB 4.4Å; C224-P356 WeakPolarHBondContact CA-O 3.21Å; Y225-P356 HydrophobicContact CD2-CB 4.18Å; Y225-P356 WeakPolarHBondContact CD2-O 3.4Å; Y225-P356 PolarHBondContact N-O 3.37Å; C255-P356 HydrophobicContact CB-CB 3.86Å; C255-P356 HydrophobicContact CB-CG 3.62Å
357	I	86.6	Confident	82.3	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.01	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-114.8	151.2	173.1	65.3	176.1	0	0	0	110.9	S160 Y220 L223 Y225 L355 F365	S160-I357 WeakPolarHBondContact OG-CD1 3.4Å; S160-I357 WeakPolarHBondContact OG-CG1 3.44Å; Y220-I357 HydrophobicContact CD2-CG2 3.75Å; Y220-I357 HydrophobicContact CE2-CG2 3.75Å; L223-I357 HydrophobicContact CB-CB 4.23Å; L223-I357 HydrophobicContact CB-CG2 4.46Å; L223-I357 CarbonylContact O-C 3.55Å; L223-I357 WeakPolarHBondContact O-CA 3.44Å; Y225-I357 VanDerWaalsContact CE2-O 3.31Å; Y225-I357 WeakPolarHBondContact CE2-O 3.27Å; L355-I357 HydrophobicContact CB-CG2 4.38Å; L355-I357 PolarHBondContact O-N 3.47Å; I357-F365 HydrophobicContact CD1-CD1 4.01Å; I357-F365 HydrophobicContact CD1-CE1 4.45Å; I357-F365 HydrophobicContact CD1-CG 4.41Å
358	H	79.8	Confident	84	Confident	71 Å²	71	24 Å²	24	33%	0.329	14%	0.137	S	C	.	.			trans	-64.8	151	171.8	-71.4	-70.6	0	0	0	111.7	L223 Y225 T360	L223-H358 PolarHBondContact O-CD2 2.94Å; L223-H358 PolarHBondContact O-N 3.41Å; Y225-H358 AromaticContact CD1-CE1 3.45Å; Y225-H358 VanDerWaalsContact CD1-CE1 3.45Å; Y225-H358 WeakPolarHBondContact CD1-CE1 3.45Å; Y225-H358 AromaticContact CD1-NE2 3.85Å; Y225-H358 AromaticContact CE1-CE1 3.16Å; Y225-H358 WeakPolarHBondContact CE1-CE1 3.47Å; Y225-H358 AromaticContact CE1-ND1 3.46Å; Y225-H358 WeakPolarHBondContact CE1-ND1 3.48Å; Y225-H358 AromaticContact CE1-NE2 4Å; Y225-H358 AromaticContact CZ-CE1 3.67Å; Y225-H358 AromaticContact CZ-ND1 3.44Å; H358-T360 VanDerWaalsContact C-N 3.34Å
359	A	77.5	Confident	85.2	Confident	34 Å²	34	23.8 Å²	23.8	28%	0.281	14%	0.136	S	C	.	.	S	Bend	trans	-62.2	-44.3	175.7	0	0	0	0	0	111.5	S362 Q394 E395	A359-S362 VanDerWaalsContact O-CB 3.26Å; A359-S362 WeakPolarHBondContact O-CB 3.1Å; A359-S362 PolarHBondContact O-N 3.48Å; A359-S362 PolarHBondContact O-OG 3.46Å; A359-Q394 HydrophobicContact CB-CB 4.16Å; A359-E395 WeakPolarHBondContact O-CG 3.43Å
360	T	79.2	Confident	86	Confident	93 Å²	93	24.5 Å²	24.5	57%	0.571	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	126.2	-174.8	55.3	0	0	0	0	111.9	L223 H358 S362 E395	L223-T360 VanDerWaalsContact CD2-O 3.27Å; L223-T360 WeakPolarHBondContact CD2-O 3.49Å; H358-T360 VanDerWaalsContact C-N 3.34Å; T360-S362 VanDerWaalsContact C-N 3.3Å; T360-E395 WeakPolarHBondContact CA-OE1 3.45Å
361	G	79.1	Confident	86.4	Confident	18 Å²	18	26.8 Å²	26.8	19%	0.186	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	9.4	-179.3	0	0	0	0	0	114.6	L223 H363 L364 E395	L223-G361 WeakPolarHBondContact CD1-O 3.39Å; G361-H363 PolarHBondContact O-N 3.31Å; G361-L364 WeakPolarHBondContact O-CB 3.4Å; G361-L364 PolarHBondContact O-N 3.36Å; G361-L364 VanDerWaalsContact O-N 3.14Å; G361-E395 VanDerWaalsContact C-OE2 3.3Å; G361-E395 WeakPolarHBondContact CA-OE2 3.28Å; G361-E395 VanDerWaalsContact N-CD 3.31Å; G361-E395 PolarHBondContact N-OE1 3.18Å; G361-E395 PolarHBondContact N-OE2 3.2Å
362	S	83.8	Confident	86.6	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-67.2	-19.8	-177.7	59.6	0	0	0	0	113.7	A359 T360 L364 F365 F366 I393 E395	A359-S362 VanDerWaalsContact O-CB 3.26Å; A359-S362 WeakPolarHBondContact O-CB 3.1Å; A359-S362 PolarHBondContact O-N 3.48Å; A359-S362 PolarHBondContact O-OG 3.46Å; T360-S362 VanDerWaalsContact C-N 3.3Å; S362-L364 VanDerWaalsContact C-N 3.27Å; S362-L364 PolarHBondContact O-N 3.33Å; S362-F365 WeakPolarHBondContact O-CB 3.22Å; S362-F365 PolarHBondContact O-N 3.31Å; S362-F366 PolarHBondContact O-N 3.1Å; S362-F366 VanDerWaalsContact O-N 3.13Å; S362-I393 VanDerWaalsContact CB-CG2 3.42Å; S362-I393 WeakPolarHBondContact OG-CG2 3.44Å; S362-E395 PolarHBondContact N-OE2 2.77Å; S362-E395 PolarHBondContact OG-OE2 2.88Å
363	H	83.7	Confident	86.6	Confident	26 Å²	26	31.5 Å²	31.5	12%	0.12	17%	0.169	C	C	.	.	H	α-helix	trans	-61.7	-31.2	170.2	70.1	-91.1	0	0	0	113.3	G361 F366 N367 E395 E398 I399 Q402	G361-H363 PolarHBondContact O-N 3.31Å; H363-F366 WeakPolarHBondContact O-CB 3.39Å; H363-F366 PolarHBondContact O-N 3.08Å; H363-N367 PolarHBondContact O-N 3.41Å; H363-N367 VanDerWaalsContact O-N 3.08Å; H363-E395 IonicContact CG-OE2 3.77Å; H363-E395 PolarHBondContact N-OE2 3.11Å; H363-E395 IonicContact ND1-OE2 3.59Å; H363-E395 PolarHBondContact ND1-OE2 2.91Å; H363-E398 IonicContact CE1-OE2 3.99Å; H363-E398 PolarHBondContact CE1-OE2 2.93Å; H363-E398 IonicContact CG-OE2 3.07Å; H363-E398 IonicContact ND1-OE2 3.38Å; H363-E398 PolarHBondContact ND1-OE2 3.14Å; H363-I399 HydrophobicContact CB-CG1 3.9Å; H363-Q402 PolarHBondContact CD2-NE2 2.73Å; H363-Q402 PolarHBondContact NE2-NE2 3.34Å
364	L	86.2	Confident	86.4	Confident	85 Å²	85	38.1 Å²	38.1	45%	0.445	20%	0.198	S	C	.	.	H	α-helix	trans	-66.7	-41.6	177	-65.3	174.9	0	0	0	110.9	T219 G361 S362 F366 N367 E368	T219-L364 HydrophobicContact CG2-CB 4.12Å; G361-L364 WeakPolarHBondContact O-CB 3.4Å; G361-L364 PolarHBondContact O-N 3.36Å; G361-L364 VanDerWaalsContact O-N 3.14Å; S362-L364 VanDerWaalsContact C-N 3.27Å; S362-L364 PolarHBondContact O-N 3.33Å; L364-F366 VanDerWaalsContact C-N 3.33Å; L364-F366 PolarHBondContact O-N 3.14Å; L364-N367 PolarHBondContact O-N 3.18Å; L364-E368 PolarHBondContact O-N 3.2Å
365	F	88.9	Confident	86.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-40.2	174.3	174.3	-98.7	0	0	0	111.6	I214 L217 T219 Y220 L223 L355 I357 S362 N367 E368 I369 I391	I214-F365 HydrophobicContact CG2-CE2 4.19Å; I214-F365 HydrophobicContact CG2-CZ 4.03Å; L217-F365 HydrophobicContact CD1-CE2 3.99Å; T219-F365 WeakPolarHBondContact OG1-CA 3.27Å; T219-F365 WeakPolarHBondContact OG1-CD2 3.39Å; Y220-F365 HydrophobicContact CD2-CE2 4.18Å; L223-F365 HydrophobicContact CD1-CB 4.07Å; L355-F365 HydrophobicContact CD2-CE1 3.97Å; L355-F365 HydrophobicContact CD2-CZ 3.61Å; I357-F365 HydrophobicContact CD1-CD1 4.01Å; I357-F365 HydrophobicContact CD1-CE1 4.45Å; I357-F365 HydrophobicContact CD1-CG 4.41Å; S362-F365 WeakPolarHBondContact O-CB 3.22Å; S362-F365 PolarHBondContact O-N 3.31Å; F365-N367 PolarHBondContact O-N 2.84Å; F365-E368 PolarHBondContact O-N 3.42Å; F365-I369 HydrophobicContact CE1-CD1 4.21Å; F365-I369 HydrophobicContact CZ-CD1 3.89Å; F365-I369 WeakPolarHBondContact O-CB 3.34Å; F365-I369 WeakPolarHBondContact O-CG2 3.39Å; F365-I369 PolarHBondContact O-N 3.17Å; F365-I391 HydrophobicContact CE1-CD1 4.41Å
366	F	88.8	Confident	86	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.013	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-47.3	174.2	179.3	-106.9	0	0	0	112.2	S362 H363 L364 E368 I369 E370 I391 I393 I399 H718 P719 L720	S362-F366 PolarHBondContact O-N 3.1Å; S362-F366 VanDerWaalsContact O-N 3.13Å; H363-F366 WeakPolarHBondContact O-CB 3.39Å; H363-F366 PolarHBondContact O-N 3.08Å; L364-F366 VanDerWaalsContact C-N 3.33Å; L364-F366 PolarHBondContact O-N 3.14Å; F366-E368 PolarHBondContact O-N 3.09Å; F366-I369 VanDerWaalsContact O-CG2 3.29Å; F366-I369 WeakPolarHBondContact O-CG2 3.19Å; F366-I369 PolarHBondContact O-N 3.39Å; F366-E370 VanDerWaalsContact O-CB 3.31Å; F366-E370 WeakPolarHBondContact O-CB 3.41Å; F366-E370 PolarHBondContact O-N 3.04Å; F366-I391 HydrophobicContact CD2-CD1 4.25Å; F366-I391 HydrophobicContact CD2-CG2 3.83Å; F366-I391 HydrophobicContact CE2-CG2 3.66Å; F366-I393 HydrophobicContact CB-CD1 3.63Å; F366-I393 HydrophobicContact CD2-CD1 4.05Å; F366-I393 HydrophobicContact CG-CD1 4.21Å; F366-I399 HydrophobicContact CB-CD1 4.31Å; F366-I399 HydrophobicContact CD1-CD1 3.98Å; F366-I399 HydrophobicContact CD1-CG1 4.42Å; F366-I399 HydrophobicContact CD1-CG2 4.48Å; F366-I399 HydrophobicContact CE1-CG2 4.37Å; F366-I399 HydrophobicContact CG-CD1 4.11Å; F366-H718 AromaticContact CZ-CE1 3.67Å; F366-P719 HydrophobicContact CE2-CG 4.1Å; F366-P719 HydrophobicContact CZ-CG 4.15Å; F366-L720 HydrophobicContact CD2-CD1 3.95Å; F366-L720 HydrophobicContact CE1-CD1 4.26Å; F366-L720 HydrophobicContact CE2-CD1 3.4Å; F366-L720 VanDerWaalsContact CE2-CD1 3.4Å; F366-L720 HydrophobicContact CZ-CD1 3.58Å
367	N	87.2	Confident	86	Confident	46 Å²	46	49.6 Å²	49.6	25%	0.246	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-40.2	179.8	-70.7	-22.6	0	0	0	111.8	H363 L364 F365 N371 Q402	H363-N367 PolarHBondContact O-N 3.41Å; H363-N367 VanDerWaalsContact O-N 3.08Å; L364-N367 PolarHBondContact O-N 3.18Å; F365-N367 PolarHBondContact O-N 2.84Å; N367-N371 WeakPolarHBondContact O-CB 3.09Å; N367-N371 PolarHBondContact O-N 3.34Å; N367-N371 VanDerWaalsContact O-N 3.12Å; N367-N371 PolarHBondContact O-ND2 3.37Å; N367-N371 VanDerWaalsContact O-ND2 3.08Å; N367-Q402 PolarHBondContact ND2-OE1 3.27Å
368	E	90.3	Very high	85.9	Confident	47 Å²	47	49.7 Å²	49.7	22%	0.22	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-46.4	177.5	-164.4	179.4	-172.1	0	0	111.4	L217 S218 T219 L364 F365 F366 E370 N371 E372	L217-E368 HydrophobicContact CD2-CG 4.16Å; S218-E368 PolarHBondContact N-OE1 3.01Å; S218-E368 PolarHBondContact OG-OE1 2.91Å; S218-E368 PolarHBondContact OG-OE2 3.17Å; T219-E368 WeakPolarHBondContact CB-OE2 3.12Å; T219-E368 HydrophobicContact CG2-CB 4.45Å; T219-E368 WeakPolarHBondContact CG2-OE2 3.48Å; T219-E368 PolarHBondContact N-OE2 3.38Å; T219-E368 VanDerWaalsContact N-OE2 3.14Å; T219-E368 PolarHBondContact OG1-OE2 3.13Å; L364-E368 PolarHBondContact O-N 3.2Å; F365-E368 PolarHBondContact O-N 3.42Å; F366-E368 PolarHBondContact O-N 3.09Å; E368-E370 PolarHBondContact O-N 3.34Å; E368-N371 PolarHBondContact O-N 3.16Å; E368-E372 WeakPolarHBondContact O-CB 3.19Å; E368-E372 WeakPolarHBondContact O-CG 3.07Å; E368-E372 PolarHBondContact O-N 3.46Å
369	I	90.2	Very high	86	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-37.2	-179.6	-159.7	170.6	0	0	0	112.1	I214 F365 F366 E372 Y373 L378 I391	I214-I369 HydrophobicContact CD1-CD1 4.45Å; I214-I369 HydrophobicContact CG1-CD1 4.45Å; F365-I369 HydrophobicContact CE1-CD1 4.21Å; F365-I369 HydrophobicContact CZ-CD1 3.89Å; F365-I369 WeakPolarHBondContact O-CB 3.34Å; F365-I369 WeakPolarHBondContact O-CG2 3.39Å; F365-I369 PolarHBondContact O-N 3.17Å; F366-I369 VanDerWaalsContact O-CG2 3.29Å; F366-I369 WeakPolarHBondContact O-CG2 3.19Å; F366-I369 PolarHBondContact O-N 3.39Å; I369-E372 PolarHBondContact O-N 3.43Å; I369-Y373 WeakPolarHBondContact O-CB 3.33Å; I369-Y373 PolarHBondContact O-N 2.95Å; I369-L378 HydrophobicContact CG1-CD2 4.22Å; I369-I391 HydrophobicContact CG2-CD1 4.29Å
370	E	88	Confident	86.2	Confident	31 Å²	31	53 Å²	53	15%	0.145	27%	0.272	C	S	.	.	H	α-helix	trans	-66.2	-41.8	177.1	-167.5	-173.2	178.2	0	0	111.2	F366 E368 Y373 K374	F366-E370 VanDerWaalsContact O-CB 3.31Å; F366-E370 WeakPolarHBondContact O-CB 3.41Å; F366-E370 PolarHBondContact O-N 3.04Å; E368-E370 PolarHBondContact O-N 3.34Å; E370-Y373 PolarHBondContact O-N 3.1Å; E370-K374 HydrophobicContact CG-CD 4.13Å; E370-K374 WeakPolarHBondContact O-CB 3.25Å; E370-K374 WeakPolarHBondContact O-CG 3.44Å; E370-K374 PolarHBondContact O-N 3.03Å; E370-K374 WeakPolarHBondContact OE1-CE 3.12Å; E370-K374 IonicContact OE1-NZ 2.92Å; E370-K374 PolarHBondContact OE1-NZ 2.99Å
371	N	89.6	Confident	86.1	Confident	102 Å²	102	51.5 Å²	51.5	55%	0.545	28%	0.275	S	S	.	.	H	α-helix	trans	-65.8	-42.4	176.9	-73.3	-24.9	0	0	0	112.2	N367 E368 Y373 K374 S375	N367-N371 WeakPolarHBondContact O-CB 3.09Å; N367-N371 PolarHBondContact O-N 3.34Å; N367-N371 VanDerWaalsContact O-N 3.12Å; N367-N371 PolarHBondContact O-ND2 3.37Å; N367-N371 VanDerWaalsContact O-ND2 3.08Å; E368-N371 PolarHBondContact O-N 3.16Å; N371-Y373 VanDerWaalsContact C-N 3.34Å; N371-K374 PolarHBondContact O-N 3.21Å; N371-S375 VanDerWaalsContact O-CB 3.3Å; N371-S375 WeakPolarHBondContact O-CB 3.09Å; N371-S375 PolarHBondContact O-N 3.4Å; N371-S375 PolarHBondContact O-OG 2.85Å
372	E	89.4	Confident	86.3	Confident	45 Å²	45	51.9 Å²	51.9	21%	0.21	27%	0.272	C	S	.	.	H	α-helix	trans	-68.9	-31.4	177	-76.2	-68.1	139.2	0	0	112.5	L217 E368 I369 S375 R377 L378	L217-E372 HydrophobicContact CD2-CG 4.06Å; E368-E372 WeakPolarHBondContact O-CB 3.19Å; E368-E372 WeakPolarHBondContact O-CG 3.07Å; E368-E372 PolarHBondContact O-N 3.46Å; I369-E372 PolarHBondContact O-N 3.43Å; E372-S375 WeakPolarHBondContact CA-OG 3.42Å; E372-S375 PolarHBondContact O-OG 3.04Å; E372-S375 VanDerWaalsContact O-OG 3.04Å; E372-R377 PolarHBondContact O-N 3.25Å; E372-R377 IonicContact OE1-NH1 2.98Å; E372-R377 PolarHBondContact OE1-NH1 2.9Å; E372-R377 WeakPolarHBondContact OE2-CB 3.44Å; E372-R377 WeakPolarHBondContact OE2-CD 3.48Å; E372-L378 PolarHBondContact O-N 3.17Å; E372-L378 VanDerWaalsContact O-N 3.12Å
373	Y	88.2	Confident	86	Confident	56 Å²	56	57.2 Å²	57.2	22%	0.22	30%	0.297	C	S	.	.	H	α-helix	trans	-70.5	-49.6	170.8	-179.9	-107.9	0	0	0	112	I369 E370 N371 S375 G376 L378 T379 H387 F388	I369-Y373 WeakPolarHBondContact O-CB 3.33Å; I369-Y373 PolarHBondContact O-N 2.95Å; E370-Y373 PolarHBondContact O-N 3.1Å; N371-Y373 VanDerWaalsContact C-N 3.34Å; Y373-S375 VanDerWaalsContact C-N 3.29Å; Y373-S375 PolarHBondContact O-N 3.2Å; Y373-G376 WeakPolarHBondContact O-CA 3.18Å; Y373-G376 PolarHBondContact O-N 3.29Å; Y373-L378 HydrophobicContact CD2-CD2 4.39Å; Y373-T379 HydrophobicContact CD2-CG2 4.12Å; Y373-T379 HydrophobicContact CE2-CG2 3.91Å; Y373-H387 PolarHBondContact OH-CD2 3.06Å; Y373-F388 HydrophobicContact CD1-CB 3.97Å; Y373-F388 HydrophobicContact CD2-CB 3.8Å; Y373-F388 HydrophobicContact CE1-CB 3.8Å; Y373-F388 HydrophobicContact CE2-CB 3.64Å; Y373-F388 HydrophobicContact CG-CB 3.97Å; Y373-F388 PolarHBondContact OH-N 3.17Å
374	K	87.4	Confident	85.6	Confident	139 Å²	139	56.7 Å²	56.7	60%	0.604	30%	0.295	S	S	*	.	H	α-helix	trans	-62.7	-33.5	179.2	-78.8	175.8	170.4	169.3	0	113.1	E370 N371 G376	E370-K374 HydrophobicContact CG-CD 4.13Å; E370-K374 WeakPolarHBondContact O-CB 3.25Å; E370-K374 WeakPolarHBondContact O-CG 3.44Å; E370-K374 PolarHBondContact O-N 3.03Å; E370-K374 WeakPolarHBondContact OE1-CE 3.12Å; E370-K374 IonicContact OE1-NZ 2.92Å; E370-K374 PolarHBondContact OE1-NZ 2.99Å; N371-K374 PolarHBondContact O-N 3.21Å; K374-G376 PolarHBondContact O-N 3.16Å
375	S	88.9	Confident	85.3	Confident	65 Å²	65	54.6 Å²	54.6	46%	0.455	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9.9	174	63.8	0	0	0	0	113.6	N371 E372 Y373 R377	N371-S375 VanDerWaalsContact O-CB 3.3Å; N371-S375 WeakPolarHBondContact O-CB 3.09Å; N371-S375 PolarHBondContact O-N 3.4Å; N371-S375 PolarHBondContact O-OG 2.85Å; E372-S375 WeakPolarHBondContact CA-OG 3.42Å; E372-S375 PolarHBondContact O-OG 3.04Å; E372-S375 VanDerWaalsContact O-OG 3.04Å; Y373-S375 VanDerWaalsContact C-N 3.29Å; Y373-S375 PolarHBondContact O-N 3.2Å; S375-R377 PolarHBondContact O-N 3.45Å
376	G	85.6	Confident	85	Confident	24 Å²	24	54.9 Å²	54.9	25%	0.247	29%	0.288	C	S	.	.	S	Bend	trans	80.2	-11.7	-178.3	0	0	0	0	0	114.6	Y373 K374 L378 T379 E380	Y373-G376 WeakPolarHBondContact O-CA 3.18Å; Y373-G376 PolarHBondContact O-N 3.29Å; K374-G376 PolarHBondContact O-N 3.16Å; G376-L378 PolarHBondContact O-N 3.1Å; G376-T379 CarbonylContact O-C 3.56Å; G376-T379 PolarHBondContact O-N 3.24Å; G376-T379 PolarHBondContact O-OG1 3.42Å; G376-E380 WeakPolarHBondContact O-CB 3.22Å; G376-E380 PolarHBondContact O-N 3.42Å
377	R	87.1	Confident	84.8	Confident	152 Å²	152	59 Å²	59	57%	0.574	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-35.6	-178.6	-72.2	177.6	175.9	175.3	-1	113	R213 E372 S375 T379	R213-R377 PolarHBondContact NH1-O 3.44Å; E372-R377 PolarHBondContact O-N 3.25Å; E372-R377 IonicContact OE1-NH1 2.98Å; E372-R377 PolarHBondContact OE1-NH1 2.9Å; E372-R377 WeakPolarHBondContact OE2-CB 3.44Å; E372-R377 WeakPolarHBondContact OE2-CD 3.48Å; S375-R377 PolarHBondContact O-N 3.45Å; R377-T379 VanDerWaalsContact C-N 3.31Å; R377-T379 PolarHBondContact O-N 3.2Å
378	L	84.3	Confident	84.8	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.021	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-35.1	178.2	-167.1	66.3	0	0	0	112.1	L210 R213 I214 I369 E372 Y373 G376	L210-L378 HydrophobicContact CD2-CD1 4.42Å; R213-L378 HydrophobicContact CB-CD1 4.04Å; R213-L378 PolarHBondContact NH1-O 3.39Å; I214-L378 HydrophobicContact CG1-CD1 4.29Å; I369-L378 HydrophobicContact CG1-CD2 4.22Å; E372-L378 PolarHBondContact O-N 3.17Å; E372-L378 VanDerWaalsContact O-N 3.12Å; Y373-L378 HydrophobicContact CD2-CD2 4.39Å; G376-L378 PolarHBondContact O-N 3.1Å
379	T	83.1	Confident	84.5	Confident	43 Å²	43	55.6 Å²	55.6	26%	0.264	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-7.5	-175.5	50.3	0	0	0	0	114.5	Y373 G376 R377 G381 L382	Y373-T379 HydrophobicContact CD2-CG2 4.12Å; Y373-T379 HydrophobicContact CE2-CG2 3.91Å; G376-T379 CarbonylContact O-C 3.56Å; G376-T379 PolarHBondContact O-N 3.24Å; G376-T379 PolarHBondContact O-OG1 3.42Å; R377-T379 VanDerWaalsContact C-N 3.31Å; R377-T379 PolarHBondContact O-N 3.2Å; T379-G381 PolarHBondContact O-N 3.22Å; T379-L382 PolarHBondContact O-N 3.04Å
380	E	82.4	Confident	84.4	Confident	133 Å²	133	55.5 Å²	55.5	62%	0.621	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	132.4	-175.3	-169.8	176.7	-179.7	0	0	111.7	R213 G376 L382	R213-E380 VanDerWaalsContact CZ-O 3.26Å; R213-E380 PolarHBondContact NH1-O 3.49Å; R213-E380 PolarHBondContact NH2-O 3.4Å; G376-E380 WeakPolarHBondContact O-CB 3.22Å; G376-E380 PolarHBondContact O-N 3.42Å; E380-L382 VanDerWaalsContact C-N 3.29Å; E380-L382 PolarHBondContact O-N 2.91Å
381	G	76.6	Confident	84.5	Confident	61 Å²	61	54 Å²	54	63%	0.629	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	15.8	175.8	0	0	0	0	0	116	T379	T379-G381 PolarHBondContact O-N 3.22Å
382	L	82.8	Confident	84.4	Confident	25 Å²	25	52.3 Å²	52.3	13%	0.131	27%	0.269	C	S	.	.			trans	-82.2	145.6	167.5	-60.2	177.1	0	0	0	110	D206 K209 L210 T379 E380 I384 F386	D206-L382 HydrophobicContact CB-CD2 3.99Å; K209-L382 HydrophobicContact CB-CD2 4.03Å; K209-L382 HydrophobicContact CD-CD2 4.13Å; L210-L382 HydrophobicContact CD1-CD1 4.47Å; T379-L382 PolarHBondContact O-N 3.04Å; E380-L382 VanDerWaalsContact C-N 3.29Å; E380-L382 PolarHBondContact O-N 2.91Å; L382-I384 VanDerWaalsContact C-N 3.33Å; L382-F386 HydrophobicContact CD1-CD2 4.01Å
383	H	77.1	Confident	84.2	Confident	114 Å²	114	50.5 Å²	50.5	53%	0.528	26%	0.26	S	S	.	.	S	Bend	trans	-74.8	-30	178	-56.6	88.9	0	0	0	111.5	I202 D206	I202-H383 HydrophobicContact CG2-CB 3.79Å; D206-H383 IonicContact OD1-CE1 2.93Å; D206-H383 IonicContact OD1-CG 3.77Å; D206-H383 IonicContact OD1-ND1 2.88Å; D206-H383 PolarHBondContact OD1-ND1 2.88Å; D206-H383 WeakPolarHBondContact OD2-CA 3.09Å; D206-H383 WeakPolarHBondContact OD2-CB 3.39Å; D206-H383 IonicContact OD2-CG 2.98Å; D206-H383 PolarHBondContact OD2-N 3.46Å; D206-H383 IonicContact OD2-ND1 3.95Å
384	I	76.5	Confident	83.6	Confident	14 Å²	14	51.7 Å²	51.7	7%	0.072	27%	0.268	C	S	.	.	S	Bend	trans	-109.2	130.7	-178.4	-60.2	174.7	0	0	0	109.5	I166 I171 I202 I203 D206 L382 F386	I166-I384 HydrophobicContact CB-CG2 4.5Å; I166-I384 HydrophobicContact CG1-CG2 4.33Å; I166-I384 HydrophobicContact CG2-CG2 3.52Å; I171-I384 HydrophobicContact CD1-CG2 4.25Å; I202-I384 HydrophobicContact CB-CD1 4.43Å; I202-I384 HydrophobicContact CG2-CD1 3.79Å; I202-I384 HydrophobicContact CG2-CG1 3.99Å; I203-I384 HydrophobicContact CB-CD1 4.19Å; I203-I384 HydrophobicContact CD1-CD1 4.42Å; I203-I384 HydrophobicContact CG1-CD1 3.28Å; D206-I384 PolarHBondContact OD2-N 2.96Å; L382-I384 VanDerWaalsContact C-N 3.33Å; I384-F386 HydrophobicContact CB-CD2 4.32Å; I384-F386 HydrophobicContact CB-CE2 3.83Å; I384-F386 HydrophobicContact CB-CZ 4.36Å; I384-F386 HydrophobicContact CG2-CD2 4.37Å; I384-F386 HydrophobicContact CG2-CE2 4.02Å; I384-F386 HydrophobicContact CG2-CZ 4.21Å; I384-F386 VanDerWaalsContact O-CD2 3.3Å; I384-F386 WeakPolarHBondContact O-CD2 3.11Å; I384-F386 PolarHBondContact O-N 2.96Å
385	P	79	Confident	83.3	Confident	41 Å²	41	46.3 Å²	46.3	27%	0.266	25%	0.245	S	C	.	.			trans	-73.4	97.7	175.2	29.5	-32.2	0	0	0	110	Q170 I171	Q170-P385 HydrophobicContact CB-CG 3.87Å; I171-P385 HydrophobicContact CG1-CG 4.17Å
386	F	83.3	Confident	82.9	Confident	7 Å²	7	45.3 Å²	45.3	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	129.5	170.5	-72.4	-81.9	0	0	0	110.4	F164 S165 I166 I203 D206 L207 L210 L382 I384	F164-F386 HydrophobicContact CB-CD1 4.04Å; S165-F386 WeakPolarHBondContact O-CA 3.09Å; I166-F386 HydrophobicContact CD1-CE1 3.87Å; I166-F386 HydrophobicContact CD1-CZ 4.41Å; I166-F386 HydrophobicContact CG1-CD1 3.86Å; I166-F386 HydrophobicContact CG1-CE1 3.55Å; I166-F386 HydrophobicContact CG1-CZ 4.35Å; I203-F386 HydrophobicContact CG2-CZ 4.46Å; D206-F386 HydrophobicContact CB-CE2 3.65Å; D206-F386 HydrophobicContact CB-CZ 4.4Å; L207-F386 HydrophobicContact CD2-CD1 4.34Å; L207-F386 HydrophobicContact CD2-CE1 3.67Å; L207-F386 HydrophobicContact CD2-CZ 3.89Å; L207-F386 HydrophobicContact CG-CE1 4.12Å; L207-F386 HydrophobicContact CG-CZ 3.89Å; L210-F386 HydrophobicContact CD1-CB 4.3Å; L210-F386 HydrophobicContact CD1-CG 4.31Å; L382-F386 HydrophobicContact CD1-CD2 4.01Å; I384-F386 HydrophobicContact CB-CD2 4.32Å; I384-F386 HydrophobicContact CB-CE2 3.83Å; I384-F386 HydrophobicContact CB-CZ 4.36Å; I384-F386 HydrophobicContact CG2-CD2 4.37Å; I384-F386 HydrophobicContact CG2-CE2 4.02Å; I384-F386 HydrophobicContact CG2-CZ 4.21Å; I384-F386 VanDerWaalsContact O-CD2 3.3Å; I384-F386 WeakPolarHBondContact O-CD2 3.11Å; I384-F386 PolarHBondContact O-N 2.96Å
387	H	84.9	Confident	82.8	Confident	88 Å²	88	46 Å²	46	41%	0.407	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.2	173.7	-174.5	-81	0	0	0	109.9	F164 S165 Y373 D389	F164-H387 WeakPolarHBondContact CA-O 3.28Å; S165-H387 PolarHBondContact N-O 3.43Å; S165-H387 PolarHBondContact O-N 3.28Å; Y373-H387 PolarHBondContact OH-CD2 3.06Å; H387-D389 IonicContact CE1-OD1 3.68Å; H387-D389 IonicContact CG-OD1 3.5Å; H387-D389 IonicContact ND1-OD1 3.58Å; H387-D389 PolarHBondContact ND1-OD1 3.35Å; H387-D389 PolarHBondContact O-N 2.87Å
388	F	86.9	Confident	82.6	Confident	14 Å²	14	42.5 Å²	42.5	6%	0.061	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	104.6	175.2	177.9	-107.4	0	0	0	108.8	V162 F164 Y373 I391 P719	V162-F388 HydrophobicContact CG1-CD2 4.04Å; V162-F388 HydrophobicContact CG1-CE2 3.73Å; F164-F388 HydrophobicContact CE1-CB 4.36Å; F164-F388 AromaticContact CE1-CD2 3.9Å; F164-F388 HydrophobicContact CE1-CD2 3.9Å; F164-F388 HydrophobicContact CZ-CD2 4.32Å; Y373-F388 HydrophobicContact CD1-CB 3.97Å; Y373-F388 HydrophobicContact CD2-CB 3.8Å; Y373-F388 HydrophobicContact CE1-CB 3.8Å; Y373-F388 HydrophobicContact CE2-CB 3.64Å; Y373-F388 HydrophobicContact CG-CB 3.97Å; Y373-F388 PolarHBondContact OH-N 3.17Å; F388-I391 HydrophobicContact CE1-CG2 4.47Å; F388-I391 HydrophobicContact CE2-CB 4.2Å; F388-I391 HydrophobicContact CE2-CD1 4.36Å; F388-I391 HydrophobicContact CZ-CB 3.71Å; F388-I391 HydrophobicContact CZ-CD1 4.08Å; F388-I391 HydrophobicContact CZ-CG1 4.46Å; F388-I391 HydrophobicContact CZ-CG2 3.85Å; F388-P719 HydrophobicContact CD1-CB 4.11Å; F388-P719 HydrophobicContact CE1-CB 3.51Å; F388-P719 HydrophobicContact CE1-CG 3.81Å; F388-P719 HydrophobicContact CZ-CB 4.28Å
389	D	83.4	Confident	82.6	Confident	8 Å²	8	42.5 Å²	42.5	4%	0.043	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-24	-164.8	-115.9	54.2	0	0	0	113.6	V163 S165 H387 Q722 K726 Y727	V163-D389 PolarHBondContact O-N 3.16Å; S165-D389 WeakPolarHBondContact CB-OD1 3.49Å; S165-D389 WeakPolarHBondContact CB-OD2 3.27Å; S165-D389 PolarHBondContact OG-OD1 3.32Å; S165-D389 PolarHBondContact OG-OD2 3.18Å; H387-D389 IonicContact CE1-OD1 3.68Å; H387-D389 IonicContact CG-OD1 3.5Å; H387-D389 IonicContact ND1-OD1 3.58Å; H387-D389 PolarHBondContact ND1-OD1 3.35Å; H387-D389 PolarHBondContact O-N 2.87Å; D389-Q722 WeakPolarHBondContact O-CG 3.26Å; D389-Q722 PolarHBondContact O-NE2 2.83Å; D389-Q722 VanDerWaalsContact O-NE2 3.11Å; D389-Q722 PolarHBondContact O-OE1 2.78Å; D389-Q722 PolarHBondContact OD2-NE2 2.91Å; D389-Q722 VanDerWaalsContact OD2-NE2 3.16Å; D389-K726 IonicContact OD2-NZ 3.89Å; D389-K726 PolarHBondContact OD2-NZ 3.3Å; D389-Y727 HydrophobicContact CB-CE2 4.11Å; D389-Y727 WeakPolarHBondContact CB-OH 3.48Å; D389-Y727 PolarHBondContact OD2-OH 2.78Å
390	G	87.3	Confident	82.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	180	155.8	176	0	0	0	0	0	113.4	V163 P719	V163-G390 PolarHBondContact N-O 2.83Å; V163-G390 PolarHBondContact O-N 3Å; G390-P719 WeakPolarHBondContact CA-O 3.37Å
391	I	89.9	Confident	82.9	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	141.7	-179.6	-168.4	166.2	0	0	0	110.1	R161 V162 F365 F366 I369 F388 I393 P719 L720	R161-I391 CarbonylContact O-C 3.58Å; R161-I391 VanDerWaalsContact O-CA 3.29Å; R161-I391 WeakPolarHBondContact O-CA 3.34Å; R161-I391 WeakPolarHBondContact O-CG1 3.3Å; V162-I391 HydrophobicContact CG2-CB 4.41Å; V162-I391 HydrophobicContact CG2-CD1 3.6Å; V162-I391 HydrophobicContact CG2-CG1 3.65Å; F365-I391 HydrophobicContact CE1-CD1 4.41Å; F366-I391 HydrophobicContact CD2-CD1 4.25Å; F366-I391 HydrophobicContact CD2-CG2 3.83Å; F366-I391 HydrophobicContact CE2-CG2 3.66Å; I369-I391 HydrophobicContact CG2-CD1 4.29Å; F388-I391 HydrophobicContact CE1-CG2 4.47Å; F388-I391 HydrophobicContact CE2-CB 4.2Å; F388-I391 HydrophobicContact CE2-CD1 4.36Å; F388-I391 HydrophobicContact CZ-CB 3.71Å; F388-I391 HydrophobicContact CZ-CD1 4.08Å; F388-I391 HydrophobicContact CZ-CG1 4.46Å; F388-I391 HydrophobicContact CZ-CG2 3.85Å; I391-I393 HydrophobicContact CD1-CD1 3.6Å; I391-I393 HydrophobicContact CD1-CG1 4.14Å; I391-I393 HydrophobicContact CG1-CD1 3.93Å; I391-I393 HydrophobicContact CG1-CG1 3.98Å; I391-P719 HydrophobicContact CG2-CB 4.25Å; I391-P719 PolarHBondContact N-O 3.08Å; I391-L720 HydrophobicContact CG2-CD1 3.75Å; I391-L720 HydrophobicContact CG2-CG 4.06Å; I391-L720 WeakPolarHBondContact O-CA 3.42Å
392	Y	87.6	Confident	83.3	Confident	65 Å²	65	36.9 Å²	36.9	26%	0.255	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	119.2	174.4	-179.4	-91.1	0	0	0	109.5	S160 R161 Q394 F723	S160-Y392 VanDerWaalsContact CA-O 3.3Å; S160-Y392 WeakPolarHBondContact CA-O 3.42Å; S160-Y392 WeakPolarHBondContact CB-O 3.49Å; R161-Y392 PolarHBondContact N-O 3.44Å; R161-Y392 PolarHBondContact O-N 2.99Å; Y392-Q394 HydrophobicContact CE1-CG 4.33Å; Y392-F723 AromaticContact CD2-CD1 3.96Å; Y392-F723 HydrophobicContact CD2-CD1 3.96Å; Y392-F723 AromaticContact CD2-CE1 3.87Å; Y392-F723 HydrophobicContact CD2-CE1 3.87Å; Y392-F723 HydrophobicContact CG-CD1 4.22Å; Y392-F723 AromaticContact CG-CE1 3.91Å; Y392-F723 HydrophobicContact CG-CE1 3.91Å; Y392-F723 HydrophobicContact CG-CZ 4.43Å
393	I	85.1	Confident	83.5	Confident	8 Å²	8	36.2 Å²	36.2	4%	0.041	17%	0.174	C	C	.	.			trans	-133.5	148.2	-179.9	-68.2	170.3	0	0	0	107.7	S362 F366 I391	S362-I393 VanDerWaalsContact CB-CG2 3.42Å; S362-I393 WeakPolarHBondContact OG-CG2 3.44Å; F366-I393 HydrophobicContact CB-CD1 3.63Å; F366-I393 HydrophobicContact CD2-CD1 4.05Å; F366-I393 HydrophobicContact CG-CD1 4.21Å; I391-I393 HydrophobicContact CD1-CD1 3.6Å; I391-I393 HydrophobicContact CD1-CG1 4.14Å; I391-I393 HydrophobicContact CG1-CD1 3.93Å; I391-I393 HydrophobicContact CG1-CG1 3.98Å
394	Q	77.6	Confident	84.1	Confident	80 Å²	80	31.4 Å²	31.4	37%	0.374	15%	0.152	S	C	.	.	S	Bend	trans	-81.1	-16.8	-174.1	-66.3	-175.9	-18.9	0	0	113.8	A157 K158 A359 Y392 Y396	A157-Q394 PolarHBondContact O-NE2 2.97Å; A157-Q394 VanDerWaalsContact O-NE2 3.14Å; K158-Q394 PolarHBondContact O-NE2 3.44Å; A359-Q394 HydrophobicContact CB-CB 4.16Å; Y392-Q394 HydrophobicContact CE1-CG 4.33Å; Q394-Y396 PolarHBondContact O-N 3.48Å
395	E	79.6	Confident	84.6	Confident	27 Å²	27	39.9 Å²	39.9	13%	0.126	18%	0.184	C	C	.	.			trans	-95.2	61.5	176.8	-69.6	178	165.6	0	0	113.2	A359 T360 G361 S362 H363 E398 I399	A359-E395 WeakPolarHBondContact O-CG 3.43Å; T360-E395 WeakPolarHBondContact CA-OE1 3.45Å; G361-E395 VanDerWaalsContact C-OE2 3.3Å; G361-E395 WeakPolarHBondContact CA-OE2 3.28Å; G361-E395 VanDerWaalsContact N-CD 3.31Å; G361-E395 PolarHBondContact N-OE1 3.18Å; G361-E395 PolarHBondContact N-OE2 3.2Å; S362-E395 PolarHBondContact N-OE2 2.77Å; S362-E395 PolarHBondContact OG-OE2 2.88Å; H363-E395 IonicContact CG-OE2 3.77Å; H363-E395 PolarHBondContact N-OE2 3.11Å; H363-E395 IonicContact ND1-OE2 3.59Å; H363-E395 PolarHBondContact ND1-OE2 2.91Å; E395-E398 HydrophobicContact CB-CB 4.42Å; E395-E398 HydrophobicContact CB-CG 4.46Å; E395-E398 VanDerWaalsContact OE2-OE2 3.13Å; E395-I399 WeakPolarHBondContact O-CG1 3.34Å
396	Y	81.9	Confident	85.1	Confident	43 Å²	43	43.6 Å²	43.6	17%	0.169	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-41.8	175.3	-178.5	-86.6	0	0	0	112	F59 Q394 E398 I399 V400 F713 L714 L720 E721	F59-Y396 AromaticContact CE2-CD1 3.88Å; F59-Y396 HydrophobicContact CE2-CD1 3.88Å; F59-Y396 AromaticContact CE2-CE1 3.85Å; F59-Y396 HydrophobicContact CE2-CE1 3.85Å; F59-Y396 HydrophobicContact CZ-CD1 4.21Å; F59-Y396 AromaticContact CZ-CE1 3.73Å; F59-Y396 HydrophobicContact CZ-CE1 3.73Å; Q394-Y396 PolarHBondContact O-N 3.48Å; Y396-E398 PolarHBondContact O-N 3.42Å; Y396-I399 PolarHBondContact O-N 3.5Å; Y396-V400 HydrophobicContact CD1-CG2 3.83Å; Y396-V400 HydrophobicContact CE1-CG2 3.43Å; Y396-V400 VanDerWaalsContact CE1-CG2 3.43Å; Y396-V400 WeakPolarHBondContact O-CG2 3.23Å; Y396-V400 PolarHBondContact O-N 2.9Å; Y396-V400 VanDerWaalsContact O-N 3.11Å; Y396-F713 PolarHBondContact OH-N 2.72Å; Y396-L714 HydrophobicContact CD2-CD1 4.36Å; Y396-L714 HydrophobicContact CE2-CD1 3.56Å; Y396-L714 HydrophobicContact CE2-CG 4.41Å; Y396-L720 HydrophobicContact CD2-CD2 3.88Å; Y396-E721 WeakPolarHBondContact CE2-OE1 3.47Å; Y396-E721 PolarHBondContact OH-OE1 3.05Å
397	D	81.6	Confident	85.4	Confident	40 Å²	40	43.3 Å²	43.3	21%	0.214	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-39	-172.2	-60.5	-22.7	0	0	0	112.5	F59 V400 T401	F59-D397 WeakPolarHBondContact CD2-OD1 3.34Å; F59-D397 VanDerWaalsContact CE2-OD1 3.24Å; F59-D397 WeakPolarHBondContact CE2-OD1 3.5Å; D397-V400 PolarHBondContact O-N 3.32Å; D397-T401 PolarHBondContact O-N 3.34Å; D397-T401 PolarHBondContact O-OG1 2.97Å
398	E	83.1	Confident	85.5	Confident	78 Å²	78	40.7 Å²	40.7	36%	0.364	18%	0.182	S	C	.	.	H	α-helix	trans	-66.3	-39.5	176.8	-63	-168.8	156	0	0	111.9	H363 E395 Y396 T401 Q402	H363-E398 IonicContact CE1-OE2 3.99Å; H363-E398 PolarHBondContact CE1-OE2 2.93Å; H363-E398 IonicContact CG-OE2 3.07Å; H363-E398 IonicContact ND1-OE2 3.38Å; H363-E398 PolarHBondContact ND1-OE2 3.14Å; E395-E398 HydrophobicContact CB-CB 4.42Å; E395-E398 HydrophobicContact CB-CG 4.46Å; E395-E398 VanDerWaalsContact OE2-OE2 3.13Å; Y396-E398 PolarHBondContact O-N 3.42Å; E398-T401 PolarHBondContact O-N 2.85Å; E398-Q402 WeakPolarHBondContact O-CG 3.02Å; E398-Q402 PolarHBondContact O-N 3.46Å
399	I	85.2	Confident	85.6	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.015	20%	0.198	C	C	.	.	H	α-helix	trans	-62.3	-45.2	175.8	-65	169.2	0	0	0	109.9	H363 F366 E395 Y396 T401 Q402 L403 L720	H363-I399 HydrophobicContact CB-CG1 3.9Å; F366-I399 HydrophobicContact CB-CD1 4.31Å; F366-I399 HydrophobicContact CD1-CD1 3.98Å; F366-I399 HydrophobicContact CD1-CG1 4.42Å; F366-I399 HydrophobicContact CD1-CG2 4.48Å; F366-I399 HydrophobicContact CE1-CG2 4.37Å; F366-I399 HydrophobicContact CG-CD1 4.11Å; E395-I399 WeakPolarHBondContact O-CG1 3.34Å; Y396-I399 PolarHBondContact O-N 3.5Å; I399-T401 VanDerWaalsContact C-N 3.32Å; I399-T401 PolarHBondContact O-N 3.27Å; I399-Q402 PolarHBondContact O-N 3.46Å; I399-L403 HydrophobicContact CG2-CD1 4Å; I399-L403 WeakPolarHBondContact O-CB 3.48Å; I399-L403 VanDerWaalsContact O-CG 3.26Å; I399-L403 WeakPolarHBondContact O-CG 3.47Å; I399-L403 PolarHBondContact O-N 3.35Å; I399-L720 HydrophobicContact CD1-CD1 4.41Å; I399-L720 HydrophobicContact CD1-CD2 3.91Å
400	V	86	Confident	86.1	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-41.5	176.8	174.4	0	0	0	0	111.2	P58 Y396 D397 L403 L404 F713 L714 L1103	P58-V400 HydrophobicContact CB-CG1 4.25Å; P58-V400 HydrophobicContact CG-CB 4.36Å; P58-V400 HydrophobicContact CG-CG1 4.03Å; Y396-V400 HydrophobicContact CD1-CG2 3.83Å; Y396-V400 HydrophobicContact CE1-CG2 3.43Å; Y396-V400 VanDerWaalsContact CE1-CG2 3.43Å; Y396-V400 WeakPolarHBondContact O-CG2 3.23Å; Y396-V400 PolarHBondContact O-N 2.9Å; Y396-V400 VanDerWaalsContact O-N 3.11Å; D397-V400 PolarHBondContact O-N 3.32Å; V400-L403 PolarHBondContact O-N 3.07Å; V400-L404 WeakPolarHBondContact O-CB 3.46Å; V400-L404 PolarHBondContact O-N 2.89Å; V400-F713 HydrophobicContact CG1-CB 3.92Å; V400-F713 HydrophobicContact CG1-CD2 4.36Å; V400-F713 HydrophobicContact CG1-CG 4.09Å; V400-F713 HydrophobicContact CG2-CB 4.15Å; V400-L714 HydrophobicContact CG2-CD1 4.5Å; V400-L714 HydrophobicContact CG2-CG 4.39Å; V400-L1103 HydrophobicContact CG1-CD2 4.23Å
401	T	85.2	Confident	86.2	Confident	40 Å²	40	46.5 Å²	46.5	25%	0.245	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-42.5	177.8	-58.5	0	0	0	0	112.2	L55 S56 D397 E398 I399 L403 L404 Y405	L55-T401 PolarHBondContact O-OG1 3.22Å; S56-T401 PolarHBondContact O-OG1 3.22Å; D397-T401 PolarHBondContact O-N 3.34Å; D397-T401 PolarHBondContact O-OG1 2.97Å; E398-T401 PolarHBondContact O-N 2.85Å; I399-T401 VanDerWaalsContact C-N 3.32Å; I399-T401 PolarHBondContact O-N 3.27Å; T401-L403 VanDerWaalsContact C-N 3.34Å; T401-L403 PolarHBondContact O-N 2.94Å; T401-L404 WeakPolarHBondContact O-CB 3.44Å; T401-L404 PolarHBondContact O-N 3.02Å; T401-Y405 PolarHBondContact O-N 3.12Å; T401-Y405 VanDerWaalsContact O-N 3.15Å
402	Q	86	Confident	86.2	Confident	76 Å²	76	53 Å²	53	36%	0.355	24%	0.241	S	C	.	.	H	α-helix	trans	-62.8	-41.3	174.5	-72.7	-176.6	2.1	0	0	111.9	H363 N367 E398 I399 L404 Y405 R406	H363-Q402 PolarHBondContact CD2-NE2 2.73Å; H363-Q402 PolarHBondContact NE2-NE2 3.34Å; N367-Q402 PolarHBondContact ND2-OE1 3.27Å; E398-Q402 WeakPolarHBondContact O-CG 3.02Å; E398-Q402 PolarHBondContact O-N 3.46Å; I399-Q402 PolarHBondContact O-N 3.46Å; Q402-L404 VanDerWaalsContact C-N 3.34Å; Q402-Y405 PolarHBondContact O-N 3.21Å; Q402-R406 PolarHBondContact O-N 2.89Å; Q402-R406 VanDerWaalsContact O-N 3.09Å
403	L	87.3	Confident	86.4	Confident	12 Å²	12	53.6 Å²	53.6	6%	0.063	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-36.6	175.8	-71	171.6	0	0	0	112.2	I399 V400 T401 R406 D407 L714 L1103	I399-L403 HydrophobicContact CG2-CD1 4Å; I399-L403 WeakPolarHBondContact O-CB 3.48Å; I399-L403 VanDerWaalsContact O-CG 3.26Å; I399-L403 WeakPolarHBondContact O-CG 3.47Å; I399-L403 PolarHBondContact O-N 3.35Å; V400-L403 PolarHBondContact O-N 3.07Å; T401-L403 VanDerWaalsContact C-N 3.34Å; T401-L403 PolarHBondContact O-N 2.94Å; L403-R406 PolarHBondContact O-N 2.71Å; L403-D407 VanDerWaalsContact O-CB 3.28Å; L403-D407 WeakPolarHBondContact O-CB 3.5Å; L403-D407 PolarHBondContact O-N 3.23Å; L403-L714 HydrophobicContact CD1-CD2 3.38Å; L403-L1103 HydrophobicContact CB-CD2 4.02Å; L403-L1103 HydrophobicContact CB-CG 4.19Å
404	L	88.3	Confident	86.7	Confident	13 Å²	13	53.2 Å²	53.2	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-51.1	174.9	-173.7	159	0	0	0	111.2	L55 V400 T401 Q402 R406 D407 T408 V461 L464 L1103	L55-L404 HydrophobicContact CD1-CD1 4.27Å; L55-L404 HydrophobicContact CD1-CD2 3.91Å; V400-L404 WeakPolarHBondContact O-CB 3.46Å; V400-L404 PolarHBondContact O-N 2.89Å; T401-L404 WeakPolarHBondContact O-CB 3.44Å; T401-L404 PolarHBondContact O-N 3.02Å; Q402-L404 VanDerWaalsContact C-N 3.34Å; L404-R406 VanDerWaalsContact C-N 3.32Å; L404-R406 PolarHBondContact O-N 3.27Å; L404-D407 PolarHBondContact O-N 3.34Å; L404-T408 HydrophobicContact CD2-CG2 4.1Å; L404-T408 WeakPolarHBondContact O-CG2 3.39Å; L404-T408 PolarHBondContact O-N 2.85Å; L404-V461 HydrophobicContact CD1-CB 4.39Å; L404-V461 HydrophobicContact CD1-CG1 3.62Å; L404-V461 HydrophobicContact CD1-CG2 3.97Å; L404-L464 HydrophobicContact CD1-CD1 3.72Å; L404-L464 HydrophobicContact CD2-CD1 3.75Å; L404-L464 HydrophobicContact CG-CD1 3.83Å; L404-L1103 VanDerWaalsContact CA-CD1 3.46Å; L404-L1103 HydrophobicContact CB-CD1 3.94Å; L404-L1103 HydrophobicContact CG-CD1 4.43Å
405	Y	86.9	Confident	87.4	Confident	191 Å²	191	51 Å²	51	75%	0.749	24%	0.236	S	C	*	.	H	α-helix	trans	-59.8	-44.3	177.3	-174.1	-100.5	0	0	0	111.6	T401 Q402 T408	T401-Y405 PolarHBondContact O-N 3.12Å; T401-Y405 VanDerWaalsContact O-N 3.15Å; Q402-Y405 PolarHBondContact O-N 3.21Å; Y405-T408 PolarHBondContact O-OG1 2.96Å
406	R	89.4	Confident	88	Confident	120 Å²	120	54.5 Å²	54.5	45%	0.453	26%	0.255	S	S	.	.	H	α-helix	trans	-62.7	-47.1	178.1	-173.5	174.8	75.8	-169.5	8.7	112.5	Q402 L403 L404 T408 S409 N1102	Q402-R406 PolarHBondContact O-N 2.89Å; Q402-R406 VanDerWaalsContact O-N 3.09Å; L403-R406 PolarHBondContact O-N 2.71Å; L404-R406 VanDerWaalsContact C-N 3.32Å; L404-R406 PolarHBondContact O-N 3.27Å; R406-T408 VanDerWaalsContact C-N 3.33Å; R406-T408 PolarHBondContact O-N 3.43Å; R406-S409 VanDerWaalsContact O-CB 3.29Å; R406-S409 WeakPolarHBondContact O-CB 3.29Å; R406-S409 PolarHBondContact O-N 3.45Å; R406-S409 PolarHBondContact O-OG 2.87Å; R406-N1102 PolarHBondContact NH2-ND2 3.01Å
407	D	89.7	Confident	88.4	Confident	1 Å²	1	54 Å²	54	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-78.9	-16.5	-173.6	-73.1	-1.3	0	0	0	112.7	L403 L404 S409 W410 N1102 L1103 F1106	L403-D407 VanDerWaalsContact O-CB 3.28Å; L403-D407 WeakPolarHBondContact O-CB 3.5Å; L403-D407 PolarHBondContact O-N 3.23Å; L404-D407 PolarHBondContact O-N 3.34Å; D407-S409 PolarHBondContact O-N 3.21Å; D407-S409 VanDerWaalsContact O-N 3.11Å; D407-W410 WeakPolarHBondContact O-CB 3.44Å; D407-W410 PolarHBondContact O-N 2.76Å; D407-N1102 WeakPolarHBondContact OD2-CA 3.45Å; D407-N1102 PolarHBondContact OD2-N 3.19Å; D407-L1103 HydrophobicContact CB-CD1 4.27Å; D407-L1103 PolarHBondContact OD2-N 3.37Å; D407-F1106 HydrophobicContact CB-CD2 3.94Å; D407-F1106 HydrophobicContact CB-CE2 4.15Å
408	T	87.3	Confident	88.9	Confident	33 Å²	33	52.1 Å²	52.1	20%	0.202	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.4	167.7	67.8	0	0	0	0	112.6	L404 Y405 R406 W410 L411	L404-T408 HydrophobicContact CD2-CG2 4.1Å; L404-T408 WeakPolarHBondContact O-CG2 3.39Å; L404-T408 PolarHBondContact O-N 2.85Å; Y405-T408 PolarHBondContact O-OG1 2.96Å; R406-T408 VanDerWaalsContact C-N 3.33Å; R406-T408 PolarHBondContact O-N 3.43Å; T408-W410 PolarHBondContact O-N 2.88Å; T408-L411 WeakPolarHBondContact O-CB 3.48Å; T408-L411 PolarHBondContact O-N 3.03Å
409	S	89.9	Confident	89.3	Confident	57 Å²	57	50.5 Å²	50.5	40%	0.399	24%	0.241	S	C	.	.	H	α-helix	trans	-57.9	-33	173.3	67	0	0	0	0	113.2	R406 D407 L411 F412 I413	R406-S409 VanDerWaalsContact O-CB 3.29Å; R406-S409 WeakPolarHBondContact O-CB 3.29Å; R406-S409 PolarHBondContact O-N 3.45Å; R406-S409 PolarHBondContact O-OG 2.87Å; D407-S409 PolarHBondContact O-N 3.21Å; D407-S409 VanDerWaalsContact O-N 3.11Å; S409-L411 PolarHBondContact O-N 3.05Å; S409-F412 WeakPolarHBondContact O-CB 3.49Å; S409-F412 PolarHBondContact O-N 3.18Å; S409-F412 VanDerWaalsContact O-N 3.14Å; S409-I413 PolarHBondContact O-N 3.48Å
410	W	93.1	Very high	89.5	Confident	72 Å²	72	54.8 Å²	54.8	27%	0.273	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-26.4	176.1	-65.9	110.1	0	0	0	112.6	D407 T408 I413 S414 P1097 F1100	D407-W410 WeakPolarHBondContact O-CB 3.44Å; D407-W410 PolarHBondContact O-N 2.76Å; T408-W410 PolarHBondContact O-N 2.88Å; W410-I413 HydrophobicContact CD2-CD1 4.33Å; W410-I413 HydrophobicContact CE3-CD1 3.58Å; W410-I413 HydrophobicContact CZ3-CD1 3.79Å; W410-I413 PolarHBondContact O-N 3.34Å; W410-S414 PolarHBondContact O-N 2.9Å; W410-P1097 HydrophobicContact CE3-CB 4.34Å; W410-F1100 HydrophobicContact CE3-CB 4.44Å; W410-F1100 HydrophobicContact CH2-CB 3.73Å; W410-F1100 HydrophobicContact CH2-CG 4.46Å; W410-F1100 HydrophobicContact CZ2-CB 3.83Å; W410-F1100 HydrophobicContact CZ3-CB 4.05Å; W410-F1100 HydrophobicContact CZ3-CD2 4.48Å
411	L	89.2	Confident	89.7	Confident	15 Å²	15	56.5 Å²	56.5	8%	0.079	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-41.1	172.9	-57.7	175.9	0	0	0	111.4	T408 S409 I413 S414 L415 I467 V468 M1098 F1106	T408-L411 WeakPolarHBondContact O-CB 3.48Å; T408-L411 PolarHBondContact O-N 3.03Å; S409-L411 PolarHBondContact O-N 3.05Å; L411-I413 VanDerWaalsContact C-N 3.32Å; L411-I413 PolarHBondContact O-N 3.08Å; L411-S414 WeakPolarHBondContact O-CB 3.21Å; L411-S414 PolarHBondContact O-N 2.93Å; L411-L415 PolarHBondContact O-N 3.01Å; L411-I467 HydrophobicContact CD1-CG2 4.24Å; L411-V468 HydrophobicContact CD2-CG2 3.63Å; L411-M1098 HydrophobicContact CD2-CE 3.26Å; L411-F1106 HydrophobicContact CD1-CZ 4.45Å
412	F	90.7	Very high	89.8	Confident	137 Å²	137	54.6 Å²	54.6	60%	0.601	26%	0.26	S	S	*	.	H	α-helix	trans	-64.2	-39.8	175.5	-69.8	-77.9	0	0	0	111.4	S409 S414 L415 I416	S409-F412 WeakPolarHBondContact O-CB 3.49Å; S409-F412 PolarHBondContact O-N 3.18Å; S409-F412 VanDerWaalsContact O-N 3.14Å; F412-S414 VanDerWaalsContact C-N 3.32Å; F412-S414 PolarHBondContact O-N 3.2Å; F412-L415 PolarHBondContact O-N 3.03Å; F412-I416 VanDerWaalsContact O-CG1 3.3Å; F412-I416 WeakPolarHBondContact O-CG1 3.36Å; F412-I416 PolarHBondContact O-N 3.42Å
413	I	92.5	Very high	89.9	Confident	77 Å²	77	52.8 Å²	52.8	40%	0.395	26%	0.255	S	S	.	.	H	α-helix	trans	-62.4	-41.3	174.4	-63.1	170.5	0	0	0	110.7	S409 W410 L411 I416 C417 P1097	S409-I413 PolarHBondContact O-N 3.48Å; W410-I413 HydrophobicContact CD2-CD1 4.33Å; W410-I413 HydrophobicContact CE3-CD1 3.58Å; W410-I413 HydrophobicContact CZ3-CD1 3.79Å; W410-I413 PolarHBondContact O-N 3.34Å; L411-I413 VanDerWaalsContact C-N 3.32Å; L411-I413 PolarHBondContact O-N 3.08Å; I413-I416 PolarHBondContact O-N 2.85Å; I413-C417 WeakPolarHBondContact O-CB 3.44Å; I413-C417 PolarHBondContact O-N 3.25Å; I413-P1097 HydrophobicContact CB-CB 4.44Å; I413-P1097 HydrophobicContact CG2-CB 3.99Å; I413-P1097 HydrophobicContact CG2-CG 4.14Å
414	S	91.2	Very high	89.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-44.9	174.7	179.7	0	0	0	0	112.5	W410 L411 F412 I416 C417 L418 T1094	W410-S414 PolarHBondContact O-N 2.9Å; L411-S414 WeakPolarHBondContact O-CB 3.21Å; L411-S414 PolarHBondContact O-N 2.93Å; F412-S414 VanDerWaalsContact C-N 3.32Å; F412-S414 PolarHBondContact O-N 3.2Å; S414-I416 PolarHBondContact O-N 2.89Å; S414-C417 WeakPolarHBondContact O-CB 3.47Å; S414-C417 PolarHBondContact O-N 3.35Å; S414-L418 PolarHBondContact O-N 2.84Å; S414-T1094 WeakPolarHBondContact CB-O 3.46Å; S414-T1094 PolarHBondContact OG-O 3.31Å
415	L	91.1	Very high	89.4	Confident	32 Å²	32	59.3 Å²	59.3	17%	0.168	29%	0.285	C	S	.	.	H	α-helix	trans	-62.1	-41.5	175.6	-78.9	169.3	0	0	0	112.8	L411 F412 C417 L418 L419 V436 T471	L411-L415 PolarHBondContact O-N 3.01Å; F412-L415 PolarHBondContact O-N 3.03Å; L415-C417 VanDerWaalsContact C-N 3.33Å; L415-L418 PolarHBondContact O-N 2.93Å; L415-L419 PolarHBondContact O-N 3.21Å; L415-V436 HydrophobicContact CD2-CG1 4.27Å; L415-T471 HydrophobicContact CD2-CG2 3.55Å; L415-T471 HydrophobicContact CG-CG2 3.99Å
416	I	91.7	Very high	89	Confident	101 Å²	101	50.2 Å²	50.2	52%	0.518	25%	0.249	S	C	.	.	H	α-helix	trans	-63.8	-42.2	175.5	-67.1	164.6	0	0	0	110.2	F412 I413 S414 L418 L419 I420	F412-I416 VanDerWaalsContact O-CG1 3.3Å; F412-I416 WeakPolarHBondContact O-CG1 3.36Å; F412-I416 PolarHBondContact O-N 3.42Å; I413-I416 PolarHBondContact O-N 2.85Å; S414-I416 PolarHBondContact O-N 2.89Å; I416-L418 PolarHBondContact O-N 3.45Å; I416-L419 WeakPolarHBondContact O-CB 3.02Å; I416-L419 PolarHBondContact O-N 2.68Å; I416-I420 HydrophobicContact CG2-CD1 3.97Å; I416-I420 WeakPolarHBondContact O-CG1 3.1Å; I416-I420 PolarHBondContact O-N 3.35Å
417	C	91.6	Very high	88.5	Confident	33 Å²	33	49.4 Å²	49.4	22%	0.223	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-45.4	176	-169.1	0	0	0	0	111.6	I413 S414 L415 L419 I420 L421	I413-C417 WeakPolarHBondContact O-CB 3.44Å; I413-C417 PolarHBondContact O-N 3.25Å; S414-C417 WeakPolarHBondContact O-CB 3.47Å; S414-C417 PolarHBondContact O-N 3.35Å; L415-C417 VanDerWaalsContact C-N 3.33Å; C417-L419 PolarHBondContact O-N 3.04Å; C417-I420 PolarHBondContact O-N 3.31Å; C417-L421 WeakPolarHBondContact O-CG 3.14Å; C417-L421 PolarHBondContact O-N 2.97Å
418	L	91.8	Very high	88	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.7	-47.7	175.2	-176.9	68.8	0	0	0	111.8	S414 L415 I416 I420 L421 L422 I439 T471 A475 T1094	S414-L418 PolarHBondContact O-N 2.84Å; L415-L418 PolarHBondContact O-N 2.93Å; I416-L418 PolarHBondContact O-N 3.45Å; L418-I420 VanDerWaalsContact C-N 3.3Å; L418-I420 PolarHBondContact O-N 3.28Å; L418-L421 PolarHBondContact O-N 3.2Å; L418-L422 HydrophobicContact CD1-CD1 4.19Å; L418-L422 HydrophobicContact CD1-CG 4.26Å; L418-L422 HydrophobicContact CD2-CD1 4.47Å; L418-L422 HydrophobicContact CG-CD1 3.99Å; L418-L422 HydrophobicContact CG-CG 4.39Å; L418-L422 WeakPolarHBondContact O-CB 3.47Å; L418-L422 WeakPolarHBondContact O-CG 3.11Å; L418-L422 PolarHBondContact O-N 3.27Å; L418-I439 HydrophobicContact CD2-CD1 4.02Å; L418-T471 WeakPolarHBondContact CD2-O 3.37Å; L418-A475 HydrophobicContact CD1-CB 3.75Å; L418-T1094 HydrophobicContact CB-CG2 3.67Å; L418-T1094 HydrophobicContact CD1-CG2 3.63Å; L418-T1094 HydrophobicContact CG-CG2 4.19Å
419	L	91.4	Very high	87.8	Confident	45 Å²	45	52 Å²	52	24%	0.236	26%	0.259	C	S	.	.	H	α-helix	trans	-56.6	-44.9	178.6	-171.7	90.5	0	0	0	111.3	L415 I416 C417 T423 P432 I433 V436	L415-L419 PolarHBondContact O-N 3.21Å; I416-L419 WeakPolarHBondContact O-CB 3.02Å; I416-L419 PolarHBondContact O-N 2.68Å; C417-L419 PolarHBondContact O-N 3.04Å; L419-T423 WeakPolarHBondContact O-CB 3.41Å; L419-T423 PolarHBondContact O-N 3.22Å; L419-T423 PolarHBondContact O-OG1 3.41Å; L419-P432 HydrophobicContact CD1-CB 3.88Å; L419-P432 HydrophobicContact CG-CB 4.36Å; L419-I433 HydrophobicContact CD1-CG1 3.95Å; L419-V436 HydrophobicContact CD1-CG2 3.95Å
420	I	90	Very high	87.5	Confident	92 Å²	92	54.3 Å²	54.3	47%	0.472	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-48.9	178.8	-67.7	165.7	0	0	0	110.5	I416 C417 L418 L422 T423 I424	I416-I420 HydrophobicContact CG2-CD1 3.97Å; I416-I420 WeakPolarHBondContact O-CG1 3.1Å; I416-I420 PolarHBondContact O-N 3.35Å; C417-I420 PolarHBondContact O-N 3.31Å; L418-I420 VanDerWaalsContact C-N 3.3Å; L418-I420 PolarHBondContact O-N 3.28Å; I420-L422 PolarHBondContact O-N 3.05Å; I420-T423 PolarHBondContact O-N 3.35Å; I420-I424 HydrophobicContact CG2-CD1 3.92Å; I420-I424 WeakPolarHBondContact O-CG1 2.97Å; I420-I424 PolarHBondContact O-N 3.06Å
421	L	89.5	Confident	87	Confident	40 Å²	40	51.4 Å²	51.4	21%	0.209	25%	0.251	C	S	.	.	H	α-helix	trans	-60.7	-46	-179.9	-69.5	170.3	0	0	0	112.1	C417 L418 T423 I424 W425 T1090 I1093	C417-L421 WeakPolarHBondContact O-CG 3.14Å; C417-L421 PolarHBondContact O-N 2.97Å; L418-L421 PolarHBondContact O-N 3.2Å; L421-T423 VanDerWaalsContact C-N 3.32Å; L421-T423 PolarHBondContact O-N 3.25Å; L421-I424 PolarHBondContact O-N 3.39Å; L421-W425 PolarHBondContact O-N 2.57Å; L421-T1090 HydrophobicContact CB-CG2 4.16Å; L421-T1090 HydrophobicContact CD1-CG2 4.32Å; L421-I1093 HydrophobicContact CD1-CB 3.84Å; L421-I1093 HydrophobicContact CD1-CD1 4.26Å; L421-I1093 HydrophobicContact CD1-CG2 3.69Å; L421-I1093 HydrophobicContact CD2-CD1 4.17Å
422	L	87.7	Confident	86.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.6	-34.6	177.4	-72.7	-179.5	0	0	0	112.3	L418 I420 W425 T426 P432 T435 A475 L478 L479	L418-L422 HydrophobicContact CD1-CD1 4.19Å; L418-L422 HydrophobicContact CD1-CG 4.26Å; L418-L422 HydrophobicContact CD2-CD1 4.47Å; L418-L422 HydrophobicContact CG-CD1 3.99Å; L418-L422 HydrophobicContact CG-CG 4.39Å; L418-L422 WeakPolarHBondContact O-CB 3.47Å; L418-L422 WeakPolarHBondContact O-CG 3.11Å; L418-L422 PolarHBondContact O-N 3.27Å; I420-L422 PolarHBondContact O-N 3.05Å; L422-W425 PolarHBondContact O-N 3.3Å; L422-T426 WeakPolarHBondContact O-CB 3.45Å; L422-T426 WeakPolarHBondContact O-CG2 3.43Å; L422-T426 PolarHBondContact O-N 2.7Å; L422-T426 PolarHBondContact O-OG1 3.17Å; L422-P432 HydrophobicContact CB-CB 3.79Å; L422-P432 HydrophobicContact CB-CG 3.75Å; L422-T435 WeakPolarHBondContact CD1-OG1 3.35Å; L422-A475 HydrophobicContact CD1-CB 4.13Å; L422-A475 HydrophobicContact CD2-CB 4.04Å; L422-A475 HydrophobicContact CG-CB 4.44Å; L422-L478 HydrophobicContact CD1-CD2 4.21Å; L422-L478 HydrophobicContact CD2-CD2 4.02Å; L422-L479 HydrophobicContact CD2-CD1 4.32Å; L422-L479 HydrophobicContact CD2-CD2 3.83Å; L422-L479 HydrophobicContact CD2-CG 4.09Å
423	T	86.8	Confident	86.8	Confident	38 Å²	38	47.5 Å²	47.5	23%	0.233	24%	0.236	C	C	.	.	H	α-helix	trans	-66	-43.4	176.1	-59	0	0	0	0	111.3	L419 I420 L421 W425 R427 I429	L419-T423 WeakPolarHBondContact O-CB 3.41Å; L419-T423 PolarHBondContact O-N 3.22Å; L419-T423 PolarHBondContact O-OG1 3.41Å; I420-T423 PolarHBondContact O-N 3.35Å; L421-T423 VanDerWaalsContact C-N 3.32Å; L421-T423 PolarHBondContact O-N 3.25Å; T423-W425 PolarHBondContact O-N 3.41Å; T423-R427 WeakPolarHBondContact O-CA 3.26Å; T423-R427 PolarHBondContact O-N 2.98Å; T423-I429 HydrophobicContact CG2-CB 4.41Å; T423-I429 HydrophobicContact CG2-CG1 4.48Å
424	I	83.4	Confident	86.5	Confident	112 Å²	112	45.9 Å²	45.9	57%	0.574	23%	0.228	S	C	*	.	H	α-helix	trans	-58.9	-39	176.6	-69.1	166.7	0	0	0	110.5	I420 L421	I420-I424 HydrophobicContact CG2-CD1 3.92Å; I420-I424 WeakPolarHBondContact O-CG1 2.97Å; I420-I424 PolarHBondContact O-N 3.06Å; L421-I424 PolarHBondContact O-N 3.39Å
425	W	81.5	Confident	86.3	Confident	50 Å²	50	46.1 Å²	46.1	19%	0.189	23%	0.229	C	C	.	.	H	α-helix	trans	-79.9	-53.6	-177.2	-159.1	-32.1	0	0	0	113.7	L421 L422 T423 R427 L479 P1082 G1086 T1090	L421-W425 PolarHBondContact O-N 2.57Å; L422-W425 PolarHBondContact O-N 3.3Å; T423-W425 PolarHBondContact O-N 3.41Å; W425-R427 PolarHBondContact O-N 3.25Å; W425-L479 HydrophobicContact CB-CD2 4.43Å; W425-L479 HydrophobicContact CD2-CD2 3.45Å; W425-L479 VanDerWaalsContact CD2-CD2 3.45Å; W425-L479 HydrophobicContact CE3-CD1 3.9Å; W425-L479 HydrophobicContact CE3-CD2 3.31Å; W425-L479 HydrophobicContact CE3-CG 4.19Å; W425-L479 HydrophobicContact CG-CD2 3.95Å; W425-L479 HydrophobicContact CH2-CB 4.17Å; W425-L479 HydrophobicContact CH2-CD1 3.72Å; W425-L479 HydrophobicContact CH2-CD2 3.84Å; W425-L479 HydrophobicContact CH2-CG 4.11Å; W425-L479 HydrophobicContact CZ2-CD2 4.05Å; W425-L479 HydrophobicContact CZ3-CB 4.43Å; W425-L479 HydrophobicContact CZ3-CD1 3.25Å; W425-L479 HydrophobicContact CZ3-CD2 3.47Å; W425-L479 VanDerWaalsContact CZ3-CD2 3.47Å; W425-L479 HydrophobicContact CZ3-CG 3.86Å; W425-P1082 WeakPolarHBondContact CH2-O 2.64Å; W425-P1082 VanDerWaalsContact CZ2-C 3.49Å; W425-P1082 WeakPolarHBondContact CZ2-O 3.35Å; W425-G1086 VanDerWaalsContact CH2-C 3.48Å; W425-T1090 HydrophobicContact CZ3-CG2 4.44Å
426	T	79.4	Confident	86.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-72.8	-12.5	-176.2	60.8	0	0	0	0	112.9	L422 T428 I431 Y482	L422-T426 WeakPolarHBondContact O-CB 3.45Å; L422-T426 WeakPolarHBondContact O-CG2 3.43Å; L422-T426 PolarHBondContact O-N 2.7Å; L422-T426 PolarHBondContact O-OG1 3.17Å; T426-T428 PolarHBondContact O-N 2.74Å; T426-T428 VanDerWaalsContact O-N 3.16Å; T426-T428 PolarHBondContact OG1-O 2.82Å; T426-I431 HydrophobicContact CG2-CG2 4.24Å; T426-Y482 HydrophobicContact CG2-CD1 4.46Å; T426-Y482 HydrophobicContact CG2-CD2 4.47Å; T426-Y482 HydrophobicContact CG2-CG 4.44Å; T426-Y482 PolarHBondContact O-OH 2.84Å
427	R	78.1	Confident	86.1	Confident	103 Å²	103	43.8 Å²	43.8	39%	0.389	22%	0.218	S	C	.	.	S	Bend	trans	62	14.4	-177	-42.3	-167.7	168.5	156.4	1.6	114.2	T423 W425 Y655	T423-R427 WeakPolarHBondContact O-CA 3.26Å; T423-R427 PolarHBondContact O-N 2.98Å; W425-R427 PolarHBondContact O-N 3.25Å; R427-Y655 WeakPolarHBondContact CD-OH 3.46Å; R427-Y655 VanDerWaalsContact CG-OH 3.25Å; R427-Y655 WeakPolarHBondContact CG-OH 3.07Å; R427-Y655 PolarHBondContact NE-OH 2.9Å
428	T	79.3	Confident	85.9	Confident	17 Å²	17	42.3 Å²	42.3	10%	0.104	21%	0.208	C	C	.	.			trans	-141.4	146.7	-179.5	67.4	0	0	0	0	108.7	T426 P432 F635	T426-T428 PolarHBondContact O-N 2.74Å; T426-T428 VanDerWaalsContact O-N 3.16Å; T426-T428 PolarHBondContact OG1-O 2.82Å; T428-P432 WeakPolarHBondContact O-CD 3.46Å; T428-P432 WeakPolarHBondContact O-CG 3.21Å; T428-F635 HydrophobicContact CG2-CE1 3.95Å; T428-F635 HydrophobicContact CG2-CZ 4.39Å
429	I	83	Confident	85.9	Confident	72 Å²	72	42.4 Å²	42.4	37%	0.369	21%	0.209	S	C	.	.	S	Bend	trans	-86.9	-23	176.1	-157.5	168.4	0	0	0	112.3	T423 P432 I433	T423-I429 HydrophobicContact CG2-CB 4.41Å; T423-I429 HydrophobicContact CG2-CG1 4.48Å; I429-P432 WeakPolarHBondContact O-CD 3.34Å; I429-I433 HydrophobicContact CG1-CD1 3.97Å; I429-I433 HydrophobicContact CG1-CG1 4.39Å; I429-I433 HydrophobicContact CG2-CD1 4.41Å; I429-I433 WeakPolarHBondContact O-CD1 3.41Å; I429-I433 VanDerWaalsContact O-CG1 3.26Å; I429-I433 WeakPolarHBondContact O-CG1 3.38Å; I429-I433 PolarHBondContact O-N 3.4Å
430	F	83.6	Confident	85.8	Confident	105 Å²	105	44.3 Å²	44.3	46%	0.461	22%	0.218	S	C	.	.	H	α-helix	trans	-67.1	-44.5	-175.1	-68.5	-77.6	0	0	0	113.2	I433 L434 F635	F430-I433 PolarHBondContact O-N 3.46Å; F430-L434 WeakPolarHBondContact O-CG 3.06Å; F430-L434 PolarHBondContact O-N 3.33Å; F430-L434 VanDerWaalsContact O-N 3.12Å; F430-F635 HydrophobicContact CB-CD2 4.48Å; F430-F635 HydrophobicContact CB-CE2 4.25Å; F430-F635 HydrophobicContact CD2-CD2 4.28Å; F430-F635 AromaticContact CD2-CE2 3.34Å; F430-F635 HydrophobicContact CD2-CE2 3.34Å; F430-F635 AromaticContact CD2-CZ 3.73Å; F430-F635 HydrophobicContact CD2-CZ 3.73Å; F430-F635 AromaticContact CE2-CE2 3.82Å; F430-F635 HydrophobicContact CE2-CE2 3.82Å; F430-F635 HydrophobicContact CE2-CZ 4.29Å; F430-F635 HydrophobicContact CG-CD2 4.42Å; F430-F635 AromaticContact CG-CE2 3.89Å; F430-F635 HydrophobicContact CG-CE2 3.89Å
431	I	83.7	Confident	85.7	Confident	10 Å²	10	42.5 Å²	42.5	5%	0.051	21%	0.206	C	C	.	.	H	α-helix	trans	-63	-49.1	179.7	-60.4	172.6	0	0	0	111.1	T426 I433 L434 T435 L478 Y482 I632	T426-I431 HydrophobicContact CG2-CG2 4.24Å; I431-I433 PolarHBondContact O-N 2.78Å; I431-L434 PolarHBondContact O-N 3.27Å; I431-T435 VanDerWaalsContact O-CG2 3.23Å; I431-T435 WeakPolarHBondContact O-CG2 3.07Å; I431-T435 PolarHBondContact O-N 3.23Å; I431-L478 HydrophobicContact CG2-CD1 3.68Å; I431-L478 HydrophobicContact CG2-CD2 4.12Å; I431-L478 HydrophobicContact CG2-CG 4.4Å; I431-Y482 HydrophobicContact CD1-CD2 4.19Å; I431-Y482 HydrophobicContact CD1-CE2 3.95Å; I431-I632 HydrophobicContact CD1-CG1 4.23Å; I431-I632 HydrophobicContact CG1-CG1 4.4Å
432	P	86.7	Confident	85.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.1	-38.3	174	-25.7	32.1	0	0	0	115	L419 L422 T428 I429 L434 T435 V436	L419-P432 HydrophobicContact CD1-CB 3.88Å; L419-P432 HydrophobicContact CG-CB 4.36Å; L422-P432 HydrophobicContact CB-CB 3.79Å; L422-P432 HydrophobicContact CB-CG 3.75Å; T428-P432 WeakPolarHBondContact O-CD 3.46Å; T428-P432 WeakPolarHBondContact O-CG 3.21Å; I429-P432 WeakPolarHBondContact O-CD 3.34Å; P432-L434 VanDerWaalsContact C-N 3.33Å; P432-T435 WeakPolarHBondContact CA-OG1 3.4Å; P432-T435 PolarHBondContact O-N 3.39Å; P432-T435 PolarHBondContact O-OG1 2.98Å; P432-V436 WeakPolarHBondContact O-CG2 3.4Å; P432-V436 PolarHBondContact O-N 3.27Å; P432-V436 VanDerWaalsContact O-N 3.07Å
433	I	88.2	Confident	86	Confident	71 Å²	71	42.1 Å²	42.1	36%	0.364	20%	0.204	S	C	.	.	H	α-helix	trans	-63.8	-43.9	177.4	-70.9	168.1	0	0	0	110.1	L419 I429 F430 I431 T435 V436 L437	L419-I433 HydrophobicContact CD1-CG1 3.95Å; I429-I433 HydrophobicContact CG1-CD1 3.97Å; I429-I433 HydrophobicContact CG1-CG1 4.39Å; I429-I433 HydrophobicContact CG2-CD1 4.41Å; I429-I433 WeakPolarHBondContact O-CD1 3.41Å; I429-I433 VanDerWaalsContact O-CG1 3.26Å; I429-I433 WeakPolarHBondContact O-CG1 3.38Å; I429-I433 PolarHBondContact O-N 3.4Å; F430-I433 PolarHBondContact O-N 3.46Å; I431-I433 PolarHBondContact O-N 2.78Å; I433-T435 VanDerWaalsContact C-N 3.28Å; I433-T435 PolarHBondContact O-N 3.39Å; I433-V436 PolarHBondContact O-N 3Å; I433-L437 HydrophobicContact CG2-CD1 4.08Å; I433-L437 WeakPolarHBondContact O-CB 3.38Å; I433-L437 WeakPolarHBondContact O-CG 3.49Å; I433-L437 PolarHBondContact O-N 3.35Å
434	L	86.7	Confident	86.1	Confident	43 Å²	43	42.2 Å²	42.2	23%	0.225	20%	0.202	C	C	.	.	H	α-helix	trans	-61.9	-36.3	176.2	-71.1	170.5	0	0	0	111.8	F430 I431 P432 L437 A438 M627 M631	F430-L434 WeakPolarHBondContact O-CG 3.06Å; F430-L434 PolarHBondContact O-N 3.33Å; F430-L434 VanDerWaalsContact O-N 3.12Å; I431-L434 PolarHBondContact O-N 3.27Å; P432-L434 VanDerWaalsContact C-N 3.33Å; L434-L437 PolarHBondContact O-N 3.19Å; L434-A438 WeakPolarHBondContact O-CB 3.39Å; L434-A438 PolarHBondContact O-N 3.49Å; L434-M627 HydrophobicContact CB-CE 4.32Å; L434-M627 HydrophobicContact CD2-SD 4.44Å; L434-M627 WeakPolarHBondContact O-CE 3.26Å; L434-M631 HydrophobicContact CD1-CB 3.62Å; L434-M631 HydrophobicContact CD1-CG 4.02Å
435	T	88	Confident	86.5	Confident	4 Å²	4	37.3 Å²	37.3	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-70.3	-41.2	179.9	63	0	0	0	0	111.9	L422 I431 P432 I433 L437 A438 I439 L478 I628	L422-T435 WeakPolarHBondContact CD1-OG1 3.35Å; I431-T435 VanDerWaalsContact O-CG2 3.23Å; I431-T435 WeakPolarHBondContact O-CG2 3.07Å; I431-T435 PolarHBondContact O-N 3.23Å; P432-T435 WeakPolarHBondContact CA-OG1 3.4Å; P432-T435 PolarHBondContact O-N 3.39Å; P432-T435 PolarHBondContact O-OG1 2.98Å; I433-T435 VanDerWaalsContact C-N 3.28Å; I433-T435 PolarHBondContact O-N 3.39Å; T435-L437 VanDerWaalsContact C-N 3.31Å; T435-L437 PolarHBondContact O-N 3.36Å; T435-A438 WeakPolarHBondContact O-CB 3.43Å; T435-A438 PolarHBondContact O-N 3.41Å; T435-I439 WeakPolarHBondContact O-CG1 3.01Å; T435-I439 PolarHBondContact O-N 3.23Å; T435-L478 HydrophobicContact CG2-CB 4.42Å; T435-L478 HydrophobicContact CG2-CD1 3.78Å; T435-L478 HydrophobicContact CG2-CD2 3.32Å; T435-L478 HydrophobicContact CG2-CG 3.99Å; T435-I628 HydrophobicContact CG2-CD1 3.58Å
436	V	89.7	Confident	87	Confident	23 Å²	23	35 Å²	35	14%	0.139	17%	0.169	C	C	.	.	H	α-helix	trans	-62.5	-41.9	174.1	171.7	0	0	0	0	110.8	L415 L419 P432 I433 A438 I439 I440	L415-V436 HydrophobicContact CD2-CG1 4.27Å; L419-V436 HydrophobicContact CD1-CG2 3.95Å; P432-V436 WeakPolarHBondContact O-CG2 3.4Å; P432-V436 PolarHBondContact O-N 3.27Å; P432-V436 VanDerWaalsContact O-N 3.07Å; I433-V436 PolarHBondContact O-N 3Å; V436-A438 VanDerWaalsContact C-N 3.34Å; V436-A438 PolarHBondContact O-N 2.74Å; V436-I439 PolarHBondContact O-N 3.08Å; V436-I440 HydrophobicContact CG1-CD1 4.04Å; V436-I440 WeakPolarHBondContact O-CG1 3.2Å; V436-I440 PolarHBondContact O-N 3.06Å
437	L	87.7	Confident	87.6	Confident	62 Å²	62	35.9 Å²	35.9	33%	0.325	17%	0.173	S	C	.	.	H	α-helix	trans	-61.6	-40.8	173.6	-76.5	175	0	0	0	112.3	I433 L434 T435 I439 I440 W441	I433-L437 HydrophobicContact CG2-CD1 4.08Å; I433-L437 WeakPolarHBondContact O-CB 3.38Å; I433-L437 WeakPolarHBondContact O-CG 3.49Å; I433-L437 PolarHBondContact O-N 3.35Å; L434-L437 PolarHBondContact O-N 3.19Å; T435-L437 VanDerWaalsContact C-N 3.31Å; T435-L437 PolarHBondContact O-N 3.36Å; L437-I439 VanDerWaalsContact C-N 3.29Å; L437-I439 PolarHBondContact O-N 2.63Å; L437-I440 PolarHBondContact O-N 3.24Å; L437-W441 HydrophobicContact CB-CE3 3.88Å; L437-W441 HydrophobicContact CB-CZ3 3.69Å; L437-W441 HydrophobicContact CD1-CZ3 4.18Å; L437-W441 HydrophobicContact CD2-CH2 4.41Å; L437-W441 HydrophobicContact CD2-CZ3 3.89Å; L437-W441 HydrophobicContact CG-CZ3 4.13Å; L437-W441 PolarHBondContact O-N 2.82Å
438	A	88.4	Confident	88.1	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-42.6	175.6	0	0	0	0	0	111.7	L434 T435 V436 W441 S442 F623 M627	L434-A438 WeakPolarHBondContact O-CB 3.39Å; L434-A438 PolarHBondContact O-N 3.49Å; T435-A438 WeakPolarHBondContact O-CB 3.43Å; T435-A438 PolarHBondContact O-N 3.41Å; V436-A438 VanDerWaalsContact C-N 3.34Å; V436-A438 PolarHBondContact O-N 2.74Å; A438-W441 PolarHBondContact O-N 3.44Å; A438-S442 WeakPolarHBondContact O-CB 3.38Å; A438-S442 PolarHBondContact O-N 2.95Å; A438-S442 PolarHBondContact O-OG 3.22Å; A438-F623 HydrophobicContact CB-CB 4.25Å; A438-M627 HydrophobicContact CB-CE 3.45Å; A438-M627 VanDerWaalsContact CB-CE 3.45Å
439	I	90.6	Very high	88.7	Confident	3 Å²	3	32.1 Å²	32.1	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-64.7	-43.1	177.5	-66.2	164.6	0	0	0	110.8	L418 T435 V436 L437 W441 S442 L443 V470	L418-I439 HydrophobicContact CD2-CD1 4.02Å; T435-I439 WeakPolarHBondContact O-CG1 3.01Å; T435-I439 PolarHBondContact O-N 3.23Å; V436-I439 PolarHBondContact O-N 3.08Å; L437-I439 VanDerWaalsContact C-N 3.29Å; L437-I439 PolarHBondContact O-N 2.63Å; I439-W441 PolarHBondContact O-N 3.45Å; I439-S442 PolarHBondContact O-N 3.45Å; I439-S442 PolarHBondContact O-OG 2.75Å; I439-L443 HydrophobicContact CG2-CD1 4.39Å; I439-L443 WeakPolarHBondContact O-CG 3.23Å; I439-L443 PolarHBondContact O-N 3.47Å; I439-L443 VanDerWaalsContact O-N 3.15Å; I439-V470 HydrophobicContact CG2-CG1 3.75Å; I439-V470 HydrophobicContact CG2-CG2 4.12Å
440	I	89	Confident	89.1	Confident	84 Å²	84	28.7 Å²	28.7	43%	0.431	14%	0.143	S	C	.	.	H	α-helix	trans	-64.5	-42.5	177.8	-66.2	166.2	0	0	0	110.6	V436 L437 L443 L444	V436-I440 HydrophobicContact CG1-CD1 4.04Å; V436-I440 WeakPolarHBondContact O-CG1 3.2Å; V436-I440 PolarHBondContact O-N 3.06Å; L437-I440 PolarHBondContact O-N 3.24Å; I440-L443 PolarHBondContact O-N 2.93Å; I440-L444 WeakPolarHBondContact O-CB 3.12Å; I440-L444 PolarHBondContact O-N 3.42Å; I440-L444 VanDerWaalsContact O-N 3.09Å
441	W	88.5	Confident	89.3	Confident	55 Å²	55	25.4 Å²	25.4	21%	0.208	13%	0.132	C	C	.	.	H	α-helix	trans	-67.6	-36	177.2	-93.8	-64.3	0	0	0	113.4	I39 L437 A438 I439 L443 L444 T445 F623	I39-W441 HydrophobicContact CG2-CD2 3.49Å; I39-W441 VanDerWaalsContact CG2-CD2 3.49Å; I39-W441 HydrophobicContact CG2-CE3 3.95Å; I39-W441 HydrophobicContact CG2-CG 3.97Å; I39-W441 HydrophobicContact CG2-CH2 3.92Å; I39-W441 HydrophobicContact CG2-CZ2 3.43Å; I39-W441 VanDerWaalsContact CG2-CZ2 3.43Å; I39-W441 HydrophobicContact CG2-CZ3 4.13Å; L437-W441 HydrophobicContact CB-CE3 3.88Å; L437-W441 HydrophobicContact CB-CZ3 3.69Å; L437-W441 HydrophobicContact CD1-CZ3 4.18Å; L437-W441 HydrophobicContact CD2-CH2 4.41Å; L437-W441 HydrophobicContact CD2-CZ3 3.89Å; L437-W441 HydrophobicContact CG-CZ3 4.13Å; L437-W441 PolarHBondContact O-N 2.82Å; A438-W441 PolarHBondContact O-N 3.44Å; I439-W441 PolarHBondContact O-N 3.45Å; W441-L443 VanDerWaalsContact C-N 3.35Å; W441-L444 PolarHBondContact O-N 3.08Å; W441-T445 WeakPolarHBondContact O-CB 3.35Å; W441-T445 WeakPolarHBondContact O-CG2 3.48Å; W441-T445 PolarHBondContact O-N 3.42Å; W441-T445 PolarHBondContact O-OG1 3.09Å; W441-F623 HydrophobicContact CB-CD2 4.34Å; W441-F623 HydrophobicContact CB-CE2 4.09Å; W441-F623 HydrophobicContact CB-CZ 4.41Å
442	S	92.1	Very high	89.5	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-40.1	175.4	70.5	0	0	0	0	111.9	A438 I439 T445 A446	A438-S442 WeakPolarHBondContact O-CB 3.38Å; A438-S442 PolarHBondContact O-N 2.95Å; A438-S442 PolarHBondContact O-OG 3.22Å; I439-S442 PolarHBondContact O-N 3.45Å; I439-S442 PolarHBondContact O-OG 2.75Å; S442-T445 PolarHBondContact O-OG1 2.82Å; S442-A446 WeakPolarHBondContact O-CB 3.29Å; S442-A446 PolarHBondContact O-N 3.3Å
443	L	91.4	Very high	89.6	Confident	31 Å²	31	32.9 Å²	32.9	16%	0.162	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-46.3	174.3	-71.4	169.5	0	0	0	112.2	I439 I440 W441 A446 Y447 I467 V470 F612 V616	I439-L443 HydrophobicContact CG2-CD1 4.39Å; I439-L443 WeakPolarHBondContact O-CG 3.23Å; I439-L443 PolarHBondContact O-N 3.47Å; I439-L443 VanDerWaalsContact O-N 3.15Å; I440-L443 PolarHBondContact O-N 2.93Å; W441-L443 VanDerWaalsContact C-N 3.35Å; L443-A446 PolarHBondContact O-N 3.37Å; L443-Y447 WeakPolarHBondContact O-CB 3.26Å; L443-Y447 PolarHBondContact O-N 2.85Å; L443-I467 HydrophobicContact CD1-CG1 4.27Å; L443-I467 HydrophobicContact CD1-CG2 4.04Å; L443-I467 HydrophobicContact CD2-CG1 3.91Å; L443-V470 HydrophobicContact CD1-CG1 4.31Å; L443-V470 HydrophobicContact CD2-CG1 4.1Å; L443-V470 HydrophobicContact CG-CG1 4.29Å; L443-F612 HydrophobicContact CD2-CZ 4.38Å; L443-V616 HydrophobicContact CD2-CG1 3.88Å; L443-V616 HydrophobicContact CD2-CG2 3.86Å
444	L	90	Very high	89.8	Confident	40 Å²	40	31.7 Å²	31.7	21%	0.209	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-42.6	-177.2	-173.8	67.1	0	0	0	112.1	C46 F50 I440 W441 Y447 T448	C46-L444 HydrophobicContact CB-CD1 3.81Å; C46-L444 HydrophobicContact CB-CD2 3.47Å; C46-L444 VanDerWaalsContact CB-CD2 3.47Å; C46-L444 HydrophobicContact CB-CG 3.35Å; F50-L444 HydrophobicContact CD2-CD1 4.26Å; I440-L444 WeakPolarHBondContact O-CB 3.12Å; I440-L444 PolarHBondContact O-N 3.42Å; I440-L444 VanDerWaalsContact O-N 3.09Å; W441-L444 PolarHBondContact O-N 3.08Å; L444-Y447 PolarHBondContact O-N 2.96Å; L444-T448 WeakPolarHBondContact O-CG2 3.3Å; L444-T448 PolarHBondContact O-N 2.9Å; L444-T448 VanDerWaalsContact O-N 3.16Å; L444-T448 PolarHBondContact O-OG1 3.33Å
445	T	90.3	Very high	89.9	Confident	10 Å²	10	37.3 Å²	37.3	6%	0.061	19%	0.191	C	C	.	.	H	α-helix	trans	-70.3	-39.3	176.2	51.5	0	0	0	0	112.5	W441 S442 Y447 T448 V449 F623	W441-T445 WeakPolarHBondContact O-CB 3.35Å; W441-T445 WeakPolarHBondContact O-CG2 3.48Å; W441-T445 PolarHBondContact O-N 3.42Å; W441-T445 PolarHBondContact O-OG1 3.09Å; S442-T445 PolarHBondContact O-OG1 2.82Å; T445-Y447 VanDerWaalsContact C-N 3.32Å; T445-Y447 PolarHBondContact O-N 3.29Å; T445-T448 PolarHBondContact O-N 2.9Å; T445-T448 PolarHBondContact O-OG1 2.9Å; T445-V449 WeakPolarHBondContact O-CG2 3.38Å; T445-V449 PolarHBondContact O-N 3.45Å; T445-F623 HydrophobicContact CG2-CE2 4.22Å; T445-F623 HydrophobicContact CG2-CZ 3.9Å; T445-F623 WeakPolarHBondContact OG1-CE2 3.49Å
446	A	92.9	Very high	89.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-41.8	173	0	0	0	0	0	111.9	S442 L443 T448 V449 Y450 F612 F615 V616 F619	S442-A446 WeakPolarHBondContact O-CB 3.29Å; S442-A446 PolarHBondContact O-N 3.3Å; L443-A446 PolarHBondContact O-N 3.37Å; A446-T448 PolarHBondContact O-N 3.42Å; A446-V449 PolarHBondContact O-N 2.87Å; A446-Y450 VanDerWaalsContact O-CB 3.29Å; A446-Y450 WeakPolarHBondContact O-CB 3.43Å; A446-Y450 PolarHBondContact O-N 3.35Å; A446-F612 HydrophobicContact CB-CD2 4.37Å; A446-F612 HydrophobicContact CB-CE2 4.02Å; A446-F615 HydrophobicContact CB-CB 3.92Å; A446-V616 HydrophobicContact CB-CB 4.34Å; A446-V616 HydrophobicContact CB-CG2 3.47Å; A446-V616 VanDerWaalsContact CB-CG2 3.47Å; A446-F619 HydrophobicContact CB-CD2 4.06Å; A446-F619 HydrophobicContact CB-CE2 4.5Å
447	Y	91.6	Very high	89.4	Confident	20 Å²	20	39.2 Å²	39.2	8%	0.078	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-42.6	178.6	-178.2	-105.8	0	0	0	112.3	F50 H51 L443 L444 T445 Y450 T451 F459	F50-Y447 AromaticContact CD2-CD1 3.78Å; F50-Y447 HydrophobicContact CD2-CD1 3.78Å; F50-Y447 AromaticContact CD2-CE1 3.68Å; F50-Y447 HydrophobicContact CD2-CE1 3.68Å; F50-Y447 AromaticContact CE2-CD1 3.84Å; F50-Y447 HydrophobicContact CE2-CD1 3.84Å; F50-Y447 AromaticContact CE2-CE1 3.74Å; F50-Y447 HydrophobicContact CE2-CE1 3.74Å; H51-Y447 PolarHBondContact O-OH 3.29Å; L443-Y447 WeakPolarHBondContact O-CB 3.26Å; L443-Y447 PolarHBondContact O-N 2.85Å; L444-Y447 PolarHBondContact O-N 2.96Å; T445-Y447 VanDerWaalsContact C-N 3.32Å; T445-Y447 PolarHBondContact O-N 3.29Å; Y447-Y450 WeakPolarHBondContact O-CB 3.45Å; Y447-Y450 PolarHBondContact O-N 3.02Å; Y447-T451 HydrophobicContact CD1-CG2 4.45Å; Y447-T451 HydrophobicContact CD2-CG2 4.27Å; Y447-T451 HydrophobicContact CE1-CG2 3.93Å; Y447-T451 HydrophobicContact CE2-CG2 3.74Å; Y447-T451 PolarHBondContact O-N 3.42Å; Y447-T451 PolarHBondContact O-OG1 2.79Å; Y447-T451 VanDerWaalsContact O-OG1 3.11Å; Y447-F459 HydrophobicContact CD2-CD2 4.18Å; Y447-F459 HydrophobicContact CD2-CE2 4.08Å; Y447-F459 AromaticContact CE2-CD2 3.93Å; Y447-F459 HydrophobicContact CE2-CD2 3.93Å; Y447-F459 HydrophobicContact CE2-CE2 4.23Å; Y447-F459 HydrophobicContact CE2-CG 4.44Å
448	T	89.1	Confident	89.2	Confident	11 Å²	11	37.7 Å²	37.7	7%	0.067	20%	0.195	C	C	.	.	H	α-helix	trans	-72.8	-33.2	-179.6	52.4	0	0	0	0	113.4	C46 L444 T445 A446 Y450 I452	C46-T448 VanDerWaalsContact CA-CG2 3.48Å; C46-T448 HydrophobicContact CB-CG2 3.68Å; C46-T448 VanDerWaalsContact SG-CG2 3.59Å; C46-T448 PolarHBondContact SG-OG1 3.44Å; L444-T448 WeakPolarHBondContact O-CG2 3.3Å; L444-T448 PolarHBondContact O-N 2.9Å; L444-T448 VanDerWaalsContact O-N 3.16Å; L444-T448 PolarHBondContact O-OG1 3.33Å; T445-T448 PolarHBondContact O-N 2.9Å; T445-T448 PolarHBondContact O-OG1 2.9Å; A446-T448 PolarHBondContact O-N 3.42Å; T448-Y450 VanDerWaalsContact C-N 3.33Å; T448-I452 HydrophobicContact CG2-CD1 4.4Å; T448-I452 WeakPolarHBondContact O-CB 3.33Å; T448-I452 WeakPolarHBondContact O-CG1 3.47Å; T448-I452 PolarHBondContact O-N 2.96Å
449	V	91.4	Very high	89.2	Confident	29 Å²	29	38.5 Å²	38.5	18%	0.176	20%	0.199	C	C	.	.	I	π-helix	trans	-63.9	-42.3	168.1	173.2	0	0	0	0	110.5	T445 A446 V453 L454 F615 F619	T445-V449 WeakPolarHBondContact O-CG2 3.38Å; T445-V449 PolarHBondContact O-N 3.45Å; A446-V449 PolarHBondContact O-N 2.87Å; V449-V453 HydrophobicContact CB-CG2 4.49Å; V449-V453 HydrophobicContact CG1-CB 4.15Å; V449-V453 HydrophobicContact CG1-CG2 4.39Å; V449-V453 HydrophobicContact CG2-CG2 4.42Å; V449-V453 VanDerWaalsContact O-CB 3.29Å; V449-V453 WeakPolarHBondContact O-CB 3.4Å; V449-V453 PolarHBondContact O-N 3.06Å; V449-V453 VanDerWaalsContact O-N 3.14Å; V449-L454 PolarHBondContact O-N 3.48Å; V449-F615 HydrophobicContact CG1-CD1 4.22Å; V449-F615 HydrophobicContact CG1-CD2 4.48Å; V449-F615 HydrophobicContact CG1-CE1 4.01Å; V449-F615 HydrophobicContact CG1-CE2 4.33Å; V449-F615 HydrophobicContact CG1-CG 4.46Å; V449-F615 HydrophobicContact CG1-CZ 4.08Å; V449-F619 HydrophobicContact CB-CE2 4.41Å; V449-F619 HydrophobicContact CG2-CE2 3.97Å; V449-F619 HydrophobicContact CG2-CZ 3.87Å
450	Y	91.7	Very high	89.1	Confident	1 Å²	1	38.5 Å²	38.5	0%	0.004	20%	0.199	C	C	.	.	I	π-helix	trans	-61.2	-45.2	178	-178.5	-84.1	0	0	0	112.8	A446 Y447 T448 I456 H458 F459 R608 I611 F612	A446-Y450 VanDerWaalsContact O-CB 3.29Å; A446-Y450 WeakPolarHBondContact O-CB 3.43Å; A446-Y450 PolarHBondContact O-N 3.35Å; Y447-Y450 WeakPolarHBondContact O-CB 3.45Å; Y447-Y450 PolarHBondContact O-N 3.02Å; T448-Y450 VanDerWaalsContact C-N 3.33Å; Y450-I456 HydrophobicContact CD1-CB 4.29Å; Y450-I456 HydrophobicContact CD2-CD1 3.81Å; Y450-I456 HydrophobicContact CE1-CB 3.79Å; Y450-I456 HydrophobicContact CE1-CG2 3.88Å; Y450-I456 HydrophobicContact CE2-CB 4.29Å; Y450-I456 HydrophobicContact CE2-CD1 3.55Å; Y450-I456 HydrophobicContact CE2-CG2 4.26Å; Y450-I456 HydrophobicContact CG-CD1 4.43Å; Y450-I456 PolarHBondContact O-N 3.35Å; Y450-I456 VanDerWaalsContact OH-CG2 3.27Å; Y450-I456 WeakPolarHBondContact OH-CG2 3.35Å; Y450-H458 PolarHBondContact OH-O 3Å; Y450-F459 HydrophobicContact CE1-CD2 4.16Å; Y450-R608 HydrophobicContact CE2-CB 4.48Å; Y450-R608 WeakPolarHBondContact OH-CD 3.46Å; Y450-I611 HydrophobicContact CD2-CG2 4.46Å; Y450-F612 HydrophobicContact CD2-CB 4.01Å; Y450-F612 HydrophobicContact CD2-CD2 4.3Å; Y450-F612 HydrophobicContact CE2-CB 4.19Å; Y450-F612 HydrophobicContact CG-CD2 4.42Å
451	T	87.8	Confident	88.9	Confident	36 Å²	36	35 Å²	35	22%	0.221	18%	0.181	C	C	.	.	I	π-helix	trans	-86	-40.7	-176.3	56.5	0	0	0	0	113.9	Y447 K455	Y447-T451 HydrophobicContact CD1-CG2 4.45Å; Y447-T451 HydrophobicContact CD2-CG2 4.27Å; Y447-T451 HydrophobicContact CE1-CG2 3.93Å; Y447-T451 HydrophobicContact CE2-CG2 3.74Å; Y447-T451 PolarHBondContact O-N 3.42Å; Y447-T451 PolarHBondContact O-OG1 2.79Å; Y447-T451 VanDerWaalsContact O-OG1 3.11Å; T451-K455 VanDerWaalsContact O-CA 3.27Å; T451-K455 WeakPolarHBondContact O-CA 3.2Å; T451-K455 PolarHBondContact O-N 2.8Å
452	I	87.7	Confident	89	Confident	63 Å²	63	32.5 Å²	32.5	32%	0.323	17%	0.172	S	C	.	.	I	π-helix	trans	-91.9	-48	-172.6	-53.1	168.9	0	0	0	111.3	F49 T448 K455	F49-I452 HydrophobicContact CB-CD1 3.31Å; F49-I452 HydrophobicContact CB-CG1 4.04Å; F49-I452 HydrophobicContact CD1-CD1 4.36Å; F49-I452 HydrophobicContact CD2-CD1 3.69Å; F49-I452 HydrophobicContact CG-CD1 3.55Å; F49-I452 HydrophobicContact CG-CG1 4.36Å; T448-I452 HydrophobicContact CG2-CD1 4.4Å; T448-I452 WeakPolarHBondContact O-CB 3.33Å; T448-I452 WeakPolarHBondContact O-CG1 3.47Å; T448-I452 PolarHBondContact O-N 2.96Å; I452-K455 WeakPolarHBondContact O-CG 3.46Å
453	V	89.9	Confident	88.9	Confident	104 Å²	104	32.5 Å²	32.5	63%	0.63	17%	0.172	S	C	*	.	I	π-helix	trans	-79.7	-49.6	-173.2	-179	0	0	0	0	110.1	V449	V449-V453 HydrophobicContact CB-CG2 4.49Å; V449-V453 HydrophobicContact CG1-CB 4.15Å; V449-V453 HydrophobicContact CG1-CG2 4.39Å; V449-V453 HydrophobicContact CG2-CG2 4.42Å; V449-V453 VanDerWaalsContact O-CB 3.29Å; V449-V453 WeakPolarHBondContact O-CB 3.4Å; V449-V453 PolarHBondContact O-N 3.06Å; V449-V453 VanDerWaalsContact O-N 3.14Å
454	L	90.8	Very high	88.8	Confident	46 Å²	46	31.9 Å²	31.9	24%	0.241	17%	0.169	C	C	.	.	S	Bend	trans	-84.9	-16.1	-179.9	-61.1	179.7	0	0	0	113.6	V449 I456 I611 F615 F762	V449-L454 PolarHBondContact O-N 3.48Å; L454-I456 HydrophobicContact CB-CD1 3.97Å; L454-I456 HydrophobicContact CB-CG1 3.91Å; L454-I456 HydrophobicContact CD1-CD1 4.03Å; L454-I456 PolarHBondContact O-N 3.15Å; L454-I611 HydrophobicContact CD1-CG2 3.48Å; L454-I611 VanDerWaalsContact CD1-CG2 3.48Å; L454-F615 HydrophobicContact CD1-CE2 3.76Å; L454-F615 HydrophobicContact CD1-CZ 4.46Å; L454-F762 HydrophobicContact CB-CE1 4.35Å; L454-F762 WeakPolarHBondContact O-CD1 3.44Å
455	K	88.9	Confident	88.8	Confident	160 Å²	160	30.1 Å²	30.1	70%	0.696	16%	0.16	S	C	*	.			trans	50.5	41	-179.6	-60.6	-174.7	178.2	-178.6	0	113.1	T451 I452	T451-K455 VanDerWaalsContact O-CA 3.27Å; T451-K455 WeakPolarHBondContact O-CA 3.2Å; T451-K455 PolarHBondContact O-N 2.8Å; I452-K455 WeakPolarHBondContact O-CG 3.46Å
456	I	87.1	Confident	88.9	Confident	6 Å²	6	29.8 Å²	29.8	3%	0.031	16%	0.158	C	C	.	.			trans	-78.6	122.1	176	-59.9	169.7	0	0	0	107.7	Y450 L454 R608 I611 F762	Y450-I456 HydrophobicContact CD1-CB 4.29Å; Y450-I456 HydrophobicContact CD2-CD1 3.81Å; Y450-I456 HydrophobicContact CE1-CB 3.79Å; Y450-I456 HydrophobicContact CE1-CG2 3.88Å; Y450-I456 HydrophobicContact CE2-CB 4.29Å; Y450-I456 HydrophobicContact CE2-CD1 3.55Å; Y450-I456 HydrophobicContact CE2-CG2 4.26Å; Y450-I456 HydrophobicContact CG-CD1 4.43Å; Y450-I456 PolarHBondContact O-N 3.35Å; Y450-I456 VanDerWaalsContact OH-CG2 3.27Å; Y450-I456 WeakPolarHBondContact OH-CG2 3.35Å; L454-I456 HydrophobicContact CB-CD1 3.97Å; L454-I456 HydrophobicContact CB-CG1 3.91Å; L454-I456 HydrophobicContact CD1-CD1 4.03Å; L454-I456 PolarHBondContact O-N 3.15Å; I456-R608 HydrophobicContact CG2-CG 4.25Å; I456-I611 HydrophobicContact CD1-CD1 4.32Å; I456-I611 HydrophobicContact CD1-CG2 4.38Å; I456-F762 HydrophobicContact CG1-CD1 4.04Å; I456-F762 HydrophobicContact CG1-CE1 4.24Å
457	P	80.2	Confident	88.8	Confident	62 Å²	62	31.5 Å²	31.5	40%	0.403	17%	0.166	S	C	.	.			trans	-72.4	-35.4	-164.4	26.2	-35.5	0	0	0	113.9	F762 Y764 N765	P457-F762 WeakPolarHBondContact CD-O 3.31Å; P457-Y764 WeakPolarHBondContact CG-O 3.39Å; P457-N765 HydrophobicContact CB-CB 4.15Å; P457-N765 HydrophobicContact CG-CB 4.08Å
458	H	84.1	Confident	88.7	Confident	30 Å²	30	30.6 Å²	30.6	14%	0.139	16%	0.163	C	C	.	.			trans	-123.7	147.4	-172.8	-177.9	-83.5	0	0	0	111.9	D61 Y450	D61-H458 IonicContact OD1-ND1 3.53Å; D61-H458 IonicContact OD2-CE1 2.95Å; D61-H458 IonicContact OD2-CG 3.31Å; D61-H458 IonicContact OD2-ND1 2.86Å; D61-H458 PolarHBondContact OD2-ND1 3.4Å; Y450-H458 PolarHBondContact OH-O 3Å
459	F	88.8	Confident	88.7	Confident	18 Å²	18	30.4 Å²	30.4	8%	0.079	16%	0.162	C	C	.	.			trans	-113.4	102.8	-176.5	-177.4	-93.6	0	0	0	109.8	P53 L55 Y447 Y450 N463 L464 F612	P53-F459 HydrophobicContact CB-CB 3.66Å; P53-F459 HydrophobicContact CB-CD1 3.82Å; P53-F459 HydrophobicContact CB-CG 3.95Å; P53-F459 HydrophobicContact CG-CD1 4Å; P53-F459 HydrophobicContact CG-CG 4.45Å; L55-F459 HydrophobicContact CD2-CD1 4.31Å; Y447-F459 HydrophobicContact CD2-CD2 4.18Å; Y447-F459 HydrophobicContact CD2-CE2 4.08Å; Y447-F459 AromaticContact CE2-CD2 3.93Å; Y447-F459 HydrophobicContact CE2-CD2 3.93Å; Y447-F459 HydrophobicContact CE2-CE2 4.23Å; Y447-F459 HydrophobicContact CE2-CG 4.44Å; Y450-F459 HydrophobicContact CE1-CD2 4.16Å; F459-N463 HydrophobicContact CD1-CB 4.4Å; F459-N463 HydrophobicContact CD2-CB 4.2Å; F459-N463 VanDerWaalsContact CD2-ND2 3.29Å; F459-N463 WeakPolarHBondContact CD2-ND2 3.26Å; F459-N463 HydrophobicContact CE1-CB 3.75Å; F459-N463 HydrophobicContact CE2-CB 3.52Å; F459-N463 VanDerWaalsContact CE2-ND2 3.27Å; F459-N463 WeakPolarHBondContact CE2-ND2 3.33Å; F459-N463 HydrophobicContact CZ-CB 3.27Å; F459-L464 HydrophobicContact CE1-CD2 4.23Å; F459-F612 HydrophobicContact CE2-CD1 4.4Å; F459-F612 HydrophobicContact CE2-CD2 4.37Å; F459-F612 HydrophobicContact CE2-CE1 4.23Å; F459-F612 HydrophobicContact CE2-CE2 4.22Å; F459-F612 HydrophobicContact CE2-CG 4.47Å; F459-F612 HydrophobicContact CE2-CZ 4.15Å; F459-F612 HydrophobicContact CZ-CE1 4.3Å; F459-F612 HydrophobicContact CZ-CZ 4.39Å
460	P	87.8	Confident	88.8	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.019	15%	0.154	C	C	.	.			trans	-68.2	148	-176.1	21.4	-30	0	0	0	112.8	D61 I462 N463 A605 R608	D61-P460 HydrophobicContact CB-CB 4Å; D61-P460 VanDerWaalsContact OD2-CB 3.31Å; D61-P460 WeakPolarHBondContact OD2-CB 3.41Å; D61-P460 VanDerWaalsContact OD2-CD 3.29Å; D61-P460 WeakPolarHBondContact OD2-CD 3.47Å; P460-I462 PolarHBondContact O-N 2.85Å; P460-I462 VanDerWaalsContact O-N 3.14Å; P460-N463 WeakPolarHBondContact CD-ND2 3.41Å; P460-N463 WeakPolarHBondContact CG-OD1 3.37Å; P460-N463 VanDerWaalsContact O-CB 3.26Å; P460-N463 WeakPolarHBondContact O-CB 3.49Å; P460-N463 PolarHBondContact O-N 3.42Å; P460-A605 HydrophobicContact CB-CB 4.48Å; P460-R608 HydrophobicContact CG-CB 3.79Å
461	V	85.8	Confident	88.6	Confident	10 Å²	10	29.3 Å²	29.3	6%	0.061	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-53.3	-35.6	175.1	173.9	0	0	0	0	112.3	L55 P58 L404 N463 L464 F713	L55-V461 HydrophobicContact CD2-CG2 3.95Å; P58-V461 HydrophobicContact CB-CG2 3.92Å; L404-V461 HydrophobicContact CD1-CB 4.39Å; L404-V461 HydrophobicContact CD1-CG1 3.62Å; L404-V461 HydrophobicContact CD1-CG2 3.97Å; V461-N463 PolarHBondContact O-N 2.99Å; V461-N463 VanDerWaalsContact O-N 3.16Å; V461-L464 HydrophobicContact CG1-CD1 4.49Å; V461-L464 VanDerWaalsContact O-CB 3.29Å; V461-L464 WeakPolarHBondContact O-CB 3.3Å; V461-L464 WeakPolarHBondContact O-CG 3.38Å; V461-L464 PolarHBondContact O-N 3.21Å; V461-F713 HydrophobicContact CG1-CE1 4.49Å
462	I	88.7	Confident	88.4	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.015	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-59.2	-26.6	177.4	-69.4	-177.5	0	0	0	112.2	F62 P460 L464 L465 A605 F609 I1028 I1029 L1032	F62-I462 HydrophobicContact CE1-CD1 3.37Å; F62-I462 HydrophobicContact CE1-CG1 4.35Å; F62-I462 HydrophobicContact CE2-CD1 4.41Å; F62-I462 HydrophobicContact CZ-CD1 3.3Å; F62-I462 HydrophobicContact CZ-CG1 3.79Å; P460-I462 PolarHBondContact O-N 2.85Å; P460-I462 VanDerWaalsContact O-N 3.14Å; I462-L464 PolarHBondContact O-N 3.22Å; I462-L464 VanDerWaalsContact O-N 3.14Å; I462-L465 HydrophobicContact CG2-CD1 4.04Å; I462-L465 WeakPolarHBondContact O-CB 3.14Å; I462-L465 WeakPolarHBondContact O-CG 3.32Å; I462-L465 PolarHBondContact O-N 3.4Å; I462-A605 HydrophobicContact CD1-CB 4.26Å; I462-F609 HydrophobicContact CG2-CB 3.94Å; I462-F609 HydrophobicContact CG2-CD2 3.81Å; I462-F609 HydrophobicContact CG2-CG 3.97Å; I462-F609 WeakPolarHBondContact O-CD2 3.45Å; I462-I1028 HydrophobicContact CD1-CG2 4.19Å; I462-I1029 HydrophobicContact CD1-CG1 4.48Å; I462-L1032 HydrophobicContact CG2-CD1 4.02Å
463	N	91.7	Very high	88.3	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-61.4	-23.2	176.1	-72.8	-1.3	0	0	0	112.7	F459 P460 V461 L465 A466 F609 F612	F459-N463 HydrophobicContact CD1-CB 4.4Å; F459-N463 HydrophobicContact CD2-CB 4.2Å; F459-N463 VanDerWaalsContact CD2-ND2 3.29Å; F459-N463 WeakPolarHBondContact CD2-ND2 3.26Å; F459-N463 HydrophobicContact CE1-CB 3.75Å; F459-N463 HydrophobicContact CE2-CB 3.52Å; F459-N463 VanDerWaalsContact CE2-ND2 3.27Å; F459-N463 WeakPolarHBondContact CE2-ND2 3.33Å; F459-N463 HydrophobicContact CZ-CB 3.27Å; P460-N463 WeakPolarHBondContact CD-ND2 3.41Å; P460-N463 WeakPolarHBondContact CG-OD1 3.37Å; P460-N463 VanDerWaalsContact O-CB 3.26Å; P460-N463 WeakPolarHBondContact O-CB 3.49Å; P460-N463 PolarHBondContact O-N 3.42Å; V461-N463 PolarHBondContact O-N 2.99Å; V461-N463 VanDerWaalsContact O-N 3.16Å; N463-L465 PolarHBondContact O-N 3.42Å; N463-A466 VanDerWaalsContact O-CB 3.27Å; N463-A466 WeakPolarHBondContact O-CB 3.35Å; N463-A466 PolarHBondContact O-N 3.14Å; N463-F609 WeakPolarHBondContact OD1-CA 3.38Å; N463-F609 PolarHBondContact OD1-N 3.2Å; N463-F612 HydrophobicContact CB-CD1 3.86Å; N463-F612 HydrophobicContact CB-CE1 4.26Å
464	L	89.1	Confident	87.8	Confident	18 Å²	18	20.9 Å²	20.9	9%	0.094	11%	0.106	C	C	.	.	H	α-helix	trans	-63.5	-24.5	172.7	-60.7	176.4	0	0	0	112.2	L404 F459 V461 I462 A466 I467 F1106	L404-L464 HydrophobicContact CD1-CD1 3.72Å; L404-L464 HydrophobicContact CD2-CD1 3.75Å; L404-L464 HydrophobicContact CG-CD1 3.83Å; F459-L464 HydrophobicContact CE1-CD2 4.23Å; V461-L464 HydrophobicContact CG1-CD1 4.49Å; V461-L464 VanDerWaalsContact O-CB 3.29Å; V461-L464 WeakPolarHBondContact O-CB 3.3Å; V461-L464 WeakPolarHBondContact O-CG 3.38Å; V461-L464 PolarHBondContact O-N 3.21Å; I462-L464 PolarHBondContact O-N 3.22Å; I462-L464 VanDerWaalsContact O-N 3.14Å; L464-A466 PolarHBondContact O-N 3.19Å; L464-I467 HydrophobicContact CD2-CD1 3.74Å; L464-I467 VanDerWaalsContact O-CB 3.31Å; L464-I467 WeakPolarHBondContact O-CB 3.48Å; L464-I467 PolarHBondContact O-N 3.17Å; L464-I467 VanDerWaalsContact O-N 3.14Å; L464-F1106 HydrophobicContact CB-CE1 4Å; L464-F1106 HydrophobicContact CB-CZ 4.18Å; L464-F1106 HydrophobicContact CD1-CZ 4.33Å
465	L	90.2	Very high	87.5	Confident	3 Å²	3	18.7 Å²	18.7	2%	0.016	10%	0.095	C	C	.	.	H	α-helix	trans	-64.7	-24.9	172.3	-57	-177.1	0	0	0	112.4	I462 N463 I467 V468 L469 F609 I1029 C1105 F1106 I1109	I462-L465 HydrophobicContact CG2-CD1 4.04Å; I462-L465 WeakPolarHBondContact O-CB 3.14Å; I462-L465 WeakPolarHBondContact O-CG 3.32Å; I462-L465 PolarHBondContact O-N 3.4Å; N463-L465 PolarHBondContact O-N 3.42Å; L465-I467 VanDerWaalsContact C-N 3.27Å; L465-I467 PolarHBondContact O-N 3.44Å; L465-V468 WeakPolarHBondContact O-CB 3.43Å; L465-V468 PolarHBondContact O-N 3.4Å; L465-L469 PolarHBondContact O-N 2.95Å; L465-F609 HydrophobicContact CB-CE2 3.99Å; L465-I1029 HydrophobicContact CD1-CG2 4.14Å; L465-C1105 HydrophobicContact CD2-CB 4.21Å; L465-C1105 WeakPolarHBondContact CD2-O 3.17Å; L465-F1106 HydrophobicContact CD2-CD1 4.04Å; L465-F1106 HydrophobicContact CD2-CE1 4.4Å; L465-I1109 HydrophobicContact CD2-CB 4.07Å; L465-I1109 HydrophobicContact CD2-CG2 3.8Å
466	A	91.9	Very high	87.5	Confident	2 Å²	2	11.4 Å²	11.4	2%	0.017	6%	0.064	C	C	.	.	H	α-helix	trans	-68.6	-30.5	175.6	0	0	0	0	0	111.6	N463 L464 V468 L469 V470 F609 F612 A613	N463-A466 VanDerWaalsContact O-CB 3.27Å; N463-A466 WeakPolarHBondContact O-CB 3.35Å; N463-A466 PolarHBondContact O-N 3.14Å; L464-A466 PolarHBondContact O-N 3.19Å; A466-V468 VanDerWaalsContact C-N 3.34Å; A466-L469 PolarHBondContact O-N 3.01Å; A466-V470 WeakPolarHBondContact O-CG1 3.37Å; A466-V470 PolarHBondContact O-N 2.91Å; A466-F609 HydrophobicContact CB-CD2 4.5Å; A466-F609 HydrophobicContact CB-CE2 4Å; A466-F612 HydrophobicContact CB-CD1 3.79Å; A466-F612 HydrophobicContact CB-CE1 3.87Å; A466-A613 HydrophobicContact CB-CB 3.9Å
467	I	90.4	Very high	87.4	Confident	36 Å²	36	11.5 Å²	11.5	19%	0.185	6%	0.064	C	C	.	.	H	α-helix	trans	-63	-45.1	173.8	-56.4	174.6	0	0	0	109.4	L411 L443 L464 L465 L469 V470 T471	L411-I467 HydrophobicContact CD1-CG2 4.24Å; L443-I467 HydrophobicContact CD1-CG1 4.27Å; L443-I467 HydrophobicContact CD1-CG2 4.04Å; L443-I467 HydrophobicContact CD2-CG1 3.91Å; L464-I467 HydrophobicContact CD2-CD1 3.74Å; L464-I467 VanDerWaalsContact O-CB 3.31Å; L464-I467 WeakPolarHBondContact O-CB 3.48Å; L464-I467 PolarHBondContact O-N 3.17Å; L464-I467 VanDerWaalsContact O-N 3.14Å; L465-I467 VanDerWaalsContact C-N 3.27Å; L465-I467 PolarHBondContact O-N 3.44Å; I467-L469 VanDerWaalsContact C-N 3.35Å; I467-L469 PolarHBondContact O-N 2.8Å; I467-V470 VanDerWaalsContact O-CG1 3.25Å; I467-V470 WeakPolarHBondContact O-CG1 3.24Å; I467-T471 WeakPolarHBondContact O-CG2 3.38Å; I467-T471 PolarHBondContact O-N 3.27Å
468	V	89.1	Confident	87.7	Confident	1 Å²	1	8.6 Å²	8.6	1%	0.006	5%	0.046	C	C	.	.	H	α-helix	trans	-60.6	-44.5	174.6	174	0	0	0	0	112.1	L411 L465 A466 T471 M1098 F1106 I1109 L1113	L411-V468 HydrophobicContact CD2-CG2 3.63Å; L465-V468 WeakPolarHBondContact O-CB 3.43Å; L465-V468 PolarHBondContact O-N 3.4Å; A466-V468 VanDerWaalsContact C-N 3.34Å; V468-T471 PolarHBondContact O-N 3.4Å; V468-T471 PolarHBondContact O-OG1 3.34Å; V468-M1098 HydrophobicContact CB-CE 3.57Å; V468-M1098 HydrophobicContact CB-SD 4.1Å; V468-M1098 HydrophobicContact CG1-CE 3.3Å; V468-M1098 HydrophobicContact CG1-SD 3.2Å; V468-M1098 WeakPolarHBondContact CG1-SD 3.32Å; V468-M1098 HydrophobicContact CG2-CE 3.18Å; V468-M1098 HydrophobicContact CG2-SD 3.97Å; V468-F1106 HydrophobicContact CG2-CD1 4.41Å; V468-I1109 HydrophobicContact CB-CG1 4.39Å; V468-I1109 HydrophobicContact CB-CG2 4.22Å; V468-I1109 HydrophobicContact CG1-CB 4.42Å; V468-I1109 HydrophobicContact CG1-CG1 3.8Å; V468-I1109 HydrophobicContact CG1-CG2 3.72Å; V468-I1109 HydrophobicContact CG2-CG2 4.15Å; V468-L1113 HydrophobicContact CG1-CD1 3.69Å
469	L	90.5	Very high	88	Confident	8 Å²	8	7.2 Å²	7.2	4%	0.042	4%	0.039	C	C	.	.	H	α-helix	trans	-64.5	-42.8	-177.2	-173.2	66.3	0	0	0	111.6	L465 A466 I467 G472 L473 L1040 L1113	L465-L469 PolarHBondContact O-N 2.95Å; A466-L469 PolarHBondContact O-N 3.01Å; I467-L469 VanDerWaalsContact C-N 3.35Å; I467-L469 PolarHBondContact O-N 2.8Å; L469-G472 PolarHBondContact O-N 3.46Å; L469-L473 HydrophobicContact CD1-CD1 3.94Å; L469-L473 HydrophobicContact CD1-CG 4.42Å; L469-L473 HydrophobicContact CD2-CD1 4.34Å; L469-L473 HydrophobicContact CG-CD1 3.75Å; L469-L473 HydrophobicContact CG-CG 4.49Å; L469-L473 WeakPolarHBondContact O-CG 3.38Å; L469-L473 PolarHBondContact O-N 2.9Å; L469-L473 VanDerWaalsContact O-N 3.08Å; L469-L1040 HydrophobicContact CD1-CD1 3.75Å; L469-L1040 HydrophobicContact CD1-CD2 3.93Å; L469-L1113 HydrophobicContact CD1-CD2 4.08Å
470	V	91.8	Very high	87.9	Confident	3 Å²	3	6.4 Å²	6.4	2%	0.018	4%	0.035	C	C	.	.	H	α-helix	trans	-71.3	-29.5	-178.7	71.2	0	0	0	0	112.8	I439 L443 A466 I467 G472 G474 V616 N620	I439-V470 HydrophobicContact CG2-CG1 3.75Å; I439-V470 HydrophobicContact CG2-CG2 4.12Å; L443-V470 HydrophobicContact CD1-CG1 4.31Å; L443-V470 HydrophobicContact CD2-CG1 4.1Å; L443-V470 HydrophobicContact CG-CG1 4.29Å; A466-V470 WeakPolarHBondContact O-CG1 3.37Å; A466-V470 PolarHBondContact O-N 2.91Å; I467-V470 VanDerWaalsContact O-CG1 3.25Å; I467-V470 WeakPolarHBondContact O-CG1 3.24Å; V470-G472 VanDerWaalsContact C-N 3.31Å; V470-G472 PolarHBondContact O-N 3.27Å; V470-G474 WeakPolarHBondContact O-CA 3.28Å; V470-G474 PolarHBondContact O-N 3.39Å; V470-V616 HydrophobicContact CB-CG1 3.7Å; V470-V616 HydrophobicContact CG1-CG1 4Å; V470-V616 HydrophobicContact CG2-CG1 3.67Å; V470-N620 HydrophobicContact CG2-CB 4.36Å
471	T	88.6	Confident	87.9	Confident	3 Å²	3	6.5 Å²	6.5	2%	0.018	4%	0.036	C	C	.	.	H	α-helix	trans	-66.5	-34.4	176.2	56.2	0	0	0	0	112.2	L415 L418 I467 V468	L415-T471 HydrophobicContact CD2-CG2 3.55Å; L415-T471 HydrophobicContact CG-CG2 3.99Å; L418-T471 WeakPolarHBondContact CD2-O 3.37Å; I467-T471 WeakPolarHBondContact O-CG2 3.38Å; I467-T471 PolarHBondContact O-N 3.27Å; V468-T471 PolarHBondContact O-N 3.4Å; V468-T471 PolarHBondContact O-OG1 3.34Å
472	G	82.4	Confident	88	Confident	2 Å²	2	7.1 Å²	7.1	2%	0.021	4%	0.037	C	C	.	.	H	α-helix	trans	-72.4	-54	172.6	0	0	0	0	0	112.5	L469 V470 S1091	L469-G472 PolarHBondContact O-N 3.46Å; V470-G472 VanDerWaalsContact C-N 3.31Å; V470-G472 PolarHBondContact O-N 3.27Å; G472-S1091 PolarHBondContact O-OG 3.14Å; G472-S1091 VanDerWaalsContact O-OG 3.04Å
473	L	86.1	Confident	87.9	Confident	22 Å²	22	8.1 Å²	8.1	12%	0.115	4%	0.042	C	C	.	.	H	α-helix	trans	-72.5	-31.1	-173.5	-65.7	175.7	0	0	0	114.2	L469 A475 D476 I617 L1040	L469-L473 HydrophobicContact CD1-CD1 3.94Å; L469-L473 HydrophobicContact CD1-CG 4.42Å; L469-L473 HydrophobicContact CD2-CD1 4.34Å; L469-L473 HydrophobicContact CG-CD1 3.75Å; L469-L473 HydrophobicContact CG-CG 4.49Å; L469-L473 WeakPolarHBondContact O-CG 3.38Å; L469-L473 PolarHBondContact O-N 2.9Å; L469-L473 VanDerWaalsContact O-N 3.08Å; L473-A475 PolarHBondContact O-N 2.83Å; L473-D476 PolarHBondContact O-N 2.81Å; L473-D476 VanDerWaalsContact O-N 3.1Å; L473-I617 HydrophobicContact CD1-CD1 4.22Å; L473-L1040 HydrophobicContact CD1-CD2 3.5Å; L473-L1040 HydrophobicContact CD2-CD2 3.79Å; L473-L1040 HydrophobicContact CG-CD2 4.13Å
474	G	80.4	Confident	87.7	Confident	2 Å²	2	8.8 Å²	8.8	2%	0.021	5%	0.045	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.2	-170.6	0	0	0	0	0	114.8	V470 N620	V470-G474 WeakPolarHBondContact O-CA 3.28Å; V470-G474 PolarHBondContact O-N 3.39Å; G474-N620 WeakPolarHBondContact CA-ND2 3.27Å
475	A	84.2	Confident	87.6	Confident	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-20.7	177.7	0	0	0	0	0	114.5	L418 L422 L473 L478 L479	L418-A475 HydrophobicContact CD1-CB 3.75Å; L422-A475 HydrophobicContact CD1-CB 4.13Å; L422-A475 HydrophobicContact CD2-CB 4.04Å; L422-A475 HydrophobicContact CG-CB 4.44Å; L473-A475 PolarHBondContact O-N 2.83Å; A475-L478 WeakPolarHBondContact O-CB 3.29Å; A475-L478 PolarHBondContact O-N 3.48Å; A475-L479 VanDerWaalsContact O-CG 3.28Å; A475-L479 WeakPolarHBondContact O-CG 3.29Å; A475-L479 PolarHBondContact O-N 3.06Å; A475-L479 VanDerWaalsContact O-N 3.16Å
476	D	87.7	Confident	87.3	Confident	8 Å²	8	11.4 Å²	11.4	4%	0.043	6%	0.055	C	C	.	.	H	α-helix	trans	-62	-55.1	-172.6	-175.2	15.8	0	0	0	111.9	L473 L478 L479 V480 H1047 S1087	L473-D476 PolarHBondContact O-N 2.81Å; L473-D476 VanDerWaalsContact O-N 3.1Å; D476-L478 VanDerWaalsContact C-N 3.25Å; D476-L478 PolarHBondContact O-N 3Å; D476-L479 WeakPolarHBondContact O-CB 3.49Å; D476-L479 PolarHBondContact O-N 3.38Å; D476-V480 PolarHBondContact O-N 2.95Å; D476-V480 VanDerWaalsContact O-N 3.09Å; D476-H1047 IonicContact OD1-NE2 3.94Å; D476-H1047 IonicContact OD2-NE2 3.85Å; D476-S1087 WeakPolarHBondContact OD1-CB 3.37Å; D476-S1087 PolarHBondContact OD1-OG 3.48Å
477	D	86	Confident	86.8	Confident	8 Å²	8	14.8 Å²	14.8	4%	0.043	7%	0.071	C	C	.	.	H	α-helix	trans	-56.3	-39.6	179.5	-72.7	-25.2	0	0	0	112.3	L479 F481 M584 T587 I624	D477-L479 PolarHBondContact O-N 3.46Å; D477-F481 WeakPolarHBondContact O-CB 3.47Å; D477-F481 PolarHBondContact O-N 3.36Å; D477-M584 HydrophobicContact CB-CB 4.47Å; D477-M584 HydrophobicContact CB-CG 4.03Å; D477-M584 HydrophobicContact CB-SD 3.82Å; D477-T587 PolarHBondContact OD1-OG1 2.99Å; D477-I624 HydrophobicContact CB-CD1 3.94Å
478	L	87.3	Confident	86.6	Confident	1 Å²	1	15.5 Å²	15.5	1%	0.005	7%	0.073	C	C	.	.	H	α-helix	trans	-60.6	-47.1	176	175.1	79	0	0	0	111.4	L422 I431 T435 A475 D476 F481 Y482 I628	L422-L478 HydrophobicContact CD1-CD2 4.21Å; L422-L478 HydrophobicContact CD2-CD2 4.02Å; I431-L478 HydrophobicContact CG2-CD1 3.68Å; I431-L478 HydrophobicContact CG2-CD2 4.12Å; I431-L478 HydrophobicContact CG2-CG 4.4Å; T435-L478 HydrophobicContact CG2-CB 4.42Å; T435-L478 HydrophobicContact CG2-CD1 3.78Å; T435-L478 HydrophobicContact CG2-CD2 3.32Å; T435-L478 HydrophobicContact CG2-CG 3.99Å; A475-L478 WeakPolarHBondContact O-CB 3.29Å; A475-L478 PolarHBondContact O-N 3.48Å; D476-L478 VanDerWaalsContact C-N 3.25Å; D476-L478 PolarHBondContact O-N 3Å; L478-F481 PolarHBondContact O-N 2.8Å; L478-Y482 WeakPolarHBondContact O-CB 3.34Å; L478-Y482 PolarHBondContact O-N 3.08Å; L478-I628 HydrophobicContact CD1-CD1 4.16Å; L478-I628 HydrophobicContact CD1-CG2 3.66Å
479	L	88.8	Confident	86.2	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.2	-40.3	-175.2	-70.5	168.6	0	0	0	111.4	L422 W425 A475 D476 D477 Q483 T1090	L422-L479 HydrophobicContact CD2-CD1 4.32Å; L422-L479 HydrophobicContact CD2-CD2 3.83Å; L422-L479 HydrophobicContact CD2-CG 4.09Å; W425-L479 HydrophobicContact CB-CD2 4.43Å; W425-L479 HydrophobicContact CD2-CD2 3.45Å; W425-L479 VanDerWaalsContact CD2-CD2 3.45Å; W425-L479 HydrophobicContact CE3-CD1 3.9Å; W425-L479 HydrophobicContact CE3-CD2 3.31Å; W425-L479 HydrophobicContact CE3-CG 4.19Å; W425-L479 HydrophobicContact CG-CD2 3.95Å; W425-L479 HydrophobicContact CH2-CB 4.17Å; W425-L479 HydrophobicContact CH2-CD1 3.72Å; W425-L479 HydrophobicContact CH2-CD2 3.84Å; W425-L479 HydrophobicContact CH2-CG 4.11Å; W425-L479 HydrophobicContact CZ2-CD2 4.05Å; W425-L479 HydrophobicContact CZ3-CB 4.43Å; W425-L479 HydrophobicContact CZ3-CD1 3.25Å; W425-L479 HydrophobicContact CZ3-CD2 3.47Å; W425-L479 VanDerWaalsContact CZ3-CD2 3.47Å; W425-L479 HydrophobicContact CZ3-CG 3.86Å; A475-L479 VanDerWaalsContact O-CG 3.28Å; A475-L479 WeakPolarHBondContact O-CG 3.29Å; A475-L479 PolarHBondContact O-N 3.06Å; A475-L479 VanDerWaalsContact O-N 3.16Å; D476-L479 WeakPolarHBondContact O-CB 3.49Å; D476-L479 PolarHBondContact O-N 3.38Å; D477-L479 PolarHBondContact O-N 3.46Å; L479-Q483 VanDerWaalsContact O-CB 3.25Å; L479-Q483 WeakPolarHBondContact O-CB 3.34Å; L479-Q483 PolarHBondContact O-N 3.44Å; L479-T1090 HydrophobicContact CD1-CG2 4.21Å
480	V	87.2	Confident	85.7	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-63	-49.3	174.8	176.4	0	0	0	0	110.6	D476 Q483 I484 A1083	D476-V480 PolarHBondContact O-N 2.95Å; D476-V480 VanDerWaalsContact O-N 3.09Å; V480-Q483 PolarHBondContact O-N 2.88Å; V480-I484 HydrophobicContact CG1-CD1 4.08Å; V480-I484 WeakPolarHBondContact O-CG1 3.47Å; V480-I484 PolarHBondContact O-N 2.95Å; V480-A1083 HydrophobicContact CG2-CB 4.3Å
481	F	88.9	Confident	85	Confident	5 Å²	5	29.7 Å²	29.7	2%	0.022	13%	0.134	C	C	.	.	H	α-helix	trans	-59.5	-50	177.3	-179.1	-91	0	0	0	111.9	D477 L478 Q483 I484 W485 L577 A580 M584 I629 I632	D477-F481 WeakPolarHBondContact O-CB 3.47Å; D477-F481 PolarHBondContact O-N 3.36Å; L478-F481 PolarHBondContact O-N 2.8Å; F481-Q483 VanDerWaalsContact C-N 3.33Å; F481-Q483 PolarHBondContact O-N 2.82Å; F481-I484 PolarHBondContact O-N 3.45Å; F481-W485 HydrophobicContact CZ-CE3 4.44Å; F481-W485 WeakPolarHBondContact O-CB 3.42Å; F481-W485 PolarHBondContact O-N 3.4Å; F481-L577 HydrophobicContact CE2-CD2 4.2Å; F481-A580 HydrophobicContact CD2-CB 3.89Å; F481-M584 HydrophobicContact CB-SD 4.07Å; F481-M584 HydrophobicContact CD2-CE 4.19Å; F481-I629 HydrophobicContact CE1-CG1 4.44Å; F481-I629 HydrophobicContact CE2-CD1 4.06Å; F481-I629 HydrophobicContact CE2-CG1 4.04Å; F481-I629 HydrophobicContact CZ-CD1 4.43Å; F481-I629 HydrophobicContact CZ-CG1 3.95Å; F481-I629 HydrophobicContact CZ-CG2 4.17Å; F481-I632 HydrophobicContact CD1-CD1 4.04Å; F481-I632 HydrophobicContact CE1-CD1 3.77Å
482	Y	86.8	Confident	84.4	Confident	24 Å²	24	31 Å²	31	9%	0.094	14%	0.141	C	C	.	.	H	α-helix	trans	-62.8	-37.9	-177.5	-177.5	-95.6	0	0	0	112.2	T426 I431 L478 W485 K486	T426-Y482 HydrophobicContact CG2-CD1 4.46Å; T426-Y482 HydrophobicContact CG2-CD2 4.47Å; T426-Y482 HydrophobicContact CG2-CG 4.44Å; T426-Y482 PolarHBondContact O-OH 2.84Å; I431-Y482 HydrophobicContact CD1-CD2 4.19Å; I431-Y482 HydrophobicContact CD1-CE2 3.95Å; L478-Y482 WeakPolarHBondContact O-CB 3.34Å; L478-Y482 PolarHBondContact O-N 3.08Å; Y482-W485 PolarHBondContact O-N 2.89Å; Y482-K486 HydrophobicContact CE1-CD 4.18Å; Y482-K486 VanDerWaalsContact O-CB 3.31Å; Y482-K486 WeakPolarHBondContact O-CB 3.3Å; Y482-K486 PolarHBondContact O-N 3.39Å
483	Q	87.7	Confident	83.9	Confident	24 Å²	24	33.4 Å²	33.4	11%	0.112	16%	0.161	C	C	.	.	H	α-helix	trans	-66.5	-45.9	178.1	-179.7	64.6	12.2	0	0	112.1	L479 V480 F481 W485 K486 Q487 S1079 A1083	L479-Q483 VanDerWaalsContact O-CB 3.25Å; L479-Q483 WeakPolarHBondContact O-CB 3.34Å; L479-Q483 PolarHBondContact O-N 3.44Å; V480-Q483 PolarHBondContact O-N 2.88Å; F481-Q483 VanDerWaalsContact C-N 3.33Å; F481-Q483 PolarHBondContact O-N 2.82Å; Q483-W485 VanDerWaalsContact C-N 3.31Å; Q483-W485 PolarHBondContact O-N 2.97Å; Q483-K486 PolarHBondContact O-N 3.35Å; Q483-Q487 WeakPolarHBondContact O-CB 3.37Å; Q483-Q487 PolarHBondContact O-N 3.41Å; Q483-S1079 WeakPolarHBondContact CG-O 3.31Å; Q483-S1079 PolarHBondContact NE2-O 2.7Å; Q483-A1083 HydrophobicContact CB-CB 3.83Å; Q483-A1083 HydrophobicContact CG-CB 4.02Å
484	I	86.6	Confident	83.1	Confident	14 Å²	14	36.6 Å²	36.6	7%	0.072	18%	0.175	C	C	.	.	H	α-helix	trans	-63.4	-41.2	177.2	-63.3	168.7	0	0	0	110	V480 F481 Q487 K488 Y575 T576 H579 A580 L1080	V480-I484 HydrophobicContact CG1-CD1 4.08Å; V480-I484 WeakPolarHBondContact O-CG1 3.47Å; V480-I484 PolarHBondContact O-N 2.95Å; F481-I484 PolarHBondContact O-N 3.45Å; I484-Q487 PolarHBondContact O-N 3.18Å; I484-K488 PolarHBondContact O-N 2.77Å; I484-K488 VanDerWaalsContact O-N 3.13Å; I484-Y575 HydrophobicContact CG2-CE1 4.4Å; I484-T576 HydrophobicContact CG2-CG2 4.13Å; I484-H579 HydrophobicContact CD1-CB 4.44Å; I484-H579 HydrophobicContact CG2-CB 4.39Å; I484-A580 HydrophobicContact CD1-CB 3.84Å; I484-L1080 HydrophobicContact CD1-CD2 4.3Å; I484-L1080 HydrophobicContact CG1-CD2 4.1Å
485	W	86	Confident	82.4	Confident	7 Å²	7	39.6 Å²	39.6	3%	0.027	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-53.1	175	178.7	-92.3	0	0	0	112.7	F481 Y482 Q483 Q487 K488 R489 L569 C572 L573 T576 I632	F481-W485 HydrophobicContact CZ-CE3 4.44Å; F481-W485 WeakPolarHBondContact O-CB 3.42Å; F481-W485 PolarHBondContact O-N 3.4Å; Y482-W485 PolarHBondContact O-N 2.89Å; Q483-W485 VanDerWaalsContact C-N 3.31Å; Q483-W485 PolarHBondContact O-N 2.97Å; W485-Q487 VanDerWaalsContact C-N 3.32Å; W485-Q487 PolarHBondContact O-N 3.41Å; W485-K488 PolarHBondContact O-N 3.2Å; W485-R489 WeakPolarHBondContact O-CG 3.46Å; W485-R489 PolarHBondContact O-N 3.05Å; W485-R489 VanDerWaalsContact O-N 3.11Å; W485-L569 HydrophobicContact CH2-CD1 3.55Å; W485-L569 HydrophobicContact CH2-CG 4.44Å; W485-L569 HydrophobicContact CZ2-CD1 3.78Å; W485-C572 HydrophobicContact CH2-CB 4.43Å; W485-C572 HydrophobicContact CZ3-CB 4.38Å; W485-L573 HydrophobicContact CZ3-CB 3.99Å; W485-L573 HydrophobicContact CZ3-CD1 3.72Å; W485-L573 HydrophobicContact CZ3-CG 4.48Å; W485-T576 VanDerWaalsContact CA-CG2 3.45Å; W485-T576 HydrophobicContact CB-CG2 4.05Å; W485-T576 HydrophobicContact CD2-CG2 4.42Å; W485-T576 HydrophobicContact CE3-CG2 3.77Å; W485-I632 HydrophobicContact CZ2-CG2 4.46Å
486	K	84	Confident	81.1	Confident	68 Å²	68	41.6 Å²	41.6	30%	0.296	21%	0.206	S	C	.	.	H	α-helix	trans	-60.6	-40.7	179.8	-177	178.6	178	-178.5	0	112.2	Y482 Q483 F490	Y482-K486 HydrophobicContact CE1-CD 4.18Å; Y482-K486 VanDerWaalsContact O-CB 3.31Å; Y482-K486 WeakPolarHBondContact O-CB 3.3Å; Y482-K486 PolarHBondContact O-N 3.39Å; Q483-K486 PolarHBondContact O-N 3.35Å; K486-F490 WeakPolarHBondContact O-CB 3.41Å; K486-F490 PolarHBondContact O-N 3.5Å
487	Q	83	Confident	79.6	Confident	74 Å²	74	45.5 Å²	45.5	35%	0.346	23%	0.23	S	C	.	.	H	α-helix	trans	-64.7	-48.5	179.9	-173.2	-179.1	-1.6	0	0	111.8	Q483 I484 W485 R489 F490 M491 S1079	Q483-Q487 WeakPolarHBondContact O-CB 3.37Å; Q483-Q487 PolarHBondContact O-N 3.41Å; I484-Q487 PolarHBondContact O-N 3.18Å; W485-Q487 VanDerWaalsContact C-N 3.32Å; W485-Q487 PolarHBondContact O-N 3.41Å; Q487-R489 PolarHBondContact O-N 2.94Å; Q487-F490 PolarHBondContact O-N 3.26Å; Q487-M491 WeakPolarHBondContact O-CG 3.44Å; Q487-M491 PolarHBondContact O-N 3.02Å; Q487-S1079 VanDerWaalsContact OE1-CB 3.23Å
488	K	85.1	Confident	78.1	Confident	50 Å²	50	49.8 Å²	49.8	22%	0.217	25%	0.252	C	S	.	.	H	α-helix	trans	-64.7	-39.8	-179.3	-177.8	59.4	176.2	177.2	0	111.9	I484 W485 F490 M491 L492 Y575	I484-K488 PolarHBondContact O-N 2.77Å; I484-K488 VanDerWaalsContact O-N 3.13Å; W485-K488 PolarHBondContact O-N 3.2Å; K488-F490 PolarHBondContact O-N 3.15Å; K488-M491 PolarHBondContact O-N 3.39Å; K488-L492 HydrophobicContact CD-CD1 4.32Å; K488-L492 HydrophobicContact CG-CD1 4.15Å; K488-L492 PolarHBondContact O-N 2.98Å; K488-Y575 HydrophobicContact CB-CD1 3.83Å; K488-Y575 HydrophobicContact CB-CE1 4.23Å; K488-Y575 HydrophobicContact CD-CD1 3.78Å; K488-Y575 HydrophobicContact CD-CD2 4.34Å; K488-Y575 HydrophobicContact CD-CE1 4.17Å; K488-Y575 HydrophobicContact CD-CG 3.88Å; K488-Y575 HydrophobicContact CG-CD1 3.7Å; K488-Y575 HydrophobicContact CG-CE1 4.38Å; K488-Y575 HydrophobicContact CG-CG 4.03Å
489	R	81.9	Confident	76	Confident	81 Å²	81	56 Å²	56	31%	0.306	28%	0.28	S	S	.	.	H	α-helix	trans	-60.4	-42.9	174.5	-76.6	-77.4	-71.8	163.9	-4.2	112.3	W485 Q487 L492 A493 C572 E636	W485-R489 WeakPolarHBondContact O-CG 3.46Å; W485-R489 PolarHBondContact O-N 3.05Å; W485-R489 VanDerWaalsContact O-N 3.11Å; Q487-R489 PolarHBondContact O-N 2.94Å; R489-L492 PolarHBondContact O-N 3.42Å; R489-A493 PolarHBondContact O-N 3.21Å; R489-C572 VanDerWaalsContact CD-SG 3.53Å; R489-E636 IonicContact NH2-OE2 3.48Å
490	F	79.3	Confident	73.8	Confident	126 Å²	126	62.3 Å²	62.3	55%	0.553	31%	0.31	S	S	*	.	H	α-helix	trans	-64.6	-41.9	177.1	-174.4	-99.6	0	0	0	112.1	K486 Q487 K488 L492 A493 Q494	K486-F490 WeakPolarHBondContact O-CB 3.41Å; K486-F490 PolarHBondContact O-N 3.5Å; Q487-F490 PolarHBondContact O-N 3.26Å; K488-F490 PolarHBondContact O-N 3.15Å; F490-L492 PolarHBondContact O-N 2.96Å; F490-A493 PolarHBondContact O-N 3.08Å; F490-Q494 HydrophobicContact CE1-CG 4.3Å; F490-Q494 WeakPolarHBondContact O-CG 3.18Å; F490-Q494 PolarHBondContact O-N 3.39Å
491	M	78	Confident	71.9	Confident	103 Å²	103	66 Å²	66	51%	0.507	33%	0.332	S	S	.	.	H	α-helix	trans	-62	-41.7	176.1	-64.9	-70.4	-78.1	0	0	111.8	Q487 K488 Q494 T495	Q487-M491 WeakPolarHBondContact O-CG 3.44Å; Q487-M491 PolarHBondContact O-N 3.02Å; K488-M491 PolarHBondContact O-N 3.39Å; M491-Q494 PolarHBondContact O-N 3.05Å; M491-T495 PolarHBondContact O-N 3.02Å
492	L	76.2	Confident	69.8	Low	30 Å²	30	70.7 Å²	70.7	16%	0.157	36%	0.357	C	S	.	.	H	α-helix	trans	-69.1	-36.4	177.8	-78.2	163.4	0	0	0	113.1	K488 R489 F490 Q494 T495 T496 C572	K488-L492 HydrophobicContact CD-CD1 4.32Å; K488-L492 HydrophobicContact CG-CD1 4.15Å; K488-L492 PolarHBondContact O-N 2.98Å; R489-L492 PolarHBondContact O-N 3.42Å; F490-L492 PolarHBondContact O-N 2.96Å; L492-Q494 PolarHBondContact O-N 2.91Å; L492-T495 WeakPolarHBondContact CA-OG1 3.17Å; L492-T495 PolarHBondContact O-N 3.04Å; L492-T495 PolarHBondContact O-OG1 2.97Å; L492-T496 PolarHBondContact O-N 2.82Å; L492-T496 PolarHBondContact O-OG1 3.5Å; L492-C572 HydrophobicContact CD1-CB 4.5Å; L492-C572 WeakPolarHBondContact CD1-SG 3.24Å
493	A	71.1	Confident	67.6	Low	53 Å²	53	77.3 Å²	77.3	44%	0.438	39%	0.389	S	S	.	.	H	α-helix	trans	-64.5	-29.2	174.5	0	0	0	0	0	112.3	R489 F490 T496 V497	R489-A493 PolarHBondContact O-N 3.21Å; F490-A493 PolarHBondContact O-N 3.08Å; A493-T496 PolarHBondContact O-OG1 3.02Å; A493-V497 VanDerWaalsContact O-CG2 3.26Å; A493-V497 WeakPolarHBondContact O-CG2 3.37Å
494	Q	69.4	Low	65.4	Low	90 Å²	90	82.7 Å²	82.7	42%	0.421	42%	0.418	S	S	.	.	H	α-helix	trans	-74.8	-41	174.9	-70.9	-176.9	-29	0	0	112.3	F490 M491 L492 T496 V497 I498	F490-Q494 HydrophobicContact CE1-CG 4.3Å; F490-Q494 WeakPolarHBondContact O-CG 3.18Å; F490-Q494 PolarHBondContact O-N 3.39Å; M491-Q494 PolarHBondContact O-N 3.05Å; L492-Q494 PolarHBondContact O-N 2.91Å; Q494-T496 PolarHBondContact O-N 3.22Å; Q494-V497 PolarHBondContact O-N 3.25Å; Q494-I498 WeakPolarHBondContact O-CG1 3.48Å; Q494-I498 PolarHBondContact O-N 3.32Å; Q494-I498 VanDerWaalsContact O-N 3.13Å
495	T	64.7	Low	63.2	Low	65 Å²	65	85 Å²	85	40%	0.399	43%	0.431	S	S	.	.	H	α-helix	trans	-64.6	-40.5	179.2	53.1	0	0	0	0	111.9	M491 L492 V497 I498 E499	M491-T495 PolarHBondContact O-N 3.02Å; L492-T495 WeakPolarHBondContact CA-OG1 3.17Å; L492-T495 PolarHBondContact O-N 3.04Å; L492-T495 PolarHBondContact O-OG1 2.97Å; T495-V497 VanDerWaalsContact C-N 3.25Å; T495-V497 PolarHBondContact O-N 3.44Å; T495-I498 PolarHBondContact O-N 3.4Å; T495-E499 PolarHBondContact O-N 3.43Å
496	T	57.4	Low	60.6	Low	42 Å²	42	91.3 Å²	91.3	26%	0.258	47%	0.465	S	S	.	.	H	α-helix	trans	-63.2	-30.5	176.1	51.4	0	0	0	0	113	L492 A493 Q494 H500	L492-T496 PolarHBondContact O-N 2.82Å; L492-T496 PolarHBondContact O-OG1 3.5Å; A493-T496 PolarHBondContact O-OG1 3.02Å; Q494-T496 PolarHBondContact O-N 3.22Å; T496-H500 PolarHBondContact O-CD2 2.99Å; T496-H500 PolarHBondContact O-N 2.84Å
497	V	57.4	Low	58.2	Low	90 Å²	90	94.8 Å²	94.8	55%	0.545	49%	0.486	S	S	.	.	H	α-helix	trans	-76.6	-37.7	177.9	173.6	0	0	0	0	111	A493 Q494 T495 H500 V501	A493-V497 VanDerWaalsContact O-CG2 3.26Å; A493-V497 WeakPolarHBondContact O-CG2 3.37Å; Q494-V497 PolarHBondContact O-N 3.25Å; T495-V497 VanDerWaalsContact C-N 3.25Å; T495-V497 PolarHBondContact O-N 3.44Å; V497-H500 PolarHBondContact O-N 3.49Å; V497-V501 VanDerWaalsContact O-CG2 3.3Å; V497-V501 WeakPolarHBondContact O-CG2 3.17Å; V497-V501 PolarHBondContact O-N 3.02Å
498	I	53.2	Low	55.8	Low	98 Å²	98	97.6 Å²	97.6	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-68.7	-43	178.7	-64.4	165.5	0	0	0	110.6	Q494 T495 H500 V501 D502	Q494-I498 WeakPolarHBondContact O-CG1 3.48Å; Q494-I498 PolarHBondContact O-N 3.32Å; Q494-I498 VanDerWaalsContact O-N 3.13Å; T495-I498 PolarHBondContact O-N 3.4Å; I498-H500 VanDerWaalsContact C-N 3.27Å; I498-H500 PolarHBondContact O-N 3.24Å; I498-V501 PolarHBondContact O-N 3.43Å; I498-D502 PolarHBondContact O-N 3.41Å
499	E	43	Very low	53.4	Low	131 Å²	131	101.7 Å²	101.7	61%	0.612	53%	0.533	S	S	*	.	H	α-helix	trans	-62.6	-32.9	176.7	-73.7	175.4	179.7	0	0	112.8	T495 H503	T495-E499 PolarHBondContact O-N 3.43Å; E499-H503 PolarHBondContact O-N 3.15Å
500	H	42.6	Very low	51	Low	132 Å²	132	104.2 Å²	104.2	61%	0.611	56%	0.557	S	S	*	*	H	α-helix	trans	-73.1	-24.5	173.1	-82.1	-49.8	0	0	0	113.7	T496 V497 I498	T496-H500 PolarHBondContact O-CD2 2.99Å; T496-H500 PolarHBondContact O-N 2.84Å; V497-H500 PolarHBondContact O-N 3.49Å; I498-H500 VanDerWaalsContact C-N 3.27Å; I498-H500 PolarHBondContact O-N 3.24Å
501	V	48.7	Very low	49	Very low	78 Å²	78	103.2 Å²	103.2	47%	0.473	56%	0.564	S	S	.	*	H	α-helix	trans	-87	-29.7	179	173.2	0	0	0	0	112.2	V497 I498 N505	V497-V501 VanDerWaalsContact O-CG2 3.3Å; V497-V501 WeakPolarHBondContact O-CG2 3.17Å; V497-V501 PolarHBondContact O-N 3.02Å; I498-V501 PolarHBondContact O-N 3.43Å; V501-N505 PolarHBondContact O-ND2 3.04Å; V501-N505 VanDerWaalsContact O-ND2 3.14Å
502	D	43.1	Very low	46.6	Very low	105 Å²	105	104.7 Å²	104.7	56%	0.561	57%	0.574	S	S	*	*	H	α-helix	trans	-79.7	-23.6	-179.7	-75.1	-19.3	0	0	0	113.2	I498 D504	I498-D502 PolarHBondContact O-N 3.41Å; D502-D504 VanDerWaalsContact C-N 3.32Å; D502-D504 PolarHBondContact O-N 3.26Å
503	H	40.9	Very low	44.4	Very low	163 Å²	163	111.3 Å²	111.3	76%	0.755	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-20.3	176.9	-109.4	-63.3	0	0	0	114.2	E499	E499-H503 PolarHBondContact O-N 3.15Å
504	D	42.9	Very low	42.2	Very low	137 Å²	137	117.2 Å²	117.2	73%	0.733	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-7.8	-175.6	-76.4	-13.4	0	0	0	114.2	D502	D502-D504 VanDerWaalsContact C-N 3.32Å; D502-D504 PolarHBondContact O-N 3.26Å
505	N	38.3	Very low	40.3	Very low	61 Å²	61	118.6 Å²	118.6	33%	0.326	63%	0.632	S	S	.	*			trans	-120.4	27.7	-165.9	-72.6	-45.1	0	0	0	117	V501 L507	V501-N505 PolarHBondContact O-ND2 3.04Å; V501-N505 VanDerWaalsContact O-ND2 3.14Å; N505-L507 PolarHBondContact O-N 3.47Å
506	N	32.6	Very low	38.4	Very low	140 Å²	140	125 Å²	125	75%	0.749	66%	0.658	S	S	*	*			trans	-92.6	83.6	175.2	-84.5	-26.9	0	0	0	113.4
507	L	34.4	Very low	37	Very low	141 Å²	141	131.4 Å²	131.4	74%	0.738	68%	0.684	S	S	*	*			trans	-157.6	105.6	152.8	-121.9	123.8	0	0	0	112.2	N505	N505-L507 PolarHBondContact O-N 3.47Å
508	N	31.2	Very low	35.6	Very low	133 Å²	133	132.3 Å²	132.3	71%	0.711	69%	0.686	S	S	*	*			trans	52.2	112.4	152.3	-58.2	-16.5	0	0	0	120.5
509	T	36.1	Very low	34.4	Very low	137 Å²	137	136.1 Å²	136.1	84%	0.84	71%	0.705	S	S	*	*				160.5	135.8	117.5	42.6	0	0	0	0	113.1
510	T	30	Very low	33.5	Very low	133 Å²	133	134.5 Å²	134.5	82%	0.816	71%	0.708	S	S	*	*			trans	-83.5	179.7	173.8	50.7	0	0	0	0	112.4
511	P	37.9	Very low	32.7	Very low	106 Å²	106	132.9 Å²	132.9	69%	0.688	71%	0.708	S	S	*	*			cis	-135.4	-168.2	-39.5	34.4	-13.2	0	0	0	112.9
512	N	27.5	Very low	31.8	Very low	133 Å²	133	134 Å²	134	71%	0.711	71%	0.711	S	S	*	*			trans	111.1	116.2	148	-75.3	-11.2	0	0	0	121.7
513	F	29	Very low	31.2	Very low	170 Å²	170	136.6 Å²	136.6	75%	0.746	72%	0.72	S	S	*	*			trans	84.9	122.4	137.5	-92.1	-101.1	0	0	0	122.1
514	K	26.5	Very low	30.7	Very low	177 Å²	177	133.1 Å²	133.1	77%	0.77	71%	0.707	S	S	*	*			trans	64.3	103.5	149.4	-76.5	168.7	179.2	179.7	0	118.6
515	T	29.4	Very low	30.2	Very low	119 Å²	119	130.6 Å²	130.6	73%	0.73	69%	0.693	S	S	*	*			trans	-171	86.1	138.6	33.1	0	0	0	0	111.8	E517 L518	T515-E517 VanDerWaalsContact C-N 3.26Å; T515-E517 PolarHBondContact O-N 3.19Å; T515-L518 HydrophobicContact CG2-CD1 4.35Å
516	Q	25.2	Very low	29.8	Very low	200 Å²	200	134.2 Å²	134.2	94%	0.935	71%	0.712	S	S	*	*			trans	-84.2	72.5	152.7	-88.1	172.2	-50.4	0	0	107.6
517	E	27.5	Very low	29.7	Very low	175 Å²	175	132.9 Å²	132.9	82%	0.818	70%	0.704	S	S	*	*			trans	-172.4	48.9	176.2	-118.7	172.1	-159	0	0	113.2	T515	T515-E517 VanDerWaalsContact C-N 3.26Å; T515-E517 PolarHBondContact O-N 3.19Å
518	L	27.5	Very low	29.5	Very low	109 Å²	109	129.4 Å²	129.4	57%	0.571	69%	0.692	S	S	*	*			trans	-155	65.2	179.2	-102.8	137.7	0	0	0	112.7	T515	T515-L518 HydrophobicContact CG2-CD1 4.35Å
519	I	27.4	Very low	29.5	Very low	178 Å²	178	126.6 Å²	126.6	91%	0.913	68%	0.676	S	S	*	*	S	Bend	trans	-115.8	8.5	166	-64.6	176.6	0	0	0	110.9
520	S	25.4	Very low	29.2	Very low	97 Å²	97	125.1 Å²	125.1	68%	0.678	67%	0.671	S	S	*	*	S	Bend	trans	-127.9	19.9	-170.4	61	0	0	0	0	116.5
521	T	26.3	Very low	29.3	Very low	99 Å²	99	124.1 Å²	124.1	61%	0.607	67%	0.669	S	S	*	*	S	Bend	trans	-169.6	101.5	175.1	35	0	0	0	0	108.1
522	D	28.7	Very low	28.9	Very low	101 Å²	101	123.1 Å²	123.1	54%	0.54	67%	0.665	S	S	.	*			trans	166.8	66.2	148.9	-84.6	-15.3	0	0	0	112.4
523	Q	31.1	Very low	29	Very low	160 Å²	160	121.8 Å²	121.8	75%	0.748	66%	0.657	S	S	*	*	S	Bend	trans	-96	3.1	154.2	-82.9	-176.4	-26.3	0	0	111.9
524	N	30	Very low	29	Very low	89 Å²	89	121 Å²	121	48%	0.476	66%	0.661	S	S	.	*	S	Bend	trans	-95.6	-23.3	-173.2	-74.6	-18	0	0	0	114	K660	N524-K660 WeakPolarHBondContact OD1-CE 3.2Å; N524-K660 PolarHBondContact OD1-NZ 3.48Å
525	N	31.6	Very low	29.1	Very low	84 Å²	84	118.9 Å²	118.9	45%	0.449	66%	0.658	S	S	.	*	S	Bend	trans	-97.9	-17.7	-175.3	-71.3	-20.7	0	0	0	114.6	L527 S528 I529	N525-L527 VanDerWaalsContact C-N 3.35Å; N525-L527 PolarHBondContact O-N 2.87Å; N525-S528 PolarHBondContact O-OG 3.47Å; N525-I529 HydrophobicContact CB-CD1 4.45Å; N525-I529 WeakPolarHBondContact O-CD1 3.08Å; N525-I529 WeakPolarHBondContact O-CG1 3.13Å
526	L	29.9	Very low	29.1	Very low	138 Å²	138	123.9 Å²	123.9	72%	0.723	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-12.5	-178.8	-91.3	150.6	0	0	0	115
527	L	30.4	Very low	29.3	Very low	112 Å²	112	119.7 Å²	119.7	59%	0.586	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-9.7	178.9	-84.7	155.9	0	0	0	113.9	N525	N525-L527 VanDerWaalsContact C-N 3.35Å; N525-L527 PolarHBondContact O-N 2.87Å
528	S	30.6	Very low	29.5	Very low	67 Å²	67	116.4 Å²	116.4	47%	0.469	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.5	-7.2	173.8	51.1	0	0	0	0	113.4	N525	N525-S528 PolarHBondContact O-OG 3.47Å
529	I	31.3	Very low	29.9	Very low	75 Å²	75	119.5 Å²	119.5	39%	0.385	66%	0.655	S	S	.	*	S	Bend	trans	-91.1	-18.8	-176	-79.9	174.1	0	0	0	112.2	N525 S531 L533	N525-I529 HydrophobicContact CB-CD1 4.45Å; N525-I529 WeakPolarHBondContact O-CD1 3.08Å; N525-I529 WeakPolarHBondContact O-CG1 3.13Å; I529-S531 PolarHBondContact O-N 3.41Å; I529-L533 HydrophobicContact CB-CD1 3.85Å; I529-L533 HydrophobicContact CD1-CD1 4.21Å; I529-L533 HydrophobicContact CG1-CD1 3.69Å; I529-L533 HydrophobicContact CG2-CB 4.43Å; I529-L533 HydrophobicContact CG2-CD1 3.31Å; I529-L533 HydrophobicContact CG2-CG 4.45Å
530	S	30	Very low	30.2	Very low	106 Å²	106	116.5 Å²	116.5	74%	0.741	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	5.4	-178.4	64.2	0	0	0	0	115.3
531	S	31.5	Very low	30.6	Very low	111 Å²	111	116 Å²	116	78%	0.776	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.9	4.7	176.8	62.1	0	0	0	0	114.5	I529	I529-S531 PolarHBondContact O-N 3.41Å
532	S	29.8	Very low	30.8	Very low	86 Å²	86	118.3 Å²	118.3	60%	0.601	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.4	-8.3	-174.5	59.5	0	0	0	0	115.8	N534	S532-N534 PolarHBondContact O-N 3Å
533	L	29.4	Very low	30.7	Very low	104 Å²	104	122.7 Å²	122.7	55%	0.545	66%	0.659	S	S	.	*			trans	-101	64.4	-178.5	-86.2	145.1	0	0	0	111.7	I529	I529-L533 HydrophobicContact CB-CD1 3.85Å; I529-L533 HydrophobicContact CD1-CD1 4.21Å; I529-L533 HydrophobicContact CG1-CD1 3.69Å; I529-L533 HydrophobicContact CG2-CB 4.43Å; I529-L533 HydrophobicContact CG2-CD1 3.31Å; I529-L533 HydrophobicContact CG2-CG 4.45Å
534	N	29.5	Very low	30.4	Very low	154 Å²	154	120.4 Å²	120.4	82%	0.824	66%	0.659	S	S	*	*	S	Bend	trans	-89.7	19.8	163.9	-141.6	15.7	0	0	0	111.4	S532	S532-N534 PolarHBondContact O-N 3Å
535	N	28.2	Very low	30.3	Very low	132 Å²	132	126.3 Å²	126.3	71%	0.706	68%	0.681	S	S	*	*	S	Bend	trans	-159	119.4	-177.3	-87.1	-41	0	0	0	111.5
536	R	31.2	Very low	30	Very low	225 Å²	225	129.2 Å²	129.2	85%	0.849	70%	0.697	S	S	*	*			trans	86.1	85.9	156.7	-62.7	179.1	173.8	179.2	-2.9	120.3
537	T	29.2	Very low	29.8	Very low	112 Å²	112	128.1 Å²	128.1	69%	0.687	70%	0.696	S	S	*	*				37.9	128.5	117.3	57.5	0	0	0	0	123.2
538	N	29.8	Very low	29.8	Very low	105 Å²	105	130.2 Å²	130.2	56%	0.561	71%	0.708	S	S	*	*			trans	86.5	123.5	138.5	-60.9	-2.5	0	0	0	121.3
539	I	36.1	Very low	29.6	Very low	174 Å²	174	135.5 Å²	135.5	89%	0.892	73%	0.725	S	S	*	*				173.6	146.6	114.2	-80.1	153.7	0	0	0	112
540	I	35.4	Very low	29.5	Very low	115 Å²	115	139.3 Å²	139.3	59%	0.59	75%	0.745	S	S	*	*			trans	-96.5	165.4	-148.9	-74.1	161.9	0	0	0	117
541	S	32.1	Very low	29.5	Very low	86 Å²	86	142.4 Å²	142.4	60%	0.601	75%	0.747	S	S	*	*			trans	-52.2	161.2	174	61.1	0	0	0	0	120.5
542	N	31.3	Very low	29.2	Very low	149 Å²	149	142.7 Å²	142.7	80%	0.797	75%	0.749	S	S	*	*				156.2	155.3	110.9	-95.2	-29.9	0	0	0	117.3
543	K	26.5	Very low	29.2	Very low	192 Å²	192	145.5 Å²	145.5	84%	0.835	76%	0.756	S	S	*	*			trans	104.3	108.8	152	-77	-177.8	178.7	176.8	0	119.7
544	C	24.3	Very low	29.1	Very low	112 Å²	112	145.5 Å²	145.5	76%	0.757	77%	0.765	S	S	*	*				157.7	116.9	106	-88.2	0	0	0	0	110.5
545	F	29.1	Very low	29.1	Very low	213 Å²	213	145.6 Å²	145.6	93%	0.934	76%	0.762	S	S	*	*			trans	-167.6	123.5	135.1	-106.4	-73.3	0	0	0	109.5
546	N	24.8	Very low	29.1	Very low	145 Å²	145	146.9 Å²	146.9	78%	0.775	77%	0.769	S	S	*	*			trans	-120.2	154.9	171.4	-123.6	8.1	0	0	0	107.3
547	T	26.1	Very low	29.1	Very low	115 Å²	115	145 Å²	145	71%	0.706	77%	0.77	S	S	*	*			trans	70.1	116.4	166.4	64.3	0	0	0	0	114.8
548	D	29.6	Very low	29.3	Very low	156 Å²	156	146.7 Å²	146.7	83%	0.834	77%	0.773	S	S	*	*			cis	-148.3	156.5	47.4	-76.6	-43.4	0	0	0	114.6
549	E	27	Very low	29.2	Very low	178 Å²	178	150.1 Å²	150.1	83%	0.832	79%	0.786	S	S	*	*			trans	-61.7	143.8	-178.2	-58.5	168.2	147.3	0	0	113.7
550	I	29.2	Very low	28.8	Very low	156 Å²	156	149 Å²	149	80%	0.8	78%	0.782	S	S	*	*			trans	-178.6	125.3	134	-87.9	150.9	0	0	0	109.3
551	H	29.2	Very low	28.8	Very low	171 Å²	171	151 Å²	151	79%	0.792	79%	0.794	S	S	*	*			trans	74.3	84.9	169.5	-72.1	-55.6	0	0	0	119.8	I553	H551-I553 PolarHBondContact O-N 3.23Å
552	S	25.9	Very low	29.2	Very low	116 Å²	116	155.6 Å²	155.6	81%	0.811	81%	0.806	S	S	*	*			trans	-52.8	105.3	149.7	42.6	0	0	0	0	113.6
553	I	29.2	Very low	30.3	Very low	145 Å²	145	152.4 Å²	152.4	74%	0.744	79%	0.788	S	S	*	*			trans	-138.4	105.6	149.2	-61.8	-176.7	0	0	0	108	H551	H551-I553 PolarHBondContact O-N 3.23Å
554	S	27.5	Very low	32.1	Very low	105 Å²	105	146.8 Å²	146.8	73%	0.734	77%	0.77	S	S	*	*			trans	40.8	90.7	158.3	66.5	0	0	0	0	119.1
555	M	29.5	Very low	34.2	Very low	155 Å²	155	147.5 Å²	147.5	76%	0.764	77%	0.767	S	S	*	*			trans	-106	37.4	167.5	-88.9	-74.5	-90.5	0	0	113.1	L558	M555-L558 HydrophobicContact SD-CD1 4.13Å
556	N	29	Very low	36.3	Very low	159 Å²	159	142.6 Å²	142.6	85%	0.85	75%	0.747	S	S	*	*	S	Bend	trans	-109.2	21.5	176.1	-78.6	6	0	0	0	114.1
557	H	30.9	Very low	38.8	Very low	187 Å²	187	140.5 Å²	140.5	87%	0.866	73%	0.732	S	S	*	*	S	Bend	trans	-136.3	13.6	-179.5	-93.6	-54.8	0	0	0	116.9
558	L	32.3	Very low	41.3	Very low	146 Å²	146	137.2 Å²	137.2	76%	0.764	71%	0.709	S	S	*	*			trans	-115.8	66.1	-179.3	-84.3	157.5	0	0	0	111.7	M555	M555-L558 HydrophobicContact SD-CD1 4.13Å
559	Q	28.6	Very low	43.6	Very low	177 Å²	177	130.1 Å²	130.1	83%	0.827	67%	0.671	S	S	*	*	S	Bend	trans	-129.5	22.7	176.1	-147.4	165.5	-4.3	0	0	114.1
560	N	27.7	Very low	46.2	Very low	152 Å²	152	122.9 Å²	122.9	81%	0.813	64%	0.639	S	S	*	*	S	Bend	trans	-164.1	100.5	167.7	-87.9	-31.6	0	0	0	107.6
561	D	34.8	Very low	48.8	Very low	157 Å²	157	119.1 Å²	119.1	84%	0.84	62%	0.618	S	S	*	*			trans	-173.8	111.8	152.8	-92.2	-22.4	0	0	0	109.6	L563	D561-L563 PolarHBondContact O-N 3.12Å; D561-L563 VanDerWaalsContact O-N 3.09Å
562	Q	40.6	Very low	51.4	Low	181 Å²	181	111 Å²	111	85%	0.846	58%	0.58	S	S	*	*			trans	-59.4	111.8	167.1	-74.2	-179.5	-32.1	0	0	108.1	T564	Q562-T564 PolarHBondContact O-N 3.4Å
563	L	53.9	Low	54.3	Low	83 Å²	83	105.5 Å²	105.5	44%	0.435	54%	0.541	S	S	.	.			trans	-51.6	117.2	176.4	-143.6	96.5	0	0	0	108.7	D561 Q567 Q568	D561-L563 PolarHBondContact O-N 3.12Å; D561-L563 VanDerWaalsContact O-N 3.09Å; L563-Q567 HydrophobicContact CD2-CB 3.85Å; L563-Q567 HydrophobicContact CG-CB 3.82Å; L563-Q568 HydrophobicContact CB-CG 4.15Å; L563-Q568 HydrophobicContact CD2-CB 4.28Å; L563-Q568 HydrophobicContact CD2-CG 3.48Å; L563-Q568 VanDerWaalsContact CD2-CG 3.48Å; L563-Q568 HydrophobicContact CG-CG 4.35Å
564	T	65.5	Low	57	Low	73 Å²	73	100.2 Å²	100.2	45%	0.448	51%	0.513	S	S	.	.			trans	-60.5	147.6	-177.3	55.1	0	0	0	0	110	Q562 E566 Q567 Q568	Q562-T564 PolarHBondContact O-N 3.4Å; T564-E566 PolarHBondContact O-N 3.38Å; T564-Q567 WeakPolarHBondContact O-CA 3.1Å; T564-Q567 WeakPolarHBondContact O-CB 3.17Å; T564-Q567 PolarHBondContact O-N 2.66Å; T564-Q567 WeakPolarHBondContact OG1-CG 3.39Å; T564-Q568 PolarHBondContact O-N 3.18Å; T564-Q568 VanDerWaalsContact O-N 3.11Å
565	N	69	Low	59.8	Low	128 Å²	128	99.6 Å²	99.6	68%	0.684	50%	0.495	S	S	*	.	H	α-helix	trans	-49.8	-32.1	178.3	-74.4	-23.6	0	0	0	112.4	L569	N565-L569 WeakPolarHBondContact O-CB 3.35Å; N565-L569 PolarHBondContact O-N 3.39Å; N565-L569 VanDerWaalsContact O-N 3.11Å
566	E	73.3	Confident	62.6	Low	110 Å²	110	92.2 Å²	92.2	51%	0.514	46%	0.458	S	S	.	.	H	α-helix	trans	-67.6	-44.5	175.2	-61.6	-168.4	154.7	0	0	112.7	T564 L569 T570	T564-E566 PolarHBondContact O-N 3.38Å; E566-L569 PolarHBondContact O-N 2.99Å; E566-T570 WeakPolarHBondContact O-CG2 3.22Å; E566-T570 PolarHBondContact O-N 3.16Å
567	Q	76.7	Confident	65.4	Low	100 Å²	100	84.8 Å²	84.8	47%	0.467	42%	0.419	S	S	.	.	H	α-helix	trans	-62.6	-44	176.7	-74.3	174.5	-12.6	0	0	111.1	L563 T564 L569 T570 E571	L563-Q567 HydrophobicContact CD2-CB 3.85Å; L563-Q567 HydrophobicContact CG-CB 3.82Å; T564-Q567 WeakPolarHBondContact O-CA 3.1Å; T564-Q567 WeakPolarHBondContact O-CB 3.17Å; T564-Q567 PolarHBondContact O-N 2.66Å; T564-Q567 WeakPolarHBondContact OG1-CG 3.39Å; Q567-L569 VanDerWaalsContact C-N 3.28Å; Q567-L569 PolarHBondContact O-N 3.4Å; Q567-T570 PolarHBondContact O-N 3Å; Q567-T570 PolarHBondContact O-OG1 2.44Å; Q567-E571 PolarHBondContact O-N 3.22Å; Q567-E571 VanDerWaalsContact O-N 3.11Å
568	Q	77.3	Confident	68.1	Low	47 Å²	47	78.7 Å²	78.7	22%	0.22	39%	0.392	C	S	.	.	H	α-helix	trans	-59.4	-40.9	176	-66.6	-174.9	-8.9	0	0	111.6	L563 T564 E571 C572	L563-Q568 HydrophobicContact CB-CG 4.15Å; L563-Q568 HydrophobicContact CD2-CB 4.28Å; L563-Q568 HydrophobicContact CD2-CG 3.48Å; L563-Q568 VanDerWaalsContact CD2-CG 3.48Å; L563-Q568 HydrophobicContact CG-CG 4.35Å; T564-Q568 PolarHBondContact O-N 3.18Å; T564-Q568 VanDerWaalsContact O-N 3.11Å; Q568-E571 PolarHBondContact O-N 3.11Å; Q568-C572 PolarHBondContact O-N 3.12Å; Q568-C572 PolarHBondContact O-SG 2.85Å
569	L	78.4	Confident	70.6	Confident	7 Å²	7	73.3 Å²	73.3	4%	0.037	36%	0.363	C	S	.	.	H	α-helix	trans	-70.3	-38.8	178.7	-169.4	68.7	0	0	0	112.3	V25 W485 N565 E566 Q567 E571 C572 L573 I633 L637	V25-L569 HydrophobicContact CG1-CD2 4.15Å; V25-L569 HydrophobicContact CG2-CD2 4.42Å; V25-L569 HydrophobicContact CG2-CG 4.42Å; W485-L569 HydrophobicContact CH2-CD1 3.55Å; W485-L569 HydrophobicContact CH2-CG 4.44Å; W485-L569 HydrophobicContact CZ2-CD1 3.78Å; N565-L569 WeakPolarHBondContact O-CB 3.35Å; N565-L569 PolarHBondContact O-N 3.39Å; N565-L569 VanDerWaalsContact O-N 3.11Å; E566-L569 PolarHBondContact O-N 2.99Å; Q567-L569 VanDerWaalsContact C-N 3.28Å; Q567-L569 PolarHBondContact O-N 3.4Å; L569-E571 PolarHBondContact O-N 3.17Å; L569-C572 WeakPolarHBondContact O-CB 3.37Å; L569-C572 PolarHBondContact O-N 3.4Å; L569-L573 WeakPolarHBondContact O-CB 3.46Å; L569-L573 PolarHBondContact O-N 3.01Å; L569-I633 HydrophobicContact CD2-CG2 4.1Å; L569-L637 HydrophobicContact CD2-CD1 3.6Å; L569-L637 HydrophobicContact CD2-CD2 3.89Å; L569-L637 HydrophobicContact CD2-CG 3.84Å
570	T	82.5	Confident	73.4	Confident	26 Å²	26	64.9 Å²	64.9	16%	0.16	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-35.2	177.1	66.2	0	0	0	0	111.6	R22 V25 E566 Q567 Y574	R22-T570 HydrophobicContact CG-CG2 4.42Å; V25-T570 HydrophobicContact CB-CG2 3.78Å; V25-T570 HydrophobicContact CG1-CG2 3.9Å; V25-T570 HydrophobicContact CG2-CG2 3.89Å; E566-T570 WeakPolarHBondContact O-CG2 3.22Å; E566-T570 PolarHBondContact O-N 3.16Å; Q567-T570 PolarHBondContact O-N 3Å; Q567-T570 PolarHBondContact O-OG1 2.44Å; T570-Y574 WeakPolarHBondContact O-CB 3.45Å; T570-Y574 PolarHBondContact O-N 3.42Å
571	E	83.8	Confident	76.3	Confident	77 Å²	77	59.5 Å²	59.5	36%	0.36	30%	0.295	S	S	.	.	H	α-helix	trans	-77	-38.2	178.8	-159	172.6	-136.3	0	0	111.9	Q567 Q568 L569 Y575	Q567-E571 PolarHBondContact O-N 3.22Å; Q567-E571 VanDerWaalsContact O-N 3.11Å; Q568-E571 PolarHBondContact O-N 3.11Å; L569-E571 PolarHBondContact O-N 3.17Å; E571-Y575 WeakPolarHBondContact O-CB 3.06Å; E571-Y575 PolarHBondContact O-N 3.46Å
572	C	84.2	Confident	78.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-54.5	-55.7	166.9	-68.6	0	0	0	0	110.8	W485 R489 L492 Q568 L569 Y574 Y575 T576	W485-C572 HydrophobicContact CH2-CB 4.43Å; W485-C572 HydrophobicContact CZ3-CB 4.38Å; R489-C572 VanDerWaalsContact CD-SG 3.53Å; L492-C572 HydrophobicContact CD1-CB 4.5Å; L492-C572 WeakPolarHBondContact CD1-SG 3.24Å; Q568-C572 PolarHBondContact O-N 3.12Å; Q568-C572 PolarHBondContact O-SG 2.85Å; L569-C572 WeakPolarHBondContact O-CB 3.37Å; L569-C572 PolarHBondContact O-N 3.4Å; C572-Y574 PolarHBondContact O-N 3.25Å; C572-Y575 PolarHBondContact O-N 3.07Å; C572-T576 VanDerWaalsContact O-CG2 3.22Å; C572-T576 WeakPolarHBondContact O-CG2 3.46Å; C572-T576 PolarHBondContact O-N 3.19Å; C572-T576 PolarHBondContact O-OG1 3.31Å
573	L	85.3	Confident	81.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-44	-175.2	-176	70.2	0	0	0	111.4	L24 V25 W485 L569 Y575 T576 L577 I629 I633	L24-L573 HydrophobicContact CB-CD2 4.01Å; L24-L573 HydrophobicContact CD1-CD2 4.31Å; V25-L573 HydrophobicContact CG2-CD2 3.73Å; W485-L573 HydrophobicContact CZ3-CB 3.99Å; W485-L573 HydrophobicContact CZ3-CD1 3.72Å; W485-L573 HydrophobicContact CZ3-CG 4.48Å; L569-L573 WeakPolarHBondContact O-CB 3.46Å; L569-L573 PolarHBondContact O-N 3.01Å; L573-Y575 PolarHBondContact O-N 3.17Å; L573-T576 VanDerWaalsContact CA-OG1 3.31Å; L573-T576 WeakPolarHBondContact CA-OG1 3.4Å; L573-T576 PolarHBondContact O-N 2.99Å; L573-T576 PolarHBondContact O-OG1 3.49Å; L573-L577 HydrophobicContact CD1-CD1 4.14Å; L573-L577 HydrophobicContact CD1-CG 4.16Å; L573-L577 HydrophobicContact CD2-CD1 4.28Å; L573-L577 HydrophobicContact CG-CD1 3.76Å; L573-L577 HydrophobicContact CG-CG 4.2Å; L573-L577 WeakPolarHBondContact O-CB 3.39Å; L573-L577 WeakPolarHBondContact O-CG 3.34Å; L573-L577 PolarHBondContact O-N 3.17Å; L573-I629 HydrophobicContact CD1-CG2 4.03Å; L573-I633 HydrophobicContact CD1-CD1 3.92Å; L573-I633 HydrophobicContact CD1-CG1 4.34Å; L573-I633 HydrophobicContact CD2-CD1 3.64Å; L573-I633 HydrophobicContact CG-CD1 4.42Å
574	Y	86.8	Confident	82.8	Confident	35 Å²	35	42 Å²	42	14%	0.137	21%	0.21	C	C	.	.	H	α-helix	trans	-56	-50.6	175.5	171.6	-104.4	0	0	0	111.6	L14 L17 R18 T570 C572 T576 L577 L578	L14-Y574 VanDerWaalsContact CD2-OH 3.31Å; L14-Y574 WeakPolarHBondContact CD2-OH 3.16Å; L14-Y574 WeakPolarHBondContact CG-OH 3.28Å; L17-Y574 HydrophobicContact CB-CE2 4.16Å; L17-Y574 HydrophobicContact CD2-CD2 4.18Å; L17-Y574 HydrophobicContact CD2-CE2 3.96Å; L17-Y574 HydrophobicContact CG-CD2 4.28Å; L17-Y574 HydrophobicContact CG-CE2 4.25Å; R18-Y574 HydrophobicContact CB-CD2 3.78Å; R18-Y574 HydrophobicContact CB-CE2 3.73Å; R18-Y574 HydrophobicContact CG-CD2 4.05Å; R18-Y574 HydrophobicContact CG-CE2 4.29Å; R18-Y574 HydrophobicContact CG-CG 4.39Å; T570-Y574 WeakPolarHBondContact O-CB 3.45Å; T570-Y574 PolarHBondContact O-N 3.42Å; C572-Y574 PolarHBondContact O-N 3.25Å; Y574-T576 VanDerWaalsContact C-N 3.33Å; Y574-T576 PolarHBondContact O-N 3.14Å; Y574-L577 PolarHBondContact O-N 3.46Å; Y574-L578 HydrophobicContact CE1-CD2 4.45Å; Y574-L578 WeakPolarHBondContact O-CB 3.42Å; Y574-L578 PolarHBondContact O-N 3.31Å
575	Y	86.7	Confident	84	Confident	91 Å²	91	40.5 Å²	40.5	36%	0.357	20%	0.201	S	C	.	.	H	α-helix	trans	-60.4	-44	178.5	-177.2	-88.2	0	0	0	111.5	I484 K488 E571 C572 L573 L578 H579	I484-Y575 HydrophobicContact CG2-CE1 4.4Å; K488-Y575 HydrophobicContact CB-CD1 3.83Å; K488-Y575 HydrophobicContact CB-CE1 4.23Å; K488-Y575 HydrophobicContact CD-CD1 3.78Å; K488-Y575 HydrophobicContact CD-CD2 4.34Å; K488-Y575 HydrophobicContact CD-CE1 4.17Å; K488-Y575 HydrophobicContact CD-CG 3.88Å; K488-Y575 HydrophobicContact CG-CD1 3.7Å; K488-Y575 HydrophobicContact CG-CE1 4.38Å; K488-Y575 HydrophobicContact CG-CG 4.03Å; E571-Y575 WeakPolarHBondContact O-CB 3.06Å; E571-Y575 PolarHBondContact O-N 3.46Å; C572-Y575 PolarHBondContact O-N 3.07Å; L573-Y575 PolarHBondContact O-N 3.17Å; Y575-L578 PolarHBondContact O-N 3.49Å; Y575-H579 AromaticContact CD2-CD2 3.95Å; Y575-H579 AromaticContact CD2-NE2 3.94Å; Y575-H579 AromaticContact CE1-CD2 3.75Å; Y575-H579 AromaticContact CE2-CD2 3.68Å; Y575-H579 AromaticContact CE2-NE2 3.44Å; Y575-H579 WeakPolarHBondContact CE2-NE2 3.45Å; Y575-H579 AromaticContact CZ-CD2 3.56Å; Y575-H579 AromaticContact CZ-NE2 3.64Å; Y575-H579 PolarHBondContact O-CD2 2.83Å; Y575-H579 VanDerWaalsContact O-CD2 3.26Å; Y575-H579 PolarHBondContact O-N 2.91Å
576	T	87.5	Confident	85	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68	-41.1	-177.8	55.8	0	0	0	0	112.2	I484 W485 C572 L573 Y574 H579 A580	I484-T576 HydrophobicContact CG2-CG2 4.13Å; W485-T576 VanDerWaalsContact CA-CG2 3.45Å; W485-T576 HydrophobicContact CB-CG2 4.05Å; W485-T576 HydrophobicContact CD2-CG2 4.42Å; W485-T576 HydrophobicContact CE3-CG2 3.77Å; C572-T576 VanDerWaalsContact O-CG2 3.22Å; C572-T576 WeakPolarHBondContact O-CG2 3.46Å; C572-T576 PolarHBondContact O-N 3.19Å; C572-T576 PolarHBondContact O-OG1 3.31Å; L573-T576 VanDerWaalsContact CA-OG1 3.31Å; L573-T576 WeakPolarHBondContact CA-OG1 3.4Å; L573-T576 PolarHBondContact O-N 2.99Å; L573-T576 PolarHBondContact O-OG1 3.49Å; Y574-T576 VanDerWaalsContact C-N 3.33Å; Y574-T576 PolarHBondContact O-N 3.14Å; T576-H579 PolarHBondContact O-N 3.45Å; T576-A580 WeakPolarHBondContact O-CB 3.28Å; T576-A580 PolarHBondContact O-N 3.48Å
577	L	86.9	Confident	85.8	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-65.8	-40.6	177.5	-68.2	171.2	0	0	0	111.1	L17 L24 F481 L573 Y574 H579 I581 I629	L17-L577 HydrophobicContact CD1-CB 4.47Å; L24-L577 HydrophobicContact CD1-CD1 4.24Å; F481-L577 HydrophobicContact CE2-CD2 4.2Å; L573-L577 HydrophobicContact CD1-CD1 4.14Å; L573-L577 HydrophobicContact CD1-CG 4.16Å; L573-L577 HydrophobicContact CD2-CD1 4.28Å; L573-L577 HydrophobicContact CG-CD1 3.76Å; L573-L577 HydrophobicContact CG-CG 4.2Å; L573-L577 WeakPolarHBondContact O-CB 3.39Å; L573-L577 WeakPolarHBondContact O-CG 3.34Å; L573-L577 PolarHBondContact O-N 3.17Å; Y574-L577 PolarHBondContact O-N 3.46Å; L577-H579 VanDerWaalsContact C-N 3.32Å; L577-H579 PolarHBondContact O-N 3.41Å; L577-I581 HydrophobicContact CB-CD1 4.05Å; L577-I581 HydrophobicContact CD2-CD1 3.54Å; L577-I581 HydrophobicContact CD2-CG1 4.15Å; L577-I581 HydrophobicContact CG-CD1 4.34Å; L577-I581 WeakPolarHBondContact O-CB 3.44Å; L577-I581 PolarHBondContact O-N 3.05Å; L577-I581 VanDerWaalsContact O-N 3.14Å; L577-I629 HydrophobicContact CD2-CD1 3.88Å; L577-I629 HydrophobicContact CD2-CG2 4.39Å
578	L	87.9	Confident	86.6	Confident	58 Å²	58	26 Å²	26	30%	0.304	13%	0.131	S	C	.	.	H	α-helix	trans	-61	-39.1	-179.7	-174.8	68.5	0	0	0	112.4	L17 Y574 Y575 P582	L17-L578 HydrophobicContact CD2-CB 3.88Å; L17-L578 HydrophobicContact CD2-CD1 3.75Å; L17-L578 HydrophobicContact CD2-CG 4.44Å; Y574-L578 HydrophobicContact CE1-CD2 4.45Å; Y574-L578 WeakPolarHBondContact O-CB 3.42Å; Y574-L578 PolarHBondContact O-N 3.31Å; Y575-L578 PolarHBondContact O-N 3.49Å; L578-P582 VanDerWaalsContact O-CD 3.3Å; L578-P582 WeakPolarHBondContact O-CD 3.36Å; L578-P582 WeakPolarHBondContact O-CG 3.19Å
579	H	84.5	Confident	87.3	Confident	34 Å²	34	27.7 Å²	27.7	16%	0.157	14%	0.14	C	C	.	.	H	α-helix	trans	-94.2	-32	-178	-67.7	-74.5	0	0	0	113.9	I484 Y575 T576 L577 Y1050 D1054	I484-H579 HydrophobicContact CD1-CB 4.44Å; I484-H579 HydrophobicContact CG2-CB 4.39Å; Y575-H579 AromaticContact CD2-CD2 3.95Å; Y575-H579 AromaticContact CD2-NE2 3.94Å; Y575-H579 AromaticContact CE1-CD2 3.75Å; Y575-H579 AromaticContact CE2-CD2 3.68Å; Y575-H579 AromaticContact CE2-NE2 3.44Å; Y575-H579 WeakPolarHBondContact CE2-NE2 3.45Å; Y575-H579 AromaticContact CZ-CD2 3.56Å; Y575-H579 AromaticContact CZ-NE2 3.64Å; Y575-H579 PolarHBondContact O-CD2 2.83Å; Y575-H579 VanDerWaalsContact O-CD2 3.26Å; Y575-H579 PolarHBondContact O-N 2.91Å; T576-H579 PolarHBondContact O-N 3.45Å; L577-H579 VanDerWaalsContact C-N 3.32Å; L577-H579 PolarHBondContact O-N 3.41Å; H579-Y1050 WeakPolarHBondContact O-CE1 3.27Å; H579-D1054 IonicContact CE1-OD2 3.04Å; H579-D1054 PolarHBondContact CE1-OD2 3.03Å; H579-D1054 IonicContact ND1-OD2 3.06Å; H579-D1054 PolarHBondContact ND1-OD2 3.27Å
580	A	87.7	Confident	87.9	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-82.2	-46.4	-177	0	0	0	0	0	112.9	F481 I484 T576 S583 M584	F481-A580 HydrophobicContact CD2-CB 3.89Å; I484-A580 HydrophobicContact CD1-CB 3.84Å; T576-A580 WeakPolarHBondContact O-CB 3.28Å; T576-A580 PolarHBondContact O-N 3.48Å; A580-S583 PolarHBondContact O-N 2.98Å; A580-S583 VanDerWaalsContact O-N 3.16Å; A580-M584 HydrophobicContact CB-CE 3.93Å; A580-M584 WeakPolarHBondContact O-CG 3.31Å; A580-M584 PolarHBondContact O-N 3.01Å
581	I	88.9	Confident	88.3	Confident	39 Å²	39	26.7 Å²	26.7	20%	0.2	13%	0.134	C	C	.	.	H	α-helix	trans	-59.1	-49.5	-172.5	-69.4	177.9	0	0	0	112.2	L577 S583 M584 T585	L577-I581 HydrophobicContact CB-CD1 4.05Å; L577-I581 HydrophobicContact CD2-CD1 3.54Å; L577-I581 HydrophobicContact CD2-CG1 4.15Å; L577-I581 HydrophobicContact CG-CD1 4.34Å; L577-I581 WeakPolarHBondContact O-CB 3.44Å; L577-I581 PolarHBondContact O-N 3.05Å; L577-I581 VanDerWaalsContact O-N 3.14Å; I581-S583 PolarHBondContact O-N 3.47Å; I581-M584 HydrophobicContact CG1-CE 4.06Å; I581-M584 PolarHBondContact O-N 3.46Å; I581-T585 HydrophobicContact CG2-CG2 3.94Å; I581-T585 WeakPolarHBondContact O-CG2 3.33Å; I581-T585 PolarHBondContact O-N 2.89Å; I581-T585 PolarHBondContact O-OG1 3.35Å; I581-T585 VanDerWaalsContact O-OG1 3.08Å
582	P	88.1	Confident	88.8	Confident	48 Å²	48	24.3 Å²	24.3	31%	0.312	12%	0.124	S	C	.	.	H	α-helix	trans	-59.4	-34.9	180	-25.8	36.4	0	0	0	112.9	L578 T585 L586 Y1050	L578-P582 VanDerWaalsContact O-CD 3.3Å; L578-P582 WeakPolarHBondContact O-CD 3.36Å; L578-P582 WeakPolarHBondContact O-CG 3.19Å; P582-T585 VanDerWaalsContact C-OG1 3.26Å; P582-T585 VanDerWaalsContact CA-OG1 3.28Å; P582-T585 WeakPolarHBondContact CA-OG1 3.34Å; P582-T585 PolarHBondContact O-OG1 2.98Å; P582-L586 WeakPolarHBondContact O-CB 3.27Å; P582-L586 PolarHBondContact O-N 2.71Å; P582-Y1050 HydrophobicContact CB-CE2 4.22Å
583	S	87.9	Confident	89.2	Confident	4 Å²	4	26 Å²	26	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-70.7	-44.9	178.1	-160.8	0	0	0	0	111.8	A580 I581 L586 T587 H1047	A580-S583 PolarHBondContact O-N 2.98Å; A580-S583 VanDerWaalsContact O-N 3.16Å; I581-S583 PolarHBondContact O-N 3.47Å; S583-L586 PolarHBondContact O-N 3.29Å; S583-T587 PolarHBondContact O-N 3.22Å; S583-T587 PolarHBondContact O-OG1 2.93Å; S583-H1047 PolarHBondContact OG-CE1 3.39Å; S583-H1047 VanDerWaalsContact OG-CE1 3.3Å; S583-H1047 PolarHBondContact OG-ND1 2.95Å
584	M	90.2	Very high	89.3	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-69.5	-37.3	178.3	-63.9	-178.8	-59.8	0	0	112.6	D477 F481 A580 I581 L586 T587 T588 Y621	D477-M584 HydrophobicContact CB-CB 4.47Å; D477-M584 HydrophobicContact CB-CG 4.03Å; D477-M584 HydrophobicContact CB-SD 3.82Å; F481-M584 HydrophobicContact CB-SD 4.07Å; F481-M584 HydrophobicContact CD2-CE 4.19Å; A580-M584 HydrophobicContact CB-CE 3.93Å; A580-M584 WeakPolarHBondContact O-CG 3.31Å; A580-M584 PolarHBondContact O-N 3.01Å; I581-M584 HydrophobicContact CG1-CE 4.06Å; I581-M584 PolarHBondContact O-N 3.46Å; M584-L586 PolarHBondContact O-N 2.88Å; M584-T587 PolarHBondContact O-OG1 3.49Å; M584-T588 WeakPolarHBondContact O-CB 3.09Å; M584-T588 VanDerWaalsContact O-CG2 3.31Å; M584-T588 WeakPolarHBondContact O-CG2 3.33Å; M584-T588 PolarHBondContact O-N 3.45Å; M584-T588 VanDerWaalsContact O-N 3.17Å; M584-T588 PolarHBondContact O-OG1 3.26Å; M584-Y621 HydrophobicContact CB-CE2 4.27Å
585	T	90.9	Very high	89.6	Confident	42 Å²	42	24.7 Å²	24.7	26%	0.258	13%	0.131	S	C	.	.	H	α-helix	trans	-59.7	-30.7	174.7	45.8	0	0	0	0	112.2	I581 P582 T588 I589 Y621	I581-T585 HydrophobicContact CG2-CG2 3.94Å; I581-T585 WeakPolarHBondContact O-CG2 3.33Å; I581-T585 PolarHBondContact O-N 2.89Å; I581-T585 PolarHBondContact O-OG1 3.35Å; I581-T585 VanDerWaalsContact O-OG1 3.08Å; P582-T585 VanDerWaalsContact C-OG1 3.26Å; P582-T585 VanDerWaalsContact CA-OG1 3.28Å; P582-T585 WeakPolarHBondContact CA-OG1 3.34Å; P582-T585 PolarHBondContact O-OG1 2.98Å; T585-T588 VanDerWaalsContact CA-OG1 3.3Å; T585-T588 WeakPolarHBondContact CA-OG1 3.49Å; T585-T588 PolarHBondContact O-OG1 3.37Å; T585-I589 WeakPolarHBondContact O-CB 3.26Å; T585-I589 VanDerWaalsContact O-CD1 3.28Å; T585-I589 WeakPolarHBondContact O-CD1 3.2Å; T585-I589 WeakPolarHBondContact O-CG1 3.36Å; T585-I589 PolarHBondContact O-N 3.36Å; T585-Y621 HydrophobicContact CG2-CE2 4.27Å; T585-Y621 WeakPolarHBondContact CG2-OH 3.44Å
586	L	90.1	Very high	89.9	Confident	20 Å²	20	23.7 Å²	23.7	11%	0.105	13%	0.132	C	C	.	.	H	α-helix	trans	-89	-37.8	-168.6	177.7	74.1	0	0	0	111.8	P582 S583 M584 T588 I589 S590 L989 I993 I1046	P582-L586 WeakPolarHBondContact O-CB 3.27Å; P582-L586 PolarHBondContact O-N 2.71Å; S583-L586 PolarHBondContact O-N 3.29Å; M584-L586 PolarHBondContact O-N 2.88Å; L586-T588 VanDerWaalsContact C-N 3.34Å; L586-I589 PolarHBondContact O-N 2.92Å; L586-S590 VanDerWaalsContact O-CB 3.31Å; L586-S590 WeakPolarHBondContact O-CB 3.25Å; L586-S590 PolarHBondContact O-N 3.22Å; L586-L989 HydrophobicContact CD1-CB 4.38Å; L586-L989 HydrophobicContact CD1-CD2 3.96Å; L586-I993 HydrophobicContact CD1-CD1 3.84Å; L586-I993 HydrophobicContact CD1-CG1 4.08Å; L586-I993 HydrophobicContact CD2-CD1 2.98Å; L586-I993 HydrophobicContact CD2-CG1 3.5Å; L586-I993 HydrophobicContact CG-CD1 3.85Å; L586-I993 HydrophobicContact CG-CG1 4.39Å; L586-I1046 HydrophobicContact CB-CG2 4.35Å; L586-I1046 HydrophobicContact CD2-CB 4.31Å; L586-I1046 HydrophobicContact CD2-CG1 4.22Å; L586-I1046 HydrophobicContact CD2-CG2 3.27Å; L586-I1046 HydrophobicContact CG-CD1 4.25Å; L586-I1046 HydrophobicContact CG-CG1 4.46Å; L586-I1046 HydrophobicContact CG-CG2 3.88Å
587	T	90.4	Very high	90.1	Very high	3 Å²	3	24 Å²	24	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-61.4	-45.2	168.4	49.5	0	0	0	0	110.2	D477 S583 M584 I589 S590 T591 D1043 I1046 H1047	D477-T587 PolarHBondContact OD1-OG1 2.99Å; S583-T587 PolarHBondContact O-N 3.22Å; S583-T587 PolarHBondContact O-OG1 2.93Å; M584-T587 PolarHBondContact O-OG1 3.49Å; T587-I589 PolarHBondContact O-N 3.5Å; T587-S590 WeakPolarHBondContact O-CB 3.4Å; T587-S590 PolarHBondContact O-N 3.06Å; T587-T591 WeakPolarHBondContact O-CG2 3.47Å; T587-T591 PolarHBondContact O-N 3.48Å; T587-T591 PolarHBondContact O-OG1 2.68Å; T587-T591 VanDerWaalsContact O-OG1 3.1Å; T587-D1043 WeakPolarHBondContact CB-OD1 3.41Å; T587-D1043 HydrophobicContact CG2-CB 4.1Å; T587-I1046 HydrophobicContact CG2-CB 4.39Å; T587-I1046 HydrophobicContact CG2-CG2 3.8Å; T587-H1047 WeakPolarHBondContact CG2-NE2 3.41Å
588	T	92.1	Very high	90.4	Very high	11 Å²	11	23.8 Å²	23.8	7%	0.067	13%	0.133	C	C	.	.	H	α-helix	trans	-63.2	-42.4	175.1	52.1	0	0	0	0	112.7	M584 T585 L586 S590 T591 I592 Y621	M584-T588 WeakPolarHBondContact O-CB 3.09Å; M584-T588 VanDerWaalsContact O-CG2 3.31Å; M584-T588 WeakPolarHBondContact O-CG2 3.33Å; M584-T588 PolarHBondContact O-N 3.45Å; M584-T588 VanDerWaalsContact O-N 3.17Å; M584-T588 PolarHBondContact O-OG1 3.26Å; T585-T588 VanDerWaalsContact CA-OG1 3.3Å; T585-T588 WeakPolarHBondContact CA-OG1 3.49Å; T585-T588 PolarHBondContact O-OG1 3.37Å; L586-T588 VanDerWaalsContact C-N 3.34Å; T588-S590 VanDerWaalsContact C-N 3.34Å; T588-S590 PolarHBondContact O-N 3.26Å; T588-T591 WeakPolarHBondContact CA-OG1 3.47Å; T588-T591 PolarHBondContact O-OG1 3.31Å; T588-I592 WeakPolarHBondContact O-CB 3.38Å; T588-I592 WeakPolarHBondContact O-CD1 3.46Å; T588-I592 WeakPolarHBondContact O-CG1 3.39Å; T588-I592 PolarHBondContact O-N 2.94Å; T588-Y621 HydrophobicContact CG2-CD2 3.73Å; T588-Y621 HydrophobicContact CG2-CG 4.04Å
589	I	92.1	Very high	90.6	Very high	82 Å²	82	24 Å²	24	42%	0.421	13%	0.134	S	C	.	.	H	α-helix	trans	-62	-42.2	172.6	-74.7	165.1	0	0	0	111.3	T585 L586 T587 C593 L989	T585-I589 WeakPolarHBondContact O-CB 3.26Å; T585-I589 VanDerWaalsContact O-CD1 3.28Å; T585-I589 WeakPolarHBondContact O-CD1 3.2Å; T585-I589 WeakPolarHBondContact O-CG1 3.36Å; T585-I589 PolarHBondContact O-N 3.36Å; L586-I589 PolarHBondContact O-N 2.92Å; T587-I589 PolarHBondContact O-N 3.5Å; I589-C593 VanDerWaalsContact O-CB 3.29Å; I589-C593 WeakPolarHBondContact O-CB 3.32Å; I589-C593 PolarHBondContact O-N 3.48Å; I589-C593 PolarHBondContact O-SG 2.9Å; I589-L989 HydrophobicContact CG2-CD1 4.48Å; I589-L989 HydrophobicContact CG2-CD2 4.25Å
590	S	91.6	Very high	90.8	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-61.5	-48.4	179.3	-178.2	0	0	0	0	112.1	L586 T587 T588 C593 G594 I1042	L586-S590 VanDerWaalsContact O-CB 3.31Å; L586-S590 WeakPolarHBondContact O-CB 3.25Å; L586-S590 PolarHBondContact O-N 3.22Å; T587-S590 WeakPolarHBondContact O-CB 3.4Å; T587-S590 PolarHBondContact O-N 3.06Å; T588-S590 VanDerWaalsContact C-N 3.34Å; T588-S590 PolarHBondContact O-N 3.26Å; S590-C593 PolarHBondContact O-N 3.41Å; S590-G594 PolarHBondContact O-N 2.69Å; S590-I1042 WeakPolarHBondContact OG-CG2 3.22Å
591	T	91.4	Very high	91	Very high	8 Å²	8	30 Å²	30	5%	0.049	16%	0.16	C	C	.	.	H	α-helix	trans	-63.9	-44.5	178.6	52.9	0	0	0	0	111.8	T587 T588 G594 L595 G1039 L1040	T587-T591 WeakPolarHBondContact O-CG2 3.47Å; T587-T591 PolarHBondContact O-N 3.48Å; T587-T591 PolarHBondContact O-OG1 2.68Å; T587-T591 VanDerWaalsContact O-OG1 3.1Å; T588-T591 WeakPolarHBondContact CA-OG1 3.47Å; T588-T591 PolarHBondContact O-OG1 3.31Å; T591-G594 PolarHBondContact O-N 3.33Å; T591-L595 PolarHBondContact O-N 2.83Å; T591-G1039 WeakPolarHBondContact CG2-O 3.39Å; T591-L1040 HydrophobicContact CG2-CD2 4.07Å
592	I	93.5	Very high	91.1	Very high	28 Å²	28	29.2 Å²	29.2	14%	0.144	16%	0.158	C	C	.	.	H	α-helix	trans	-62.8	-44.8	175.4	-68.4	163.6	0	0	0	111.1	T588 G594 L595 L596 I617 I618	T588-I592 WeakPolarHBondContact O-CB 3.38Å; T588-I592 WeakPolarHBondContact O-CD1 3.46Å; T588-I592 WeakPolarHBondContact O-CG1 3.39Å; T588-I592 PolarHBondContact O-N 2.94Å; I592-G594 VanDerWaalsContact C-N 3.33Å; I592-G594 PolarHBondContact O-N 3.27Å; I592-L595 WeakPolarHBondContact O-CB 3.2Å; I592-L595 PolarHBondContact O-N 3.07Å; I592-L596 HydrophobicContact CG2-CD1 3.63Å; I592-L596 HydrophobicContact CG2-CG 4.02Å; I592-L596 WeakPolarHBondContact O-CB 3.38Å; I592-L596 VanDerWaalsContact O-CG 3.29Å; I592-L596 WeakPolarHBondContact O-CG 3.43Å; I592-L596 PolarHBondContact O-N 3.02Å; I592-I617 HydrophobicContact CD1-CG2 4.27Å; I592-I617 HydrophobicContact CG1-CB 4.39Å; I592-I617 HydrophobicContact CG1-CG2 3.98Å; I592-I618 HydrophobicContact CD1-CD1 4.15Å; I592-I618 HydrophobicContact CD1-CG1 3.41Å; I592-I618 VanDerWaalsContact CD1-CG1 3.41Å; I592-I618 HydrophobicContact CG1-CG1 4.31Å
593	C	91.8	Very high	91.2	Very high	35 Å²	35	26.9 Å²	26.9	24%	0.236	14%	0.143	C	C	.	.	H	α-helix	trans	-62.4	-42.9	178.1	-71.1	0	0	0	0	111.2	I589 S590 L595 L596 V597 I985	I589-C593 VanDerWaalsContact O-CB 3.29Å; I589-C593 WeakPolarHBondContact O-CB 3.32Å; I589-C593 PolarHBondContact O-N 3.48Å; I589-C593 PolarHBondContact O-SG 2.9Å; S590-C593 PolarHBondContact O-N 3.41Å; C593-L595 VanDerWaalsContact C-N 3.3Å; C593-L595 PolarHBondContact O-N 3.4Å; C593-L596 PolarHBondContact O-N 2.98Å; C593-V597 WeakPolarHBondContact O-CG2 3.44Å; C593-V597 PolarHBondContact O-N 3.4Å; C593-I985 HydrophobicContact CB-CD1 4.24Å; C593-I985 HydrophobicContact CB-CG2 3.72Å
594	G	89.2	Confident	91.3	Very high	4 Å²	4	26.9 Å²	26.9	4%	0.041	14%	0.142	C	C	.	.	H	α-helix	trans	-59.5	-39.5	174.2	0	0	0	0	0	112.8	S590 T591 I592	S590-G594 PolarHBondContact O-N 2.69Å; T591-G594 PolarHBondContact O-N 3.33Å; I592-G594 VanDerWaalsContact C-N 3.33Å; I592-G594 PolarHBondContact O-N 3.27Å
595	L	92.3	Very high	91.3	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-64.3	-52.7	173.4	-81.1	159.3	0	0	0	111.9	T591 I592 C593 V597 N598 F609 T610 A613 I617 L1036	T591-L595 PolarHBondContact O-N 2.83Å; I592-L595 WeakPolarHBondContact O-CB 3.2Å; I592-L595 PolarHBondContact O-N 3.07Å; C593-L595 VanDerWaalsContact C-N 3.3Å; C593-L595 PolarHBondContact O-N 3.4Å; L595-V597 PolarHBondContact O-N 3.47Å; L595-V597 VanDerWaalsContact O-N 3.09Å; L595-N598 WeakPolarHBondContact O-CB 3.49Å; L595-N598 PolarHBondContact O-N 3.3Å; L595-N598 PolarHBondContact O-ND2 3.41Å; L595-F609 HydrophobicContact CD2-CE1 3.81Å; L595-F609 HydrophobicContact CD2-CZ 4.41Å; L595-T610 HydrophobicContact CB-CG2 4.44Å; L595-T610 WeakPolarHBondContact O-CG2 3.1Å; L595-A613 HydrophobicContact CD1-CB 4.31Å; L595-A613 HydrophobicContact CD2-CB 3.94Å; L595-I617 HydrophobicContact CD1-CD1 3.33Å; L595-L1036 HydrophobicContact CB-CD2 4.17Å; L595-L1036 HydrophobicContact CD2-CD1 4.14Å; L595-L1036 HydrophobicContact CD2-CD2 3.24Å; L595-L1036 HydrophobicContact CD2-CG 4.33Å; L595-L1036 HydrophobicContact CG-CD2 3.55Å
596	L	93.4	Very high	91.3	Very high	70 Å²	70	25 Å²	25	37%	0.366	13%	0.131	S	C	.	.	H	α-helix	trans	-61.2	-23.5	-171.5	-73.3	173.7	0	0	0	114.1	I592 C593 N598 L599	I592-L596 HydrophobicContact CG2-CD1 3.63Å; I592-L596 HydrophobicContact CG2-CG 4.02Å; I592-L596 WeakPolarHBondContact O-CB 3.38Å; I592-L596 VanDerWaalsContact O-CG 3.29Å; I592-L596 WeakPolarHBondContact O-CG 3.43Å; I592-L596 PolarHBondContact O-N 3.02Å; C593-L596 PolarHBondContact O-N 2.98Å; L596-N598 PolarHBondContact O-N 3.11Å; L596-L599 HydrophobicContact CD2-CD1 3.66Å; L596-L599 HydrophobicContact CD2-CG 4.44Å; L596-L599 WeakPolarHBondContact O-CB 3.36Å; L596-L599 WeakPolarHBondContact O-CG 3.48Å; L596-L599 PolarHBondContact O-N 3.07Å
597	V	91.8	Very high	91.4	Very high	6 Å²	6	26.2 Å²	26.2	4%	0.036	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-57.4	-29.3	172.2	-178	0	0	0	0	111.5	C593 L595 L599 F600 Y974 S978 I981 I985	C593-V597 WeakPolarHBondContact O-CG2 3.44Å; C593-V597 PolarHBondContact O-N 3.4Å; L595-V597 PolarHBondContact O-N 3.47Å; L595-V597 VanDerWaalsContact O-N 3.09Å; V597-L599 PolarHBondContact O-N 3.41Å; V597-F600 WeakPolarHBondContact O-CD2 3.26Å; V597-F600 PolarHBondContact O-N 3.27Å; V597-Y974 WeakPolarHBondContact O-CE2 3.5Å; V597-Y974 PolarHBondContact O-OH 3.07Å; V597-S978 VanDerWaalsContact CG1-CA 3.41Å; V597-S978 VanDerWaalsContact CG1-CB 3.47Å; V597-I981 HydrophobicContact CG1-CB 4.14Å; V597-I981 HydrophobicContact CG1-CD1 4.42Å; V597-I981 HydrophobicContact CG1-CG2 4.25Å; V597-I981 HydrophobicContact CG2-CB 4.27Å; V597-I981 HydrophobicContact CG2-CG2 3.63Å; V597-I985 HydrophobicContact CG2-CD1 4.19Å
598	N	91.9	Very high	91.6	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-66.2	-13.3	175.8	-69.7	-66.7	0	0	0	115.8	L595 L596 F600 S601 I606 T610 Y974 S1035 L1036	L595-N598 WeakPolarHBondContact O-CB 3.49Å; L595-N598 PolarHBondContact O-N 3.3Å; L595-N598 PolarHBondContact O-ND2 3.41Å; L596-N598 PolarHBondContact O-N 3.11Å; N598-F600 PolarHBondContact O-N 3.24Å; N598-S601 WeakPolarHBondContact O-CB 3.24Å; N598-S601 PolarHBondContact O-N 3.11Å; N598-I606 HydrophobicContact CB-CG2 3.8Å; N598-T610 HydrophobicContact CB-CG2 4.15Å; N598-T610 WeakPolarHBondContact CB-OG1 3.35Å; N598-Y974 WeakPolarHBondContact CA-OH 3.48Å; N598-Y974 PolarHBondContact N-OH 3.03Å; N598-Y974 WeakPolarHBondContact OD1-CE1 3.03Å; N598-Y974 VanDerWaalsContact OD1-CZ 3.27Å; N598-Y974 PolarHBondContact OD1-OH 3.12Å; N598-S1035 VanDerWaalsContact CG-OG 3.26Å; N598-S1035 PolarHBondContact ND2-OG 3.2Å; N598-S1035 PolarHBondContact OD1-OG 2.89Å; N598-L1036 WeakPolarHBondContact ND2-CD2 3.33Å
599	L	92.3	Very high	91.6	Very high	63 Å²	63	25.7 Å²	25.7	33%	0.33	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-66.4	-20.5	172.1	-66.3	178.3	0	0	0	113.2	L596 V597 S601 K607 T610 I611	L596-L599 HydrophobicContact CD2-CD1 3.66Å; L596-L599 HydrophobicContact CD2-CG 4.44Å; L596-L599 WeakPolarHBondContact O-CB 3.36Å; L596-L599 WeakPolarHBondContact O-CG 3.48Å; L596-L599 PolarHBondContact O-N 3.07Å; V597-L599 PolarHBondContact O-N 3.41Å; L599-S601 VanDerWaalsContact C-N 3.3Å; L599-K607 HydrophobicContact CD2-CB 4.46Å; L599-K607 WeakPolarHBondContact O-CE 3.22Å; L599-T610 HydrophobicContact CD2-CG2 3.82Å; L599-T610 HydrophobicContact CG-CG2 3.76Å; L599-I611 HydrophobicContact CD2-CD1 4.44Å; L599-I611 HydrophobicContact CD2-CG1 3.86Å
600	F	90.1	Very high	91.7	Very high	158 Å²	158	21.8 Å²	21.8	69%	0.693	11%	0.112	S	C	*	.	G	3₁₀ helix	trans	-76.6	-12.3	176.9	-68.1	-64.9	0	0	0	114	V597 N598 Y974	V597-F600 WeakPolarHBondContact O-CD2 3.26Å; V597-F600 PolarHBondContact O-N 3.27Å; N598-F600 PolarHBondContact O-N 3.24Å; F600-Y974 HydrophobicContact CB-CD2 4.37Å; F600-Y974 HydrophobicContact CB-CE2 4.14Å
601	S	91.1	Very high	91.9	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.007	12%	0.117	C	C	.	.	S	Bend	trans	-60.6	148.7	173.7	178.4	0	0	0	0	110.7	N598 L599 I603 K607	N598-S601 WeakPolarHBondContact O-CB 3.24Å; N598-S601 PolarHBondContact O-N 3.11Å; L599-S601 VanDerWaalsContact C-N 3.3Å; S601-I603 VanDerWaalsContact C-N 3.28Å; S601-I603 PolarHBondContact OG-N 3Å; S601-K607 WeakPolarHBondContact O-CE 3.35Å; S601-K607 PolarHBondContact O-NZ 2.91Å
602	S	90.4	Very high	92	Very high	23 Å²	23	22.7 Å²	22.7	16%	0.161	12%	0.115	C	C	.	.	S	Bend	trans	-81.6	-8.1	171.2	56.7	0	0	0	0	113.3	I65 N970	I65-S602 PolarHBondContact N-O 2.95Å; S602-N970 WeakPolarHBondContact OG-CB 3.38Å; S602-N970 PolarHBondContact OG-ND2 3.47Å; S602-N970 VanDerWaalsContact OG-ND2 3.17Å
603	I	90	Very high	92.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.109	C	C	.	.	B	Isolated β-bridge	trans	-86.3	127.2	-173.5	-58.6	167.1	0	0	0	110.5	S601 A605 I606 K607 I967 I971	S601-I603 VanDerWaalsContact C-N 3.28Å; S601-I603 PolarHBondContact OG-N 3Å; I603-A605 HydrophobicContact CG2-CB 4.35Å; I603-I606 HydrophobicContact CB-CB 4.42Å; I603-I606 HydrophobicContact CB-CD1 4.1Å; I603-I606 HydrophobicContact CB-CG1 4.18Å; I603-I606 HydrophobicContact CD1-CD1 3.88Å; I603-I606 HydrophobicContact CG2-CD1 4.4Å; I603-I606 HydrophobicContact CG2-CG1 4.14Å; I603-I606 PolarHBondContact O-N 2.99Å; I603-K607 PolarHBondContact O-N 3.47Å; I603-I967 HydrophobicContact CD1-CG2 4.09Å; I603-I971 HydrophobicContact CD1-CD1 4.39Å; I603-I971 HydrophobicContact CD1-CG1 3.6Å
604	I	90.5	Very high	92.2	Very high	3 Å²	3	20 Å²	20	2%	0.015	10%	0.1	C	C	.	.	H	α-helix	trans	-64.4	-47.4	-175	-54.3	165.4	0	0	0	111.8	V63 I65 I606 K607 R608 Y764	V63-I604 HydrophobicContact CB-CD1 4.25Å; V63-I604 PolarHBondContact O-N 3.32Å; I65-I604 HydrophobicContact CB-CG1 4.42Å; I65-I604 HydrophobicContact CD1-CD1 3.09Å; I65-I604 HydrophobicContact CD1-CG1 3.54Å; I65-I604 HydrophobicContact CG1-CD1 3.62Å; I65-I604 HydrophobicContact CG1-CG1 3.81Å; I604-I606 VanDerWaalsContact C-N 3.25Å; I604-I606 PolarHBondContact O-N 3.17Å; I604-K607 PolarHBondContact O-N 3.17Å; I604-K607 VanDerWaalsContact O-N 3.08Å; I604-R608 HydrophobicContact CG2-CG 4.13Å; I604-R608 PolarHBondContact O-N 3.47Å; I604-Y764 HydrophobicContact CD1-CD1 3.39Å; I604-Y764 HydrophobicContact CD1-CD2 3.85Å; I604-Y764 HydrophobicContact CD1-CE1 3.56Å; I604-Y764 HydrophobicContact CD1-CE2 3.97Å; I604-Y764 HydrophobicContact CD1-CG 3.53Å; I604-Y764 HydrophobicContact CG2-CD1 4.44Å
605	A	89.8	Confident	92.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-54.1	-41.8	179.9	0	0	0	0	0	112.3	D61 F62 P460 I462 I603 F609	D61-A605 HydrophobicContact CB-CB 3.96Å; D61-A605 WeakPolarHBondContact O-CB 3.34Å; D61-A605 PolarHBondContact O-N 3.11Å; F62-A605 HydrophobicContact CD1-CB 4.36Å; F62-A605 HydrophobicContact CE1-CB 4.43Å; P460-A605 HydrophobicContact CB-CB 4.48Å; I462-A605 HydrophobicContact CD1-CB 4.26Å; I603-A605 HydrophobicContact CG2-CB 4.35Å; A605-F609 WeakPolarHBondContact O-CB 3.48Å; A605-F609 PolarHBondContact O-N 3.32Å
606	I	91.4	Very high	92.6	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.015	11%	0.11	C	C	.	.	H	α-helix	trans	-66.5	-43.9	177.9	-63.1	-178.8	0	0	0	110.9	N598 I603 I604 F609 T610 I1028 L1032	N598-I606 HydrophobicContact CB-CG2 3.8Å; I603-I606 HydrophobicContact CB-CB 4.42Å; I603-I606 HydrophobicContact CB-CD1 4.1Å; I603-I606 HydrophobicContact CB-CG1 4.18Å; I603-I606 HydrophobicContact CD1-CD1 3.88Å; I603-I606 HydrophobicContact CG2-CD1 4.4Å; I603-I606 HydrophobicContact CG2-CG1 4.14Å; I603-I606 PolarHBondContact O-N 2.99Å; I604-I606 VanDerWaalsContact C-N 3.25Å; I604-I606 PolarHBondContact O-N 3.17Å; I606-F609 PolarHBondContact O-N 2.87Å; I606-T610 WeakPolarHBondContact O-CB 3.28Å; I606-T610 PolarHBondContact O-N 2.84Å; I606-T610 PolarHBondContact O-OG1 3.01Å; I606-I1028 HydrophobicContact CD1-CG2 4.16Å; I606-I1028 HydrophobicContact CG1-CG2 4.19Å; I606-L1032 HydrophobicContact CG1-CD1 4.37Å
607	K	93	Very high	92.6	Very high	46 Å²	46	20 Å²	20	20%	0.2	10%	0.096	C	C	.	.	H	α-helix	trans	-63.2	-45.6	177.9	-66.1	-169.4	-172.5	-179.2	0	111.9	L599 S601 I603 I604 T610 I611 I761	L599-K607 HydrophobicContact CD2-CB 4.46Å; L599-K607 WeakPolarHBondContact O-CE 3.22Å; S601-K607 WeakPolarHBondContact O-CE 3.35Å; S601-K607 PolarHBondContact O-NZ 2.91Å; I603-K607 PolarHBondContact O-N 3.47Å; I604-K607 PolarHBondContact O-N 3.17Å; I604-K607 VanDerWaalsContact O-N 3.08Å; K607-T610 WeakPolarHBondContact O-CB 3.22Å; K607-T610 PolarHBondContact O-N 2.71Å; K607-I611 WeakPolarHBondContact O-CG1 3.42Å; K607-I611 PolarHBondContact O-N 3.32Å; K607-I761 HydrophobicContact CB-CD1 4.16Å; K607-I761 HydrophobicContact CB-CG1 4.45Å; K607-I761 HydrophobicContact CD-CD1 3.41Å; K607-I761 VanDerWaalsContact CD-CD1 3.41Å; K607-I761 HydrophobicContact CD-CG1 3.7Å; K607-I761 HydrophobicContact CG-CD1 4.41Å
608	R	93.1	Very high	92.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.9	-44	178.9	-74.8	-177.6	175.7	172.4	1.6	111.8	D61 Y450 I456 P460 I604 T610 I611 F612 I761 Y764	D61-R608 IonicContact OD1-CZ 3.93Å; D61-R608 IonicContact OD1-NH1 3.89Å; D61-R608 PolarHBondContact OD1-NH1 2.94Å; D61-R608 IonicContact OD2-CZ 3.92Å; D61-R608 IonicContact OD2-NH1 3.92Å; D61-R608 PolarHBondContact OD2-NH1 2.63Å; Y450-R608 HydrophobicContact CE2-CB 4.48Å; Y450-R608 WeakPolarHBondContact OH-CD 3.46Å; I456-R608 HydrophobicContact CG2-CG 4.25Å; P460-R608 HydrophobicContact CG-CB 3.79Å; I604-R608 HydrophobicContact CG2-CG 4.13Å; I604-R608 PolarHBondContact O-N 3.47Å; R608-T610 VanDerWaalsContact C-N 3.32Å; R608-T610 PolarHBondContact O-N 3.14Å; R608-I611 PolarHBondContact O-N 3.33Å; R608-F612 WeakPolarHBondContact O-CB 3.39Å; R608-F612 PolarHBondContact O-N 2.87Å; R608-I761 HydrophobicContact CG-CG2 4.19Å; R608-I761 PolarHBondContact NH2-O 3.27Å; R608-I761 VanDerWaalsContact NH2-O 3.16Å; R608-Y764 PolarHBondContact NH2-O 3.18Å
609	F	93.8	Very high	92.7	Very high	3 Å²	3	24.6 Å²	24.6	1%	0.013	12%	0.118	C	C	.	.	H	α-helix	trans	-56.1	-46.9	171.5	168.9	-91.9	0	0	0	112	I462 N463 L465 A466 L595 A605 I606 I611 F612 A613 L1032 L1036	I462-F609 HydrophobicContact CG2-CB 3.94Å; I462-F609 HydrophobicContact CG2-CD2 3.81Å; I462-F609 HydrophobicContact CG2-CG 3.97Å; I462-F609 WeakPolarHBondContact O-CD2 3.45Å; N463-F609 WeakPolarHBondContact OD1-CA 3.38Å; N463-F609 PolarHBondContact OD1-N 3.2Å; L465-F609 HydrophobicContact CB-CE2 3.99Å; A466-F609 HydrophobicContact CB-CD2 4.5Å; A466-F609 HydrophobicContact CB-CE2 4Å; L595-F609 HydrophobicContact CD2-CE1 3.81Å; L595-F609 HydrophobicContact CD2-CZ 4.41Å; A605-F609 WeakPolarHBondContact O-CB 3.48Å; A605-F609 PolarHBondContact O-N 3.32Å; I606-F609 PolarHBondContact O-N 2.87Å; F609-I611 PolarHBondContact O-N 3.49Å; F609-F612 PolarHBondContact O-N 3.24Å; F609-A613 HydrophobicContact CE1-CB 4.25Å; F609-A613 HydrophobicContact CE2-CB 4.3Å; F609-A613 HydrophobicContact CZ-CB 4.08Å; F609-A613 WeakPolarHBondContact O-CB 3.39Å; F609-A613 PolarHBondContact O-N 3.35Å; F609-L1032 HydrophobicContact CB-CD1 4.41Å; F609-L1032 HydrophobicContact CD1-CD1 3.52Å; F609-L1032 HydrophobicContact CD1-CD2 4.35Å; F609-L1032 HydrophobicContact CD1-CG 4.19Å; F609-L1032 HydrophobicContact CE1-CD1 3.89Å; F609-L1032 HydrophobicContact CE1-CD2 3.85Å; F609-L1032 HydrophobicContact CE1-CG 4.1Å; F609-L1032 HydrophobicContact CG-CD1 3.92Å; F609-L1032 HydrophobicContact CZ-CD2 4.07Å; F609-L1036 HydrophobicContact CE1-CD1 3.9Å; F609-L1036 HydrophobicContact CZ-CD1 4.19Å
610	T	93.8	Very high	92.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.1	-44.7	-177.4	-57.3	0	0	0	0	112.1	L595 N598 L599 I606 K607 R608 S614	L595-T610 HydrophobicContact CB-CG2 4.44Å; L595-T610 WeakPolarHBondContact O-CG2 3.1Å; N598-T610 HydrophobicContact CB-CG2 4.15Å; N598-T610 WeakPolarHBondContact CB-OG1 3.35Å; L599-T610 HydrophobicContact CD2-CG2 3.82Å; L599-T610 HydrophobicContact CG-CG2 3.76Å; I606-T610 WeakPolarHBondContact O-CB 3.28Å; I606-T610 PolarHBondContact O-N 2.84Å; I606-T610 PolarHBondContact O-OG1 3.01Å; K607-T610 WeakPolarHBondContact O-CB 3.22Å; K607-T610 PolarHBondContact O-N 2.71Å; R608-T610 VanDerWaalsContact C-N 3.32Å; R608-T610 PolarHBondContact O-N 3.14Å; T610-S614 VanDerWaalsContact O-CB 3.26Å; T610-S614 WeakPolarHBondContact O-CB 3.28Å; T610-S614 PolarHBondContact O-N 3.49Å; T610-S614 PolarHBondContact O-OG 3.46Å
611	I	94.5	Very high	92.7	Very high	24 Å²	24	16.7 Å²	16.7	12%	0.123	8%	0.08	C	C	.	.	H	α-helix	trans	-61	-53	176.7	-67	172.3	0	0	0	109.6	Y450 L454 I456 L599 K607 R608 F609 S614 F615 I761	Y450-I611 HydrophobicContact CD2-CG2 4.46Å; L454-I611 HydrophobicContact CD1-CG2 3.48Å; L454-I611 VanDerWaalsContact CD1-CG2 3.48Å; I456-I611 HydrophobicContact CD1-CD1 4.32Å; I456-I611 HydrophobicContact CD1-CG2 4.38Å; L599-I611 HydrophobicContact CD2-CD1 4.44Å; L599-I611 HydrophobicContact CD2-CG1 3.86Å; K607-I611 WeakPolarHBondContact O-CG1 3.42Å; K607-I611 PolarHBondContact O-N 3.32Å; R608-I611 PolarHBondContact O-N 3.33Å; F609-I611 PolarHBondContact O-N 3.49Å; I611-S614 PolarHBondContact O-N 2.69Å; I611-F615 HydrophobicContact CG2-CD2 3.99Å; I611-F615 HydrophobicContact CG2-CE2 3.79Å; I611-F615 WeakPolarHBondContact O-CD2 3.48Å; I611-F615 PolarHBondContact O-N 2.97Å; I611-I761 HydrophobicContact CD1-CG2 4.31Å
612	F	95	Very high	92.6	Very high	6 Å²	6	19.5 Å²	19.5	3%	0.026	10%	0.095	C	C	.	.	H	α-helix	trans	-61	-51.9	-177.6	179.7	-112	0	0	0	112.1	L443 A446 Y450 F459 N463 A466 R608 F609 S614 F615 V616	L443-F612 HydrophobicContact CD2-CZ 4.38Å; A446-F612 HydrophobicContact CB-CD2 4.37Å; A446-F612 HydrophobicContact CB-CE2 4.02Å; Y450-F612 HydrophobicContact CD2-CB 4.01Å; Y450-F612 HydrophobicContact CD2-CD2 4.3Å; Y450-F612 HydrophobicContact CE2-CB 4.19Å; Y450-F612 HydrophobicContact CG-CD2 4.42Å; F459-F612 HydrophobicContact CE2-CD1 4.4Å; F459-F612 HydrophobicContact CE2-CD2 4.37Å; F459-F612 HydrophobicContact CE2-CE1 4.23Å; F459-F612 HydrophobicContact CE2-CE2 4.22Å; F459-F612 HydrophobicContact CE2-CG 4.47Å; F459-F612 HydrophobicContact CE2-CZ 4.15Å; F459-F612 HydrophobicContact CZ-CE1 4.3Å; F459-F612 HydrophobicContact CZ-CZ 4.39Å; N463-F612 HydrophobicContact CB-CD1 3.86Å; N463-F612 HydrophobicContact CB-CE1 4.26Å; A466-F612 HydrophobicContact CB-CD1 3.79Å; A466-F612 HydrophobicContact CB-CE1 3.87Å; R608-F612 WeakPolarHBondContact O-CB 3.39Å; R608-F612 PolarHBondContact O-N 2.87Å; F609-F612 PolarHBondContact O-N 3.24Å; F612-S614 VanDerWaalsContact C-N 3.32Å; F612-S614 PolarHBondContact O-N 3.22Å; F612-F615 PolarHBondContact O-N 2.88Å; F612-V616 HydrophobicContact CD1-CG2 4.38Å; F612-V616 HydrophobicContact CE1-CG2 4.04Å; F612-V616 HydrophobicContact CE2-CG2 4.16Å; F612-V616 HydrophobicContact CZ-CG2 3.92Å; F612-V616 WeakPolarHBondContact O-CG2 3.35Å; F612-V616 PolarHBondContact O-N 3.2Å
613	A	94.3	Very high	92.5	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.008	9%	0.088	C	C	.	.	H	α-helix	trans	-61.3	-37.3	-179.9	0	0	0	0	0	112.8	A466 L595 F609 V616 I617	A466-A613 HydrophobicContact CB-CB 3.9Å; L595-A613 HydrophobicContact CD1-CB 4.31Å; L595-A613 HydrophobicContact CD2-CB 3.94Å; F609-A613 HydrophobicContact CE1-CB 4.25Å; F609-A613 HydrophobicContact CE2-CB 4.3Å; F609-A613 HydrophobicContact CZ-CB 4.08Å; F609-A613 WeakPolarHBondContact O-CB 3.39Å; F609-A613 PolarHBondContact O-N 3.35Å; A613-V616 PolarHBondContact O-N 2.77Å; A613-I617 WeakPolarHBondContact O-CG1 3.21Å; A613-I617 PolarHBondContact O-N 3.04Å
614	S	94.3	Very high	92.4	Very high	7 Å²	7	19 Å²	19	5%	0.049	9%	0.09	C	C	.	.	H	α-helix	trans	-62.9	-43.8	176.1	-60.1	0	0	0	0	111.6	T610 I611 F612 I617 I618	T610-S614 VanDerWaalsContact O-CB 3.26Å; T610-S614 WeakPolarHBondContact O-CB 3.28Å; T610-S614 PolarHBondContact O-N 3.49Å; T610-S614 PolarHBondContact O-OG 3.46Å; I611-S614 PolarHBondContact O-N 2.69Å; F612-S614 VanDerWaalsContact C-N 3.32Å; F612-S614 PolarHBondContact O-N 3.22Å; S614-I617 PolarHBondContact O-N 3.38Å; S614-I618 WeakPolarHBondContact O-CD1 3.16Å; S614-I618 VanDerWaalsContact O-CG1 3.24Å; S614-I618 WeakPolarHBondContact O-CG1 3.22Å; S614-I618 PolarHBondContact O-N 3.46Å
615	F	94.7	Very high	92.1	Very high	60 Å²	60	21 Å²	21	26%	0.263	10%	0.1	S	C	.	.	H	α-helix	trans	-64	-41.1	175	-79.4	-64.9	0	0	0	112.4	A446 V449 L454 I611 F612 I617 I618 F619	A446-F615 HydrophobicContact CB-CB 3.92Å; V449-F615 HydrophobicContact CG1-CD1 4.22Å; V449-F615 HydrophobicContact CG1-CD2 4.48Å; V449-F615 HydrophobicContact CG1-CE1 4.01Å; V449-F615 HydrophobicContact CG1-CE2 4.33Å; V449-F615 HydrophobicContact CG1-CG 4.46Å; V449-F615 HydrophobicContact CG1-CZ 4.08Å; L454-F615 HydrophobicContact CD1-CE2 3.76Å; L454-F615 HydrophobicContact CD1-CZ 4.46Å; I611-F615 HydrophobicContact CG2-CD2 3.99Å; I611-F615 HydrophobicContact CG2-CE2 3.79Å; I611-F615 WeakPolarHBondContact O-CD2 3.48Å; I611-F615 PolarHBondContact O-N 2.97Å; F612-F615 PolarHBondContact O-N 2.88Å; F615-I617 VanDerWaalsContact C-N 3.34Å; F615-I617 PolarHBondContact O-N 2.91Å; F615-I618 PolarHBondContact O-N 3.29Å; F615-F619 HydrophobicContact CB-CD2 4.16Å; F615-F619 HydrophobicContact CB-CE2 3.98Å; F615-F619 AromaticContact CD1-CE2 3.81Å; F615-F619 HydrophobicContact CD1-CE2 3.81Å; F615-F619 HydrophobicContact CD1-CZ 4.18Å; F615-F619 HydrophobicContact CG-CE2 4.26Å; F615-F619 WeakPolarHBondContact O-CB 3.43Å; F615-F619 WeakPolarHBondContact O-CD2 3.25Å; F615-F619 WeakPolarHBondContact O-CG 3.35Å; F615-F619 PolarHBondContact O-N 2.94Å
616	V	94.9	Very high	91.8	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-57.2	-46.9	176.7	173.2	0	0	0	0	111	L443 A446 V470 F612 A613 N620	L443-V616 HydrophobicContact CD2-CG1 3.88Å; L443-V616 HydrophobicContact CD2-CG2 3.86Å; A446-V616 HydrophobicContact CB-CB 4.34Å; A446-V616 HydrophobicContact CB-CG2 3.47Å; A446-V616 VanDerWaalsContact CB-CG2 3.47Å; V470-V616 HydrophobicContact CB-CG1 3.7Å; V470-V616 HydrophobicContact CG1-CG1 4Å; V470-V616 HydrophobicContact CG2-CG1 3.67Å; F612-V616 HydrophobicContact CD1-CG2 4.38Å; F612-V616 HydrophobicContact CE1-CG2 4.04Å; F612-V616 HydrophobicContact CE2-CG2 4.16Å; F612-V616 HydrophobicContact CZ-CG2 3.92Å; F612-V616 WeakPolarHBondContact O-CG2 3.35Å; F612-V616 PolarHBondContact O-N 3.2Å; A613-V616 PolarHBondContact O-N 2.77Å; V616-N620 WeakPolarHBondContact O-CB 3.34Å; V616-N620 PolarHBondContact O-N 2.82Å
617	I	93.6	Very high	91.3	Very high	14 Å²	14	24.8 Å²	24.8	7%	0.072	12%	0.12	C	C	.	.	H	α-helix	trans	-66.7	-43.2	179.3	-65.6	177.1	0	0	0	111.5	L473 I592 L595 A613 S614 F615 N620 Y621	L473-I617 HydrophobicContact CD1-CD1 4.22Å; I592-I617 HydrophobicContact CD1-CG2 4.27Å; I592-I617 HydrophobicContact CG1-CB 4.39Å; I592-I617 HydrophobicContact CG1-CG2 3.98Å; L595-I617 HydrophobicContact CD1-CD1 3.33Å; A613-I617 WeakPolarHBondContact O-CG1 3.21Å; A613-I617 PolarHBondContact O-N 3.04Å; S614-I617 PolarHBondContact O-N 3.38Å; F615-I617 VanDerWaalsContact C-N 3.34Å; F615-I617 PolarHBondContact O-N 2.91Å; I617-N620 PolarHBondContact O-N 2.8Å; I617-Y621 PolarHBondContact O-N 2.92Å
618	I	93.3	Very high	90.6	Very high	62 Å²	62	22.8 Å²	22.8	32%	0.318	11%	0.112	S	C	.	.	H	α-helix	trans	-60.5	-49.8	178	-69.8	166.7	0	0	0	110.8	I592 S614 F615 N620 Y621 I622	I592-I618 HydrophobicContact CD1-CD1 4.15Å; I592-I618 HydrophobicContact CD1-CG1 3.41Å; I592-I618 VanDerWaalsContact CD1-CG1 3.41Å; I592-I618 HydrophobicContact CG1-CG1 4.31Å; S614-I618 WeakPolarHBondContact O-CD1 3.16Å; S614-I618 VanDerWaalsContact O-CG1 3.24Å; S614-I618 WeakPolarHBondContact O-CG1 3.22Å; S614-I618 PolarHBondContact O-N 3.46Å; F615-I618 PolarHBondContact O-N 3.29Å; I618-N620 VanDerWaalsContact C-N 3.33Å; I618-N620 PolarHBondContact O-N 3.42Å; I618-Y621 PolarHBondContact O-N 3.21Å; I618-I622 HydrophobicContact CG2-CD1 3.81Å; I618-I622 VanDerWaalsContact O-CG1 3.31Å; I618-I622 WeakPolarHBondContact O-CG1 3.36Å; I618-I622 PolarHBondContact O-N 3.43Å
619	F	92.6	Very high	89.9	Confident	42 Å²	42	23.1 Å²	23.1	18%	0.184	11%	0.113	C	C	.	.	H	α-helix	trans	-67.2	-35.6	179.6	-69.5	-51.2	0	0	0	111.9	A446 V449 F615 I622 F623	A446-F619 HydrophobicContact CB-CD2 4.06Å; A446-F619 HydrophobicContact CB-CE2 4.5Å; V449-F619 HydrophobicContact CB-CE2 4.41Å; V449-F619 HydrophobicContact CG2-CE2 3.97Å; V449-F619 HydrophobicContact CG2-CZ 3.87Å; F615-F619 HydrophobicContact CB-CD2 4.16Å; F615-F619 HydrophobicContact CB-CE2 3.98Å; F615-F619 AromaticContact CD1-CE2 3.81Å; F615-F619 HydrophobicContact CD1-CE2 3.81Å; F615-F619 HydrophobicContact CD1-CZ 4.18Å; F615-F619 HydrophobicContact CG-CE2 4.26Å; F615-F619 WeakPolarHBondContact O-CB 3.43Å; F615-F619 WeakPolarHBondContact O-CD2 3.25Å; F615-F619 WeakPolarHBondContact O-CG 3.35Å; F615-F619 PolarHBondContact O-N 2.94Å; F619-I622 HydrophobicContact CD1-CD1 4.29Å; F619-I622 PolarHBondContact O-N 2.95Å; F619-F623 HydrophobicContact CB-CD2 4.26Å; F619-F623 HydrophobicContact CB-CE2 4Å; F619-F623 WeakPolarHBondContact O-CB 3.46Å; F619-F623 WeakPolarHBondContact O-CD2 3.48Å; F619-F623 WeakPolarHBondContact O-CG 3.31Å; F619-F623 PolarHBondContact O-N 2.96Å
620	N	91.5	Very high	89.2	Confident	9 Å²	9	23.2 Å²	23.2	5%	0.048	11%	0.114	C	C	.	.	H	α-helix	trans	-59.2	-49	173.5	-174.4	61.8	0	0	0	111.5	V470 G474 V616 I617 I618 I622 F623 I624	V470-N620 HydrophobicContact CG2-CB 4.36Å; G474-N620 WeakPolarHBondContact CA-ND2 3.27Å; V616-N620 WeakPolarHBondContact O-CB 3.34Å; V616-N620 PolarHBondContact O-N 2.82Å; I617-N620 PolarHBondContact O-N 2.8Å; I618-N620 VanDerWaalsContact C-N 3.33Å; I618-N620 PolarHBondContact O-N 3.42Å; N620-I622 PolarHBondContact O-N 3.02Å; N620-F623 PolarHBondContact O-N 3.5Å; N620-I624 VanDerWaalsContact O-CG1 3.27Å; N620-I624 WeakPolarHBondContact O-CG1 3.4Å; N620-I624 PolarHBondContact O-N 3.16Å
621	Y	91.4	Very high	88.4	Confident	45 Å²	45	25.6 Å²	25.6	18%	0.176	13%	0.126	C	C	.	.	H	α-helix	trans	-58.2	-45.2	175.6	171.7	-104.1	0	0	0	112.5	M584 T585 T588 I617 I618 F623 I624 I625	M584-Y621 HydrophobicContact CB-CE2 4.27Å; T585-Y621 HydrophobicContact CG2-CE2 4.27Å; T585-Y621 WeakPolarHBondContact CG2-OH 3.44Å; T588-Y621 HydrophobicContact CG2-CD2 3.73Å; T588-Y621 HydrophobicContact CG2-CG 4.04Å; I617-Y621 PolarHBondContact O-N 2.92Å; I618-Y621 PolarHBondContact O-N 3.21Å; Y621-F623 PolarHBondContact O-N 3.32Å; Y621-I624 PolarHBondContact O-N 3.15Å; Y621-I625 HydrophobicContact CD1-CD1 4.32Å; Y621-I625 HydrophobicContact CD2-CD1 4.24Å; Y621-I625 HydrophobicContact CE1-CD1 3.61Å; Y621-I625 HydrophobicContact CE2-CD1 3.54Å; Y621-I625 HydrophobicContact CE2-CG1 4.44Å; Y621-I625 PolarHBondContact O-N 3.03Å; Y621-I625 WeakPolarHBondContact OH-CD1 3.19Å
622	I	89.8	Confident	87.5	Confident	61 Å²	61	24.8 Å²	24.8	31%	0.313	12%	0.121	S	C	.	.	H	α-helix	trans	-61.4	-45.3	177.3	-69.6	168.5	0	0	0	111	I618 F619 N620 I625 L626	I618-I622 HydrophobicContact CG2-CD1 3.81Å; I618-I622 VanDerWaalsContact O-CG1 3.31Å; I618-I622 WeakPolarHBondContact O-CG1 3.36Å; I618-I622 PolarHBondContact O-N 3.43Å; F619-I622 HydrophobicContact CD1-CD1 4.29Å; F619-I622 PolarHBondContact O-N 2.95Å; N620-I622 PolarHBondContact O-N 3.02Å; I622-I625 PolarHBondContact O-N 3.06Å; I622-L626 HydrophobicContact CG2-CD1 3.5Å; I622-L626 HydrophobicContact CG2-CG 4.15Å; I622-L626 WeakPolarHBondContact O-CB 3.32Å; I622-L626 WeakPolarHBondContact O-CG 3.36Å; I622-L626 PolarHBondContact O-N 3.16Å
623	F	88.3	Confident	86.5	Confident	4 Å²	4	24.5 Å²	24.5	2%	0.018	12%	0.12	C	C	.	.	H	α-helix	trans	-69.1	-33.4	179.9	-71.2	-48.8	0	0	0	113	F38 I39 A438 W441 T445 F619 N620 Y621 I625 M627	F38-F623 HydrophobicContact CD1-CE1 4.43Å; F38-F623 HydrophobicContact CE1-CE1 4.15Å; I39-F623 HydrophobicContact CG1-CD1 4.49Å; I39-F623 HydrophobicContact CG1-CE1 4.25Å; A438-F623 HydrophobicContact CB-CB 4.25Å; W441-F623 HydrophobicContact CB-CD2 4.34Å; W441-F623 HydrophobicContact CB-CE2 4.09Å; W441-F623 HydrophobicContact CB-CZ 4.41Å; T445-F623 HydrophobicContact CG2-CE2 4.22Å; T445-F623 HydrophobicContact CG2-CZ 3.9Å; T445-F623 WeakPolarHBondContact OG1-CE2 3.49Å; F619-F623 HydrophobicContact CB-CD2 4.26Å; F619-F623 HydrophobicContact CB-CE2 4Å; F619-F623 WeakPolarHBondContact O-CB 3.46Å; F619-F623 WeakPolarHBondContact O-CD2 3.48Å; F619-F623 WeakPolarHBondContact O-CG 3.31Å; F619-F623 PolarHBondContact O-N 2.96Å; N620-F623 PolarHBondContact O-N 3.5Å; Y621-F623 PolarHBondContact O-N 3.32Å; F623-I625 VanDerWaalsContact C-N 3.32Å; F623-I625 PolarHBondContact O-N 2.94Å; F623-M627 WeakPolarHBondContact O-CA 3.3Å; F623-M627 WeakPolarHBondContact O-CB 3.32Å; F623-M627 PolarHBondContact O-N 3.09Å
624	I	86.9	Confident	85.5	Confident	7 Å²	7	25.8 Å²	25.8	4%	0.036	13%	0.127	C	C	.	.	I	π-helix	trans	-59.4	-46.2	172.4	-70.5	170.8	0	0	0	110.2	D477 N620 Y621 I628	D477-I624 HydrophobicContact CB-CD1 3.94Å; N620-I624 VanDerWaalsContact O-CG1 3.27Å; N620-I624 WeakPolarHBondContact O-CG1 3.4Å; N620-I624 PolarHBondContact O-N 3.16Å; Y621-I624 PolarHBondContact O-N 3.15Å; I624-I628 HydrophobicContact CB-CD1 4.26Å; I624-I628 HydrophobicContact CG1-CD1 3.91Å; I624-I628 HydrophobicContact CG2-CD1 4.28Å; I624-I628 WeakPolarHBondContact O-CB 3.49Å; I624-I628 PolarHBondContact O-N 3.46Å; I624-I628 VanDerWaalsContact O-N 3.16Å
625	I	84.5	Confident	84.4	Confident	47 Å²	47	27.2 Å²	27.2	24%	0.241	13%	0.132	C	C	.	.	I	π-helix	trans	-69.5	-45.4	179.7	-70.4	169.8	0	0	0	112.2	Y621 I622 F623 I629	Y621-I625 HydrophobicContact CD1-CD1 4.32Å; Y621-I625 HydrophobicContact CD2-CD1 4.24Å; Y621-I625 HydrophobicContact CE1-CD1 3.61Å; Y621-I625 HydrophobicContact CE2-CD1 3.54Å; Y621-I625 HydrophobicContact CE2-CG1 4.44Å; Y621-I625 PolarHBondContact O-N 3.03Å; Y621-I625 WeakPolarHBondContact OH-CD1 3.19Å; I622-I625 PolarHBondContact O-N 3.06Å; F623-I625 VanDerWaalsContact C-N 3.32Å; F623-I625 PolarHBondContact O-N 2.94Å; I625-I629 HydrophobicContact CB-CD1 4.36Å; I625-I629 HydrophobicContact CG1-CD1 4.26Å; I625-I629 HydrophobicContact CG2-CD1 4.31Å
626	L	82.9	Confident	83.1	Confident	74 Å²	74	26.5 Å²	26.5	39%	0.387	13%	0.13	S	C	.	.	I	π-helix	trans	-77.3	-34.3	-174.1	-70.3	179.3	0	0	0	113.6	S35 I622 P630	S35-L626 WeakPolarHBondContact CB-O 3.4Å; I622-L626 HydrophobicContact CG2-CD1 3.5Å; I622-L626 HydrophobicContact CG2-CG 4.15Å; I622-L626 WeakPolarHBondContact O-CB 3.32Å; I622-L626 WeakPolarHBondContact O-CG 3.36Å; I622-L626 PolarHBondContact O-N 3.16Å; L626-P630 WeakPolarHBondContact O-CD 3.4Å; L626-P630 WeakPolarHBondContact O-CG 3.44Å
627	M	80.4	Confident	81.7	Confident	8 Å²	8	29.6 Å²	29.6	4%	0.039	15%	0.146	C	C	.	.	I	π-helix	trans	-101.3	-49.9	-173.3	-169.8	178.5	64.2	0	0	112.1	I39 L434 A438 F623 M631	I39-M627 HydrophobicContact CD1-CB 4.24Å; I39-M627 HydrophobicContact CD1-CG 4.01Å; I39-M627 HydrophobicContact CD1-SD 3.73Å; L434-M627 HydrophobicContact CB-CE 4.32Å; L434-M627 HydrophobicContact CD2-SD 4.44Å; L434-M627 WeakPolarHBondContact O-CE 3.26Å; A438-M627 HydrophobicContact CB-CE 3.45Å; A438-M627 VanDerWaalsContact CB-CE 3.45Å; F623-M627 WeakPolarHBondContact O-CA 3.3Å; F623-M627 WeakPolarHBondContact O-CB 3.32Å; F623-M627 PolarHBondContact O-N 3.09Å; M627-M631 WeakPolarHBondContact O-CB 3.24Å; M627-M631 WeakPolarHBondContact O-CG 3.36Å; M627-M631 PolarHBondContact O-N 3.4Å
628	I	78.9	Confident	80.2	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.021	16%	0.161	C	C	.	.	I	π-helix	trans	-76.3	-44	-168.3	-59.7	176.8	0	0	0	111.1	T435 L478 I624 M631 I632	T435-I628 HydrophobicContact CG2-CD1 3.58Å; L478-I628 HydrophobicContact CD1-CD1 4.16Å; L478-I628 HydrophobicContact CD1-CG2 3.66Å; I624-I628 HydrophobicContact CB-CD1 4.26Å; I624-I628 HydrophobicContact CG1-CD1 3.91Å; I624-I628 HydrophobicContact CG2-CD1 4.28Å; I624-I628 WeakPolarHBondContact O-CB 3.49Å; I624-I628 PolarHBondContact O-N 3.46Å; I624-I628 VanDerWaalsContact O-N 3.16Å; I628-M631 PolarHBondContact O-N 3.02Å; I628-I632 HydrophobicContact CG2-CD1 3.62Å; I628-I632 HydrophobicContact CG2-CG1 4.11Å; I628-I632 WeakPolarHBondContact O-CG1 3.06Å; I628-I632 PolarHBondContact O-N 3.13Å
629	I	79.6	Confident	78.5	Confident	6 Å²	6	35.4 Å²	35.4	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-50.3	-178	-58.7	176.6	0	0	0	111.4	F481 L573 L577 I625 M631 I632 I633	F481-I629 HydrophobicContact CE1-CG1 4.44Å; F481-I629 HydrophobicContact CE2-CD1 4.06Å; F481-I629 HydrophobicContact CE2-CG1 4.04Å; F481-I629 HydrophobicContact CZ-CD1 4.43Å; F481-I629 HydrophobicContact CZ-CG1 3.95Å; F481-I629 HydrophobicContact CZ-CG2 4.17Å; L573-I629 HydrophobicContact CD1-CG2 4.03Å; L577-I629 HydrophobicContact CD2-CD1 3.88Å; L577-I629 HydrophobicContact CD2-CG2 4.39Å; I625-I629 HydrophobicContact CB-CD1 4.36Å; I625-I629 HydrophobicContact CG1-CD1 4.26Å; I625-I629 HydrophobicContact CG2-CD1 4.31Å; I629-M631 VanDerWaalsContact C-N 3.33Å; I629-M631 PolarHBondContact O-N 2.94Å; I629-I632 PolarHBondContact O-N 3.03Å; I629-I633 HydrophobicContact CG2-CD1 4.35Å; I629-I633 WeakPolarHBondContact O-CG1 3.44Å; I629-I633 PolarHBondContact O-N 3.28Å
630	P	77.8	Confident	76.6	Confident	5 Å²	5	39 Å²	39	3%	0.032	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-36.6	176.7	-24.7	37.6	0	0	0	113.4	V31 L626 I633 I634	V31-P630 HydrophobicContact CG1-CB 4.11Å; V31-P630 HydrophobicContact CG1-CG 3.68Å; L626-P630 WeakPolarHBondContact O-CD 3.4Å; L626-P630 WeakPolarHBondContact O-CG 3.44Å; P630-I633 WeakPolarHBondContact O-CB 3.49Å; P630-I633 PolarHBondContact O-N 2.64Å; P630-I634 WeakPolarHBondContact O-CG1 3.22Å; P630-I634 PolarHBondContact O-N 2.9Å; P630-I634 VanDerWaalsContact O-N 3.1Å
631	M	77.3	Confident	74.4	Confident	50 Å²	50	42.7 Å²	42.7	25%	0.246	21%	0.211	C	C	.	.	H	α-helix	trans	-71.5	-34.7	-178.2	-68.8	-62.2	172.1	0	0	112.8	A32 L434 M627 I628 I629 I633 I634 F635	A32-M631 HydrophobicContact CB-CE 3.87Å; L434-M631 HydrophobicContact CD1-CB 3.62Å; L434-M631 HydrophobicContact CD1-CG 4.02Å; M627-M631 WeakPolarHBondContact O-CB 3.24Å; M627-M631 WeakPolarHBondContact O-CG 3.36Å; M627-M631 PolarHBondContact O-N 3.4Å; I628-M631 PolarHBondContact O-N 3.02Å; I629-M631 VanDerWaalsContact C-N 3.33Å; I629-M631 PolarHBondContact O-N 2.94Å; M631-I633 VanDerWaalsContact C-N 3.3Å; M631-I633 PolarHBondContact O-N 2.96Å; M631-I634 PolarHBondContact O-N 3.32Å; M631-I634 HydrophobicContact SD-CD1 4.19Å; M631-F635 WeakPolarHBondContact O-CB 3.27Å; M631-F635 PolarHBondContact O-N 3.36Å
632	I	76.5	Confident	72.2	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.036	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-42.8	172	-69.9	171.2	0	0	0	110.4	I431 F481 W485 I628 I629 I634 F635 E636	I431-I632 HydrophobicContact CD1-CG1 4.23Å; I431-I632 HydrophobicContact CG1-CG1 4.4Å; F481-I632 HydrophobicContact CD1-CD1 4.04Å; F481-I632 HydrophobicContact CE1-CD1 3.77Å; W485-I632 HydrophobicContact CZ2-CG2 4.46Å; I628-I632 HydrophobicContact CG2-CD1 3.62Å; I628-I632 HydrophobicContact CG2-CG1 4.11Å; I628-I632 WeakPolarHBondContact O-CG1 3.06Å; I628-I632 PolarHBondContact O-N 3.13Å; I629-I632 PolarHBondContact O-N 3.03Å; I632-I634 PolarHBondContact O-N 3.25Å; I632-F635 PolarHBondContact O-N 2.86Å; I632-E636 WeakPolarHBondContact O-CB 3.29Å; I632-E636 WeakPolarHBondContact O-CG 3.38Å; I632-E636 PolarHBondContact O-N 3.31Å; I632-E636 VanDerWaalsContact O-N 3.08Å
633	I	73.3	Confident	70.2	Confident	1 Å²	1	47 Å²	47	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-43.5	178	-64.9	166.2	0	0	0	111	K28 L569 L573 I629 P630 M631 L637	K28-I633 HydrophobicContact CB-CG2 4.25Å; K28-I633 HydrophobicContact CD-CG2 4.28Å; L569-I633 HydrophobicContact CD2-CG2 4.1Å; L573-I633 HydrophobicContact CD1-CD1 3.92Å; L573-I633 HydrophobicContact CD1-CG1 4.34Å; L573-I633 HydrophobicContact CD2-CD1 3.64Å; L573-I633 HydrophobicContact CG-CD1 4.42Å; I629-I633 HydrophobicContact CG2-CD1 4.35Å; I629-I633 WeakPolarHBondContact O-CG1 3.44Å; I629-I633 PolarHBondContact O-N 3.28Å; P630-I633 WeakPolarHBondContact O-CB 3.49Å; P630-I633 PolarHBondContact O-N 2.64Å; M631-I633 VanDerWaalsContact C-N 3.3Å; M631-I633 PolarHBondContact O-N 2.96Å; I633-L637 HydrophobicContact CG2-CD1 3.95Å; I633-L637 WeakPolarHBondContact O-CD1 3.26Å; I633-L637 WeakPolarHBondContact O-CG 3.33Å; I633-L637 PolarHBondContact O-N 2.92Å
634	I	72.8	Confident	68.2	Low	27 Å²	27	52.9 Å²	52.9	14%	0.138	26%	0.258	C	S	.	.	H	α-helix	trans	-67.2	-44.6	179.3	-67.4	168.8	0	0	0	111	K28 A32 P630 M631 I632 L637 N638	K28-I634 HydrophobicContact CB-CG1 4.35Å; K28-I634 HydrophobicContact CD-CG1 4.49Å; K28-I634 HydrophobicContact CG-CG1 4.39Å; A32-I634 HydrophobicContact CB-CD1 3.43Å; A32-I634 VanDerWaalsContact CB-CD1 3.43Å; P630-I634 WeakPolarHBondContact O-CG1 3.22Å; P630-I634 PolarHBondContact O-N 2.9Å; P630-I634 VanDerWaalsContact O-N 3.1Å; M631-I634 PolarHBondContact O-N 3.32Å; M631-I634 HydrophobicContact SD-CD1 4.19Å; I632-I634 PolarHBondContact O-N 3.25Å; I634-L637 PolarHBondContact O-N 3.4Å; I634-N638 PolarHBondContact O-N 2.87Å
635	F	71.6	Confident	66.2	Low	38 Å²	38	58.1 Å²	58.1	17%	0.167	29%	0.286	C	S	.	.	H	α-helix	trans	-63.6	-45.3	-177.1	-173.3	-99.2	0	0	0	112.1	T428 F430 M631 I632 L637 Y639	T428-F635 HydrophobicContact CG2-CE1 3.95Å; T428-F635 HydrophobicContact CG2-CZ 4.39Å; F430-F635 HydrophobicContact CB-CD2 4.48Å; F430-F635 HydrophobicContact CB-CE2 4.25Å; F430-F635 HydrophobicContact CD2-CD2 4.28Å; F430-F635 AromaticContact CD2-CE2 3.34Å; F430-F635 HydrophobicContact CD2-CE2 3.34Å; F430-F635 AromaticContact CD2-CZ 3.73Å; F430-F635 HydrophobicContact CD2-CZ 3.73Å; F430-F635 AromaticContact CE2-CE2 3.82Å; F430-F635 HydrophobicContact CE2-CE2 3.82Å; F430-F635 HydrophobicContact CE2-CZ 4.29Å; F430-F635 HydrophobicContact CG-CD2 4.42Å; F430-F635 AromaticContact CG-CE2 3.89Å; F430-F635 HydrophobicContact CG-CE2 3.89Å; M631-F635 WeakPolarHBondContact O-CB 3.27Å; M631-F635 PolarHBondContact O-N 3.36Å; I632-F635 PolarHBondContact O-N 2.86Å; F635-L637 VanDerWaalsContact C-N 3.32Å; F635-L637 PolarHBondContact O-N 3.23Å; F635-Y639 PolarHBondContact O-N 3.07Å; F635-Y639 VanDerWaalsContact O-N 3.14Å
636	E	67.9	Low	64.3	Low	45 Å²	45	64.5 Å²	64.5	21%	0.21	31%	0.313	C	S	.	.	H	α-helix	trans	-65.9	-31.5	179	-77.2	-76.1	153.9	0	0	113	R489 I632 F640	R489-E636 IonicContact NH2-OE2 3.48Å; I632-E636 WeakPolarHBondContact O-CB 3.29Å; I632-E636 WeakPolarHBondContact O-CG 3.38Å; I632-E636 PolarHBondContact O-N 3.31Å; I632-E636 VanDerWaalsContact O-N 3.08Å; E636-F640 WeakPolarHBondContact OE2-CD2 3.49Å; E636-F640 WeakPolarHBondContact OE2-CE2 3.28Å
637	L	65	Low	62.6	Low	65 Å²	65	66.2 Å²	66.2	34%	0.34	32%	0.32	S	S	.	.	H	α-helix	trans	-79.3	-34.1	-179.5	-75.4	167.9	0	0	0	113.4	K28 L569 I633 I634 F635	K28-L637 HydrophobicContact CD-CD1 3.64Å; L569-L637 HydrophobicContact CD2-CD1 3.6Å; L569-L637 HydrophobicContact CD2-CD2 3.89Å; L569-L637 HydrophobicContact CD2-CG 3.84Å; I633-L637 HydrophobicContact CG2-CD1 3.95Å; I633-L637 WeakPolarHBondContact O-CD1 3.26Å; I633-L637 WeakPolarHBondContact O-CG 3.33Å; I633-L637 PolarHBondContact O-N 2.92Å; I634-L637 PolarHBondContact O-N 3.4Å; F635-L637 VanDerWaalsContact C-N 3.32Å; F635-L637 PolarHBondContact O-N 3.23Å
638	N	62.3	Low	61	Low	72 Å²	72	68.9 Å²	68.9	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-101.4	-29.1	-169.9	-73.6	-3.3	0	0	0	114.5	Y29 I634	Y29-N638 PolarHBondContact OH-ND2 3.21Å; I634-N638 PolarHBondContact O-N 2.87Å
639	Y	57.7	Low	59.6	Low	126 Å²	126	75.8 Å²	75.8	49%	0.494	37%	0.371	S	S	.	.	S	Bend	trans	-119.1	1.7	-166.1	-75.6	-82.3	0	0	0	115.6	F635 S641 L642 Y643	F635-Y639 PolarHBondContact O-N 3.07Å; F635-Y639 VanDerWaalsContact O-N 3.14Å; Y639-S641 PolarHBondContact O-N 2.92Å; Y639-L642 HydrophobicContact CD1-CB 4.49Å; Y639-L642 PolarHBondContact O-N 3.05Å; Y639-Y643 PolarHBondContact O-N 3.16Å; Y639-Y643 VanDerWaalsContact O-N 3.17Å
640	F	51.7	Low	58.3	Low	117 Å²	117	83 Å²	83	51%	0.513	41%	0.408	S	S	.	.	H	α-helix	trans	-62.3	-24.3	-179.6	-151.6	-90.5	0	0	0	113.4	E636 K644	E636-F640 WeakPolarHBondContact OE2-CD2 3.49Å; E636-F640 WeakPolarHBondContact OE2-CE2 3.28Å; F640-K644 WeakPolarHBondContact O-CB 3.32Å
641	S	45.8	Very low	57.2	Low	87 Å²	87	89.7 Å²	89.7	61%	0.608	44%	0.437	S	S	*	.	H	α-helix	trans	-83	-35.7	176.3	63.4	0	0	0	0	113.6	Y639	Y639-S641 PolarHBondContact O-N 2.92Å
642	L	44.6	Very low	56.2	Low	123 Å²	123	92.5 Å²	92.5	64%	0.644	45%	0.446	S	S	*	.	H	α-helix	trans	-84.8	-39	-172.1	-138.7	97.4	0	0	0	112.5	Y639 N645	Y639-L642 HydrophobicContact CD1-CB 4.49Å; Y639-L642 PolarHBondContact O-N 3.05Å; L642-N645 PolarHBondContact O-N 3.28Å
643	Y	47.8	Very low	55.3	Low	73 Å²	73	100.7 Å²	100.7	29%	0.286	48%	0.481	S	S	.	.	H	α-helix	trans	-77.6	-27.9	-177	-156.1	-102.1	0	0	0	112.8	Y639 N645 F646 M647	Y639-Y643 PolarHBondContact O-N 3.16Å; Y639-Y643 VanDerWaalsContact O-N 3.17Å; Y643-N645 PolarHBondContact O-N 2.91Å; Y643-F646 PolarHBondContact O-N 3.14Å; Y643-M647 HydrophobicContact CD1-CG 4.24Å; Y643-M647 HydrophobicContact CE1-CB 4.36Å; Y643-M647 HydrophobicContact CE1-CG 3.58Å; Y643-M647 HydrophobicContact CE2-CG 4.45Å; Y643-M647 PolarHBondContact O-N 3.14Å
644	K	47.5	Very low	54.6	Low	128 Å²	128	108.9 Å²	108.9	56%	0.557	51%	0.513	S	S	*	.	H	α-helix	trans	-59.6	-27.1	172.5	-166.7	176.2	-178	-177.1	0	111.7	F640 N648	F640-K644 WeakPolarHBondContact O-CB 3.32Å; K644-N648 WeakPolarHBondContact O-CB 3.39Å; K644-N648 PolarHBondContact O-ND2 2.89Å
645	N	43.4	Very low	54.2	Low	118 Å²	118	111.4 Å²	111.4	63%	0.631	52%	0.521	S	S	*	.	H	α-helix	trans	-87.3	-27.7	178.7	-75.1	-10	0	0	0	114	L642 Y643	L642-N645 PolarHBondContact O-N 3.28Å; Y643-N645 PolarHBondContact O-N 2.91Å
646	F	45.1	Very low	53.9	Low	181 Å²	181	113.1 Å²	113.1	79%	0.794	53%	0.53	S	S	*	.	H	α-helix	trans	-87.4	-35.5	-173.5	-144	-95.7	0	0	0	113.7	Y643	Y643-F646 PolarHBondContact O-N 3.14Å
647	M	47.3	Very low	53.9	Low	109 Å²	109	114.6 Å²	114.6	54%	0.537	55%	0.545	S	S	.	.	S	Bend	trans	-89.2	-12	176.3	-73.6	-66	-80.5	0	0	113.8	Y643 L649	Y643-M647 HydrophobicContact CD1-CG 4.24Å; Y643-M647 HydrophobicContact CE1-CB 4.36Å; Y643-M647 HydrophobicContact CE1-CG 3.58Å; Y643-M647 HydrophobicContact CE2-CG 4.45Å; Y643-M647 PolarHBondContact O-N 3.14Å; M647-L649 VanDerWaalsContact C-N 3.31Å; M647-L649 PolarHBondContact O-N 3.02Å
648	N	46.9	Very low	54.3	Low	64 Å²	64	116.5 Å²	116.5	34%	0.342	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	-13.7	179.3	-88.6	-2.1	0	0	0	114.4	K644 Y652	K644-N648 WeakPolarHBondContact O-CB 3.39Å; K644-N648 PolarHBondContact O-ND2 2.89Å; N648-Y652 WeakPolarHBondContact O-CB 3.5Å; N648-Y652 WeakPolarHBondContact OD1-CD2 3.4Å
649	L	50.4	Low	54.7	Low	150 Å²	150	114.3 Å²	114.3	79%	0.785	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-19.7	-167.8	-116.3	107.8	0	0	0	116.3	M647	M647-L649 VanDerWaalsContact C-N 3.31Å; M647-L649 PolarHBondContact O-N 3.02Å
650	L	52.5	Low	55.5	Low	156 Å²	156	112 Å²	112	82%	0.817	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	-26.6	-172	-86.9	149.9	0	0	0	116
651	F	54.9	Low	56.9	Low	146 Å²	146	110.7 Å²	110.7	64%	0.64	53%	0.529	S	S	*	.	S	Bend	trans	-130.7	-2.9	-175.9	-84.2	-85.2	0	0	0	115.5	K653 Y654 Y655	F651-K653 PolarHBondContact O-N 3.25Å; F651-Y654 PolarHBondContact O-N 3.16Å; F651-Y655 WeakPolarHBondContact O-CB 3.29Å; F651-Y655 PolarHBondContact O-N 3.47Å
652	Y	55.8	Low	58.4	Low	110 Å²	110	109.5 Å²	109.5	43%	0.431	52%	0.516	S	S	.	.	H	α-helix	trans	-56.8	-44.9	-169.7	-176.3	-101.4	0	0	0	114.1	N648 Q656	N648-Y652 WeakPolarHBondContact O-CB 3.5Å; N648-Y652 WeakPolarHBondContact OD1-CD2 3.4Å; Y652-Q656 VanDerWaalsContact CZ-OE1 3.22Å; Y652-Q656 VanDerWaalsContact O-CB 3.22Å; Y652-Q656 WeakPolarHBondContact O-CB 3.27Å; Y652-Q656 PolarHBondContact O-N 3.39Å; Y652-Q656 PolarHBondContact OH-OE1 3.49Å
653	K	56.5	Low	60	Low	179 Å²	179	108 Å²	108	78%	0.778	51%	0.509	S	S	*	.	H	α-helix	trans	-70.7	-40.8	-176	-158.6	174.8	-176.4	179.1	0	112.8	F651 S657	F651-K653 PolarHBondContact O-N 3.25Å; K653-S657 WeakPolarHBondContact O-CB 3.43Å; K653-S657 PolarHBondContact O-N 3.35Å; K653-S657 PolarHBondContact O-OG 3.04Å
654	Y	59.4	Low	61.5	Low	172 Å²	172	109 Å²	109	68%	0.675	52%	0.516	S	S	*	.	H	α-helix	trans	-69.3	-44.7	175.7	-172.6	-101.5	0	0	0	111	F651 S657 F658	F651-Y654 PolarHBondContact O-N 3.16Å; Y654-S657 PolarHBondContact O-N 3.22Å; Y654-F658 WeakPolarHBondContact O-CB 3.29Å; Y654-F658 PolarHBondContact O-N 2.94Å
655	Y	63.8	Low	63.4	Low	80 Å²	80	107.5 Å²	107.5	31%	0.314	51%	0.513	S	S	.	.	H	α-helix	trans	-64.6	-43.4	179.9	-175.1	-110.2	0	0	0	112.9	R427 F651 S657 F658 I659	R427-Y655 WeakPolarHBondContact CD-OH 3.46Å; R427-Y655 VanDerWaalsContact CG-OH 3.25Å; R427-Y655 WeakPolarHBondContact CG-OH 3.07Å; R427-Y655 PolarHBondContact NE-OH 2.9Å; F651-Y655 WeakPolarHBondContact O-CB 3.29Å; F651-Y655 PolarHBondContact O-N 3.47Å; Y655-S657 VanDerWaalsContact C-N 3.34Å; Y655-S657 PolarHBondContact O-N 3.49Å; Y655-F658 PolarHBondContact O-N 2.99Å; Y655-I659 HydrophobicContact CD1-CD1 3.46Å; Y655-I659 VanDerWaalsContact CD1-CD1 3.46Å; Y655-I659 HydrophobicContact CD2-CD1 4.35Å; Y655-I659 HydrophobicContact CE1-CD1 3.09Å; Y655-I659 HydrophobicContact CE1-CG1 4.24Å; Y655-I659 HydrophobicContact CE2-CD1 4.05Å; Y655-I659 HydrophobicContact CE2-CG1 4.41Å; Y655-I659 HydrophobicContact CG-CD1 4.06Å; Y655-I659 WeakPolarHBondContact O-CD1 3.47Å; Y655-I659 WeakPolarHBondContact O-CG1 3.44Å; Y655-I659 PolarHBondContact O-N 3.36Å
656	Q	65.6	Low	65.2	Low	75 Å²	75	104.1 Å²	104.1	35%	0.35	50%	0.495	S	S	.	.	H	α-helix	trans	-66.4	-36.1	177.3	-168	172	10.9	0	0	112.1	Y652 K660	Y652-Q656 VanDerWaalsContact CZ-OE1 3.22Å; Y652-Q656 VanDerWaalsContact O-CB 3.22Å; Y652-Q656 WeakPolarHBondContact O-CB 3.27Å; Y652-Q656 PolarHBondContact O-N 3.39Å; Y652-Q656 PolarHBondContact OH-OE1 3.49Å; Q656-K660 WeakPolarHBondContact O-CB 3.39Å; Q656-K660 PolarHBondContact O-N 3.31Å
657	S	68.1	Low	67	Low	76 Å²	76	98.3 Å²	98.3	53%	0.531	47%	0.471	S	S	.	.	H	α-helix	trans	-65.7	-43.7	173.7	-58.6	0	0	0	0	111.4	K653 Y654 Y655 K660 L661	K653-S657 WeakPolarHBondContact O-CB 3.43Å; K653-S657 PolarHBondContact O-N 3.35Å; K653-S657 PolarHBondContact O-OG 3.04Å; Y654-S657 PolarHBondContact O-N 3.22Å; Y655-S657 VanDerWaalsContact C-N 3.34Å; Y655-S657 PolarHBondContact O-N 3.49Å; S657-K660 PolarHBondContact O-N 3.48Å; S657-L661 PolarHBondContact O-N 2.91Å
658	F	72.8	Confident	69	Low	105 Å²	105	97.9 Å²	97.9	46%	0.461	47%	0.471	S	S	.	.	H	α-helix	trans	-63.4	-43.1	177.4	-171.4	-111.4	0	0	0	112.5	Y654 Y655 L661 I662	Y654-F658 WeakPolarHBondContact O-CB 3.29Å; Y654-F658 PolarHBondContact O-N 2.94Å; Y655-F658 PolarHBondContact O-N 2.99Å; F658-L661 WeakPolarHBondContact O-CB 3.38Å; F658-L661 PolarHBondContact O-N 3.18Å; F658-I662 HydrophobicContact CD1-CD1 3.49Å; F658-I662 VanDerWaalsContact CD1-CD1 3.49Å; F658-I662 HydrophobicContact CD1-CG1 4.45Å; F658-I662 HydrophobicContact CE1-CD1 3.23Å; F658-I662 HydrophobicContact CE1-CG1 4.28Å; F658-I662 HydrophobicContact CE2-CD1 4.46Å; F658-I662 HydrophobicContact CG-CD1 4.24Å; F658-I662 HydrophobicContact CZ-CD1 3.76Å; F658-I662 HydrophobicContact CZ-CG1 4.44Å; F658-I662 WeakPolarHBondContact O-CG1 3.29Å; F658-I662 PolarHBondContact O-N 3.06Å
659	I	71.3	Confident	70.9	Confident	26 Å²	26	98.3 Å²	98.3	13%	0.133	47%	0.47	C	S	.	.	H	α-helix	trans	-64.5	-41.1	175	-70.2	157.9	0	0	0	111.8	Y655 L661 I662 N663	Y655-I659 HydrophobicContact CD1-CD1 3.46Å; Y655-I659 VanDerWaalsContact CD1-CD1 3.46Å; Y655-I659 HydrophobicContact CD2-CD1 4.35Å; Y655-I659 HydrophobicContact CE1-CD1 3.09Å; Y655-I659 HydrophobicContact CE1-CG1 4.24Å; Y655-I659 HydrophobicContact CE2-CD1 4.05Å; Y655-I659 HydrophobicContact CE2-CG1 4.41Å; Y655-I659 HydrophobicContact CG-CD1 4.06Å; Y655-I659 WeakPolarHBondContact O-CD1 3.47Å; Y655-I659 WeakPolarHBondContact O-CG1 3.44Å; Y655-I659 PolarHBondContact O-N 3.36Å; I659-L661 VanDerWaalsContact C-N 3.3Å; I659-L661 PolarHBondContact O-N 3.46Å; I659-I662 PolarHBondContact O-N 3.49Å; I659-N663 WeakPolarHBondContact O-CB 3.46Å; I659-N663 PolarHBondContact O-N 3.38Å
660	K	73.8	Confident	72.6	Confident	76 Å²	76	91.2 Å²	91.2	33%	0.33	43%	0.433	S	S	.	.	H	α-helix	trans	-62.2	-42.8	178.1	-171.6	175.4	-179.9	178.2	0	110.4	N524 Q656 S657 N663 Q664	N524-K660 WeakPolarHBondContact OD1-CE 3.2Å; N524-K660 PolarHBondContact OD1-NZ 3.48Å; Q656-K660 WeakPolarHBondContact O-CB 3.39Å; Q656-K660 PolarHBondContact O-N 3.31Å; S657-K660 PolarHBondContact O-N 3.48Å; K660-N663 PolarHBondContact O-N 3.27Å; K660-Q664 WeakPolarHBondContact O-CB 3.26Å; K660-Q664 VanDerWaalsContact O-CG 3.29Å; K660-Q664 WeakPolarHBondContact O-CG 3.34Å; K660-Q664 PolarHBondContact O-N 3.3Å
661	L	81.5	Confident	74.3	Confident	90 Å²	90	89 Å²	89	47%	0.471	42%	0.416	S	S	.	.	H	α-helix	trans	-61.2	-47.8	173.3	-173.8	71.8	0	0	0	111.4	S657 F658 I659 N663 Q664 L665	S657-L661 PolarHBondContact O-N 2.91Å; F658-L661 WeakPolarHBondContact O-CB 3.38Å; F658-L661 PolarHBondContact O-N 3.18Å; I659-L661 VanDerWaalsContact C-N 3.3Å; I659-L661 PolarHBondContact O-N 3.46Å; L661-N663 PolarHBondContact O-N 3.17Å; L661-Q664 PolarHBondContact O-N 2.84Å; L661-L665 HydrophobicContact CG-CD1 4.05Å; L661-L665 HydrophobicContact CG-CG 4.49Å; L661-L665 WeakPolarHBondContact O-CB 3.48Å; L661-L665 VanDerWaalsContact O-CG 3.28Å; L661-L665 WeakPolarHBondContact O-CG 3.31Å; L661-L665 PolarHBondContact O-N 3.42Å
662	I	78.5	Confident	75.9	Confident	62 Å²	62	85.3 Å²	85.3	32%	0.318	40%	0.403	S	S	.	.	H	α-helix	trans	-58.4	-48.4	177.2	-74.2	168.6	0	0	0	111.2	F658 I659 Q664 L665 I666	F658-I662 HydrophobicContact CD1-CD1 3.49Å; F658-I662 VanDerWaalsContact CD1-CD1 3.49Å; F658-I662 HydrophobicContact CD1-CG1 4.45Å; F658-I662 HydrophobicContact CE1-CD1 3.23Å; F658-I662 HydrophobicContact CE1-CG1 4.28Å; F658-I662 HydrophobicContact CE2-CD1 4.46Å; F658-I662 HydrophobicContact CG-CD1 4.24Å; F658-I662 HydrophobicContact CZ-CD1 3.76Å; F658-I662 HydrophobicContact CZ-CG1 4.44Å; F658-I662 WeakPolarHBondContact O-CG1 3.29Å; F658-I662 PolarHBondContact O-N 3.06Å; I659-I662 PolarHBondContact O-N 3.49Å; I662-Q664 VanDerWaalsContact C-N 3.3Å; I662-Q664 PolarHBondContact O-N 3.38Å; I662-L665 CarbonylContact O-C 3.6Å; I662-L665 PolarHBondContact O-N 3.25Å; I662-L665 VanDerWaalsContact O-N 3.17Å; I662-I666 HydrophobicContact CG2-CD1 3.54Å; I662-I666 HydrophobicContact CG2-CG1 4.18Å; I662-I666 VanDerWaalsContact O-CG1 3.24Å; I662-I666 WeakPolarHBondContact O-CG1 3.45Å; I662-I666 PolarHBondContact O-N 3.11Å
663	N	76.6	Confident	77.4	Confident	93 Å²	93	80.4 Å²	80.4	50%	0.497	38%	0.384	S	S	.	.	H	α-helix	trans	-63.6	-37.4	179.8	-73.6	-13.5	0	0	0	111.9	I659 K660 L661 L667	I659-N663 WeakPolarHBondContact O-CB 3.46Å; I659-N663 PolarHBondContact O-N 3.38Å; K660-N663 PolarHBondContact O-N 3.27Å; L661-N663 PolarHBondContact O-N 3.17Å; N663-L667 WeakPolarHBondContact O-CB 3.37Å; N663-L667 PolarHBondContact O-N 3.24Å
664	Q	81	Confident	78.8	Confident	93 Å²	93	72.8 Å²	72.8	44%	0.435	35%	0.352	S	S	.	.	H	α-helix	trans	-65.3	-42.5	173.3	-75.9	177	-9.7	0	0	111.7	K660 L661 I662 L667 L668	K660-Q664 WeakPolarHBondContact O-CB 3.26Å; K660-Q664 VanDerWaalsContact O-CG 3.29Å; K660-Q664 WeakPolarHBondContact O-CG 3.34Å; K660-Q664 PolarHBondContact O-N 3.3Å; L661-Q664 PolarHBondContact O-N 2.84Å; I662-Q664 VanDerWaalsContact C-N 3.3Å; I662-Q664 PolarHBondContact O-N 3.38Å; Q664-L667 PolarHBondContact O-N 3.11Å; Q664-L668 VanDerWaalsContact O-CB 3.31Å; Q664-L668 WeakPolarHBondContact O-CB 3.46Å; Q664-L668 PolarHBondContact O-N 2.94Å
665	L	85.6	Confident	80.1	Confident	97 Å²	97	72.1 Å²	72.1	51%	0.508	35%	0.352	S	S	.	.	H	α-helix	trans	-64.4	-42.3	175.6	-72.3	170.9	0	0	0	111.7	L661 I662 L668 F669	L661-L665 HydrophobicContact CG-CD1 4.05Å; L661-L665 HydrophobicContact CG-CG 4.49Å; L661-L665 WeakPolarHBondContact O-CB 3.48Å; L661-L665 VanDerWaalsContact O-CG 3.28Å; L661-L665 WeakPolarHBondContact O-CG 3.31Å; L661-L665 PolarHBondContact O-N 3.42Å; I662-L665 CarbonylContact O-C 3.6Å; I662-L665 PolarHBondContact O-N 3.25Å; I662-L665 VanDerWaalsContact O-N 3.17Å; L665-L668 PolarHBondContact O-N 2.95Å; L665-F669 VanDerWaalsContact O-CB 3.23Å; L665-F669 WeakPolarHBondContact O-CB 3.21Å; L665-F669 PolarHBondContact O-N 3.25Å
666	I	82.8	Confident	81.2	Confident	47 Å²	47	73.2 Å²	73.2	24%	0.241	36%	0.359	C	S	.	.	H	α-helix	trans	-61.1	-46.2	175.2	-69.3	165.4	0	0	0	110.3	I662 L668 F669 N670 P1082	I662-I666 HydrophobicContact CG2-CD1 3.54Å; I662-I666 HydrophobicContact CG2-CG1 4.18Å; I662-I666 VanDerWaalsContact O-CG1 3.24Å; I662-I666 WeakPolarHBondContact O-CG1 3.45Å; I662-I666 PolarHBondContact O-N 3.11Å; I666-L668 VanDerWaalsContact C-N 3.33Å; I666-L668 PolarHBondContact O-N 3.13Å; I666-F669 PolarHBondContact O-N 3.5Å; I666-N670 WeakPolarHBondContact O-CB 3.48Å; I666-N670 VanDerWaalsContact O-CG 3.27Å; I666-N670 PolarHBondContact O-N 3.3Å; I666-N670 PolarHBondContact O-ND2 3.24Å; I666-P1082 HydrophobicContact CD1-CG 4.47Å
667	L	82.9	Confident	82.1	Confident	58 Å²	58	70.1 Å²	70.1	30%	0.304	35%	0.345	S	S	.	.	H	α-helix	trans	-62.9	-42.6	177.9	-178.4	66.5	0	0	0	111.4	N663 Q664 K671 N1078	N663-L667 WeakPolarHBondContact O-CB 3.37Å; N663-L667 PolarHBondContact O-N 3.24Å; Q664-L667 PolarHBondContact O-N 3.11Å; L667-K671 HydrophobicContact CG-CD 4.38Å; L667-K671 WeakPolarHBondContact O-CB 3.43Å; L667-K671 VanDerWaalsContact O-CG 3.3Å; L667-K671 WeakPolarHBondContact O-CG 3.29Å; L667-K671 PolarHBondContact O-N 3.02Å; L667-N1078 WeakPolarHBondContact CD1-ND2 3.23Å
668	L	87.7	Confident	83	Confident	100 Å²	100	71.5 Å²	71.5	52%	0.524	35%	0.346	S	S	.	.	H	α-helix	trans	-64.5	-45.3	177.4	-171.4	143.9	0	0	0	110.6	Q664 L665 I666 K671 L672	Q664-L668 VanDerWaalsContact O-CB 3.31Å; Q664-L668 WeakPolarHBondContact O-CB 3.46Å; Q664-L668 PolarHBondContact O-N 2.94Å; L665-L668 PolarHBondContact O-N 2.95Å; I666-L668 VanDerWaalsContact C-N 3.33Å; I666-L668 PolarHBondContact O-N 3.13Å; L668-K671 PolarHBondContact O-N 3.26Å; L668-L672 HydrophobicContact CD2-CD1 3.46Å; L668-L672 VanDerWaalsContact CD2-CD1 3.46Å; L668-L672 HydrophobicContact CD2-CG 4.02Å; L668-L672 VanDerWaalsContact O-CG 3.26Å; L668-L672 WeakPolarHBondContact O-CG 3.39Å; L668-L672 PolarHBondContact O-N 3.38Å
669	F	87.6	Confident	83.8	Confident	74 Å²	74	70.7 Å²	70.7	33%	0.325	35%	0.345	S	S	.	.	H	α-helix	trans	-57.6	-50.7	175.2	179.8	-105.9	0	0	0	111.9	L665 I666 K671 L672 I673 W1121 Y1125 I1126	L665-F669 VanDerWaalsContact O-CB 3.23Å; L665-F669 WeakPolarHBondContact O-CB 3.21Å; L665-F669 PolarHBondContact O-N 3.25Å; I666-F669 PolarHBondContact O-N 3.5Å; F669-K671 VanDerWaalsContact C-N 3.33Å; F669-K671 PolarHBondContact O-N 3.42Å; F669-L672 WeakPolarHBondContact O-CB 3.3Å; F669-L672 PolarHBondContact O-N 3Å; F669-L672 VanDerWaalsContact O-N 3.13Å; F669-I673 HydrophobicContact CD1-CD1 3.76Å; F669-I673 HydrophobicContact CE1-CD1 3.4Å; F669-I673 HydrophobicContact CE1-CG1 4.44Å; F669-I673 HydrophobicContact CE2-CD1 4.37Å; F669-I673 HydrophobicContact CG-CD1 4.41Å; F669-I673 HydrophobicContact CZ-CD1 3.74Å; F669-I673 HydrophobicContact CZ-CG1 4.46Å; F669-I673 WeakPolarHBondContact O-CG1 3.2Å; F669-I673 PolarHBondContact O-N 3.38Å; F669-W1121 HydrophobicContact CE1-CZ2 4.36Å; F669-W1121 HydrophobicContact CZ-CH2 4.23Å; F669-W1121 AromaticContact CZ-CZ2 3.96Å; F669-W1121 HydrophobicContact CZ-CZ2 3.96Å; F669-Y1125 HydrophobicContact CE1-CE1 4.48Å; F669-I1126 HydrophobicContact CZ-CD1 3.8Å; F669-I1126 HydrophobicContact CZ-CG1 4.15Å
670	N	86.6	Confident	84.8	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-39	177.6	-70.4	-18.1	0	0	0	112.2	I666 I674 L1074 L1077 N1078 Y1125	I666-N670 WeakPolarHBondContact O-CB 3.48Å; I666-N670 VanDerWaalsContact O-CG 3.27Å; I666-N670 PolarHBondContact O-N 3.3Å; I666-N670 PolarHBondContact O-ND2 3.24Å; N670-I674 PolarHBondContact O-N 3.14Å; N670-L1074 HydrophobicContact CB-CD1 3.92Å; N670-L1077 HydrophobicContact CB-CB 4.33Å; N670-N1078 PolarHBondContact ND2-OD1 3.07Å; N670-Y1125 PolarHBondContact OD1-OH 3.35Å
671	K	87.3	Confident	85.4	Confident	108 Å²	108	68.3 Å²	68.3	47%	0.47	34%	0.337	S	S	.	.	H	α-helix	trans	-65.8	-39.4	173.9	-77	178.9	179.1	-177.1	0	112.2	L667 L668 F669 I674 K675 L1074	L667-K671 HydrophobicContact CG-CD 4.38Å; L667-K671 WeakPolarHBondContact O-CB 3.43Å; L667-K671 VanDerWaalsContact O-CG 3.3Å; L667-K671 WeakPolarHBondContact O-CG 3.29Å; L667-K671 PolarHBondContact O-N 3.02Å; L668-K671 PolarHBondContact O-N 3.26Å; F669-K671 VanDerWaalsContact C-N 3.33Å; F669-K671 PolarHBondContact O-N 3.42Å; K671-I674 PolarHBondContact O-N 3.44Å; K671-K675 WeakPolarHBondContact O-CB 3.37Å; K671-K675 PolarHBondContact O-N 3.07Å; K671-L1074 HydrophobicContact CG-CD1 4.23Å; K671-L1074 HydrophobicContact CG-CD2 4.38Å
672	L	89	Confident	85.9	Confident	70 Å²	70	70 Å²	70	37%	0.366	34%	0.341	S	S	.	.	H	α-helix	trans	-64.4	-42.7	177.4	-72	175.6	0	0	0	111.4	L668 F669 I674 K675 F676	L668-L672 HydrophobicContact CD2-CD1 3.46Å; L668-L672 VanDerWaalsContact CD2-CD1 3.46Å; L668-L672 HydrophobicContact CD2-CG 4.02Å; L668-L672 VanDerWaalsContact O-CG 3.26Å; L668-L672 WeakPolarHBondContact O-CG 3.39Å; L668-L672 PolarHBondContact O-N 3.38Å; F669-L672 WeakPolarHBondContact O-CB 3.3Å; F669-L672 PolarHBondContact O-N 3Å; F669-L672 VanDerWaalsContact O-N 3.13Å; L672-I674 VanDerWaalsContact C-N 3.33Å; L672-I674 PolarHBondContact O-N 3.12Å; L672-K675 PolarHBondContact O-N 3.18Å; L672-F676 HydrophobicContact CB-CD2 4.37Å; L672-F676 HydrophobicContact CD2-CD2 4.4Å; L672-F676 HydrophobicContact CD2-CE2 3.88Å; L672-F676 WeakPolarHBondContact O-CD2 3.48Å; L672-F676 PolarHBondContact O-N 3.14Å
673	I	87.8	Confident	86.6	Confident	7 Å²	7	69 Å²	69	4%	0.036	34%	0.336	C	S	.	.	H	α-helix	trans	-56.4	-47.9	176.4	-67	169.1	0	0	0	110.6	F669 K675 F680 I1126 T1129	F669-I673 HydrophobicContact CD1-CD1 3.76Å; F669-I673 HydrophobicContact CE1-CD1 3.4Å; F669-I673 HydrophobicContact CE1-CG1 4.44Å; F669-I673 HydrophobicContact CE2-CD1 4.37Å; F669-I673 HydrophobicContact CG-CD1 4.41Å; F669-I673 HydrophobicContact CZ-CD1 3.74Å; F669-I673 HydrophobicContact CZ-CG1 4.46Å; F669-I673 WeakPolarHBondContact O-CG1 3.2Å; F669-I673 PolarHBondContact O-N 3.38Å; I673-K675 VanDerWaalsContact C-N 3.35Å; I673-K675 PolarHBondContact O-N 3.32Å; I673-F680 HydrophobicContact CG2-CE2 4.3Å; I673-F680 HydrophobicContact CG2-CZ 4.1Å; I673-F680 WeakPolarHBondContact O-CE2 3.42Å; I673-I1126 HydrophobicContact CD1-CG1 4.39Å; I673-I1126 HydrophobicContact CD1-CG2 4.07Å; I673-I1126 HydrophobicContact CG1-CG2 4.09Å; I673-T1129 WeakPolarHBondContact CG2-OG1 3.34Å
674	I	84.8	Confident	87.3	Confident	18 Å²	18	65.3 Å²	65.3	9%	0.092	32%	0.316	C	S	.	.	H	α-helix	trans	-68.2	-35.4	179.9	-63.5	175.3	0	0	0	111.5	N670 K671 L672 R1070 L1073 L1074 L1077 A1133	N670-I674 PolarHBondContact O-N 3.14Å; K671-I674 PolarHBondContact O-N 3.44Å; L672-I674 VanDerWaalsContact C-N 3.33Å; L672-I674 PolarHBondContact O-N 3.12Å; I674-R1070 HydrophobicContact CG2-CB 4.18Å; I674-R1070 HydrophobicContact CG2-CG 3.95Å; I674-L1073 HydrophobicContact CG1-CD2 4.5Å; I674-L1074 HydrophobicContact CD1-CB 3.73Å; I674-L1074 HydrophobicContact CD1-CD1 4Å; I674-L1074 HydrophobicContact CD1-CG 4.41Å; I674-L1077 HydrophobicContact CD1-CD1 4.21Å; I674-L1077 HydrophobicContact CG1-CD1 4.41Å; I674-A1133 HydrophobicContact CG2-CB 4.22Å
675	K	87.4	Confident	87.8	Confident	158 Å²	158	65.3 Å²	65.3	69%	0.687	32%	0.318	S	S	*	.	H	α-helix	trans	-69.4	-38.3	180	-172.6	178.9	179.8	-177.7	0	112.6	K671 L672 I673 N677	K671-K675 WeakPolarHBondContact O-CB 3.37Å; K671-K675 PolarHBondContact O-N 3.07Å; L672-K675 PolarHBondContact O-N 3.18Å; I673-K675 VanDerWaalsContact C-N 3.35Å; I673-K675 PolarHBondContact O-N 3.32Å; K675-N677 VanDerWaalsContact C-N 3.28Å; K675-N677 PolarHBondContact O-N 3.17Å
676	F	86.2	Confident	88.2	Confident	104 Å²	104	65.9 Å²	65.9	46%	0.456	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	29.5	-178.3	-71.7	-64	0	0	0	113.6	L672 L678 I679 F680	L672-F676 HydrophobicContact CB-CD2 4.37Å; L672-F676 HydrophobicContact CD2-CD2 4.4Å; L672-F676 HydrophobicContact CD2-CE2 3.88Å; L672-F676 WeakPolarHBondContact O-CD2 3.48Å; L672-F676 PolarHBondContact O-N 3.14Å; F676-L678 PolarHBondContact O-N 3.48Å; F676-L678 VanDerWaalsContact O-N 3.11Å; F676-I679 HydrophobicContact CB-CD1 4.12Å; F676-I679 HydrophobicContact CD1-CD1 3.85Å; F676-I679 HydrophobicContact CG-CD1 4.27Å; F676-I679 PolarHBondContact O-N 3.33Å; F676-I679 VanDerWaalsContact O-N 3.16Å; F676-F680 WeakPolarHBondContact O-CD2 3.42Å; F676-F680 VanDerWaalsContact O-CE2 3.29Å; F676-F680 WeakPolarHBondContact O-CE2 3.2Å
677	N	84.7	Confident	88.6	Confident	10 Å²	10	64.8 Å²	64.8	5%	0.053	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-30.3	-174.7	68.9	-22.8	0	0	0	114.8	K675 I679 P681 R1070 A1133 F1134 Q1137	K675-N677 VanDerWaalsContact C-N 3.28Å; K675-N677 PolarHBondContact O-N 3.17Å; N677-I679 VanDerWaalsContact C-N 3.27Å; N677-I679 PolarHBondContact O-N 3.39Å; N677-P681 WeakPolarHBondContact O-CD 3.24Å; N677-R1070 PolarHBondContact ND2-NH2 3.3Å; N677-A1133 HydrophobicContact CB-CB 4Å; N677-A1133 PolarHBondContact ND2-O 3.2Å; N677-F1134 HydrophobicContact CB-CB 4.19Å; N677-F1134 WeakPolarHBondContact ND2-CA 3.5Å; N677-Q1137 PolarHBondContact ND2-OE1 3.11Å
678	L	86.5	Confident	89	Confident	105 Å²	105	65 Å²	65	55%	0.55	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-24.5	-178.9	-168	70.8	0	0	0	113.6	F676 F682 F1134	F676-L678 PolarHBondContact O-N 3.48Å; F676-L678 VanDerWaalsContact O-N 3.11Å; L678-F682 WeakPolarHBondContact O-CD2 3.4Å; L678-F1134 HydrophobicContact CD1-CD2 4.31Å; L678-F1134 HydrophobicContact CD1-CE2 3.75Å
679	I	90.9	Very high	89.3	Confident	87 Å²	87	65.9 Å²	65.9	45%	0.446	32%	0.322	S	S	.	.	H	α-helix	trans	-78	-33.5	-173.7	-56.6	179.4	0	0	0	111.2	F676 N677 F682 I683	F676-I679 HydrophobicContact CB-CD1 4.12Å; F676-I679 HydrophobicContact CD1-CD1 3.85Å; F676-I679 HydrophobicContact CG-CD1 4.27Å; F676-I679 PolarHBondContact O-N 3.33Å; F676-I679 VanDerWaalsContact O-N 3.16Å; N677-I679 VanDerWaalsContact C-N 3.27Å; N677-I679 PolarHBondContact O-N 3.39Å; I679-F682 WeakPolarHBondContact O-CB 3.22Å; I679-F682 PolarHBondContact O-N 3.34Å; I679-F682 VanDerWaalsContact O-N 3.11Å; I679-I683 HydrophobicContact CG2-CD1 3.85Å; I679-I683 HydrophobicContact CG2-CG1 4.05Å; I679-I683 PolarHBondContact O-N 2.61Å
680	F	91	Very high	89.5	Confident	18 Å²	18	67.6 Å²	67.6	8%	0.079	33%	0.33	C	S	.	.	H	α-helix	trans	-63.4	-39.4	-170.9	-61	-73.6	0	0	0	115.3	I673 F676 F682 I683 I684 I1126 V1127 I1131	I673-F680 HydrophobicContact CG2-CE2 4.3Å; I673-F680 HydrophobicContact CG2-CZ 4.1Å; I673-F680 WeakPolarHBondContact O-CE2 3.42Å; F676-F680 WeakPolarHBondContact O-CD2 3.42Å; F676-F680 VanDerWaalsContact O-CE2 3.29Å; F676-F680 WeakPolarHBondContact O-CE2 3.2Å; F680-F682 VanDerWaalsContact C-N 3.3Å; F680-F682 PolarHBondContact O-N 2.96Å; F680-I683 HydrophobicContact CD1-CD1 4.06Å; F680-I683 WeakPolarHBondContact O-CB 3.21Å; F680-I683 PolarHBondContact O-N 3.32Å; F680-I684 PolarHBondContact O-N 3.41Å; F680-I684 VanDerWaalsContact O-N 3.15Å; F680-I1126 HydrophobicContact CE1-CG2 3.72Å; F680-I1126 HydrophobicContact CZ-CG2 4.12Å; F680-V1127 HydrophobicContact CB-CG1 4.33Å; F680-V1127 HydrophobicContact CD1-CB 4.33Å; F680-V1127 HydrophobicContact CD1-CG2 4.04Å; F680-I1131 HydrophobicContact CB-CG1 4.03Å
681	P	88	Confident	89.8	Confident	34 Å²	34	67.8 Å²	67.8	22%	0.221	33%	0.33	C	S	.	.	H	α-helix	trans	-58.4	-39.7	171.7	-25.8	34.8	0	0	0	113.2	N677 I684 I685 F1134	N677-P681 WeakPolarHBondContact O-CD 3.24Å; P681-I684 PolarHBondContact O-N 3.01Å; P681-I685 WeakPolarHBondContact O-CG1 3.38Å; P681-I685 PolarHBondContact O-N 3.28Å; P681-F1134 HydrophobicContact CG-CD1 3.95Å; P681-F1134 HydrophobicContact CG-CE1 4.2Å; P681-F1134 HydrophobicContact CG-CG 4.13Å
682	F	91.7	Very high	89.9	Confident	127 Å²	127	65.7 Å²	65.7	56%	0.557	33%	0.329	S	S	*	.	H	α-helix	trans	-67.8	-37.1	176.3	-69.4	-75.6	0	0	0	112.1	L678 I679 F680 I684 I685 I686	L678-F682 WeakPolarHBondContact O-CD2 3.4Å; I679-F682 WeakPolarHBondContact O-CB 3.22Å; I679-F682 PolarHBondContact O-N 3.34Å; I679-F682 VanDerWaalsContact O-N 3.11Å; F680-F682 VanDerWaalsContact C-N 3.3Å; F680-F682 PolarHBondContact O-N 2.96Å; F682-I684 VanDerWaalsContact C-N 3.34Å; F682-I684 PolarHBondContact O-N 3.27Å; F682-I685 PolarHBondContact O-N 3.38Å; F682-I686 WeakPolarHBondContact O-CB 3.3Å; F682-I686 VanDerWaalsContact O-CG1 3.27Å; F682-I686 WeakPolarHBondContact O-CG1 3.41Å; F682-I686 PolarHBondContact O-N 2.91Å
683	I	92.4	Very high	90	Very high	41 Å²	41	67.7 Å²	67.7	21%	0.21	33%	0.332	C	S	.	.	H	α-helix	trans	-56.9	-48.9	174.3	-68.3	171.3	0	0	0	110	I679 F680 I685 I686 T687 F1122 F1123 V1127	I679-I683 HydrophobicContact CG2-CD1 3.85Å; I679-I683 HydrophobicContact CG2-CG1 4.05Å; I679-I683 PolarHBondContact O-N 2.61Å; F680-I683 HydrophobicContact CD1-CD1 4.06Å; F680-I683 WeakPolarHBondContact O-CB 3.21Å; F680-I683 PolarHBondContact O-N 3.32Å; I683-I685 VanDerWaalsContact C-N 3.34Å; I683-I685 PolarHBondContact O-N 3.24Å; I683-I686 PolarHBondContact O-N 3.11Å; I683-T687 HydrophobicContact CG2-CG2 4.11Å; I683-T687 WeakPolarHBondContact O-CB 3.2Å; I683-T687 WeakPolarHBondContact O-CG2 3.41Å; I683-T687 PolarHBondContact O-N 3.15Å; I683-T687 PolarHBondContact O-OG1 3.46Å; I683-F1122 HydrophobicContact CG2-CE1 3.99Å; I683-F1122 HydrophobicContact CG2-CZ 4.18Å; I683-F1123 HydrophobicContact CG2-CE1 4.39Å; I683-V1127 HydrophobicContact CG2-CG2 4.47Å
684	I	91.4	Very high	90.2	Very high	14 Å²	14	68.1 Å²	68.1	7%	0.072	33%	0.334	C	S	.	.	H	α-helix	trans	-58.2	-44.9	178	-69.5	-166.8	0	0	0	112	F680 P681 F682 T687 L688 I1005 V1127 I1131	F680-I684 PolarHBondContact O-N 3.41Å; F680-I684 VanDerWaalsContact O-N 3.15Å; P681-I684 PolarHBondContact O-N 3.01Å; F682-I684 VanDerWaalsContact C-N 3.34Å; F682-I684 PolarHBondContact O-N 3.27Å; I684-T687 WeakPolarHBondContact CA-OG1 3.24Å; I684-T687 PolarHBondContact O-N 3Å; I684-T687 PolarHBondContact O-OG1 3.42Å; I684-L688 HydrophobicContact CG2-CD1 3.78Å; I684-L688 HydrophobicContact CG2-CG 4.31Å; I684-L688 WeakPolarHBondContact O-CB 3.5Å; I684-L688 VanDerWaalsContact O-CG 3.26Å; I684-L688 WeakPolarHBondContact O-CG 3.11Å; I684-L688 PolarHBondContact O-N 2.86Å; I684-I1005 HydrophobicContact CD1-CG2 4.18Å; I684-I1005 HydrophobicContact CG2-CG2 4.09Å; I684-V1127 HydrophobicContact CD1-CG1 3.77Å; I684-V1127 HydrophobicContact CG1-CG1 3.7Å; I684-I1131 HydrophobicContact CD1-CD1 3.2Å; I684-I1131 HydrophobicContact CG1-CD1 4.13Å
685	I	91.5	Very high	90.3	Very high	94 Å²	94	68.8 Å²	68.8	48%	0.482	34%	0.338	S	S	.	.	H	α-helix	trans	-65.2	-45.2	-178.3	-65.5	167.8	0	0	0	110.3	P681 F682 I683 L688 L689	P681-I685 WeakPolarHBondContact O-CG1 3.38Å; P681-I685 PolarHBondContact O-N 3.28Å; F682-I685 PolarHBondContact O-N 3.38Å; I683-I685 VanDerWaalsContact C-N 3.34Å; I683-I685 PolarHBondContact O-N 3.24Å; I685-L688 PolarHBondContact O-N 3.27Å; I685-L689 HydrophobicContact CG2-CD1 4.04Å; I685-L689 WeakPolarHBondContact O-CB 3.3Å; I685-L689 WeakPolarHBondContact O-CG 3.21Å; I685-L689 PolarHBondContact O-N 3.17Å
686	I	93.5	Very high	90.2	Very high	108 Å²	108	67.4 Å²	67.4	55%	0.554	34%	0.337	S	S	*	.	H	α-helix	trans	-63.9	-43.4	179.7	-68.3	167.5	0	0	0	110.7	F682 I683 L689 F690	F682-I686 WeakPolarHBondContact O-CB 3.3Å; F682-I686 VanDerWaalsContact O-CG1 3.27Å; F682-I686 WeakPolarHBondContact O-CG1 3.41Å; F682-I686 PolarHBondContact O-N 2.91Å; I683-I686 PolarHBondContact O-N 3.11Å; I686-L689 PolarHBondContact O-N 2.74Å; I686-F690 VanDerWaalsContact O-CB 3.31Å; I686-F690 WeakPolarHBondContact O-CB 3.42Å; I686-F690 PolarHBondContact O-N 3.12Å
687	T	92.2	Very high	90.2	Very high	25 Å²	25	70.4 Å²	70.4	15%	0.153	35%	0.346	C	S	.	.	H	α-helix	trans	-67.6	-40.3	-179.9	54	0	0	0	0	111.3	I683 I684 F690 T691 C1009 F1123	I683-T687 HydrophobicContact CG2-CG2 4.11Å; I683-T687 WeakPolarHBondContact O-CB 3.2Å; I683-T687 WeakPolarHBondContact O-CG2 3.41Å; I683-T687 PolarHBondContact O-N 3.15Å; I683-T687 PolarHBondContact O-OG1 3.46Å; I684-T687 WeakPolarHBondContact CA-OG1 3.24Å; I684-T687 PolarHBondContact O-N 3Å; I684-T687 PolarHBondContact O-OG1 3.42Å; T687-F690 PolarHBondContact O-N 2.99Å; T687-T691 VanDerWaalsContact O-CB 3.3Å; T687-T691 WeakPolarHBondContact O-CB 3.46Å; T687-T691 WeakPolarHBondContact O-CG2 3.3Å; T687-T691 PolarHBondContact O-N 3.4Å; T687-T691 PolarHBondContact O-OG1 3.33Å; T687-C1009 PolarHBondContact OG1-SG 3.32Å; T687-F1123 HydrophobicContact CG2-CE1 3.99Å; T687-F1123 HydrophobicContact CG2-CZ 3.72Å
688	L	91.5	Very high	90.3	Very high	61 Å²	61	73.4 Å²	73.4	32%	0.319	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-43	173.9	-72.9	174.5	0	0	0	112.1	I684 I685 T691 C692 C1009 L1012	I684-L688 HydrophobicContact CG2-CD1 3.78Å; I684-L688 HydrophobicContact CG2-CG 4.31Å; I684-L688 WeakPolarHBondContact O-CB 3.5Å; I684-L688 VanDerWaalsContact O-CG 3.26Å; I684-L688 WeakPolarHBondContact O-CG 3.11Å; I684-L688 PolarHBondContact O-N 2.86Å; I685-L688 PolarHBondContact O-N 3.27Å; L688-T691 WeakPolarHBondContact CA-OG1 3.44Å; L688-T691 PolarHBondContact O-OG1 2.73Å; L688-C692 WeakPolarHBondContact O-CB 3.12Å; L688-C692 PolarHBondContact O-N 2.76Å; L688-C1009 HydrophobicContact CD2-CB 4.48Å; L688-L1012 HydrophobicContact CD2-CD1 3.76Å
689	L	93.1	Very high	90	Very high	120 Å²	120	76.2 Å²	76.2	63%	0.628	36%	0.364	S	S	*	.	H	α-helix	trans	-65.1	-45.1	176.6	-72.2	173.2	0	0	0	112	I685 I686 Y693	I685-L689 HydrophobicContact CG2-CD1 4.04Å; I685-L689 WeakPolarHBondContact O-CB 3.3Å; I685-L689 WeakPolarHBondContact O-CG 3.21Å; I685-L689 PolarHBondContact O-N 3.17Å; I686-L689 PolarHBondContact O-N 2.74Å; L689-Y693 WeakPolarHBondContact O-CB 3.36Å; L689-Y693 PolarHBondContact O-N 3.03Å
690	F	92.7	Very high	89.3	Confident	110 Å²	110	76.3 Å²	76.3	48%	0.482	36%	0.362	S	S	.	.	H	α-helix	trans	-63.8	-45.7	178.5	-179.5	-100.8	0	0	0	111.6	I686 T687 Y693 Q694	I686-F690 VanDerWaalsContact O-CB 3.31Å; I686-F690 WeakPolarHBondContact O-CB 3.42Å; I686-F690 PolarHBondContact O-N 3.12Å; T687-F690 PolarHBondContact O-N 2.99Å; F690-Y693 PolarHBondContact O-N 2.92Å; F690-Q694 HydrophobicContact CD1-CG 4.19Å; F690-Q694 HydrophobicContact CE1-CG 3.77Å; F690-Q694 HydrophobicContact CE2-CG 4.13Å; F690-Q694 HydrophobicContact CZ-CG 3.75Å; F690-Q694 WeakPolarHBondContact O-CG 3.45Å; F690-Q694 PolarHBondContact O-N 3.09Å
691	T	92.3	Very high	88.7	Confident	4 Å²	4	78.4 Å²	78.4	3%	0.025	37%	0.371	C	S	.	.	H	α-helix	trans	-65.7	-42.1	-179.7	54.4	0	0	0	0	111.8	T687 L688 Y693 Q694 L695 L1012 T1016	T687-T691 VanDerWaalsContact O-CB 3.3Å; T687-T691 WeakPolarHBondContact O-CB 3.46Å; T687-T691 WeakPolarHBondContact O-CG2 3.3Å; T687-T691 PolarHBondContact O-N 3.4Å; T687-T691 PolarHBondContact O-OG1 3.33Å; L688-T691 WeakPolarHBondContact CA-OG1 3.44Å; L688-T691 PolarHBondContact O-OG1 2.73Å; T691-Y693 VanDerWaalsContact C-N 3.33Å; T691-Y693 PolarHBondContact O-N 3.36Å; T691-Q694 PolarHBondContact O-N 3.41Å; T691-L695 WeakPolarHBondContact O-CB 3.34Å; T691-L695 WeakPolarHBondContact O-CG 3.35Å; T691-L695 PolarHBondContact O-N 3.15Å; T691-L1012 HydrophobicContact CG2-CB 4.22Å; T691-T1016 HydrophobicContact CG2-CG2 3.76Å
692	C	89.8	Confident	88	Confident	64 Å²	64	80 Å²	80	43%	0.432	38%	0.377	S	S	.	.	H	α-helix	trans	-58.8	-43.1	173.6	-173.9	0	0	0	0	111.9	L688 L696	L688-C692 WeakPolarHBondContact O-CB 3.12Å; L688-C692 PolarHBondContact O-N 2.76Å; C692-L696 VanDerWaalsContact O-CB 3.29Å; C692-L696 WeakPolarHBondContact O-CB 3.26Å; C692-L696 PolarHBondContact O-N 3.18Å; C692-L696 VanDerWaalsContact SG-CD1 3.53Å
693	Y	91.2	Very high	87	Confident	112 Å²	112	77.2 Å²	77.2	44%	0.439	37%	0.368	S	S	.	.	I	π-helix	trans	-64.2	-45.8	176.8	176.4	-99.1	0	0	0	112.6	L689 F690 T691 W697 L698	L689-Y693 WeakPolarHBondContact O-CB 3.36Å; L689-Y693 PolarHBondContact O-N 3.03Å; F690-Y693 PolarHBondContact O-N 2.92Å; T691-Y693 VanDerWaalsContact C-N 3.33Å; T691-Y693 PolarHBondContact O-N 3.36Å; Y693-W697 HydrophobicContact CD2-CB 4.15Å; Y693-W697 HydrophobicContact CD2-CD2 4.17Å; Y693-W697 AromaticContact CD2-CE3 3.85Å; Y693-W697 HydrophobicContact CD2-CE3 3.85Å; Y693-W697 HydrophobicContact CD2-CG 4.29Å; Y693-W697 HydrophobicContact CE1-CE3 4.12Å; Y693-W697 HydrophobicContact CE1-CZ3 4.31Å; Y693-W697 AromaticContact CE2-CD2 3.69Å; Y693-W697 HydrophobicContact CE2-CD2 3.69Å; Y693-W697 AromaticContact CE2-CE3 3.15Å; Y693-W697 HydrophobicContact CE2-CE3 3.15Å; Y693-W697 HydrophobicContact CE2-CG 4.27Å; Y693-W697 HydrophobicContact CE2-CH2 4.43Å; Y693-W697 AromaticContact CE2-CZ3 3.6Å; Y693-W697 HydrophobicContact CE2-CZ3 3.6Å; Y693-W697 AromaticContact CZ-CE3 3.33Å; Y693-W697 AromaticContact CZ-CZ3 3.39Å; Y693-W697 WeakPolarHBondContact O-CB 3.34Å; Y693-W697 PolarHBondContact O-N 2.8Å; Y693-W697 WeakPolarHBondContact OH-CZ3 3.34Å; Y693-L698 HydrophobicContact CE1-CD1 4.07Å; Y693-L698 HydrophobicContact CE1-CG 4.36Å; Y693-L698 PolarHBondContact O-N 3.42Å; Y693-L698 VanDerWaalsContact O-N 3.12Å
694	Q	91	Very high	85.7	Confident	17 Å²	17	75.7 Å²	75.7	8%	0.079	36%	0.36	C	S	.	.	I	π-helix	trans	-67	-44	179.8	-65.2	-66.6	-31.6	0	0	112.5	F690 T691 T1016	F690-Q694 HydrophobicContact CD1-CG 4.19Å; F690-Q694 HydrophobicContact CE1-CG 3.77Å; F690-Q694 HydrophobicContact CE2-CG 4.13Å; F690-Q694 HydrophobicContact CZ-CG 3.75Å; F690-Q694 WeakPolarHBondContact O-CG 3.45Å; F690-Q694 PolarHBondContact O-N 3.09Å; T691-Q694 PolarHBondContact O-N 3.41Å; Q694-T1016 HydrophobicContact CB-CG2 4.24Å
695	L	87.1	Confident	84.2	Confident	31 Å²	31	78.1 Å²	78.1	16%	0.162	38%	0.379	C	S	.	.	I	π-helix	trans	-79.6	-49.2	-175.2	-63.6	176.6	0	0	0	112.5	T691 R699 F701 L1012 I1015 T1016	T691-L695 WeakPolarHBondContact O-CB 3.34Å; T691-L695 WeakPolarHBondContact O-CG 3.35Å; T691-L695 PolarHBondContact O-N 3.15Å; L695-R699 WeakPolarHBondContact O-CA 3.24Å; L695-F701 HydrophobicContact CD2-CB 4.13Å; L695-L1012 HydrophobicContact CD1-CD2 4.07Å; L695-I1015 HydrophobicContact CD1-CG2 4.48Å; L695-I1015 HydrophobicContact CD2-CG2 4.03Å; L695-T1016 HydrophobicContact CD1-CG2 3.77Å; L695-T1016 HydrophobicContact CD2-CG2 3.75Å; L695-T1016 HydrophobicContact CG-CG2 3.51Å
696	L	86.4	Confident	82.7	Confident	129 Å²	129	75.5 Å²	75.5	68%	0.675	37%	0.366	S	S	*	.	I	π-helix	trans	-86.6	-43.9	-172.9	-58.2	-177.2	0	0	0	112.7	C692 R699	C692-L696 VanDerWaalsContact O-CB 3.29Å; C692-L696 WeakPolarHBondContact O-CB 3.26Å; C692-L696 PolarHBondContact O-N 3.18Å; C692-L696 VanDerWaalsContact SG-CD1 3.53Å; L696-R699 WeakPolarHBondContact O-CG 3.16Å
697	W	85	Confident	81	Confident	168 Å²	168	71.2 Å²	71.2	64%	0.636	34%	0.343	S	S	*	.	I	π-helix	trans	-84.4	-51.6	-173.1	-175.7	80.8	0	0	0	112.4	Y693 R699	Y693-W697 HydrophobicContact CD2-CB 4.15Å; Y693-W697 HydrophobicContact CD2-CD2 4.17Å; Y693-W697 AromaticContact CD2-CE3 3.85Å; Y693-W697 HydrophobicContact CD2-CE3 3.85Å; Y693-W697 HydrophobicContact CD2-CG 4.29Å; Y693-W697 HydrophobicContact CE1-CE3 4.12Å; Y693-W697 HydrophobicContact CE1-CZ3 4.31Å; Y693-W697 AromaticContact CE2-CD2 3.69Å; Y693-W697 HydrophobicContact CE2-CD2 3.69Å; Y693-W697 AromaticContact CE2-CE3 3.15Å; Y693-W697 HydrophobicContact CE2-CE3 3.15Å; Y693-W697 HydrophobicContact CE2-CG 4.27Å; Y693-W697 HydrophobicContact CE2-CH2 4.43Å; Y693-W697 AromaticContact CE2-CZ3 3.6Å; Y693-W697 HydrophobicContact CE2-CZ3 3.6Å; Y693-W697 AromaticContact CZ-CE3 3.33Å; Y693-W697 AromaticContact CZ-CZ3 3.39Å; Y693-W697 WeakPolarHBondContact O-CB 3.34Å; Y693-W697 PolarHBondContact O-N 2.8Å; Y693-W697 WeakPolarHBondContact OH-CZ3 3.34Å; W697-R699 PolarHBondContact O-N 3.22Å
698	L	86.4	Confident	79.3	Confident	72 Å²	72	73 Å²	73	38%	0.377	35%	0.348	S	S	.	.	S	Bend	trans	-73	-13.7	175.9	-74.8	175.6	0	0	0	113.3	Y693 K700	Y693-L698 HydrophobicContact CE1-CD1 4.07Å; Y693-L698 HydrophobicContact CE1-CG 4.36Å; Y693-L698 PolarHBondContact O-N 3.42Å; Y693-L698 VanDerWaalsContact O-N 3.12Å; L698-K700 HydrophobicContact CB-CG 4Å; L698-K700 HydrophobicContact CD1-CD 4.46Å; L698-K700 PolarHBondContact O-N 3.12Å; L698-K700 VanDerWaalsContact O-N 3.17Å
699	R	81.9	Confident	77.3	Confident	164 Å²	164	71.4 Å²	71.4	62%	0.619	34%	0.338	S	S	*	.			trans	48.1	42.6	-176.3	-61.6	178.8	60.2	172.7	0.9	111.8	L695 L696 W697 F701 N702	L695-R699 WeakPolarHBondContact O-CA 3.24Å; L696-R699 WeakPolarHBondContact O-CG 3.16Å; W697-R699 PolarHBondContact O-N 3.22Å; R699-F701 PolarHBondContact O-N 2.78Å; R699-N702 PolarHBondContact O-ND2 3.34Å; R699-N702 PolarHBondContact O-OD1 3.07Å
700	K	75.3	Confident	75.2	Confident	90 Å²	90	66 Å²	66	39%	0.391	31%	0.311	S	S	.	.			trans	-65.1	-32.7	-179.8	-80	-175.5	170.1	175.3	0	112	L698 N702 C1020	L698-K700 HydrophobicContact CB-CG 4Å; L698-K700 HydrophobicContact CD1-CD 4.46Å; L698-K700 PolarHBondContact O-N 3.12Å; L698-K700 VanDerWaalsContact O-N 3.17Å; K700-N702 PolarHBondContact O-N 2.83Å; K700-C1020 PolarHBondContact NZ-SG 3.17Å; K700-C1020 VanDerWaalsContact NZ-SG 3.44Å
701	F	77.5	Confident	73.5	Confident	61 Å²	61	62.4 Å²	62.4	27%	0.268	30%	0.299	S	S	.	.	S	Bend	trans	-89.8	93	175.7	-165.9	-116.7	0	0	0	110.4	L695 R699 T1019 L1026 I1034	L695-F701 HydrophobicContact CD2-CB 4.13Å; R699-F701 PolarHBondContact O-N 2.78Å; F701-T1019 HydrophobicContact CB-CG2 4.05Å; F701-T1019 HydrophobicContact CD2-CG2 3.58Å; F701-T1019 HydrophobicContact CE2-CG2 4.45Å; F701-T1019 HydrophobicContact CG-CG2 4.21Å; F701-L1026 HydrophobicContact CE1-CB 4.34Å; F701-L1026 HydrophobicContact CE1-CD1 4.1Å; F701-L1026 HydrophobicContact CE2-CB 4.4Å; F701-L1026 HydrophobicContact CZ-CB 3.94Å; F701-L1026 HydrophobicContact CZ-CD1 3.59Å; F701-L1026 HydrophobicContact CZ-CG 4.31Å; F701-I1034 HydrophobicContact CE1-CD1 4.34Å; F701-I1034 HydrophobicContact CE2-CD1 4.12Å; F701-I1034 HydrophobicContact CZ-CD1 3.52Å
702	N	74.1	Confident	72.4	Confident	68 Å²	68	63.4 Å²	63.4	36%	0.364	31%	0.305	S	S	.	.			trans	-115.9	154.1	179.3	-74.9	-31.1	0	0	0	111.8	R699 K700 L1026	R699-N702 PolarHBondContact O-ND2 3.34Å; R699-N702 PolarHBondContact O-OD1 3.07Å; K700-N702 PolarHBondContact O-N 2.83Å; N702-L1026 PolarHBondContact O-N 2.95Å
703	I	71.1	Confident	71.8	Confident	68 Å²	68	60.7 Å²	60.7	35%	0.349	29%	0.286	S	S	.	.			trans	-63.2	137.1	163.1	-57.2	161.9	0	0	0	107	S705 H927 T968 T972 L1026	I703-S705 PolarHBondContact O-N 2.95Å; I703-H927 HydrophobicContact CG2-CB 4.4Å; I703-T968 HydrophobicContact CG2-CG2 4.04Å; I703-T972 HydrophobicContact CD1-CG2 3.85Å; I703-T972 HydrophobicContact CG1-CG2 4.1Å; I703-L1026 HydrophobicContact CG1-CD2 4.41Å
704	P	65.1	Low	71.3	Confident	9 Å²	9	55.4 Å²	55.4	6%	0.058	27%	0.265	C	S	.	.			trans	-55.2	126.1	175.7	21.2	-32.5	0	0	0	111	N706 H709 K1025 L1026	P704-N706 VanDerWaalsContact C-N 3.25Å; P704-N706 PolarHBondContact O-N 3.43Å; P704-H709 HydrophobicContact CB-CB 3.47Å; P704-H709 VanDerWaalsContact CB-CB 3.47Å; P704-H709 HydrophobicContact CG-CB 4.16Å; P704-K1025 HydrophobicContact CB-CD 4.46Å; P704-L1026 WeakPolarHBondContact CD-O 3.17Å
705	S	59.6	Low	70.8	Confident	66 Å²	66	56.5 Å²	56.5	46%	0.462	27%	0.274	S	S	.	.	S	Bend	trans	-67.3	-29.4	179.1	60.9	0	0	0	0	112.5	I703	I703-S705 PolarHBondContact O-N 2.95Å
706	N	60.8	Low	70.4	Confident	38 Å²	38	58.9 Å²	58.9	20%	0.203	29%	0.286	C	S	.	.	S	Bend	trans	-112	132.9	-178.4	-66.1	13.6	0	0	0	109.7	P704 Y708 H709	P704-N706 VanDerWaalsContact C-N 3.25Å; P704-N706 PolarHBondContact O-N 3.43Å; N706-Y708 PolarHBondContact O-N 3.35Å; N706-H709 PolarHBondContact O-N 2.84Å
707	H	57.2	Low	70.1	Confident	18 Å²	18	59.6 Å²	59.6	8%	0.083	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-59.1	-15.9	-175.2	-79	73.4	0	0	0	115.3	H709 S710 L922 I930 F965	H707-H709 VanDerWaalsContact C-N 3.31Å; H707-H709 PolarHBondContact O-N 3.04Å; H707-S710 PolarHBondContact O-OG 2.87Å; H707-L922 HydrophobicContact CB-CG 4.32Å; H707-L922 VanDerWaalsContact CD2-CD1 3.48Å; H707-L922 WeakPolarHBondContact CD2-CD1 3.46Å; H707-L922 PolarHBondContact ND1-O 3.26Å; H707-I930 WeakPolarHBondContact CE1-CD1 3.19Å; H707-F965 AromaticContact NE2-CD2 3.29Å; H707-F965 VanDerWaalsContact NE2-CD2 3.29Å; H707-F965 WeakPolarHBondContact NE2-CD2 3.48Å; H707-F965 AromaticContact NE2-CG 3.86Å
708	Y	55.5	Low	70.1	Confident	64 Å²	64	52.8 Å²	52.8	25%	0.251	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-67.9	-29.5	179	-70.2	-72.5	0	0	0	113.2	N706 S710 T712 I923	N706-Y708 PolarHBondContact O-N 3.35Å; Y708-S710 VanDerWaalsContact C-N 3.35Å; Y708-S710 PolarHBondContact O-N 3Å; Y708-T712 VanDerWaalsContact O-CG2 3.27Å; Y708-T712 WeakPolarHBondContact O-CG2 3.46Å; Y708-I923 HydrophobicContact CE2-CD1 4.36Å; Y708-I923 HydrophobicContact CE2-CG1 4.01Å; Y708-I923 HydrophobicContact CE2-CG2 4.2Å; Y708-I923 WeakPolarHBondContact OH-CD1 3.28Å; Y708-I923 WeakPolarHBondContact OH-CG1 3.34Å
709	H	49.9	Very low	70.1	Confident	26 Å²	26	50.4 Å²	50.4	12%	0.12	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-76.9	-14.7	-172.4	-69.9	-76.5	0	0	0	114.7	P704 N706 H707 S711 H725	P704-H709 HydrophobicContact CB-CB 3.47Å; P704-H709 VanDerWaalsContact CB-CB 3.47Å; P704-H709 HydrophobicContact CG-CB 4.16Å; N706-H709 PolarHBondContact O-N 2.84Å; H707-H709 VanDerWaalsContact C-N 3.31Å; H707-H709 PolarHBondContact O-N 3.04Å; H709-S711 PolarHBondContact O-N 2.93Å; H709-H725 AromaticContact CE1-CD2 3.44Å; H709-H725 PolarHBondContact CE1-CD2 3.48Å; H709-H725 VanDerWaalsContact CE1-CD2 3.44Å; H709-H725 AromaticContact CE1-NE2 3.64Å; H709-H725 AromaticContact NE2-CD2 3.06Å; H709-H725 PolarHBondContact NE2-CD2 3.42Å; H709-H725 AromaticContact NE2-NE2 3.14Å; H709-H725 PolarHBondContact NE2-NE2 2.94Å; H709-H725 VanDerWaalsContact NE2-NE2 3.14Å
710	S	49.6	Very low	70.3	Confident	8 Å²	8	43 Å²	43	6%	0.056	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-72.5	-15.2	-175.3	50.8	0	0	0	0	113.2	H707 Y708 I1028	H707-S710 PolarHBondContact O-OG 2.87Å; Y708-S710 VanDerWaalsContact C-N 3.35Å; Y708-S710 PolarHBondContact O-N 3Å; S710-I1028 WeakPolarHBondContact O-CD1 3.42Å
711	S	56.8	Low	70.7	Confident	34 Å²	34	39.3 Å²	39.3	24%	0.238	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-144.4	44.2	-175.8	69.7	0	0	0	0	112.5	F59 H709	F59-S711 WeakPolarHBondContact CE1-O 3.47Å; H709-S711 PolarHBondContact O-N 2.93Å
712	T	69.8	Low	71	Confident	24 Å²	24	38.4 Å²	38.4	15%	0.147	21%	0.208	C	C	.	.			trans	-92.4	126.7	172.5	53.3	0	0	0	0	110.2	Y708 E721	Y708-T712 VanDerWaalsContact O-CG2 3.27Å; Y708-T712 WeakPolarHBondContact O-CG2 3.46Å; T712-E721 VanDerWaalsContact CG2-OE2 3.29Å; T712-E721 WeakPolarHBondContact CG2-OE2 3.29Å
713	F	75.9	Confident	71.5	Confident	8 Å²	8	35.2 Å²	35.2	4%	0.035	19%	0.191	C	C	.	.			trans	-88.2	-17.3	171	-70.2	-76.9	0	0	0	112.7	P58 F59 F62 Y396 V400 V461 L1104	P58-F713 HydrophobicContact CB-CD2 4.11Å; P58-F713 HydrophobicContact CB-CE1 4.34Å; P58-F713 HydrophobicContact CB-CE2 3.54Å; P58-F713 HydrophobicContact CB-CZ 3.68Å; P58-F713 HydrophobicContact CG-CD2 4.06Å; P58-F713 HydrophobicContact CG-CE2 3.76Å; P58-F713 HydrophobicContact CG-CZ 4.41Å; P58-F713 WeakPolarHBondContact O-CZ 3.4Å; F59-F713 AromaticContact CD1-CE2 3.73Å; F59-F713 HydrophobicContact CD1-CE2 3.73Å; F59-F713 HydrophobicContact CD2-CE2 4.44Å; F59-F713 AromaticContact CE1-CD2 3.79Å; F59-F713 HydrophobicContact CE1-CD2 3.79Å; F59-F713 AromaticContact CE1-CE2 3.34Å; F59-F713 HydrophobicContact CE1-CE2 3.34Å; F59-F713 HydrophobicContact CE1-CZ 4.43Å; F59-F713 HydrophobicContact CE2-CD2 4.28Å; F59-F713 HydrophobicContact CE2-CE2 4.13Å; F59-F713 HydrophobicContact CG-CE2 4.27Å; F59-F713 AromaticContact CZ-CD2 3.62Å; F59-F713 HydrophobicContact CZ-CD2 3.62Å; F59-F713 AromaticContact CZ-CE2 3.57Å; F59-F713 HydrophobicContact CZ-CE2 3.57Å; F62-F713 HydrophobicContact CD2-CZ 4.41Å; F62-F713 HydrophobicContact CE2-CE1 4.25Å; F62-F713 HydrophobicContact CE2-CE2 4.5Å; F62-F713 AromaticContact CE2-CZ 3.53Å; F62-F713 HydrophobicContact CE2-CZ 3.53Å; F62-F713 HydrophobicContact CZ-CE1 4.15Å; F62-F713 AromaticContact CZ-CZ 3.8Å; F62-F713 HydrophobicContact CZ-CZ 3.8Å; Y396-F713 PolarHBondContact OH-N 2.72Å; V400-F713 HydrophobicContact CG1-CB 3.92Å; V400-F713 HydrophobicContact CG1-CD2 4.36Å; V400-F713 HydrophobicContact CG1-CG 4.09Å; V400-F713 HydrophobicContact CG2-CB 4.15Å; V461-F713 HydrophobicContact CG1-CE1 4.49Å; F713-L1104 VanDerWaalsContact O-CB 3.25Å; F713-L1104 WeakPolarHBondContact O-CB 3.38Å; F713-L1104 PolarHBondContact O-N 3.26Å
714	L	82.1	Confident	71.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-102.8	149.3	-177.4	-61.9	170.4	0	0	0	110.7	Y396 V400 L403 H718 L720 E721	Y396-L714 HydrophobicContact CD2-CD1 4.36Å; Y396-L714 HydrophobicContact CE2-CD1 3.56Å; Y396-L714 HydrophobicContact CE2-CG 4.41Å; V400-L714 HydrophobicContact CG2-CD1 4.5Å; V400-L714 HydrophobicContact CG2-CG 4.39Å; L403-L714 HydrophobicContact CD1-CD2 3.38Å; L714-H718 HydrophobicContact CB-CB 4.06Å; L714-L720 HydrophobicContact CD1-CB 4.48Å; L714-E721 HydrophobicContact CB-CG 3.69Å
715	P	80.9	Confident	72.3	Confident	41 Å²	41	36.4 Å²	36.4	27%	0.266	20%	0.196	S	C	.	.			trans	-64.8	149.8	174.5	25.9	-34.2	0	0	0	110.4	N717 H718 N1102	P715-N717 PolarHBondContact O-N 2.66Å; P715-H718 HydrophobicContact CG-CB 4.34Å; P715-H718 WeakPolarHBondContact O-CB 3.41Å; P715-H718 PolarHBondContact O-N 3.15Å; P715-N1102 WeakPolarHBondContact CD-O 3.35Å
716	I	77.9	Confident	73.1	Confident	81 Å²	81	37.5 Å²	37.5	42%	0.415	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.9	-177.8	-62	167.9	0	0	0	112.6	H718	I716-H718 VanDerWaalsContact C-N 3.28Å; I716-H718 PolarHBondContact O-N 2.83Å
717	N	79.6	Confident	73.9	Confident	143 Å²	143	35.7 Å²	35.7	77%	0.765	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-9.3	178.8	-63.7	-11.2	0	0	0	113.5	P715	P715-N717 PolarHBondContact O-N 2.66Å
718	H	85.8	Confident	74.8	Confident	25 Å²	25	35 Å²	35	12%	0.116	18%	0.18	C	C	.	.	S	Bend	trans	-66.4	138.8	177.5	-164.2	-92.1	0	0	0	109.9	F366 L714 P715 I716 L720 E721 Q722	F366-H718 AromaticContact CZ-CE1 3.67Å; L714-H718 HydrophobicContact CB-CB 4.06Å; P715-H718 HydrophobicContact CG-CB 4.34Å; P715-H718 WeakPolarHBondContact O-CB 3.41Å; P715-H718 PolarHBondContact O-N 3.15Å; I716-H718 VanDerWaalsContact C-N 3.28Å; I716-H718 PolarHBondContact O-N 2.83Å; H718-L720 VanDerWaalsContact CE1-CD1 3.41Å; H718-L720 WeakPolarHBondContact CE1-CD1 3.44Å; H718-L720 PolarHBondContact ND1-N 3.1Å; H718-L720 PolarHBondContact O-N 2.85Å; H718-L720 VanDerWaalsContact O-N 3.13Å; H718-E721 HydrophobicContact CB-CB 4.49Å; H718-E721 HydrophobicContact CB-CG 4.41Å; H718-E721 PolarHBondContact O-N 3.44Å; H718-Q722 PolarHBondContact O-N 3.29Å
719	P	86.1	Confident	75.3	Confident	22 Å²	22	33.5 Å²	33.5	14%	0.143	18%	0.176	C	C	.	.	H	α-helix	trans	-58.8	-30.6	-175	21.9	-35.2	0	0	0	114	F366 F388 G390 I391 F723	F366-P719 HydrophobicContact CE2-CG 4.1Å; F366-P719 HydrophobicContact CZ-CG 4.15Å; F388-P719 HydrophobicContact CD1-CB 4.11Å; F388-P719 HydrophobicContact CE1-CB 3.51Å; F388-P719 HydrophobicContact CE1-CG 3.81Å; F388-P719 HydrophobicContact CZ-CB 4.28Å; G390-P719 WeakPolarHBondContact CA-O 3.37Å; I391-P719 HydrophobicContact CG2-CB 4.25Å; I391-P719 PolarHBondContact N-O 3.08Å; P719-F723 PolarHBondContact O-N 2.85Å
720	L	86.3	Confident	76.1	Confident	8 Å²	8	39.4 Å²	39.4	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-66.8	-45.6	173.6	-79.9	87.9	0	0	0	112.1	F366 I391 Y396 I399 L714 H718 F723 T724	F366-L720 HydrophobicContact CD2-CD1 3.95Å; F366-L720 HydrophobicContact CE1-CD1 4.26Å; F366-L720 HydrophobicContact CE2-CD1 3.4Å; F366-L720 VanDerWaalsContact CE2-CD1 3.4Å; F366-L720 HydrophobicContact CZ-CD1 3.58Å; I391-L720 HydrophobicContact CG2-CD1 3.75Å; I391-L720 HydrophobicContact CG2-CG 4.06Å; I391-L720 WeakPolarHBondContact O-CA 3.42Å; Y396-L720 HydrophobicContact CD2-CD2 3.88Å; I399-L720 HydrophobicContact CD1-CD1 4.41Å; I399-L720 HydrophobicContact CD1-CD2 3.91Å; L714-L720 HydrophobicContact CD1-CB 4.48Å; H718-L720 VanDerWaalsContact CE1-CD1 3.41Å; H718-L720 WeakPolarHBondContact CE1-CD1 3.44Å; H718-L720 PolarHBondContact ND1-N 3.1Å; H718-L720 PolarHBondContact O-N 2.85Å; H718-L720 VanDerWaalsContact O-N 3.13Å; L720-F723 PolarHBondContact O-N 3.45Å; L720-T724 PolarHBondContact O-N 3.11Å
721	E	83.7	Confident	77.3	Confident	14 Å²	14	39.3 Å²	39.3	7%	0.065	20%	0.203	C	C	.	.	H	α-helix	trans	-72.6	-34	179.2	-65.6	-60.9	164.4	0	0	112.2	Y396 T712 L714 H718 F723 T724 H725	Y396-E721 WeakPolarHBondContact CE2-OE1 3.47Å; Y396-E721 PolarHBondContact OH-OE1 3.05Å; T712-E721 VanDerWaalsContact CG2-OE2 3.29Å; T712-E721 WeakPolarHBondContact CG2-OE2 3.29Å; L714-E721 HydrophobicContact CB-CG 3.69Å; H718-E721 HydrophobicContact CB-CB 4.49Å; H718-E721 HydrophobicContact CB-CG 4.41Å; H718-E721 PolarHBondContact O-N 3.44Å; E721-F723 VanDerWaalsContact C-N 3.25Å; E721-F723 PolarHBondContact O-N 2.79Å; E721-T724 PolarHBondContact O-N 3.27Å; E721-T724 PolarHBondContact O-OG1 3.03Å; E721-T724 PolarHBondContact OE2-OG1 3.32Å; E721-H725 WeakPolarHBondContact O-CB 3.48Å; E721-H725 PolarHBondContact O-N 3.24Å
722	Q	83.1	Confident	78.4	Confident	42 Å²	42	37.7 Å²	37.7	20%	0.196	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-35.8	174.6	-173.7	169.1	-21.7	0	0	110.9	D389 H718 K726	D389-Q722 WeakPolarHBondContact O-CG 3.26Å; D389-Q722 PolarHBondContact O-NE2 2.83Å; D389-Q722 VanDerWaalsContact O-NE2 3.11Å; D389-Q722 PolarHBondContact O-OE1 2.78Å; D389-Q722 PolarHBondContact OD2-NE2 2.91Å; D389-Q722 VanDerWaalsContact OD2-NE2 3.16Å; H718-Q722 PolarHBondContact O-N 3.29Å; Q722-K726 HydrophobicContact CG-CB 4.42Å; Q722-K726 HydrophobicContact CG-CD 4.18Å; Q722-K726 WeakPolarHBondContact O-CB 3.47Å; Q722-K726 PolarHBondContact O-N 3.09Å
723	F	84.8	Confident	79	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	I	π-helix	trans	-62.6	-51.5	174.7	-173.3	-81.6	0	0	0	111.9	R161 V163 Y392 P719 L720 E721 H725 Y727 I728	R161-F723 HydrophobicContact CB-CE2 3.76Å; R161-F723 HydrophobicContact CB-CZ 3.84Å; R161-F723 HydrophobicContact CG-CZ 4.22Å; V163-F723 HydrophobicContact CG2-CD2 3.83Å; V163-F723 HydrophobicContact CG2-CE2 3.7Å; Y392-F723 AromaticContact CD2-CD1 3.96Å; Y392-F723 HydrophobicContact CD2-CD1 3.96Å; Y392-F723 AromaticContact CD2-CE1 3.87Å; Y392-F723 HydrophobicContact CD2-CE1 3.87Å; Y392-F723 HydrophobicContact CG-CD1 4.22Å; Y392-F723 AromaticContact CG-CE1 3.91Å; Y392-F723 HydrophobicContact CG-CE1 3.91Å; Y392-F723 HydrophobicContact CG-CZ 4.43Å; P719-F723 PolarHBondContact O-N 2.85Å; L720-F723 PolarHBondContact O-N 3.45Å; E721-F723 VanDerWaalsContact C-N 3.25Å; E721-F723 PolarHBondContact O-N 2.79Å; F723-H725 PolarHBondContact O-N 3.05Å; F723-Y727 HydrophobicContact CD2-CD2 4.21Å; F723-Y727 WeakPolarHBondContact O-CB 3.31Å; F723-Y727 PolarHBondContact O-N 3Å; F723-I728 HydrophobicContact CD1-CG1 4.36Å; F723-I728 HydrophobicContact CE1-CG1 4.19Å; F723-I728 PolarHBondContact O-N 2.83Å
724	T	79.2	Confident	79.2	Confident	26 Å²	26	38.5 Å²	38.5	16%	0.16	19%	0.192	C	C	.	.	I	π-helix	trans	-64.4	-42.4	-178.2	58.7	0	0	0	0	111.9	L720 E721 I728	L720-T724 PolarHBondContact O-N 3.11Å; E721-T724 PolarHBondContact O-N 3.27Å; E721-T724 PolarHBondContact O-OG1 3.03Å; E721-T724 PolarHBondContact OE2-OG1 3.32Å; T724-I728 HydrophobicContact CG2-CD1 4.12Å
725	H	73.6	Confident	79.3	Confident	77 Å²	77	38.5 Å²	38.5	36%	0.356	19%	0.192	S	C	.	.	I	π-helix	trans	-76.4	-41.6	-175.5	-172.9	-101.7	0	0	0	113.9	H709 E721 F723	H709-H725 AromaticContact CE1-CD2 3.44Å; H709-H725 PolarHBondContact CE1-CD2 3.48Å; H709-H725 VanDerWaalsContact CE1-CD2 3.44Å; H709-H725 AromaticContact CE1-NE2 3.64Å; H709-H725 AromaticContact NE2-CD2 3.06Å; H709-H725 PolarHBondContact NE2-CD2 3.42Å; H709-H725 AromaticContact NE2-NE2 3.14Å; H709-H725 PolarHBondContact NE2-NE2 2.94Å; H709-H725 VanDerWaalsContact NE2-NE2 3.14Å; E721-H725 WeakPolarHBondContact O-CB 3.48Å; E721-H725 PolarHBondContact O-N 3.24Å; F723-H725 PolarHBondContact O-N 3.05Å
726	K	76.9	Confident	79.2	Confident	89 Å²	89	37.6 Å²	37.6	39%	0.387	19%	0.187	S	C	.	.	I	π-helix	trans	-98.2	-34.9	-169.9	-167.8	-178.8	176.8	-173.5	0	113	D389 Q722	D389-K726 IonicContact OD2-NZ 3.89Å; D389-K726 PolarHBondContact OD2-NZ 3.3Å; Q722-K726 HydrophobicContact CG-CB 4.42Å; Q722-K726 HydrophobicContact CG-CD 4.18Å; Q722-K726 WeakPolarHBondContact O-CB 3.47Å; Q722-K726 PolarHBondContact O-N 3.09Å
727	Y	77.6	Confident	79.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.174	C	C	.	.	I	π-helix	trans	-103.7	-26.5	-165.9	-63.3	-49.8	0	0	0	114.8	V163 K350 D389 F723 S731 F732	V163-Y727 HydrophobicContact CB-CD2 4.02Å; V163-Y727 HydrophobicContact CB-CE2 3.84Å; V163-Y727 HydrophobicContact CG1-CD1 4.46Å; V163-Y727 HydrophobicContact CG1-CD2 4.04Å; V163-Y727 HydrophobicContact CG1-CE1 4.04Å; V163-Y727 HydrophobicContact CG1-CE2 3.6Å; V163-Y727 HydrophobicContact CG1-CG 4.48Å; V163-Y727 HydrophobicContact CG2-CD2 3.87Å; V163-Y727 HydrophobicContact CG2-CE2 4.23Å; V163-Y727 HydrophobicContact CG2-CG 4.27Å; K350-Y727 HydrophobicContact CD-CE1 3.74Å; K350-Y727 HydrophobicContact CG-CE1 4.46Å; D389-Y727 HydrophobicContact CB-CE2 4.11Å; D389-Y727 WeakPolarHBondContact CB-OH 3.48Å; D389-Y727 PolarHBondContact OD2-OH 2.78Å; F723-Y727 HydrophobicContact CD2-CD2 4.21Å; F723-Y727 WeakPolarHBondContact O-CB 3.31Å; F723-Y727 PolarHBondContact O-N 3Å; Y727-S731 WeakPolarHBondContact CA-OG 2.96Å; Y727-S731 WeakPolarHBondContact CB-OG 3.42Å; Y727-S731 VanDerWaalsContact CD1-OG 3.27Å; Y727-S731 WeakPolarHBondContact CD1-OG 3.4Å; Y727-S731 PolarHBondContact O-OG 2.82Å; Y727-F732 HydrophobicContact CD1-CE2 4.09Å; Y727-F732 HydrophobicContact CG-CE2 4.33Å
728	I	75	Confident	79.3	Confident	3 Å²	3	28.5 Å²	28.5	2%	0.015	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-46.9	179.4	-68.5	-178.7	0	0	0	112.4	F723 T724 S736 H739 I923	F723-I728 HydrophobicContact CD1-CG1 4.36Å; F723-I728 HydrophobicContact CE1-CG1 4.19Å; F723-I728 PolarHBondContact O-N 2.83Å; T724-I728 HydrophobicContact CG2-CD1 4.12Å; I728-S736 VanDerWaalsContact O-CA 3.3Å; I728-S736 WeakPolarHBondContact O-CA 3.1Å; I728-S736 PolarHBondContact O-N 3.01Å; I728-H739 HydrophobicContact CG2-CB 3.62Å; I728-H739 VanDerWaalsContact CG2-CD2 3.49Å; I728-H739 WeakPolarHBondContact CG2-CD2 3.42Å; I728-H739 VanDerWaalsContact CG2-CG 3.46Å; I728-I923 HydrophobicContact CG2-CG2 4.34Å
729	N	66.8	Low	78.9	Confident	32 Å²	32	28.1 Å²	28.1	17%	0.171	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-34.8	-166.3	-74.9	12.3	0	0	0	115	I923	N729-I923 WeakPolarHBondContact OD1-CG2 3.37Å
730	H	66.8	Low	78.6	Confident	150 Å²	150	30.4 Å²	30.4	69%	0.694	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-138.7	-17.1	-164	-68.7	-59.9	0	0	0	116.1
731	S	73.6	Confident	78.2	Confident	6 Å²	6	32.1 Å²	32.1	4%	0.042	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-34.3	-168.3	66.7	0	0	0	0	114.6	P339 N340 Y727	P339-S731 CarbonylContact C-O 3.58Å; P339-S731 WeakPolarHBondContact CA-O 3.46Å; N340-S731 PolarHBondContact N-O 3Å; Y727-S731 WeakPolarHBondContact CA-OG 2.96Å; Y727-S731 WeakPolarHBondContact CB-OG 3.42Å; Y727-S731 VanDerWaalsContact CD1-OG 3.27Å; Y727-S731 WeakPolarHBondContact CD1-OG 3.4Å; Y727-S731 PolarHBondContact O-OG 2.82Å
732	F	81.3	Confident	77.9	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-123.6	137.2	-176	-62.7	-73.8	0	0	0	110.7	V163 L352 Y727 E735 S736	V163-F732 HydrophobicContact CG1-CE2 4.41Å; V163-F732 HydrophobicContact CG1-CZ 4.41Å; V163-F732 HydrophobicContact CG2-CE2 4.03Å; L352-F732 HydrophobicContact CB-CD1 4.17Å; L352-F732 HydrophobicContact CB-CE1 3.6Å; L352-F732 HydrophobicContact CB-CE2 4.15Å; L352-F732 HydrophobicContact CB-CZ 3.61Å; L352-F732 HydrophobicContact CD1-CD1 4.14Å; L352-F732 HydrophobicContact CD1-CD2 3.56Å; L352-F732 HydrophobicContact CD1-CE1 4.22Å; L352-F732 HydrophobicContact CD1-CE2 3.67Å; L352-F732 HydrophobicContact CD1-CG 3.84Å; L352-F732 HydrophobicContact CD1-CZ 4.02Å; L352-F732 HydrophobicContact CG-CZ 4.43Å; Y727-F732 HydrophobicContact CD1-CE2 4.09Å; Y727-F732 HydrophobicContact CG-CE2 4.33Å; F732-E735 HydrophobicContact CB-CB 4.21Å; F732-E735 HydrophobicContact CB-CG 4.17Å; F732-S736 WeakPolarHBondContact O-CB 3.34Å; F732-S736 PolarHBondContact O-N 3.32Å; F732-S736 PolarHBondContact O-OG 3.28Å
733	W	81.2	Confident	77.7	Confident	45 Å²	45	35.9 Å²	35.9	17%	0.17	17%	0.168	C	C	.	.	H	α-helix	trans	-66	-41.2	-176.9	178.7	97.2	0	0	0	111.8	W153 F295 A335 N340 S736 N737	W153-W733 HydrophobicContact CH2-CZ3 4.08Å; W153-W733 HydrophobicContact CZ2-CH2 4.37Å; W153-W733 HydrophobicContact CZ2-CZ3 4.27Å; F295-W733 HydrophobicContact CE1-CD2 4.26Å; F295-W733 HydrophobicContact CE1-CG 4.21Å; F295-W733 AromaticContact CZ-CD2 3.77Å; F295-W733 HydrophobicContact CZ-CD2 3.77Å; F295-W733 AromaticContact CZ-CE2 3.92Å; F295-W733 AromaticContact CZ-CE3 3.98Å; F295-W733 HydrophobicContact CZ-CE3 3.98Å; F295-W733 HydrophobicContact CZ-CG 4.19Å; F295-W733 HydrophobicContact CZ-CZ2 4.31Å; F295-W733 HydrophobicContact CZ-CZ3 4.36Å; A335-W733 HydrophobicContact CB-CE3 3.56Å; A335-W733 HydrophobicContact CB-CZ3 3.78Å; N340-W733 HydrophobicContact CB-CB 4.37Å; W733-S736 PolarHBondContact O-OG 3.11Å; W733-S736 VanDerWaalsContact O-OG 3.08Å; W733-N737 VanDerWaalsContact CD2-ND2 3.26Å; W733-N737 PolarHBondContact NE1-ND2 2.87Å; W733-N737 VanDerWaalsContact NE1-ND2 3.14Å; W733-N737 WeakPolarHBondContact O-CB 3Å; W733-N737 PolarHBondContact O-N 3.27Å; W733-N737 VanDerWaalsContact O-N 3.16Å; W733-N737 PolarHBondContact O-ND2 3.43Å
734	T	81.7	Confident	77.7	Confident	4 Å²	4	36 Å²	36	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-49.7	176.2	43.9	0	0	0	0	112.1	W153 Y156 A335 A336 N737 L738	W153-T734 HydrophobicContact CZ3-CG2 4.34Å; W153-T734 WeakPolarHBondContact CZ3-O 3.48Å; Y156-T734 PolarHBondContact OH-OG1 3.1Å; A335-T734 HydrophobicContact CB-CG2 3.83Å; A335-T734 WeakPolarHBondContact O-CG2 3.24Å; A335-T734 PolarHBondContact O-N 3.45Å; A335-T734 PolarHBondContact O-OG1 3.47Å; A336-T734 WeakPolarHBondContact CA-OG1 3.16Å; A336-T734 HydrophobicContact CB-CG2 3.82Å; T734-N737 PolarHBondContact O-N 3.25Å; T734-L738 WeakPolarHBondContact O-CB 3.46Å; T734-L738 PolarHBondContact O-N 3.28Å
735	E	82.9	Confident	78.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.4	-46.1	-177.2	-66.2	-64	176.6	0	0	111.2	Y156 R161 F732 N737 L738 H739	Y156-E735 HydrophobicContact CE1-CG 4.49Å; Y156-E735 WeakPolarHBondContact CE1-OE1 3.48Å; Y156-E735 PolarHBondContact OH-OE1 3.48Å; R161-E735 IonicContact CZ-OE1 2.83Å; R161-E735 IonicContact NE-OE1 4Å; R161-E735 PolarHBondContact NE-OE1 3.14Å; R161-E735 IonicContact NH2-OE1 3.68Å; R161-E735 PolarHBondContact NH2-OE1 3.27Å; R161-E735 IonicContact NH2-OE2 2.66Å; F732-E735 HydrophobicContact CB-CB 4.21Å; F732-E735 HydrophobicContact CB-CG 4.17Å; E735-N737 PolarHBondContact O-N 3.33Å; E735-L738 PolarHBondContact O-N 3.26Å; E735-H739 VanDerWaalsContact O-CB 3.29Å; E735-H739 WeakPolarHBondContact O-CB 3.11Å; E735-H739 PolarHBondContact O-CD2 2.99Å; E735-H739 VanDerWaalsContact O-CD2 3.25Å; E735-H739 PolarHBondContact O-N 3.38Å; E735-H739 IonicContact OE2-CD2 3.48Å; E735-H739 PolarHBondContact OE2-CD2 2.86Å; E735-H739 IonicContact OE2-NE2 3.69Å; E735-H739 PolarHBondContact OE2-NE2 3.41Å
736	S	79	Confident	78.8	Confident	22 Å²	22	33.7 Å²	33.7	15%	0.154	16%	0.156	C	C	.	.	H	α-helix	trans	-60.5	-45.4	178.9	54.9	0	0	0	0	112.6	I728 F732 W733 Y740	I728-S736 VanDerWaalsContact O-CA 3.3Å; I728-S736 WeakPolarHBondContact O-CA 3.1Å; I728-S736 PolarHBondContact O-N 3.01Å; F732-S736 WeakPolarHBondContact O-CB 3.34Å; F732-S736 PolarHBondContact O-N 3.32Å; F732-S736 PolarHBondContact O-OG 3.28Å; W733-S736 PolarHBondContact O-OG 3.11Å; W733-S736 VanDerWaalsContact O-OG 3.08Å; S736-Y740 WeakPolarHBondContact O-CB 3.47Å; S736-Y740 PolarHBondContact O-N 2.67Å
737	N	79.4	Confident	79.5	Confident	30 Å²	30	29.4 Å²	29.4	16%	0.16	14%	0.137	C	C	.	.	H	α-helix	trans	-72.3	-42.6	179	-71.9	-58.4	0	0	0	112.4	W153 W733 T734 E735 H739 Y740 Y741	W153-N737 HydrophobicContact CH2-CB 4.03Å; W733-N737 VanDerWaalsContact CD2-ND2 3.26Å; W733-N737 PolarHBondContact NE1-ND2 2.87Å; W733-N737 VanDerWaalsContact NE1-ND2 3.14Å; W733-N737 WeakPolarHBondContact O-CB 3Å; W733-N737 PolarHBondContact O-N 3.27Å; W733-N737 VanDerWaalsContact O-N 3.16Å; W733-N737 PolarHBondContact O-ND2 3.43Å; T734-N737 PolarHBondContact O-N 3.25Å; E735-N737 PolarHBondContact O-N 3.33Å; N737-H739 VanDerWaalsContact C-N 3.34Å; N737-H739 PolarHBondContact O-N 3.19Å; N737-Y740 PolarHBondContact O-N 2.86Å; N737-Y741 HydrophobicContact CB-CD2 4.1Å; N737-Y741 HydrophobicContact CB-CE2 4.16Å; N737-Y741 WeakPolarHBondContact O-CD2 3.38Å; N737-Y741 PolarHBondContact O-N 3.01Å; N737-Y741 WeakPolarHBondContact OD1-CE2 3.25Å
738	L	80.1	Confident	80.2	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-53.7	-55.1	176	178.9	139.4	0	0	0	110	W153 Y156 A157 T734 E735 Q742 L826	W153-L738 HydrophobicContact CE3-CB 4.05Å; W153-L738 HydrophobicContact CE3-CD1 3.82Å; W153-L738 HydrophobicContact CE3-CG 4.4Å; W153-L738 HydrophobicContact CH2-CB 4.41Å; W153-L738 HydrophobicContact CZ3-CB 3.64Å; W153-L738 HydrophobicContact CZ3-CD1 4.16Å; W153-L738 HydrophobicContact CZ3-CG 4.45Å; Y156-L738 HydrophobicContact CD1-CD1 3.93Å; Y156-L738 HydrophobicContact CE1-CD1 4.44Å; A157-L738 HydrophobicContact CB-CD1 4.14Å; T734-L738 WeakPolarHBondContact O-CB 3.46Å; T734-L738 PolarHBondContact O-N 3.28Å; E735-L738 PolarHBondContact O-N 3.26Å; L738-Q742 WeakPolarHBondContact O-CB 3.48Å; L738-Q742 PolarHBondContact O-N 3.4Å; L738-L826 HydrophobicContact CG-CD2 4.29Å
739	H	77.7	Confident	81	Confident	17 Å²	17	29.7 Å²	29.7	8%	0.079	14%	0.138	C	C	.	.	H	α-helix	trans	-69.9	-38.1	-176.5	-80.2	-71	0	0	0	112.4	I728 E735 N737 N743 I923	I728-H739 HydrophobicContact CG2-CB 3.62Å; I728-H739 VanDerWaalsContact CG2-CD2 3.49Å; I728-H739 WeakPolarHBondContact CG2-CD2 3.42Å; I728-H739 VanDerWaalsContact CG2-CG 3.46Å; E735-H739 VanDerWaalsContact O-CB 3.29Å; E735-H739 WeakPolarHBondContact O-CB 3.11Å; E735-H739 PolarHBondContact O-CD2 2.99Å; E735-H739 VanDerWaalsContact O-CD2 3.25Å; E735-H739 PolarHBondContact O-N 3.38Å; E735-H739 IonicContact OE2-CD2 3.48Å; E735-H739 PolarHBondContact OE2-CD2 2.86Å; E735-H739 IonicContact OE2-NE2 3.69Å; E735-H739 PolarHBondContact OE2-NE2 3.41Å; N737-H739 VanDerWaalsContact C-N 3.34Å; N737-H739 PolarHBondContact O-N 3.19Å; H739-N743 VanDerWaalsContact O-CB 3.28Å; H739-N743 WeakPolarHBondContact O-CB 3.38Å; H739-N743 PolarHBondContact O-N 3.23Å; H739-N743 PolarHBondContact O-ND2 3.37Å; H739-I923 HydrophobicContact CB-CD1 3.59Å
740	Y	79.5	Confident	82.2	Confident	71 Å²	71	28.1 Å²	28.1	28%	0.278	13%	0.13	S	C	.	.	H	α-helix	trans	-62.9	-53	177.3	-179.8	-95.2	0	0	0	112.3	S736 N737 N743 L744 N919 S921	S736-Y740 WeakPolarHBondContact O-CB 3.47Å; S736-Y740 PolarHBondContact O-N 2.67Å; N737-Y740 PolarHBondContact O-N 2.86Å; Y740-N743 PolarHBondContact O-N 2.78Å; Y740-L744 HydrophobicContact CE1-CD2 3.98Å; Y740-L744 WeakPolarHBondContact O-CG 3.4Å; Y740-L744 PolarHBondContact O-N 2.91Å; Y740-N919 PolarHBondContact OH-O 3.27Å; Y740-S921 VanDerWaalsContact CD2-OG 3.32Å; Y740-S921 WeakPolarHBondContact CD2-OG 3.07Å; Y740-S921 WeakPolarHBondContact O-CB 3.34Å
741	Y	78.3	Confident	83.3	Confident	44 Å²	44	21.1 Å²	21.1	17%	0.173	10%	0.098	C	C	.	.	H	α-helix	trans	-75.6	-33.4	-174	-71.4	-69.2	0	0	0	113.2	N737 N743 L744 L823 I830	N737-Y741 HydrophobicContact CB-CD2 4.1Å; N737-Y741 HydrophobicContact CB-CE2 4.16Å; N737-Y741 WeakPolarHBondContact O-CD2 3.38Å; N737-Y741 PolarHBondContact O-N 3.01Å; N737-Y741 WeakPolarHBondContact OD1-CE2 3.25Å; Y741-N743 VanDerWaalsContact C-N 3.29Å; Y741-N743 PolarHBondContact O-N 3.03Å; Y741-L744 HydrophobicContact CD1-CD1 3.81Å; Y741-L823 HydrophobicContact CD1-CD2 4.2Å; Y741-L823 HydrophobicContact CD2-CD2 3.92Å; Y741-L823 HydrophobicContact CD2-CG 4.06Å; Y741-L823 HydrophobicContact CE1-CD2 3.7Å; Y741-L823 HydrophobicContact CE2-CD2 3.41Å; Y741-L823 VanDerWaalsContact CE2-CD2 3.41Å; Y741-L823 HydrophobicContact CE2-CG 4Å; Y741-L823 HydrophobicContact CG-CD2 4.32Å; Y741-L823 HydrophobicContact CG-CG 4.47Å; Y741-I830 HydrophobicContact CD1-CD1 3.76Å; Y741-I830 HydrophobicContact CG-CD1 4.22Å
742	Q	77.8	Confident	83.9	Confident	93 Å²	93	21 Å²	21	44%	0.435	10%	0.097	S	C	.	.	H	α-helix	trans	-68.5	-30.2	175.3	-171.7	175.6	-4.3	0	0	111.9	L738	L738-Q742 WeakPolarHBondContact O-CB 3.48Å; L738-Q742 PolarHBondContact O-N 3.4Å
743	N	79	Confident	84.2	Confident	41 Å²	41	21 Å²	21	22%	0.219	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	22.2	-177.8	-61.3	-72.5	0	0	0	113.8	H739 Y740 Y741 S921 L922 I923	H739-N743 VanDerWaalsContact O-CB 3.28Å; H739-N743 WeakPolarHBondContact O-CB 3.38Å; H739-N743 PolarHBondContact O-N 3.23Å; H739-N743 PolarHBondContact O-ND2 3.37Å; Y740-N743 PolarHBondContact O-N 2.78Å; Y741-N743 VanDerWaalsContact C-N 3.29Å; Y741-N743 PolarHBondContact O-N 3.03Å; N743-S921 VanDerWaalsContact O-CA 3.23Å; N743-S921 WeakPolarHBondContact O-CA 3.3Å; N743-S921 WeakPolarHBondContact O-CB 2.94Å; N743-L922 HydrophobicContact CB-CB 4.38Å; N743-L922 PolarHBondContact O-N 3.17Å; N743-I923 HydrophobicContact CB-CD1 4.01Å; N743-I923 HydrophobicContact CB-CG1 4.17Å; N743-I923 WeakPolarHBondContact ND2-CD1 3.42Å
744	L	84.9	Confident	84.4	Confident	2 Å²	2	23.5 Å²	23.5	1%	0.01	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	133.6	167.3	-73	172.6	0	0	0	109.8	Y740 Y741 K746 F807 L917	Y740-L744 HydrophobicContact CE1-CD2 3.98Å; Y740-L744 WeakPolarHBondContact O-CG 3.4Å; Y740-L744 PolarHBondContact O-N 2.91Å; Y741-L744 HydrophobicContact CD1-CD1 3.81Å; L744-K746 PolarHBondContact O-N 2.63Å; L744-F807 HydrophobicContact CD1-CD2 4.28Å; L744-F807 HydrophobicContact CD1-CE2 4.13Å; L744-L917 HydrophobicContact CB-CD1 3.88Å; L744-L917 HydrophobicContact CD1-CD2 4.2Å
745	L	87.9	Confident	84.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.5	-177.9	-60.5	176	0	0	0	110	T918 I920 L922 F933 V959 E961 L962	L745-T918 WeakPolarHBondContact CB-OG1 3.07Å; L745-T918 PolarHBondContact O-N 2.86Å; L745-T918 VanDerWaalsContact O-N 3.12Å; L745-T918 PolarHBondContact O-OG1 2.57Å; L745-I920 HydrophobicContact CD1-CB 4.29Å; L745-I920 HydrophobicContact CD1-CG2 3.98Å; L745-I920 PolarHBondContact N-O 3.45Å; L745-L922 HydrophobicContact CD2-CB 4.48Å; L745-F933 HydrophobicContact CB-CZ 4.47Å; L745-F933 HydrophobicContact CD1-CD1 4.3Å; L745-F933 HydrophobicContact CD1-CE1 3.68Å; L745-F933 HydrophobicContact CD1-CZ 4.07Å; L745-V959 HydrophobicContact CB-CG1 4.25Å; L745-V959 HydrophobicContact CD2-CG1 4.15Å; L745-E961 HydrophobicContact CD2-CB 3.88Å; L745-L962 HydrophobicContact CD1-CD2 4.22Å; L745-L962 HydrophobicContact CD2-CD2 4.03Å; L745-L962 HydrophobicContact CD2-CG 4.35Å
746	K	87.7	Confident	84.8	Confident	55 Å²	55	30.9 Å²	30.9	24%	0.239	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.3	172.8	78.9	-163.9	-177.4	-134.2	0	109.3	L744 L829 E961	L744-K746 PolarHBondContact O-N 2.63Å; K746-L829 HydrophobicContact CB-CD1 4.34Å; K746-E961 WeakPolarHBondContact CD-OE1 3.41Å; K746-E961 WeakPolarHBondContact CE-OE1 3.13Å; K746-E961 WeakPolarHBondContact CG-OE1 3.28Å; K746-E961 IonicContact NZ-OE1 3.58Å; K746-E961 PolarHBondContact NZ-OE1 3.3Å
747	I	91.4	Very high	85	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	125.7	179.2	-66	176.6	0	0	0	108.3	F749 M803 N915 A916 T918 F933 I937 L957 V959	I747-F749 HydrophobicContact CG2-CD2 4.17Å; I747-F749 HydrophobicContact CG2-CE1 4.13Å; I747-F749 HydrophobicContact CG2-CE2 3.69Å; I747-F749 HydrophobicContact CG2-CZ 3.67Å; I747-M803 HydrophobicContact CB-CE 4.38Å; I747-M803 HydrophobicContact CD1-CE 3.25Å; I747-M803 HydrophobicContact CG1-CE 4.37Å; I747-M803 HydrophobicContact CG2-CE 4.37Å; I747-N915 CarbonylContact O-C 3.4Å; I747-N915 VanDerWaalsContact O-CA 3.27Å; I747-N915 WeakPolarHBondContact O-CA 3.48Å; I747-A916 PolarHBondContact N-O 3.02Å; I747-A916 PolarHBondContact O-N 3.02Å; I747-T918 HydrophobicContact CD1-CG2 3.43Å; I747-T918 VanDerWaalsContact CD1-CG2 3.43Å; I747-T918 HydrophobicContact CG1-CG2 3.88Å; I747-F933 HydrophobicContact CD1-CE1 4.49Å; I747-F933 HydrophobicContact CD1-CE2 4.16Å; I747-F933 HydrophobicContact CD1-CZ 3.64Å; I747-F933 HydrophobicContact CG1-CZ 4.31Å; I747-I937 HydrophobicContact CD1-CD1 3.5Å; I747-I937 HydrophobicContact CD1-CG2 4.25Å; I747-L957 HydrophobicContact CG2-CD1 3.49Å; I747-L957 VanDerWaalsContact CG2-CD1 3.49Å; I747-L957 HydrophobicContact CG2-CD2 4.27Å; I747-L957 HydrophobicContact CG2-CG 3.67Å; I747-V959 HydrophobicContact CG1-CG2 3.88Å
748	N	91.4	Very high	85.2	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.043	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	118.2	173.8	-61.4	-34.4	0	0	0	109.1	F76 I750 I913 I914 V958	F76-N748 WeakPolarHBondContact CE1-ND2 3.23Å; F76-N748 HydrophobicContact CE2-CB 4.25Å; F76-N748 HydrophobicContact CZ-CB 4.35Å; F76-N748 WeakPolarHBondContact CZ-ND2 3.27Å; N748-I750 HydrophobicContact CB-CD1 4.3Å; N748-I750 HydrophobicContact CB-CG1 4.33Å; N748-I913 HydrophobicContact CB-CG2 4.4Å; N748-I914 CarbonylContact C-O 3.59Å; N748-I914 WeakPolarHBondContact CA-O 3.22Å; N748-V958 HydrophobicContact CB-CB 4.46Å; N748-V958 PolarHBondContact N-O 2.96Å; N748-V958 PolarHBondContact O-N 2.82Å
749	F	93.1	Very high	85.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	123.1	169.2	-56	-86.6	0	0	0	108.5	I747 W751 F796 L800 M803 I914 A916 W940 F941 L957	I747-F749 HydrophobicContact CG2-CD2 4.17Å; I747-F749 HydrophobicContact CG2-CE1 4.13Å; I747-F749 HydrophobicContact CG2-CE2 3.69Å; I747-F749 HydrophobicContact CG2-CZ 3.67Å; F749-W751 HydrophobicContact CB-CH2 3.71Å; F749-W751 HydrophobicContact CB-CZ3 3.62Å; F749-F796 HydrophobicContact CB-CZ 4.41Å; F749-F796 HydrophobicContact CD1-CZ 4.11Å; F749-F796 HydrophobicContact CD2-CZ 4.34Å; F749-F796 HydrophobicContact CE1-CZ 4.42Å; F749-F796 HydrophobicContact CG-CZ 4.04Å; F749-L800 HydrophobicContact CD2-CD2 4.26Å; F749-L800 HydrophobicContact CE2-CD2 3.67Å; F749-L800 HydrophobicContact CZ-CD2 4.06Å; F749-M803 HydrophobicContact CE2-CE 4.4Å; F749-M803 HydrophobicContact CE2-SD 4.2Å; F749-M803 HydrophobicContact CZ-CE 3.9Å; F749-M803 HydrophobicContact CZ-SD 3.96Å; F749-I914 HydrophobicContact CB-CB 4.29Å; F749-I914 HydrophobicContact CD2-CG2 4.35Å; F749-I914 PolarHBondContact N-O 3.22Å; F749-I914 PolarHBondContact O-N 3.23Å; F749-A916 HydrophobicContact CE2-CB 4.18Å; F749-W940 AromaticContact CE1-CZ3 3.95Å; F749-W940 HydrophobicContact CE1-CZ3 3.95Å; F749-W940 HydrophobicContact CZ-CH2 4.49Å; F749-W940 AromaticContact CZ-CZ3 3.84Å; F749-W940 HydrophobicContact CZ-CZ3 3.84Å; F749-F941 AromaticContact CD1-CD2 3.5Å; F749-F941 HydrophobicContact CD1-CD2 3.5Å; F749-F941 AromaticContact CD1-CE2 3.41Å; F749-F941 HydrophobicContact CD1-CE2 3.41Å; F749-F941 VanDerWaalsContact CD1-CE2 3.41Å; F749-F941 HydrophobicContact CD1-CG 4.21Å; F749-F941 HydrophobicContact CD1-CZ 4.05Å; F749-F941 HydrophobicContact CE1-CB 4.45Å; F749-F941 AromaticContact CE1-CD2 3.52Å; F749-F941 HydrophobicContact CE1-CD2 3.52Å; F749-F941 AromaticContact CE1-CE2 3.96Å; F749-F941 HydrophobicContact CE1-CE2 3.96Å; F749-F941 HydrophobicContact CE1-CG 4.07Å; F749-F941 HydrophobicContact CG-CE2 4.36Å; F749-L957 HydrophobicContact CD1-CD1 4.19Å; F749-L957 HydrophobicContact CE1-CD1 3.65Å; F749-L957 HydrophobicContact CE1-CG 4.48Å; F749-L957 HydrophobicContact CZ-CD1 4.22Å
750	I	91.5	Very high	85.7	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.2	-169.2	-58.8	150.8	0	0	0	109.5	F76 L79 N748 P753 L912 G955 F956 V958	F76-I750 HydrophobicContact CB-CD1 3.71Å; F76-I750 HydrophobicContact CD2-CD1 3.22Å; F76-I750 HydrophobicContact CD2-CG1 3.86Å; F76-I750 HydrophobicContact CE2-CD1 4.01Å; F76-I750 HydrophobicContact CE2-CG1 4.33Å; F76-I750 HydrophobicContact CG-CD1 3.67Å; L79-I750 HydrophobicContact CD2-CG2 3.93Å; N748-I750 HydrophobicContact CB-CD1 4.3Å; N748-I750 HydrophobicContact CB-CG1 4.33Å; I750-P753 HydrophobicContact CG2-CG 3.77Å; I750-L912 WeakPolarHBondContact CA-O 3.29Å; I750-G955 CarbonylContact O-C 3.53Å; I750-G955 WeakPolarHBondContact O-CA 3.34Å; I750-F956 HydrophobicContact CB-CE1 4.49Å; I750-F956 HydrophobicContact CB-CE2 4.16Å; I750-F956 HydrophobicContact CB-CZ 4.14Å; I750-F956 HydrophobicContact CD1-CD2 4.43Å; I750-F956 HydrophobicContact CD1-CE2 3.81Å; I750-F956 HydrophobicContact CD1-CZ 4.35Å; I750-F956 HydrophobicContact CG2-CE1 4.26Å; I750-F956 HydrophobicContact CG2-CE2 4.41Å; I750-F956 HydrophobicContact CG2-CZ 3.93Å; I750-F956 PolarHBondContact N-O 2.83Å; I750-F956 PolarHBondContact O-N 3.07Å; I750-V958 HydrophobicContact CD1-CB 3.65Å; I750-V958 HydrophobicContact CD1-CG1 4.49Å; I750-V958 HydrophobicContact CD1-CG2 3.44Å; I750-V958 VanDerWaalsContact CD1-CG2 3.44Å
751	W	90.4	Very high	85.9	Confident	3 Å²	3	35.3 Å²	35.3	1%	0.011	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	151.5	168.4	-66.7	-98.3	0	0	0	109.6	F749 P753 F784 W792 F796 G911 L912 I914 F941 L952 G955	F749-W751 HydrophobicContact CB-CH2 3.71Å; F749-W751 HydrophobicContact CB-CZ3 3.62Å; W751-P753 VanDerWaalsContact C-CD 3.42Å; W751-P753 WeakPolarHBondContact O-CD 3.17Å; W751-F784 HydrophobicContact CB-CE1 3.6Å; W751-F784 HydrophobicContact CB-CZ 3.68Å; W751-F784 HydrophobicContact CG-CE1 4.34Å; W751-W792 AromaticContact CZ2-CH2 3.97Å; W751-W792 HydrophobicContact CZ2-CH2 3.97Å; W751-W792 AromaticContact CZ2-CZ3 3.96Å; W751-W792 HydrophobicContact CZ2-CZ3 3.96Å; W751-F796 HydrophobicContact CH2-CD1 4.11Å; W751-F796 AromaticContact CH2-CE1 3.57Å; W751-F796 HydrophobicContact CH2-CE1 3.57Å; W751-F796 HydrophobicContact CH2-CE2 4.32Å; W751-F796 AromaticContact CH2-CZ 3.7Å; W751-F796 HydrophobicContact CH2-CZ 3.7Å; W751-F796 HydrophobicContact CZ2-CE1 4.43Å; W751-F796 HydrophobicContact CZ2-CZ 4.34Å; W751-F796 HydrophobicContact CZ3-CE1 4.39Å; W751-G911 VanDerWaalsContact O-CA 3.24Å; W751-G911 WeakPolarHBondContact O-CA 3.01Å; W751-L912 HydrophobicContact CE3-CD2 4.29Å; W751-L912 HydrophobicContact CE3-CG 4.41Å; W751-L912 PolarHBondContact N-O 3.44Å; W751-L912 PolarHBondContact O-N 3.48Å; W751-I914 HydrophobicContact CH2-CD1 4.16Å; W751-I914 HydrophobicContact CZ3-CB 4.34Å; W751-I914 HydrophobicContact CZ3-CD1 3.73Å; W751-I914 HydrophobicContact CZ3-CG1 4.1Å; W751-F941 HydrophobicContact CH2-CE2 4.33Å; W751-F941 HydrophobicContact CZ2-CE2 4.09Å; W751-F941 HydrophobicContact CZ2-CZ 4.16Å; W751-L952 HydrophobicContact CG-CD2 4.41Å; W751-L952 PolarHBondContact NE1-O 2.84Å; W751-L952 VanDerWaalsContact NE1-O 3.13Å; W751-G955 VanDerWaalsContact CD1-CA 3.4Å
752	G	85.3	Confident	86.1	Confident	2 Å²	2	38.2 Å²	38.2	2%	0.021	18%	0.181	C	C	.	.	S	Bend	trans	119.6	-69	-178.5	0	0	0	0	0	113	Y777 I782 V910	G752-Y777 WeakPolarHBondContact O-CD2 3.21Å; G752-I782 WeakPolarHBondContact O-CD1 3.42Å; G752-V910 VanDerWaalsContact CA-O 3.3Å; G752-V910 WeakPolarHBondContact CA-O 2.92Å
753	P	87.5	Confident	86.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-74.3	157.6	-179.4	26.7	-30.7	0	0	0	112.9	Q75 L79 I750 W751 L774 L775 Y777 F956	Q75-P753 HydrophobicContact CB-CB 4.24Å; L79-P753 HydrophobicContact CD2-CG 4.29Å; I750-P753 HydrophobicContact CG2-CG 3.77Å; W751-P753 VanDerWaalsContact C-CD 3.42Å; W751-P753 WeakPolarHBondContact O-CD 3.17Å; P753-L774 HydrophobicContact CB-CD1 3.83Å; P753-L775 CarbonylContact C-O 3.55Å; P753-L775 WeakPolarHBondContact CA-O 3.23Å; P753-Y777 WeakPolarHBondContact O-CE2 3.12Å; P753-F956 HydrophobicContact CG-CE1 3.93Å; P753-F956 HydrophobicContact CG-CZ 3.86Å; P753-F956 WeakPolarHBondContact O-CE1 3.2Å
754	K	86.9	Confident	86.3	Confident	99 Å²	99	37.3 Å²	37.3	43%	0.43	18%	0.178	S	C	.	.	P	Polyproline II helix	trans	-99.7	128.3	170.6	177.3	176.2	173	-168.2	0	108.7	Q75 Y756 L775 Y777	Q75-K754 VanDerWaalsContact CG-O 3.3Å; Q75-K754 WeakPolarHBondContact CG-O 3.21Å; K754-Y756 PolarHBondContact O-N 2.86Å; K754-Y756 VanDerWaalsContact O-N 3.15Å; K754-L775 HydrophobicContact CB-CD2 3.65Å; K754-L775 HydrophobicContact CD-CD2 3.62Å; K754-L775 HydrophobicContact CG-CD2 4.06Å; K754-L775 PolarHBondContact N-O 3.41Å; K754-Y777 HydrophobicContact CB-CD2 4.21Å; K754-Y777 HydrophobicContact CB-CE1 4.22Å; K754-Y777 HydrophobicContact CB-CE2 3.76Å; K754-Y777 HydrophobicContact CD-CE1 4.13Å; K754-Y777 HydrophobicContact CG-CE1 4.18Å; K754-Y777 HydrophobicContact CG-CE2 4.37Å
755	P	85.8	Confident	85.7	Confident	49 Å²	49	38.8 Å²	38.8	32%	0.318	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-63.1	117.5	-179.1	26.7	-34.5	0	0	0	110.6	A71 R72	A71-P755 HydrophobicContact CB-CB 4.42Å; R72-P755 HydrophobicContact CG-CB 3.88Å
756	Y	86	Confident	84.5	Confident	110 Å²	110	41.2 Å²	41.2	43%	0.431	20%	0.199	S	C	.	.			trans	-157.7	134.7	-178.1	-176.5	-116.9	0	0	0	110.2	A71 Q75 K754 E758 L775	A71-Y756 PolarHBondContact O-N 3.32Å; Q75-Y756 WeakPolarHBondContact CG-O 3.32Å; Q75-Y756 PolarHBondContact NE2-O 3.14Å; K754-Y756 PolarHBondContact O-N 2.86Å; K754-Y756 VanDerWaalsContact O-N 3.15Å; Y756-E758 HydrophobicContact CD1-CG 3.83Å; Y756-E758 HydrophobicContact CE1-CB 4.43Å; Y756-E758 HydrophobicContact CE1-CG 3.28Å; Y756-L775 HydrophobicContact CD1-CD1 4.34Å
757	D	84.1	Confident	82.8	Confident	20 Å²	20	44.6 Å²	44.6	11%	0.107	22%	0.219	C	C	.	.			trans	-114.6	118.7	175.8	-163.9	-9.2	0	0	0	108.8	A71 R759	A71-D757 HydrophobicContact CB-CB 4.17Å; D757-R759 VanDerWaalsContact OD1-CB 3.26Å; D757-R759 WeakPolarHBondContact OD1-CB 3.14Å; D757-R759 VanDerWaalsContact OD1-CG 3.24Å; D757-R759 WeakPolarHBondContact OD1-CG 3.34Å; D757-R759 IonicContact OD1-CZ 3.95Å; D757-R759 PolarHBondContact OD1-N 3.06Å; D757-R759 IonicContact OD1-NE 3.94Å; D757-R759 PolarHBondContact OD1-NE 3.44Å; D757-R759 IonicContact OD1-NH2 3.64Å; D757-R759 IonicContact OD2-CZ 3.18Å; D757-R759 IonicContact OD2-NE 2.68Å; D757-R759 PolarHBondContact OD2-NE 3.48Å; D757-R759 IonicContact OD2-NH2 3.97Å; D757-R759 PolarHBondContact OD2-NH2 3.01Å
758	E	82.3	Confident	80.9	Confident	63 Å²	63	49.4 Å²	49.4	29%	0.294	24%	0.244	S	C	.	.			trans	-85.1	-14.9	175.9	-76.3	-175.2	162.3	0	0	112.6	Y756 K773	Y756-E758 HydrophobicContact CD1-CG 3.83Å; Y756-E758 HydrophobicContact CE1-CB 4.43Å; Y756-E758 HydrophobicContact CE1-CG 3.28Å; E758-K773 PolarHBondContact OE2-N 3.1Å
759	R	83.9	Confident	78.9	Confident	18 Å²	18	57.9 Å²	57.9	7%	0.068	28%	0.277	C	S	.	.			trans	-69.2	137.8	-172.7	-56.6	173.8	-57.2	161.1	5.2	109.1	I65 Q74 D757 Y764	I65-R759 HydrophobicContact CD1-CB 3.71Å; I65-R759 HydrophobicContact CG2-CB 4.16Å; I65-R759 WeakPolarHBondContact CG2-O 3.42Å; Q74-R759 VanDerWaalsContact CG-CZ 3.49Å; Q74-R759 VanDerWaalsContact NE2-CZ 3.35Å; Q74-R759 VanDerWaalsContact NE2-NH1 3.17Å; D757-R759 VanDerWaalsContact OD1-CB 3.26Å; D757-R759 WeakPolarHBondContact OD1-CB 3.14Å; D757-R759 VanDerWaalsContact OD1-CG 3.24Å; D757-R759 WeakPolarHBondContact OD1-CG 3.34Å; D757-R759 IonicContact OD1-CZ 3.95Å; D757-R759 PolarHBondContact OD1-N 3.06Å; D757-R759 IonicContact OD1-NE 3.94Å; D757-R759 PolarHBondContact OD1-NE 3.44Å; D757-R759 IonicContact OD1-NH2 3.64Å; D757-R759 IonicContact OD2-CZ 3.18Å; D757-R759 IonicContact OD2-NE 2.68Å; D757-R759 PolarHBondContact OD2-NE 3.48Å; D757-R759 IonicContact OD2-NH2 3.97Å; D757-R759 PolarHBondContact OD2-NH2 3.01Å; R759-Y764 HydrophobicContact CB-CD2 4.48Å
760	N	84.2	Confident	76.9	Confident	99 Å²	99	61.1 Å²	61.1	53%	0.529	29%	0.293	S	S	.	.			trans	-138.7	167.8	178.7	-78.8	-35.1	0	0	0	108.8	F762 N763 Y764	N760-F762 PolarHBondContact O-N 3.48Å; N760-N763 PolarHBondContact O-N 2.8Å; N760-Y764 WeakPolarHBondContact O-CB 3.48Å; N760-Y764 PolarHBondContact O-N 2.86Å
761	I	84.5	Confident	75.1	Confident	35 Å²	35	63.6 Å²	63.6	18%	0.179	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-38.4	-178	-53.6	166.3	0	0	0	112.4	K607 R608 I611	K607-I761 HydrophobicContact CB-CD1 4.16Å; K607-I761 HydrophobicContact CB-CG1 4.45Å; K607-I761 HydrophobicContact CD-CD1 3.41Å; K607-I761 VanDerWaalsContact CD-CD1 3.41Å; K607-I761 HydrophobicContact CD-CG1 3.7Å; K607-I761 HydrophobicContact CG-CD1 4.41Å; R608-I761 HydrophobicContact CG-CG2 4.19Å; R608-I761 PolarHBondContact NH2-O 3.27Å; R608-I761 VanDerWaalsContact NH2-O 3.16Å; I611-I761 HydrophobicContact CD1-CG2 4.31Å
762	F	83.5	Confident	73.5	Confident	105 Å²	105	63.5 Å²	63.5	46%	0.461	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-28.3	-177.3	-57.2	-71.1	0	0	0	114.1	L454 I456 P457 N760	L454-F762 HydrophobicContact CB-CE1 4.35Å; L454-F762 WeakPolarHBondContact O-CD1 3.44Å; I456-F762 HydrophobicContact CG1-CD1 4.04Å; I456-F762 HydrophobicContact CG1-CE1 4.24Å; P457-F762 WeakPolarHBondContact CD-O 3.31Å; N760-F762 PolarHBondContact O-N 3.48Å
763	N	80.2	Confident	72.7	Confident	94 Å²	94	70.5 Å²	70.5	50%	0.503	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-23.7	-174.3	-71.1	4.7	0	0	0	112.5	N760 N765 I770	N760-N763 PolarHBondContact O-N 2.8Å; N763-N765 PolarHBondContact O-N 2.82Å; N763-N765 VanDerWaalsContact O-N 3.17Å; N763-I770 HydrophobicContact CB-CD1 4.49Å; N763-I770 WeakPolarHBondContact O-CD1 3.31Å
764	Y	80.3	Confident	72.2	Confident	21 Å²	21	71.5 Å²	71.5	8%	0.082	34%	0.339	C	S	.	.			trans	-66.5	114.8	-176.3	-176.3	-97.6	0	0	0	111.7	V60 V63 I65 P457 I604 R608 R759 N760 D766	V60-Y764 PolarHBondContact O-OH 2.92Å; V63-Y764 WeakPolarHBondContact CG2-OH 3.5Å; I65-Y764 HydrophobicContact CD1-CD2 3.64Å; I65-Y764 HydrophobicContact CD1-CE2 4.24Å; I65-Y764 HydrophobicContact CD1-CG 3.98Å; P457-Y764 WeakPolarHBondContact CG-O 3.39Å; I604-Y764 HydrophobicContact CD1-CD1 3.39Å; I604-Y764 HydrophobicContact CD1-CD2 3.85Å; I604-Y764 HydrophobicContact CD1-CE1 3.56Å; I604-Y764 HydrophobicContact CD1-CE2 3.97Å; I604-Y764 HydrophobicContact CD1-CG 3.53Å; I604-Y764 HydrophobicContact CG2-CD1 4.44Å; R608-Y764 PolarHBondContact NH2-O 3.18Å; R759-Y764 HydrophobicContact CB-CD2 4.48Å; N760-Y764 WeakPolarHBondContact O-CB 3.48Å; N760-Y764 PolarHBondContact O-N 2.86Å; Y764-D766 VanDerWaalsContact CE1-OD1 3.26Å; Y764-D766 WeakPolarHBondContact CE1-OD1 3.25Å; Y764-D766 PolarHBondContact OH-OD1 3.29Å
765	N	72.7	Confident	71.7	Confident	34 Å²	34	69.8 Å²	69.8	18%	0.182	34%	0.335	C	S	.	.			trans	-140.2	133.6	171.6	-165.5	28.9	0	0	0	108.3	P457 N763	P457-N765 HydrophobicContact CB-CB 4.15Å; P457-N765 HydrophobicContact CG-CB 4.08Å; N763-N765 PolarHBondContact O-N 2.82Å; N763-N765 VanDerWaalsContact O-N 3.17Å
766	D	61.8	Low	71.3	Confident	51 Å²	51	70.4 Å²	70.4	27%	0.273	34%	0.335	S	S	.	.	S	Bend	trans	-73.1	-33.9	-176.6	-86.2	16.4	0	0	0	112.3	V60 Y764 I768	V60-D766 VanDerWaalsContact CA-OD2 3.29Å; V60-D766 WeakPolarHBondContact CA-OD2 3.46Å; V60-D766 VanDerWaalsContact CB-OD2 3.3Å; V60-D766 WeakPolarHBondContact CB-OD2 3.5Å; V60-D766 HydrophobicContact CG1-CB 3.82Å; V60-D766 WeakPolarHBondContact CG1-OD2 3.41Å; V60-D766 HydrophobicContact CG2-CB 4.47Å; V60-D766 VanDerWaalsContact CG2-OD2 3.31Å; V60-D766 WeakPolarHBondContact CG2-OD2 3.29Å; Y764-D766 VanDerWaalsContact CE1-OD1 3.26Å; Y764-D766 WeakPolarHBondContact CE1-OD1 3.25Å; Y764-D766 PolarHBondContact OH-OD1 3.29Å; D766-I768 PolarHBondContact O-N 2.7Å
767	D	52.2	Low	70.6	Confident	125 Å²	125	67.9 Å²	67.9	67%	0.668	33%	0.325	S	S	*	.	S	Bend	trans	-67.9	-21.8	-177	-60.7	-26.6	0	0	0	113.4
768	I	50.6	Low	69.6	Low	101 Å²	101	70.8 Å²	70.8	52%	0.518	35%	0.347	S	S	.	.	S	Bend	trans	-112.4	101.9	175.3	-54.1	172.7	0	0	0	104.2	D766 I770	D766-I768 PolarHBondContact O-N 2.7Å; I768-I770 HydrophobicContact CB-CG1 4.23Å; I768-I770 HydrophobicContact CG2-CG1 3.71Å; I768-I770 PolarHBondContact O-N 2.96Å
769	Y	50.5	Low	68.5	Low	187 Å²	187	72.3 Å²	72.3	73%	0.733	36%	0.364	S	S	*	.			trans	-57.7	82.2	163.5	-78.7	-85.2	0	0	0	108.4	H771	Y769-H771 AromaticContact CD1-CE1 3.46Å; Y769-H771 VanDerWaalsContact CD1-CE1 3.46Å; Y769-H771 WeakPolarHBondContact CD1-CE1 3.3Å; Y769-H771 AromaticContact CD1-NE2 3.61Å; Y769-H771 AromaticContact CG-NE2 3.83Å; Y769-H771 PolarHBondContact O-N 2.87Å
770	I	49.8	Very low	67.3	Low	68 Å²	68	78 Å²	78	35%	0.349	40%	0.396	S	S	.	.			trans	-75.2	75.1	163.7	-54.1	178.5	0	0	0	103.5	N763 I768 S772	N763-I770 HydrophobicContact CB-CD1 4.49Å; N763-I770 WeakPolarHBondContact O-CD1 3.31Å; I768-I770 HydrophobicContact CB-CG1 4.23Å; I768-I770 HydrophobicContact CG2-CG1 3.71Å; I768-I770 PolarHBondContact O-N 2.96Å; I770-S772 PolarHBondContact O-N 3.34Å; I770-S772 VanDerWaalsContact O-N 3.12Å
771	H	54.4	Low	66.1	Low	52 Å²	52	77.3 Å²	77.3	24%	0.241	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-56.7	119.7	159.3	-67.4	-53	0	0	0	105.3	T81 Y769 K773	T81-H771 WeakPolarHBondContact CG2-NE2 3.47Å; Y769-H771 AromaticContact CD1-CE1 3.46Å; Y769-H771 VanDerWaalsContact CD1-CE1 3.46Å; Y769-H771 WeakPolarHBondContact CD1-CE1 3.3Å; Y769-H771 AromaticContact CD1-NE2 3.61Å; Y769-H771 AromaticContact CG-NE2 3.83Å; Y769-H771 PolarHBondContact O-N 2.87Å; H771-K773 PolarHBondContact O-N 2.53Å
772	S	57.6	Low	65.3	Low	0 Å²	0	76.8 Å²	76.8	0%	0	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-47.7	131.8	168.7	55.8	0	0	0	0	107.3	Q75 A78 I770 L774	Q75-S772 PolarHBondContact NE2-OG 3.02Å; A78-S772 WeakPolarHBondContact CB-O 3.08Å; I770-S772 PolarHBondContact O-N 3.34Å; I770-S772 VanDerWaalsContact O-N 3.12Å; S772-L774 PolarHBondContact O-N 3.18Å
773	K	68.2	Low	64.9	Low	150 Å²	150	74.1 Å²	74.1	65%	0.652	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-53.1	135	177.3	-70.7	177.8	-179.1	174.3	0	109.3	Q75 E82 E758 H771 L775	Q75-K773 PolarHBondContact NE2-O 3.15Å; E82-K773 WeakPolarHBondContact OE1-CA 3.1Å; E758-K773 PolarHBondContact OE2-N 3.1Å; H771-K773 PolarHBondContact O-N 2.53Å; K773-L775 PolarHBondContact O-N 3.16Å
774	L	76	Confident	64.9	Low	20 Å²	20	69.8 Å²	69.8	11%	0.105	36%	0.355	C	S	.	.			trans	-60	113.2	178.7	-177.5	65.5	0	0	0	109.1	A78 L79 E82 T83 P753 S772 L776 I901	A78-L774 HydrophobicContact CB-CB 4.45Å; A78-L774 HydrophobicContact CB-CD1 4.37Å; L79-L774 HydrophobicContact CB-CD1 3.97Å; L79-L774 HydrophobicContact CD1-CD1 4.12Å; L79-L774 HydrophobicContact CD1-CD2 4.09Å; E82-L774 HydrophobicContact CB-CB 4.42Å; E82-L774 HydrophobicContact CB-CD2 4.42Å; E82-L774 HydrophobicContact CG-CB 4.42Å; E82-L774 PolarHBondContact OE1-N 3.45Å; E82-L774 WeakPolarHBondContact OE2-CB 3.17Å; T83-L774 HydrophobicContact CG2-CD2 3.79Å; P753-L774 HydrophobicContact CB-CD1 3.83Å; S772-L774 PolarHBondContact O-N 3.18Å; L774-L776 HydrophobicContact CD2-CD2 3.96Å; L774-L776 HydrophobicContact CD2-CG 4.31Å; L774-L776 HydrophobicContact CG-CD2 3.99Å; L774-L776 HydrophobicContact CG-CG 4.17Å; L774-I901 HydrophobicContact CD2-CD1 4.14Å
775	L	77.1	Confident	64.8	Low	64 Å²	64	68.8 Å²	68.8	34%	0.335	35%	0.352	S	S	.	.			trans	-101.4	108	-179.1	-162.6	141.4	0	0	0	109	P753 K754 Y756 K773	P753-L775 CarbonylContact C-O 3.55Å; P753-L775 WeakPolarHBondContact CA-O 3.23Å; K754-L775 HydrophobicContact CB-CD2 3.65Å; K754-L775 HydrophobicContact CD-CD2 3.62Å; K754-L775 HydrophobicContact CG-CD2 4.06Å; K754-L775 PolarHBondContact N-O 3.41Å; Y756-L775 HydrophobicContact CD1-CD1 4.34Å; K773-L775 PolarHBondContact O-N 3.16Å
776	L	76.7	Confident	65.3	Low	62 Å²	62	68.4 Å²	68.4	33%	0.325	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-92	149.1	-178.5	-60.7	162.7	0	0	0	110.4	L774 I901 V910	L774-L776 HydrophobicContact CD2-CD2 3.96Å; L774-L776 HydrophobicContact CD2-CG 4.31Å; L774-L776 HydrophobicContact CG-CD2 3.99Å; L774-L776 HydrophobicContact CG-CG 4.17Å; L776-I901 HydrophobicContact CD1-CD1 3.39Å; L776-V910 HydrophobicContact CD1-CG1 3.6Å; L776-V910 HydrophobicContact CD2-CG1 3.26Å; L776-V910 HydrophobicContact CG-CG1 4.01Å
777	Y	71.9	Confident	66.5	Low	56 Å²	56	69.7 Å²	69.7	22%	0.22	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-62.5	147.6	160.3	-69.3	-82.4	0	0	0	109.1	G752 P753 K754 S779 I782 H954	G752-Y777 WeakPolarHBondContact O-CD2 3.21Å; P753-Y777 WeakPolarHBondContact O-CE2 3.12Å; K754-Y777 HydrophobicContact CB-CD2 4.21Å; K754-Y777 HydrophobicContact CB-CE1 4.22Å; K754-Y777 HydrophobicContact CB-CE2 3.76Å; K754-Y777 HydrophobicContact CD-CE1 4.13Å; K754-Y777 HydrophobicContact CG-CE1 4.18Å; K754-Y777 HydrophobicContact CG-CE2 4.37Å; Y777-S779 PolarHBondContact O-N 2.92Å; Y777-I782 HydrophobicContact CD2-CD1 3.79Å; Y777-I782 HydrophobicContact CG-CD1 4.19Å; Y777-H954 HydrophobicContact CD2-CB 4.4Å; Y777-H954 HydrophobicContact CE1-CB 4.47Å; Y777-H954 HydrophobicContact CE2-CB 3.7Å; Y777-H954 AromaticContact CZ-CG 3.85Å
778	S	63.1	Low	68.2	Low	81 Å²	81	70.4 Å²	70.4	57%	0.566	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-48.8	136.1	177.2	-179.8	0	0	0	0	110.1	N780 M781	S778-N780 PolarHBondContact O-N 2.97Å; S778-M781 WeakPolarHBondContact O-CB 3.49Å; S778-M781 PolarHBondContact O-N 3.27Å
779	S	59.6	Low	69.9	Low	95 Å²	95	65.6 Å²	65.6	66%	0.664	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-49.5	-26.6	-171.5	55.7	0	0	0	0	114.3	Y777 M781	Y777-S779 PolarHBondContact O-N 2.92Å; S779-M781 PolarHBondContact O-N 3.38Å
780	N	58.5	Low	71.7	Confident	138 Å²	138	56.7 Å²	56.7	74%	0.738	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-72.9	-12.4	178.9	-65.8	-2.2	0	0	0	114.2	S778	S778-N780 PolarHBondContact O-N 2.97Å
781	M	59.4	Low	73.6	Confident	84 Å²	84	57.4 Å²	57.4	41%	0.414	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-95.5	-20.2	-171.8	-65.9	-69.4	-77.7	0	0	113.7	S778 S779 L951	S778-M781 WeakPolarHBondContact O-CB 3.49Å; S778-M781 PolarHBondContact O-N 3.27Å; S779-M781 PolarHBondContact O-N 3.38Å; M781-L951 WeakPolarHBondContact O-CA 3.43Å; M781-L951 WeakPolarHBondContact O-CB 3.37Å
782	I	66.9	Low	75.4	Confident	24 Å²	24	56 Å²	56	12%	0.123	29%	0.294	C	S	.	.			trans	-127.9	97.7	-173.6	-54.4	-176	0	0	0	109.3	G752 Y777 F784	G752-I782 WeakPolarHBondContact O-CD1 3.42Å; Y777-I782 HydrophobicContact CD2-CD1 3.79Å; Y777-I782 HydrophobicContact CG-CD1 4.19Å; I782-F784 HydrophobicContact CG2-CD1 4.49Å; I782-F784 HydrophobicContact CG2-CD2 3.92Å; I782-F784 HydrophobicContact CG2-CE1 4.01Å; I782-F784 HydrophobicContact CG2-CE2 3.38Å; I782-F784 HydrophobicContact CG2-CG 4.45Å; I782-F784 HydrophobicContact CG2-CZ 3.43Å; I782-F784 VanDerWaalsContact CG2-CZ 3.43Å
783	N	75.7	Confident	76.9	Confident	49 Å²	49	56 Å²	56	26%	0.262	29%	0.294	S	S	.	.			trans	-116.2	96.7	170.7	-168.4	-19.8	0	0	0	110	T785 S786 S789 L951	N783-T785 PolarHBondContact O-N 2.84Å; N783-T785 WeakPolarHBondContact OD1-CA 3.38Å; N783-T785 WeakPolarHBondContact OD1-CB 3.36Å; N783-T785 PolarHBondContact OD1-N 2.61Å; N783-T785 PolarHBondContact OD1-OG1 3.22Å; N783-S786 PolarHBondContact OD1-N 3.46Å; N783-S789 PolarHBondContact O-OG 3.48Å; N783-S789 VanDerWaalsContact O-OG 3.12Å; N783-L951 HydrophobicContact CB-CD2 4.11Å
784	F	79.9	Confident	78	Confident	3 Å²	3	50.7 Å²	50.7	1%	0.013	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.4	175.7	-62.9	-72.3	0	0	0	112.7	W751 I782 S789 F898 P909 L912 L952	W751-F784 HydrophobicContact CB-CE1 3.6Å; W751-F784 HydrophobicContact CB-CZ 3.68Å; W751-F784 HydrophobicContact CG-CE1 4.34Å; I782-F784 HydrophobicContact CG2-CD1 4.49Å; I782-F784 HydrophobicContact CG2-CD2 3.92Å; I782-F784 HydrophobicContact CG2-CE1 4.01Å; I782-F784 HydrophobicContact CG2-CE2 3.38Å; I782-F784 HydrophobicContact CG2-CG 4.45Å; I782-F784 HydrophobicContact CG2-CZ 3.43Å; I782-F784 VanDerWaalsContact CG2-CZ 3.43Å; F784-S789 PolarHBondContact O-OG 2.04Å; F784-F898 HydrophobicContact CB-CE1 4.08Å; F784-F898 HydrophobicContact CG-CE1 4.31Å; F784-P909 HydrophobicContact CB-CG 4.15Å; F784-P909 HydrophobicContact CD2-CB 4.34Å; F784-P909 HydrophobicContact CD2-CG 4.02Å; F784-P909 VanDerWaalsContact CD2-O 3.32Å; F784-P909 WeakPolarHBondContact CD2-O 3.26Å; F784-P909 HydrophobicContact CG-CG 4.5Å; F784-L912 HydrophobicContact CD1-CB 4.25Å; F784-L912 HydrophobicContact CD1-CD2 4.3Å; F784-L912 HydrophobicContact CE1-CB 3.73Å; F784-L912 HydrophobicContact CE1-CD2 4.28Å; F784-L912 HydrophobicContact CZ-CB 3.9Å; F784-L952 HydrophobicContact CD1-CD2 3.78Å; F784-L952 HydrophobicContact CE1-CD2 3.65Å
785	T	78.9	Confident	78.7	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.006	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.2	-173.6	76	0	0	0	0	113.4	N783 R790 V875 I879	N783-T785 PolarHBondContact O-N 2.84Å; N783-T785 WeakPolarHBondContact OD1-CA 3.38Å; N783-T785 WeakPolarHBondContact OD1-CB 3.36Å; N783-T785 PolarHBondContact OD1-N 2.61Å; N783-T785 PolarHBondContact OD1-OG1 3.22Å; T785-R790 PolarHBondContact O-NE 2.85Å; T785-R790 PolarHBondContact O-NH2 2.69Å; T785-V875 WeakPolarHBondContact OG1-CG1 3.48Å; T785-I879 HydrophobicContact CG2-CD1 4.04Å; T785-I879 HydrophobicContact CG2-CG1 3.8Å
786	S	83.7	Confident	79.4	Confident	25 Å²	25	52 Å²	52	18%	0.175	28%	0.275	C	S	.	.	S	Bend	trans	-63.1	153.4	177.4	81.3	0	0	0	0	112.6	N783 H788 S789 R790	N783-S786 PolarHBondContact OD1-N 3.46Å; S786-H788 VanDerWaalsContact C-N 3.31Å; S786-H788 PolarHBondContact O-N 3.13Å; S786-S789 PolarHBondContact N-OG 3.36Å; S786-S789 PolarHBondContact O-N 3Å; S786-S789 PolarHBondContact O-OG 2.85Å; S786-S789 WeakPolarHBondContact OG-CB 3.27Å; S786-S789 PolarHBondContact OG-N 2.7Å; S786-S789 VanDerWaalsContact OG-N 3.09Å; S786-S789 PolarHBondContact OG-OG 2.9Å; S786-R790 WeakPolarHBondContact O-CG 2.94Å; S786-R790 PolarHBondContact O-N 3.39Å; S786-R790 VanDerWaalsContact O-N 3.15Å
787	I	86.8	Confident	80.1	Confident	78 Å²	78	49.1 Å²	49.1	40%	0.4	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-40.1	178.9	-64	170.1	0	0	0	110.7	R790 L791	I787-R790 PolarHBondContact O-N 3.26Å; I787-L791 HydrophobicContact CG2-CD1 4.15Å; I787-L791 WeakPolarHBondContact O-CG 3.24Å; I787-L791 PolarHBondContact O-N 3.29Å; I787-L791 VanDerWaalsContact O-N 3.07Å
788	H	87	Confident	80.9	Confident	141 Å²	141	50 Å²	50	65%	0.653	27%	0.268	S	S	*	.	H	α-helix	trans	-65	-39.3	178.4	-70.2	-58.9	0	0	0	113	S786 W792	S786-H788 VanDerWaalsContact C-N 3.31Å; S786-H788 PolarHBondContact O-N 3.13Å; H788-W792 WeakPolarHBondContact O-CB 3.37Å; H788-W792 PolarHBondContact O-N 3.09Å
789	S	87.1	Confident	82.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-42.3	175.4	51	0	0	0	0	111.6	N783 F784 S786 W792 L793	N783-S789 PolarHBondContact O-OG 3.48Å; N783-S789 VanDerWaalsContact O-OG 3.12Å; F784-S789 PolarHBondContact O-OG 2.04Å; S786-S789 PolarHBondContact N-OG 3.36Å; S786-S789 PolarHBondContact O-N 3Å; S786-S789 PolarHBondContact O-OG 2.85Å; S786-S789 WeakPolarHBondContact OG-CB 3.27Å; S786-S789 PolarHBondContact OG-N 2.7Å; S786-S789 VanDerWaalsContact OG-N 3.09Å; S786-S789 PolarHBondContact OG-OG 2.9Å; S789-W792 PolarHBondContact O-N 2.86Å; S789-L793 WeakPolarHBondContact O-CB 3.15Å; S789-L793 VanDerWaalsContact O-CG 3.29Å; S789-L793 WeakPolarHBondContact O-CG 3.33Å; S789-L793 PolarHBondContact O-N 3.33Å
790	R	88.2	Confident	83.7	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-45.9	177.2	-65.8	176.7	-151.3	175.3	2.4	112.4	T785 S786 I787 L793 L794 F838 I870 Y871 S873 F878	T785-R790 PolarHBondContact O-NE 2.85Å; T785-R790 PolarHBondContact O-NH2 2.69Å; S786-R790 WeakPolarHBondContact O-CG 2.94Å; S786-R790 PolarHBondContact O-N 3.39Å; S786-R790 VanDerWaalsContact O-N 3.15Å; I787-R790 PolarHBondContact O-N 3.26Å; R790-L793 PolarHBondContact O-N 3.38Å; R790-L794 WeakPolarHBondContact O-CB 2.93Å; R790-L794 PolarHBondContact O-N 3.16Å; R790-F838 HydrophobicContact CG-CE1 4.38Å; R790-F838 HydrophobicContact CG-CZ 4.42Å; R790-I870 PolarHBondContact NH1-O 3.13Å; R790-Y871 HydrophobicContact CB-CD1 4.36Å; R790-S873 PolarHBondContact NH1-O 2.98Å; R790-S873 PolarHBondContact NH1-OG 3.13Å; R790-F878 VanDerWaalsContact CZ-CD1 3.45Å
791	L	89.5	Confident	84.9	Confident	83 Å²	83	42.6 Å²	42.6	44%	0.435	21%	0.208	S	C	.	.	H	α-helix	trans	-64.4	-40.2	178.1	-71.9	174.1	0	0	0	111.9	I787 K795 Y871	I787-L791 HydrophobicContact CG2-CD1 4.15Å; I787-L791 WeakPolarHBondContact O-CG 3.24Å; I787-L791 PolarHBondContact O-N 3.29Å; I787-L791 VanDerWaalsContact O-N 3.07Å; L791-K795 PolarHBondContact O-N 3.09Å; L791-K795 VanDerWaalsContact O-N 3.08Å; L791-Y871 HydrophobicContact CD2-CD1 4.28Å; L791-Y871 HydrophobicContact CD2-CG 4.46Å
792	W	91.4	Very high	86.3	Confident	21 Å²	21	47.4 Å²	47.4	8%	0.08	22%	0.221	C	C	.	.	H	α-helix	trans	-68.9	-42.2	176.8	-174.3	86	0	0	0	112.1	W751 H788 S789 L794 K795 F796 T947 A948 L952	W751-W792 AromaticContact CZ2-CH2 3.97Å; W751-W792 HydrophobicContact CZ2-CH2 3.97Å; W751-W792 AromaticContact CZ2-CZ3 3.96Å; W751-W792 HydrophobicContact CZ2-CZ3 3.96Å; H788-W792 WeakPolarHBondContact O-CB 3.37Å; H788-W792 PolarHBondContact O-N 3.09Å; S789-W792 PolarHBondContact O-N 2.86Å; W792-L794 VanDerWaalsContact C-N 3.32Å; W792-L794 PolarHBondContact O-N 3.49Å; W792-K795 CarbonylContact O-C 3.55Å; W792-K795 WeakPolarHBondContact O-CA 3.36Å; W792-K795 WeakPolarHBondContact O-CB 3.08Å; W792-K795 PolarHBondContact O-N 3.33Å; W792-K795 VanDerWaalsContact O-N 3.1Å; W792-F796 HydrophobicContact CE3-CB 4.39Å; W792-F796 HydrophobicContact CH2-CB 4.36Å; W792-F796 HydrophobicContact CH2-CD2 4.08Å; W792-F796 HydrophobicContact CH2-CG 4.32Å; W792-F796 HydrophobicContact CZ2-CD2 4.45Å; W792-F796 HydrophobicContact CZ3-CB 4.23Å; W792-F796 HydrophobicContact CZ3-CG 4.4Å; W792-F796 WeakPolarHBondContact O-CB 3.42Å; W792-F796 PolarHBondContact O-N 3.15Å; W792-T947 VanDerWaalsContact CD1-O 3.32Å; W792-T947 PolarHBondContact NE1-O 2.92Å; W792-T947 PolarHBondContact NE1-OG1 3.49Å; W792-A948 HydrophobicContact CD2-CB 4.16Å; W792-A948 HydrophobicContact CH2-CB 4.04Å; W792-A948 HydrophobicContact CZ2-CB 3.56Å; W792-A948 VanDerWaalsContact NE1-CA 3.34Å; W792-L952 HydrophobicContact CD2-CD1 4.5Å; W792-L952 HydrophobicContact CE3-CB 4.43Å; W792-L952 HydrophobicContact CE3-CD1 3.66Å; W792-L952 HydrophobicContact CZ3-CB 4.4Å; W792-L952 HydrophobicContact CZ3-CD1 4.15Å
793	L	89.7	Confident	87.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.4	-37.1	175.9	-73.4	171.2	0	0	0	111.9	S789 R790 F796 C797 F838 L912 L952	S789-L793 WeakPolarHBondContact O-CB 3.15Å; S789-L793 VanDerWaalsContact O-CG 3.29Å; S789-L793 WeakPolarHBondContact O-CG 3.33Å; S789-L793 PolarHBondContact O-N 3.33Å; R790-L793 PolarHBondContact O-N 3.38Å; L793-F796 PolarHBondContact O-N 3.12Å; L793-C797 WeakPolarHBondContact O-CB 3.43Å; L793-C797 PolarHBondContact O-N 3.45Å; L793-C797 PolarHBondContact O-SG 3.27Å; L793-F838 HydrophobicContact CB-CD2 3.68Å; L793-F838 HydrophobicContact CB-CE2 3.97Å; L793-F838 HydrophobicContact CB-CG 4.44Å; L793-F838 HydrophobicContact CD1-CD2 4.18Å; L793-F838 HydrophobicContact CD1-CE2 3.64Å; L793-F838 HydrophobicContact CD1-CZ 4.46Å; L793-F838 HydrophobicContact CG-CE2 4.44Å; L793-L912 HydrophobicContact CD1-CD2 3.9Å; L793-L912 HydrophobicContact CD2-CD2 3.86Å; L793-L952 HydrophobicContact CD2-CD1 4.49Å; L793-L952 HydrophobicContact CG-CD1 4.2Å
794	L	90.4	Very high	87.9	Confident	39 Å²	39	46.2 Å²	46.2	20%	0.204	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-45.3	170.3	174.9	63.9	0	0	0	111.6	R790 W792 C797 N798 G839 Y871	R790-L794 WeakPolarHBondContact O-CB 2.93Å; R790-L794 PolarHBondContact O-N 3.16Å; W792-L794 VanDerWaalsContact C-N 3.32Å; W792-L794 PolarHBondContact O-N 3.49Å; L794-C797 PolarHBondContact O-N 2.7Å; L794-N798 PolarHBondContact O-N 3.4Å; L794-N798 PolarHBondContact O-ND2 2.96Å; L794-G839 VanDerWaalsContact CD1-CA 3.49Å; L794-Y871 HydrophobicContact CB-CE1 3.84Å; L794-Y871 HydrophobicContact CD1-CE1 4.43Å; L794-Y871 HydrophobicContact CD2-CD1 4.18Å; L794-Y871 HydrophobicContact CD2-CE1 3.74Å; L794-Y871 HydrophobicContact CD2-CE2 4.18Å; L794-Y871 HydrophobicContact CG-CE1 4.2Å
795	K	91.4	Very high	88.2	Confident	109 Å²	109	48.9 Å²	48.9	47%	0.474	23%	0.229	S	C	.	.	H	α-helix	trans	-61.8	-44.4	175.7	-174.1	-176.7	177.2	-172.8	0	111	L791 W792 N798 E799	L791-K795 PolarHBondContact O-N 3.09Å; L791-K795 VanDerWaalsContact O-N 3.08Å; W792-K795 CarbonylContact O-C 3.55Å; W792-K795 WeakPolarHBondContact O-CA 3.36Å; W792-K795 WeakPolarHBondContact O-CB 3.08Å; W792-K795 PolarHBondContact O-N 3.33Å; W792-K795 VanDerWaalsContact O-N 3.1Å; K795-N798 PolarHBondContact O-N 3.36Å; K795-E799 PolarHBondContact O-N 3.1Å
796	F	91.6	Very high	88.6	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-49.4	177.2	178.4	-100.5	0	0	0	111.7	F749 W751 W792 L793 N798 E799 L800 I914 F941 L944	F749-F796 HydrophobicContact CB-CZ 4.41Å; F749-F796 HydrophobicContact CD1-CZ 4.11Å; F749-F796 HydrophobicContact CD2-CZ 4.34Å; F749-F796 HydrophobicContact CE1-CZ 4.42Å; F749-F796 HydrophobicContact CG-CZ 4.04Å; W751-F796 HydrophobicContact CH2-CD1 4.11Å; W751-F796 AromaticContact CH2-CE1 3.57Å; W751-F796 HydrophobicContact CH2-CE1 3.57Å; W751-F796 HydrophobicContact CH2-CE2 4.32Å; W751-F796 AromaticContact CH2-CZ 3.7Å; W751-F796 HydrophobicContact CH2-CZ 3.7Å; W751-F796 HydrophobicContact CZ2-CE1 4.43Å; W751-F796 HydrophobicContact CZ2-CZ 4.34Å; W751-F796 HydrophobicContact CZ3-CE1 4.39Å; W792-F796 HydrophobicContact CE3-CB 4.39Å; W792-F796 HydrophobicContact CH2-CB 4.36Å; W792-F796 HydrophobicContact CH2-CD2 4.08Å; W792-F796 HydrophobicContact CH2-CG 4.32Å; W792-F796 HydrophobicContact CZ2-CD2 4.45Å; W792-F796 HydrophobicContact CZ3-CB 4.23Å; W792-F796 HydrophobicContact CZ3-CG 4.4Å; W792-F796 WeakPolarHBondContact O-CB 3.42Å; W792-F796 PolarHBondContact O-N 3.15Å; L793-F796 PolarHBondContact O-N 3.12Å; F796-N798 VanDerWaalsContact C-N 3.26Å; F796-N798 PolarHBondContact O-N 3.34Å; F796-E799 PolarHBondContact O-N 2.65Å; F796-E799 VanDerWaalsContact O-N 3.09Å; F796-L800 HydrophobicContact CD1-CD1 4.05Å; F796-L800 HydrophobicContact CD1-CG 4.28Å; F796-L800 HydrophobicContact CE1-CD1 3.67Å; F796-L800 HydrophobicContact CE1-CD2 4.01Å; F796-L800 HydrophobicContact CE1-CG 3.88Å; F796-L800 HydrophobicContact CZ-CD1 4.38Å; F796-L800 HydrophobicContact CZ-CD2 3.87Å; F796-L800 HydrophobicContact CZ-CG 4.14Å; F796-L800 PolarHBondContact O-N 3.32Å; F796-I914 HydrophobicContact CD1-CD1 3.95Å; F796-I914 HydrophobicContact CE1-CD1 3.81Å; F796-I914 HydrophobicContact CE1-CG2 4.31Å; F796-F941 HydrophobicContact CE2-CD2 4.04Å; F796-F941 AromaticContact CE2-CE2 3.86Å; F796-F941 HydrophobicContact CE2-CE2 3.86Å; F796-F941 HydrophobicContact CZ-CD2 4.4Å; F796-F941 HydrophobicContact CZ-CE2 4.06Å; F796-L944 HydrophobicContact CD2-CD1 4.47Å; F796-L944 HydrophobicContact CE2-CD1 4.46Å
797	C	90.6	Very high	88.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.9	-38.6	176	-69.9	0	0	0	0	111.6	L793 L794 L800 C836 F838 Y841	L793-C797 WeakPolarHBondContact O-CB 3.43Å; L793-C797 PolarHBondContact O-N 3.45Å; L793-C797 PolarHBondContact O-SG 3.27Å; L794-C797 PolarHBondContact O-N 2.7Å; C797-L800 WeakPolarHBondContact O-CB 3.31Å; C797-L800 PolarHBondContact O-N 3.44Å; C797-C836 HydrophobicContact CB-CB 3.91Å; C797-C836 WeakPolarHBondContact CB-SG 3.19Å; C797-C836 WeakPolarHBondContact SG-CB 3.36Å; C797-C836 CovalentContact SG-SG 2.04Å; C797-C836 PolarHBondContact SG-SG 3.21Å; C797-F838 WeakPolarHBondContact CB-O 3.31Å; C797-F838 PolarHBondContact SG-O 2.78Å; C797-F838 VanDerWaalsContact SG-O 3.36Å; C797-Y841 HydrophobicContact CB-CE2 3.98Å; C797-Y841 PolarHBondContact O-OH 2.9Å
798	N	90.3	Very high	88.1	Confident	75 Å²	75	53.7 Å²	53.7	40%	0.401	25%	0.247	S	C	.	.	H	α-helix	trans	-67.8	-38	175.8	-74	-33.5	0	0	0	113	L794 K795 F796 L800 K801	L794-N798 PolarHBondContact O-N 3.4Å; L794-N798 PolarHBondContact O-ND2 2.96Å; K795-N798 PolarHBondContact O-N 3.36Å; F796-N798 VanDerWaalsContact C-N 3.26Å; F796-N798 PolarHBondContact O-N 3.34Å; N798-L800 VanDerWaalsContact C-N 3.34Å; N798-K801 PolarHBondContact O-N 2.79Å
799	E	91.2	Very high	87	Confident	50 Å²	50	49.6 Å²	49.6	23%	0.234	24%	0.235	C	C	.	.	H	α-helix	trans	-72.5	-23.9	176.5	-67.9	-58.4	151.2	0	0	113	K795 F796 K801 R802 M803 L944	K795-E799 PolarHBondContact O-N 3.1Å; F796-E799 PolarHBondContact O-N 2.65Å; F796-E799 VanDerWaalsContact O-N 3.09Å; E799-K801 PolarHBondContact O-N 2.8Å; E799-R802 WeakPolarHBondContact O-CA 3.5Å; E799-R802 PolarHBondContact O-N 2.65Å; E799-R802 IonicContact OE1-NH1 3.91Å; E799-R802 PolarHBondContact OE1-NH1 3.46Å; E799-R802 IonicContact OE2-NH1 4Å; E799-M803 PolarHBondContact O-N 3.34Å; E799-L944 HydrophobicContact CB-CD1 4.22Å; E799-L944 HydrophobicContact CB-CD2 4.28Å; E799-L944 HydrophobicContact CG-CD2 4.15Å
800	L	88.7	Confident	85.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.4	-29.9	172.8	-76.9	169.8	0	0	0	112.6	F749 F796 C797 N798 R802 M803 V834 C836 I914 W940	F749-L800 HydrophobicContact CD2-CD2 4.26Å; F749-L800 HydrophobicContact CE2-CD2 3.67Å; F749-L800 HydrophobicContact CZ-CD2 4.06Å; F796-L800 HydrophobicContact CD1-CD1 4.05Å; F796-L800 HydrophobicContact CD1-CG 4.28Å; F796-L800 HydrophobicContact CE1-CD1 3.67Å; F796-L800 HydrophobicContact CE1-CD2 4.01Å; F796-L800 HydrophobicContact CE1-CG 3.88Å; F796-L800 HydrophobicContact CZ-CD1 4.38Å; F796-L800 HydrophobicContact CZ-CD2 3.87Å; F796-L800 HydrophobicContact CZ-CG 4.14Å; F796-L800 PolarHBondContact O-N 3.32Å; C797-L800 WeakPolarHBondContact O-CB 3.31Å; C797-L800 PolarHBondContact O-N 3.44Å; N798-L800 VanDerWaalsContact C-N 3.34Å; L800-R802 PolarHBondContact O-N 3.47Å; L800-M803 HydrophobicContact CD2-SD 4.34Å; L800-M803 WeakPolarHBondContact O-CB 3.26Å; L800-M803 PolarHBondContact O-N 2.96Å; L800-V834 HydrophobicContact CB-CG1 4.35Å; L800-V834 HydrophobicContact CD1-CG1 4.12Å; L800-C836 VanDerWaalsContact CD1-SG 3.57Å; L800-I914 HydrophobicContact CD1-CG2 3.71Å; L800-W940 HydrophobicContact CD2-CH2 3.9Å
801	K	84.7	Confident	83.1	Confident	109 Å²	109	62.6 Å²	62.6	47%	0.474	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-21.8	175	-60.5	-171	177.6	178.9	0	113	N798 E799 Y841	N798-K801 PolarHBondContact O-N 2.79Å; E799-K801 PolarHBondContact O-N 2.8Å; K801-Y841 VanDerWaalsContact CE-CZ 3.49Å; K801-Y841 WeakPolarHBondContact CE-OH 3.48Å; K801-Y841 WeakPolarHBondContact CG-OH 3.4Å
802	R	87.8	Confident	80.9	Confident	184 Å²	184	63.2 Å²	63.2	69%	0.694	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	10.5	178.3	-63.1	177	176.4	160.8	-4.2	112.4	E799 L800	E799-R802 WeakPolarHBondContact O-CA 3.5Å; E799-R802 PolarHBondContact O-N 2.65Å; E799-R802 IonicContact OE1-NH1 3.91Å; E799-R802 PolarHBondContact OE1-NH1 3.46Å; E799-R802 IonicContact OE2-NH1 4Å; L800-R802 PolarHBondContact O-N 3.47Å
803	M	89.2	Confident	78.2	Confident	8 Å²	8	70.7 Å²	70.7	4%	0.039	34%	0.339	C	S	.	.			trans	-59.6	133.5	178.8	179.9	-178.6	172.5	0	0	110.5	I747 F749 E799 L800 L806 A916 I937 W940	I747-M803 HydrophobicContact CB-CE 4.38Å; I747-M803 HydrophobicContact CD1-CE 3.25Å; I747-M803 HydrophobicContact CG1-CE 4.37Å; I747-M803 HydrophobicContact CG2-CE 4.37Å; F749-M803 HydrophobicContact CE2-CE 4.4Å; F749-M803 HydrophobicContact CE2-SD 4.2Å; F749-M803 HydrophobicContact CZ-CE 3.9Å; F749-M803 HydrophobicContact CZ-SD 3.96Å; E799-M803 PolarHBondContact O-N 3.34Å; L800-M803 HydrophobicContact CD2-SD 4.34Å; L800-M803 WeakPolarHBondContact O-CB 3.26Å; L800-M803 PolarHBondContact O-N 2.96Å; M803-L806 HydrophobicContact CB-CB 4.38Å; M803-L806 WeakPolarHBondContact O-CB 3.29Å; M803-L806 PolarHBondContact O-N 2.91Å; M803-A916 HydrophobicContact SD-CB 3.89Å; M803-I937 HydrophobicContact CE-CD1 3.86Å; M803-I937 HydrophobicContact CE-CG1 4.4Å; M803-I937 HydrophobicContact CE-CG2 4.13Å; M803-W940 HydrophobicContact CB-CH2 4.1Å; M803-W940 HydrophobicContact CB-CZ2 4.09Å; M803-W940 HydrophobicContact CG-CE3 4.45Å; M803-W940 HydrophobicContact CG-CH2 4.1Å; M803-W940 HydrophobicContact CG-CZ2 4.43Å; M803-W940 HydrophobicContact CG-CZ3 4.09Å; M803-W940 HydrophobicContact SD-CZ3 4.46Å
804	P	87.2	Confident	75.8	Confident	40 Å²	40	79 Å²	79	26%	0.26	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	142.3	176.6	28.2	-34	0	0	0	110	L806 I937 W940	P804-L806 PolarHBondContact O-N 2.91Å; P804-I937 HydrophobicContact CG-CG1 4Å; P804-W940 HydrophobicContact CG-CB 4.48Å; P804-W940 HydrophobicContact CG-CG 4.44Å
805	F	87.3	Confident	73.4	Confident	59 Å²	59	83.7 Å²	83.7	26%	0.259	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	14.7	-179.2	-50.1	-82.2	0	0	0	115.4	F807 T918 N919 I920 F933 K936 I937	F805-F807 PolarHBondContact O-N 3.48Å; F805-T918 CarbonylContact O-C 3.57Å; F805-T918 VanDerWaalsContact O-CA 3.22Å; F805-T918 WeakPolarHBondContact O-CA 3.42Å; F805-T918 WeakPolarHBondContact O-CB 3.47Å; F805-N919 WeakPolarHBondContact CB-OD1 3.49Å; F805-N919 PolarHBondContact O-N 2.93Å; F805-N919 PolarHBondContact O-OD1 3.34Å; F805-I920 HydrophobicContact CB-CD1 4.46Å; F805-I920 HydrophobicContact CB-CG1 4.48Å; F805-I920 HydrophobicContact CD1-CD1 3.83Å; F805-I920 HydrophobicContact CD1-CG1 4.25Å; F805-I920 HydrophobicContact CE1-CD1 4.21Å; F805-I920 HydrophobicContact CG-CD1 4.15Å; F805-F933 HydrophobicContact CB-CD2 3.92Å; F805-F933 HydrophobicContact CB-CE2 3.97Å; F805-F933 AromaticContact CD2-CD2 3.63Å; F805-F933 HydrophobicContact CD2-CD2 3.63Å; F805-F933 HydrophobicContact CD2-CE2 4.39Å; F805-F933 HydrophobicContact CE2-CB 4.44Å; F805-F933 HydrophobicContact CE2-CD2 4.23Å; F805-F933 AromaticContact CG-CD2 3.79Å; F805-F933 HydrophobicContact CG-CD2 3.79Å; F805-F933 HydrophobicContact CG-CE2 4.35Å; F805-K936 HydrophobicContact CE2-CB 4.23Å; F805-K936 HydrophobicContact CE2-CD 3.85Å; F805-K936 HydrophobicContact CZ-CD 4.02Å; F805-I937 HydrophobicContact CD2-CD1 4.34Å; F805-I937 HydrophobicContact CD2-CG1 4.4Å
806	L	87.8	Confident	71.1	Confident	30 Å²	30	84 Å²	84	16%	0.157	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-57.5	133.9	174.1	-176.3	68.7	0	0	0	110.4	M803 P804 Q808 V834 A916	M803-L806 HydrophobicContact CB-CB 4.38Å; M803-L806 WeakPolarHBondContact O-CB 3.29Å; M803-L806 PolarHBondContact O-N 2.91Å; P804-L806 PolarHBondContact O-N 2.91Å; L806-Q808 PolarHBondContact O-N 3.36Å; L806-V834 HydrophobicContact CD1-CG2 3.48Å; L806-V834 VanDerWaalsContact CD1-CG2 3.48Å; L806-V834 HydrophobicContact CD2-CG2 4.09Å; L806-V834 HydrophobicContact CG-CG2 4.37Å; L806-A916 HydrophobicContact CD1-CB 4.3Å
807	F	84.8	Confident	68.8	Low	28 Å²	28	85.5 Å²	85.5	12%	0.123	40%	0.404	C	S	.	.			trans	-63.8	109.8	174.3	-173.2	-95.4	0	0	0	109.2	L744 F805 S809 I830 P833 L917 N919	L744-F807 HydrophobicContact CD1-CD2 4.28Å; L744-F807 HydrophobicContact CD1-CE2 4.13Å; F805-F807 PolarHBondContact O-N 3.48Å; F807-S809 PolarHBondContact O-N 3.39Å; F807-I830 HydrophobicContact CE1-CG2 4.06Å; F807-I830 HydrophobicContact CZ-CG2 4.38Å; F807-P833 HydrophobicContact CB-CB 4.33Å; F807-P833 HydrophobicContact CD1-CB 4.28Å; F807-L917 HydrophobicContact CB-CB 4.16Å; F807-L917 HydrophobicContact CB-CD2 4.21Å; F807-L917 HydrophobicContact CB-CG 4.08Å; F807-L917 VanDerWaalsContact CB-O 3.31Å; F807-L917 WeakPolarHBondContact CB-O 3.39Å; F807-L917 HydrophobicContact CD1-CD2 4.14Å; F807-L917 HydrophobicContact CG-CD2 4.04Å; F807-L917 HydrophobicContact CG-CG 4.39Å; F807-L917 PolarHBondContact N-O 3.39Å; F807-N919 HydrophobicContact CD2-CB 4.48Å
808	Q	74.7	Confident	66.8	Low	148 Å²	148	85.9 Å²	85.9	69%	0.692	41%	0.406	S	S	*	.			trans	-83.8	104.6	170.4	-67.8	-177.1	-9.3	0	0	107	L806 F810	L806-Q808 PolarHBondContact O-N 3.36Å; Q808-F810 VanDerWaalsContact C-N 3.3Å; Q808-F810 PolarHBondContact O-N 3.32Å
809	S	63.4	Low	64.6	Low	55 Å²	55	86.7 Å²	86.7	39%	0.385	41%	0.411	S	S	.	.			trans	-61.6	103.2	160.7	51.1	0	0	0	0	106.2	F807	F807-S809 PolarHBondContact O-N 3.39Å
810	F	53	Low	62.6	Low	162 Å²	162	85.7 Å²	85.7	71%	0.711	41%	0.409	S	S	*	.			trans	-51.3	132.9	166.6	-75	-81	0	0	0	106.4	Q808 I812	Q808-F810 VanDerWaalsContact C-N 3.3Å; Q808-F810 PolarHBondContact O-N 3.32Å; F810-I812 PolarHBondContact O-N 2.84Å
811	P	40.3	Very low	61	Low	111 Å²	111	85.8 Å²	85.8	72%	0.721	41%	0.41	S	S	*	.			trans	-52.7	113.8	179	21.2	-30.9	0	0	0	106.3	K813	P811-K813 PolarHBondContact O-N 3Å
812	I	42.4	Very low	59.9	Low	96 Å²	96	83.8 Å²	83.8	49%	0.492	40%	0.402	S	S	.	.			trans	-68.3	66.9	-175.8	-54.4	170	0	0	0	107.2	F810 Q815 Q816	F810-I812 PolarHBondContact O-N 2.84Å; I812-Q815 WeakPolarHBondContact CG2-O 3.5Å; I812-Q816 HydrophobicContact CG2-CG 4.38Å
813	K	36.6	Very low	58.8	Low	178 Å²	178	76.4 Å²	76.4	77%	0.774	38%	0.376	S	S	*	.	S	Bend	trans	-102.6	-9.3	-179.1	-100.9	-176.5	173.8	-178.1	0	112.3	P811	P811-K813 PolarHBondContact O-N 3Å
814	Y	39.5	Very low	57.5	Low	175 Å²	175	76.7 Å²	76.7	69%	0.686	38%	0.379	S	S	*	.	S	Bend	trans	-143.1	-8.1	172.9	-77.3	-79.2	0	0	0	116.3
815	Q	39.5	Very low	56.2	Low	136 Å²	136	77.9 Å²	77.9	64%	0.636	38%	0.383	S	S	*	.			trans	-111.5	60.5	172.9	-75	178.8	-23.9	0	0	111.2	I812 T817	I812-Q815 WeakPolarHBondContact CG2-O 3.5Å; Q815-T817 PolarHBondContact O-N 3.13Å
816	Q	42.5	Very low	55	Low	116 Å²	116	76 Å²	76	54%	0.542	38%	0.375	S	S	.	.			trans	-71.2	88.3	161.6	-92.6	173	-8.7	0	0	106.3	R301 I812	R301-Q816 WeakPolarHBondContact CD-O 3.48Å; R301-Q816 PolarHBondContact NE-O 2.97Å; R301-Q816 PolarHBondContact NH1-O 3.37Å; R301-Q816 PolarHBondContact NH2-O 3.11Å; I812-Q816 HydrophobicContact CG2-CG 4.38Å
817	T	43.1	Very low	54	Low	35 Å²	35	75.5 Å²	75.5	22%	0.215	37%	0.373	C	S	.	.			trans	-52.5	145.2	170	50.2	0	0	0	0	109.8	Q815 N819 L823	Q815-T817 PolarHBondContact O-N 3.13Å; T817-N819 PolarHBondContact O-N 3.16Å; T817-L823 HydrophobicContact CG2-CD1 3.26Å
818	L	48.1	Very low	53.1	Low	8 Å²	8	76.8 Å²	76.8	4%	0.042	38%	0.384	C	S	.	.			trans	-38.4	130.5	-174.9	-50.1	81.7	0	0	0	110.3	R301 R302 P331 S820 L821 E822	R301-L818 HydrophobicContact CB-CB 4.31Å; R301-L818 HydrophobicContact CB-CG 4.1Å; R301-L818 HydrophobicContact CG-CG 4.44Å; R302-L818 HydrophobicContact CB-CB 4.15Å; R302-L818 HydrophobicContact CB-CD2 3.66Å; R302-L818 HydrophobicContact CB-CG 4.48Å; P331-L818 HydrophobicContact CB-CD2 3.55Å; P331-L818 HydrophobicContact CG-CD2 4.31Å; L818-S820 PolarHBondContact O-N 3Å; L818-L821 HydrophobicContact CB-CB 4.06Å; L818-L821 HydrophobicContact CD1-CB 4.02Å; L818-L821 HydrophobicContact CD1-CD1 3.76Å; L818-L821 HydrophobicContact CD2-CD1 3.88Å; L818-L821 HydrophobicContact CG-CB 4.47Å; L818-L821 HydrophobicContact CG-CD1 4.24Å; L818-L821 CarbonylContact O-C 3.55Å; L818-L821 WeakPolarHBondContact O-CA 3.48Å; L818-L821 PolarHBondContact O-N 3.03Å; L818-E822 PolarHBondContact O-N 2.92Å
819	N	44.3	Very low	52.9	Low	93 Å²	93	70.6 Å²	70.6	50%	0.497	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-18.8	176.9	-71.9	-4.4	0	0	0	112.6	T817	T817-N819 PolarHBondContact O-N 3.16Å
820	S	50.1	Low	53.4	Low	28 Å²	28	68.5 Å²	68.5	20%	0.196	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-21.4	172.2	69	0	0	0	0	115.6	L152 R302 L818	L152-S820 VanDerWaalsContact CB-O 3.3Å; L152-S820 WeakPolarHBondContact CB-O 3.1Å; L152-S820 PolarHBondContact N-O 3.19Å; R302-S820 WeakPolarHBondContact CB-OG 3.05Å; R302-S820 WeakPolarHBondContact CG-OG 3.48Å; L818-S820 PolarHBondContact O-N 3Å
821	L	55.4	Low	54.2	Low	3 Å²	3	64.3 Å²	64.3	2%	0.016	33%	0.325	C	S	.	.	S	Bend	trans	-123.7	39.4	179	-74.3	155.9	0	0	0	109.9	L152 W153 L818 L823	L152-L821 HydrophobicContact CB-CD2 4.41Å; L152-L821 HydrophobicContact CB-CG 4.43Å; L152-L821 HydrophobicContact CD2-CD1 4.2Å; L152-L821 HydrophobicContact CD2-CD2 3.59Å; L152-L821 HydrophobicContact CD2-CG 3.92Å; W153-L821 HydrophobicContact CD2-CD2 3.51Å; W153-L821 HydrophobicContact CE3-CD2 3.99Å; W153-L821 HydrophobicContact CG-CD2 3.94Å; W153-L821 HydrophobicContact CH2-CD2 4.16Å; W153-L821 HydrophobicContact CZ2-CB 4.46Å; W153-L821 HydrophobicContact CZ2-CD2 3.67Å; W153-L821 HydrophobicContact CZ3-CD2 4.27Å; W153-L821 PolarHBondContact NE1-O 3.11Å; L818-L821 HydrophobicContact CB-CB 4.06Å; L818-L821 HydrophobicContact CD1-CB 4.02Å; L818-L821 HydrophobicContact CD1-CD1 3.76Å; L818-L821 HydrophobicContact CD2-CD1 3.88Å; L818-L821 HydrophobicContact CG-CB 4.47Å; L818-L821 HydrophobicContact CG-CD1 4.24Å; L818-L821 CarbonylContact O-C 3.55Å; L818-L821 WeakPolarHBondContact O-CA 3.48Å; L818-L821 PolarHBondContact O-N 3.03Å; L821-L823 PolarHBondContact O-N 3.3Å
822	E	62.2	Low	55.9	Low	67 Å²	67	60.3 Å²	60.3	31%	0.313	30%	0.298	S	S	.	.			trans	-63.3	127	177.7	-152	-174.2	142.8	0	0	108.9	L818 S824 L825	L818-E822 PolarHBondContact O-N 2.92Å; E822-S824 WeakPolarHBondContact CG-OG 3.32Å; E822-S824 PolarHBondContact O-N 2.8Å; E822-S824 PolarHBondContact OE1-OG 2.88Å; E822-L825 HydrophobicContact CB-CD1 3.67Å; E822-L825 HydrophobicContact CB-CG 4.06Å; E822-L825 WeakPolarHBondContact O-CB 3.06Å; E822-L825 PolarHBondContact O-N 3.35Å
823	L	64.1	Low	57.7	Low	28 Å²	28	56.8 Å²	56.8	15%	0.147	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-59.9	-30.4	-179.6	-85.2	62.5	0	0	0	111.3	Y741 T817 L821 L825 L826 N827 I830	Y741-L823 HydrophobicContact CD1-CD2 4.2Å; Y741-L823 HydrophobicContact CD2-CD2 3.92Å; Y741-L823 HydrophobicContact CD2-CG 4.06Å; Y741-L823 HydrophobicContact CE1-CD2 3.7Å; Y741-L823 HydrophobicContact CE2-CD2 3.41Å; Y741-L823 VanDerWaalsContact CE2-CD2 3.41Å; Y741-L823 HydrophobicContact CE2-CG 4Å; Y741-L823 HydrophobicContact CG-CD2 4.32Å; Y741-L823 HydrophobicContact CG-CG 4.47Å; T817-L823 HydrophobicContact CG2-CD1 3.26Å; L821-L823 PolarHBondContact O-N 3.3Å; L823-L825 PolarHBondContact O-N 2.85Å; L823-L826 WeakPolarHBondContact O-CB 3.28Å; L823-L826 PolarHBondContact O-N 2.97Å; L823-N827 PolarHBondContact O-N 3.49Å; L823-I830 HydrophobicContact CB-CD1 4.2Å; L823-I830 WeakPolarHBondContact O-CD1 3.4Å
824	S	61.4	Low	59.9	Low	15 Å²	15	48.9 Å²	48.9	11%	0.105	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-59.2	-23.4	174.9	65.5	0	0	0	0	113.6	E822 N827 P828 N831	E822-S824 WeakPolarHBondContact CG-OG 3.32Å; E822-S824 PolarHBondContact O-N 2.8Å; E822-S824 PolarHBondContact OE1-OG 2.88Å; S824-N827 CarbonylContact O-C 3.51Å; S824-P828 VanDerWaalsContact O-CA 3.28Å; S824-P828 WeakPolarHBondContact O-CA 3.12Å; S824-N831 WeakPolarHBondContact CB-ND2 3.32Å
825	L	60.1	Low	62.1	Low	64 Å²	64	40.6 Å²	40.6	34%	0.335	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-78.5	-22.7	175.9	-65.8	159	0	0	0	112.6	V149 E822 L823	V149-L825 HydrophobicContact CG1-CD2 4.39Å; E822-L825 HydrophobicContact CB-CD1 3.67Å; E822-L825 HydrophobicContact CB-CG 4.06Å; E822-L825 WeakPolarHBondContact O-CB 3.06Å; E822-L825 PolarHBondContact O-N 3.35Å; L823-L825 PolarHBondContact O-N 2.85Å
826	L	62.3	Low	64.4	Low	19 Å²	19	34.1 Å²	34.1	10%	0.099	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-41.5	172.2	-74.3	168.1	0	0	0	111	W153 L738 L823	W153-L826 HydrophobicContact CB-CD2 3.7Å; W153-L826 HydrophobicContact CB-CG 4.19Å; W153-L826 HydrophobicContact CD2-CD1 3.79Å; W153-L826 HydrophobicContact CD2-CD2 3.74Å; W153-L826 HydrophobicContact CD2-CG 3.83Å; W153-L826 HydrophobicContact CE3-CD1 4.3Å; W153-L826 HydrophobicContact CE3-CD2 4.05Å; W153-L826 HydrophobicContact CG-CD1 4.18Å; W153-L826 HydrophobicContact CG-CD2 3.64Å; W153-L826 HydrophobicContact CG-CG 3.69Å; W153-L826 HydrophobicContact CH2-CD1 4.29Å; W153-L826 HydrophobicContact CZ2-CD1 3.8Å; L738-L826 HydrophobicContact CG-CD2 4.29Å; L823-L826 WeakPolarHBondContact O-CB 3.28Å; L823-L826 PolarHBondContact O-N 2.97Å
827	N	65.8	Low	66.5	Low	20 Å²	20	28.6 Å²	28.6	11%	0.107	16%	0.159	C	C	.	.			trans	-144.5	110	176.6	-173.9	-15.5	0	0	0	109.6	L823 S824 L829 I830	L823-N827 PolarHBondContact O-N 3.49Å; S824-N827 CarbonylContact O-C 3.51Å; N827-L829 PolarHBondContact O-N 3.23Å; N827-L829 VanDerWaalsContact O-N 3.08Å; N827-L829 WeakPolarHBondContact OD1-CB 3.19Å; N827-L829 PolarHBondContact OD1-N 3.39Å; N827-L829 VanDerWaalsContact OD1-N 3.12Å; N827-I830 HydrophobicContact CB-CD1 3.83Å; N827-I830 HydrophobicContact CB-CG1 4.01Å; N827-I830 WeakPolarHBondContact O-CB 2.92Å; N827-I830 WeakPolarHBondContact O-CG1 3.49Å; N827-I830 PolarHBondContact O-N 3.07Å
828	P	66.9	Low	68.5	Low	55 Å²	55	27 Å²	27	36%	0.357	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-63.1	-20.2	-175.8	25.3	-33.9	0	0	0	112.9	F113 S824 I830	F113-P828 HydrophobicContact CD2-CB 4.37Å; F113-P828 HydrophobicContact CD2-CG 4.35Å; F113-P828 HydrophobicContact CE2-CG 4.22Å; S824-P828 VanDerWaalsContact O-CA 3.28Å; S824-P828 WeakPolarHBondContact O-CA 3.12Å; P828-I830 PolarHBondContact O-N 3.33Å
829	L	71.2	Confident	70.2	Confident	18 Å²	18	26.7 Å²	26.7	9%	0.094	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-73.5	-9.3	177.1	-57.5	175.6	0	0	0	113.2	K746 N827 N831 I832 P833 N915 L917	K746-L829 HydrophobicContact CB-CD1 4.34Å; N827-L829 PolarHBondContact O-N 3.23Å; N827-L829 VanDerWaalsContact O-N 3.08Å; N827-L829 WeakPolarHBondContact OD1-CB 3.19Å; N827-L829 PolarHBondContact OD1-N 3.39Å; N827-L829 VanDerWaalsContact OD1-N 3.12Å; L829-N831 VanDerWaalsContact C-N 3.31Å; L829-N831 PolarHBondContact O-N 3.19Å; L829-I832 CarbonylContact O-C 3.19Å; L829-I832 PolarHBondContact O-N 3.11Å; L829-P833 WeakPolarHBondContact O-CA 3.45Å; L829-N915 VanDerWaalsContact CD2-ND2 3.25Å; L829-N915 WeakPolarHBondContact CD2-ND2 3.18Å; L829-L917 HydrophobicContact CB-CB 4.43Å; L829-L917 HydrophobicContact CB-CD1 4.48Å; L829-L917 HydrophobicContact CB-CD2 4.3Å
830	I	72.2	Confident	72	Confident	11 Å²	11	32.5 Å²	32.5	6%	0.056	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-65.1	-38.8	177.9	-70.2	169.2	0	0	0	111.2	Y741 F807 L823 N827 P828 I832 L917	Y741-I830 HydrophobicContact CD1-CD1 3.76Å; Y741-I830 HydrophobicContact CG-CD1 4.22Å; F807-I830 HydrophobicContact CE1-CG2 4.06Å; F807-I830 HydrophobicContact CZ-CG2 4.38Å; L823-I830 HydrophobicContact CB-CD1 4.2Å; L823-I830 WeakPolarHBondContact O-CD1 3.4Å; N827-I830 HydrophobicContact CB-CD1 3.83Å; N827-I830 HydrophobicContact CB-CG1 4.01Å; N827-I830 WeakPolarHBondContact O-CB 2.92Å; N827-I830 WeakPolarHBondContact O-CG1 3.49Å; N827-I830 PolarHBondContact O-N 3.07Å; P828-I830 PolarHBondContact O-N 3.33Å; I830-I832 VanDerWaalsContact C-N 3.33Å; I830-L917 HydrophobicContact CG1-CD2 3.89Å
831	N	69.9	Low	73.4	Confident	74 Å²	74	32.4 Å²	32.4	40%	0.396	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-27.1	177	-74.1	-4.8	0	0	0	111.8	S824 L829	S824-N831 WeakPolarHBondContact CB-ND2 3.32Å; L829-N831 VanDerWaalsContact C-N 3.31Å; L829-N831 PolarHBondContact O-N 3.19Å
832	I	76.4	Confident	74.5	Confident	28 Å²	28	38.3 Å²	38.3	14%	0.144	19%	0.189	C	C	.	.	S	Bend	trans	-128.3	74.2	-179.3	-48.6	172.6	0	0	0	107.9	L829 I830 V834	L829-I832 CarbonylContact O-C 3.19Å; L829-I832 PolarHBondContact O-N 3.11Å; I830-I832 VanDerWaalsContact C-N 3.33Å; I832-V834 PolarHBondContact O-N 3.29Å; I832-V834 VanDerWaalsContact O-N 3.1Å
833	P	80	Confident	75.3	Confident	22 Å²	22	36.2 Å²	36.2	14%	0.143	18%	0.18	C	C	.	.	S	Bend	trans	-67.2	-14.5	-172.4	26.4	-35.3	0	0	0	113.1	F807 L829 A916 L917	F807-P833 HydrophobicContact CB-CB 4.33Å; F807-P833 HydrophobicContact CD1-CB 4.28Å; L829-P833 WeakPolarHBondContact O-CA 3.45Å; P833-A916 CarbonylContact O-C 3.6Å; P833-A916 WeakPolarHBondContact O-CA 3.3Å; P833-L917 HydrophobicContact CB-CB 4.29Å; P833-L917 PolarHBondContact O-N 3.3Å
834	V	84	Confident	76.3	Confident	11 Å²	11	34.9 Å²	34.9	7%	0.067	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	121.3	175.1	-177.8	0	0	0	0	108.5	L800 L806 I832 Y841	L800-V834 HydrophobicContact CB-CG1 4.35Å; L800-V834 HydrophobicContact CD1-CG1 4.12Å; L806-V834 HydrophobicContact CD1-CG2 3.48Å; L806-V834 VanDerWaalsContact CD1-CG2 3.48Å; L806-V834 HydrophobicContact CD2-CG2 4.09Å; L806-V834 HydrophobicContact CG-CG2 4.37Å; I832-V834 PolarHBondContact O-N 3.29Å; I832-V834 VanDerWaalsContact O-N 3.1Å; V834-Y841 HydrophobicContact CB-CD1 4.36Å; V834-Y841 HydrophobicContact CB-CE1 3.8Å; V834-Y841 HydrophobicContact CG1-CD1 4.35Å; V834-Y841 HydrophobicContact CG1-CE1 3.69Å
835	W	85.9	Confident	77.4	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.008	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.4	167.9	-172.4	107.2	0	0	0	108.8	P837 N843 E889 T896 I913 I914 N915	W835-P837 HydrophobicContact CH2-CB 3.85Å; W835-P837 HydrophobicContact CH2-CG 3.97Å; W835-P837 HydrophobicContact CZ3-CB 4.4Å; W835-P837 HydrophobicContact CZ3-CG 4.07Å; W835-N843 PolarHBondContact NE1-ND2 3.3Å; W835-E889 WeakPolarHBondContact CZ2-OE1 3.2Å; W835-E889 WeakPolarHBondContact CZ2-OE2 3.37Å; W835-E889 PolarHBondContact NE1-OE1 3.24Å; W835-T896 HydrophobicContact CB-CG2 4.47Å; W835-T896 VanDerWaalsContact CD1-OG1 3.29Å; W835-T896 HydrophobicContact CD2-CG2 4.27Å; W835-T896 VanDerWaalsContact CD2-OG1 3.28Å; W835-T896 HydrophobicContact CE3-CG2 4.21Å; W835-T896 HydrophobicContact CG-CG2 4.34Å; W835-T896 PolarHBondContact NE1-OG1 3.22Å; W835-I913 WeakPolarHBondContact CZ3-O 3.27Å; W835-I914 VanDerWaalsContact O-CG2 3.23Å; W835-I914 WeakPolarHBondContact O-CG2 3.36Å; W835-N915 WeakPolarHBondContact CB-OD1 3.05Å; W835-N915 PolarHBondContact N-O 2.92Å; W835-N915 VanDerWaalsContact N-O 3.13Å; W835-N915 PolarHBondContact N-OD1 3.15Å; W835-N915 VanDerWaalsContact N-OD1 3.13Å
836	C	87.5	Confident	78.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.			trans	-140.9	134.4	174.4	-134.4	0	0	0	0	109.9	C797 L800 F838 Y841	C797-C836 HydrophobicContact CB-CB 3.91Å; C797-C836 WeakPolarHBondContact CB-SG 3.19Å; C797-C836 WeakPolarHBondContact SG-CB 3.36Å; C797-C836 CovalentContact SG-SG 2.04Å; C797-C836 PolarHBondContact SG-SG 3.21Å; L800-C836 VanDerWaalsContact CD1-SG 3.57Å; C836-F838 VanDerWaalsContact C-N 3.33Å; C836-F838 PolarHBondContact O-N 2.78Å; C836-Y841 HydrophobicContact CB-CD2 3.75Å; C836-Y841 HydrophobicContact CB-CE2 3.92Å; C836-Y841 HydrophobicContact CB-CG 4.26Å
837	P	85.2	Confident	79.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-77.7	-19.2	-176.8	27.5	-28.7	0	0	0	112.8	W835 S844 I845 F898 L912	W835-P837 HydrophobicContact CH2-CB 3.85Å; W835-P837 HydrophobicContact CH2-CG 3.97Å; W835-P837 HydrophobicContact CZ3-CB 4.4Å; W835-P837 HydrophobicContact CZ3-CG 4.07Å; P837-S844 CarbonylContact O-C 3.57Å; P837-S844 WeakPolarHBondContact O-CA 3.33Å; P837-I845 HydrophobicContact CB-CD1 4.4Å; P837-I845 WeakPolarHBondContact O-CG1 3.24Å; P837-I845 PolarHBondContact O-N 3.21Å; P837-F898 HydrophobicContact CB-CE2 4.08Å; P837-F898 HydrophobicContact CG-CE2 4.15Å; P837-F898 HydrophobicContact CG-CZ 4.48Å; P837-L912 HydrophobicContact CG-CD1 4.19Å
838	F	86.2	Confident	80.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-111.8	152.9	-179.3	-61.3	-78.8	0	0	0	112	R790 L793 C797 C836 I845 I870 Y871 F878 F898	R790-F838 HydrophobicContact CG-CE1 4.38Å; R790-F838 HydrophobicContact CG-CZ 4.42Å; L793-F838 HydrophobicContact CB-CD2 3.68Å; L793-F838 HydrophobicContact CB-CE2 3.97Å; L793-F838 HydrophobicContact CB-CG 4.44Å; L793-F838 HydrophobicContact CD1-CD2 4.18Å; L793-F838 HydrophobicContact CD1-CE2 3.64Å; L793-F838 HydrophobicContact CD1-CZ 4.46Å; L793-F838 HydrophobicContact CG-CE2 4.44Å; C797-F838 WeakPolarHBondContact CB-O 3.31Å; C797-F838 PolarHBondContact SG-O 2.78Å; C797-F838 VanDerWaalsContact SG-O 3.36Å; C836-F838 VanDerWaalsContact C-N 3.33Å; C836-F838 PolarHBondContact O-N 2.78Å; F838-I845 HydrophobicContact CE1-CD1 4.25Å; F838-I870 HydrophobicContact CD1-CG2 4.43Å; F838-I870 HydrophobicContact CE1-CG2 4.08Å; F838-Y871 HydrophobicContact CD1-CE1 4.16Å; F838-F878 HydrophobicContact CE1-CE2 4.13Å; F838-F878 AromaticContact CE1-CZ 3.92Å; F838-F878 HydrophobicContact CE1-CZ 3.92Å; F838-F878 AromaticContact CZ-CZ 3.86Å; F838-F878 HydrophobicContact CZ-CZ 3.86Å; F838-F898 AromaticContact CE2-CZ 3.93Å; F838-F898 HydrophobicContact CE2-CZ 3.93Å; F838-F898 HydrophobicContact CZ-CZ 4.1Å
839	G	83.5	Confident	81.4	Confident	3 Å²	3	33.3 Å²	33.3	3%	0.031	16%	0.159	C	C	.	.	S	Bend	trans	88.2	-160.1	177.6	0	0	0	0	0	113.1	L794 Y841 S844 D846	L794-G839 VanDerWaalsContact CD1-CA 3.49Å; G839-Y841 PolarHBondContact O-N 3.23Å; G839-S844 WeakPolarHBondContact O-CB 3.37Å; G839-S844 PolarHBondContact O-OG 3.01Å; G839-D846 PolarHBondContact N-OD2 3.33Å
840	R	81.5	Confident	82	Confident	214 Å²	214	40.5 Å²	40.5	81%	0.808	19%	0.19	S	C	*	.	S	Bend	trans	-97.7	69.2	-174.9	-62.4	-177.6	-177.2	174.7	0.4	111.4
841	Y	80.5	Confident	82.6	Confident	26 Å²	26	43.6 Å²	43.6	10%	0.102	21%	0.213	C	C	.	.			trans	-117.1	151.5	174.2	-71.1	-83.5	0	0	0	110.2	C797 K801 V834 C836 G839 N843 S844 N847	C797-Y841 HydrophobicContact CB-CE2 3.98Å; C797-Y841 PolarHBondContact O-OH 2.9Å; K801-Y841 VanDerWaalsContact CE-CZ 3.49Å; K801-Y841 WeakPolarHBondContact CE-OH 3.48Å; K801-Y841 WeakPolarHBondContact CG-OH 3.4Å; V834-Y841 HydrophobicContact CB-CD1 4.36Å; V834-Y841 HydrophobicContact CB-CE1 3.8Å; V834-Y841 HydrophobicContact CG1-CD1 4.35Å; V834-Y841 HydrophobicContact CG1-CE1 3.69Å; C836-Y841 HydrophobicContact CB-CD2 3.75Å; C836-Y841 HydrophobicContact CB-CE2 3.92Å; C836-Y841 HydrophobicContact CB-CG 4.26Å; G839-Y841 PolarHBondContact O-N 3.23Å; Y841-N843 PolarHBondContact O-N 3.02Å; Y841-N843 VanDerWaalsContact O-N 3.1Å; Y841-S844 PolarHBondContact N-OG 2.96Å; Y841-S844 VanDerWaalsContact O-CB 3.26Å; Y841-S844 WeakPolarHBondContact O-CB 3.19Å; Y841-S844 PolarHBondContact O-N 3.32Å; Y841-S844 PolarHBondContact O-OG 2.77Å; Y841-N847 VanDerWaalsContact O-CG 3.32Å; Y841-N847 PolarHBondContact O-ND2 2.97Å
842	I	78.6	Confident	83.2	Confident	127 Å²	127	41.7 Å²	41.7	65%	0.651	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	-39.9	-178.8	-63.2	170.2	0	0	0	110.8
843	N	77.5	Confident	83.3	Confident	24 Å²	24	46.9 Å²	46.9	13%	0.128	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	10.9	-177.4	-57.6	4.6	0	0	0	113	W835 Y841 Y885	W835-N843 PolarHBondContact NE1-ND2 3.3Å; Y841-N843 PolarHBondContact O-N 3.02Å; Y841-N843 VanDerWaalsContact O-N 3.1Å; N843-Y885 PolarHBondContact O-OH 3.39Å
844	S	85.3	Confident	83.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.228	C	C	.	.			trans	-74.8	151.8	-178.4	62.4	0	0	0	0	112.5	P837 G839 Y841 D846 N847 Y848	P837-S844 CarbonylContact O-C 3.57Å; P837-S844 WeakPolarHBondContact O-CA 3.33Å; G839-S844 WeakPolarHBondContact O-CB 3.37Å; G839-S844 PolarHBondContact O-OG 3.01Å; Y841-S844 PolarHBondContact N-OG 2.96Å; Y841-S844 VanDerWaalsContact O-CB 3.26Å; Y841-S844 WeakPolarHBondContact O-CB 3.19Å; Y841-S844 PolarHBondContact O-N 3.32Å; Y841-S844 PolarHBondContact O-OG 2.77Å; S844-D846 PolarHBondContact O-N 2.98Å; S844-N847 PolarHBondContact O-N 2.97Å; S844-N847 WeakPolarHBondContact OG-CB 3.45Å; S844-N847 PolarHBondContact OG-N 3.37Å; S844-N847 VanDerWaalsContact OG-N 3.14Å; S844-Y848 PolarHBondContact O-N 2.85Å
845	I	85.2	Confident	82.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-37.7	172.1	-55.9	166.2	0	0	0	109.7	P837 F838 N847 Y848 I849 I870 F878 L882 Y885	P837-I845 HydrophobicContact CB-CD1 4.4Å; P837-I845 WeakPolarHBondContact O-CG1 3.24Å; P837-I845 PolarHBondContact O-N 3.21Å; F838-I845 HydrophobicContact CE1-CD1 4.25Å; I845-N847 VanDerWaalsContact C-N 3.33Å; I845-N847 PolarHBondContact O-N 2.54Å; I845-Y848 PolarHBondContact O-N 2.74Å; I845-Y848 VanDerWaalsContact O-N 3.17Å; I845-I849 HydrophobicContact CG2-CD1 3.92Å; I845-I849 HydrophobicContact CG2-CG1 4.18Å; I845-I849 VanDerWaalsContact O-CG1 3.3Å; I845-I849 WeakPolarHBondContact O-CG1 3.37Å; I845-I849 PolarHBondContact O-N 3.39Å; I845-I870 HydrophobicContact CB-CD1 3.81Å; I845-I870 HydrophobicContact CG2-CD1 3.51Å; I845-I870 HydrophobicContact CG2-CG1 4.5Å; I845-F878 HydrophobicContact CD1-CE2 4.31Å; I845-F878 HydrophobicContact CD1-CZ 4.39Å; I845-L882 HydrophobicContact CD1-CD1 3.71Å; I845-Y885 HydrophobicContact CB-CD2 4.41Å; I845-Y885 HydrophobicContact CD1-CD1 4.27Å; I845-Y885 HydrophobicContact CD1-CE1 4.39Å; I845-Y885 HydrophobicContact CG1-CD1 3.66Å; I845-Y885 HydrophobicContact CG1-CD2 3.99Å; I845-Y885 HydrophobicContact CG1-CE1 3.69Å; I845-Y885 HydrophobicContact CG1-CE2 3.99Å; I845-Y885 HydrophobicContact CG1-CG 3.8Å; I845-Y885 HydrophobicContact CG2-CG 4.49Å
846	D	85	Confident	82.1	Confident	46 Å²	46	55.9 Å²	55.9	25%	0.246	28%	0.282	C	S	.	.	H	α-helix	trans	-58.1	-44	176.3	-72.5	-41.9	0	0	0	111.6	G839 S844 F850 I870 Y871	G839-D846 PolarHBondContact N-OD2 3.33Å; S844-D846 PolarHBondContact O-N 2.98Å; D846-F850 VanDerWaalsContact O-CB 3.3Å; D846-F850 WeakPolarHBondContact O-CB 3.26Å; D846-F850 PolarHBondContact O-N 3.17Å; D846-I870 WeakPolarHBondContact OD1-CD1 3.05Å; D846-Y871 PolarHBondContact OD2-OH 2.99Å
847	N	85.1	Confident	81.2	Confident	60 Å²	60	63.1 Å²	63.1	32%	0.321	32%	0.321	S	S	.	.	H	α-helix	trans	-71	-34.4	176.2	-84.5	4.6	0	0	0	112.7	Y841 S844 I845 F850 S851	Y841-N847 VanDerWaalsContact O-CG 3.32Å; Y841-N847 PolarHBondContact O-ND2 2.97Å; S844-N847 PolarHBondContact O-N 2.97Å; S844-N847 WeakPolarHBondContact OG-CB 3.45Å; S844-N847 PolarHBondContact OG-N 3.37Å; S844-N847 VanDerWaalsContact OG-N 3.14Å; I845-N847 VanDerWaalsContact C-N 3.33Å; I845-N847 PolarHBondContact O-N 2.54Å; N847-F850 PolarHBondContact O-N 3.33Å; N847-S851 WeakPolarHBondContact O-CB 3.02Å; N847-S851 PolarHBondContact O-N 3.5Å
848	Y	84.5	Confident	80.8	Confident	24 Å²	24	70.5 Å²	70.5	9%	0.094	36%	0.361	C	S	.	.	H	α-helix	trans	-63.5	-49.9	174.1	175.5	-106.1	0	0	0	111.3	S844 I845 F850 S851 L852 E884 Y885 Y888	S844-Y848 PolarHBondContact O-N 2.85Å; I845-Y848 PolarHBondContact O-N 2.74Å; I845-Y848 VanDerWaalsContact O-N 3.17Å; Y848-F850 VanDerWaalsContact C-N 3.26Å; Y848-F850 PolarHBondContact O-N 3.34Å; Y848-S851 PolarHBondContact O-N 2.88Å; Y848-S851 PolarHBondContact O-OG 2.65Å; Y848-L852 HydrophobicContact CD1-CD1 4.09Å; Y848-L852 HydrophobicContact CE1-CD1 3.56Å; Y848-L852 HydrophobicContact CE1-CG 4.28Å; Y848-L852 HydrophobicContact CE2-CG 4.47Å; Y848-L852 PolarHBondContact O-N 3.31Å; Y848-E884 HydrophobicContact CE1-CG 4.43Å; Y848-Y885 AromaticContact CD1-CD2 3.99Å; Y848-Y885 HydrophobicContact CD1-CD2 3.99Å; Y848-Y885 HydrophobicContact CD1-CG 4.49Å; Y848-Y885 AromaticContact CG-CD2 3.82Å; Y848-Y885 HydrophobicContact CG-CD2 3.82Å; Y848-Y888 AromaticContact CD2-CD1 3.55Å; Y848-Y888 HydrophobicContact CD2-CD1 3.55Å; Y848-Y888 AromaticContact CD2-CE1 3.88Å; Y848-Y888 HydrophobicContact CD2-CE1 3.88Å; Y848-Y888 AromaticContact CD2-CG 3.92Å; Y848-Y888 HydrophobicContact CD2-CG 3.92Å; Y848-Y888 AromaticContact CE2-CD1 3.61Å; Y848-Y888 HydrophobicContact CE2-CD1 3.61Å; Y848-Y888 AromaticContact CE2-CD2 3.89Å; Y848-Y888 HydrophobicContact CE2-CD2 3.89Å; Y848-Y888 HydrophobicContact CE2-CE1 4.17Å; Y848-Y888 HydrophobicContact CE2-CE2 4.42Å; Y848-Y888 AromaticContact CE2-CG 3.44Å; Y848-Y888 HydrophobicContact CE2-CG 3.44Å; Y848-Y888 VanDerWaalsContact CE2-CG 3.44Å
849	I	84.6	Confident	80.4	Confident	9 Å²	9	71 Å²	71	5%	0.046	36%	0.364	C	S	.	.	H	α-helix	trans	-59.1	-40.9	175.7	-64.7	176.8	0	0	0	110.4	I845 L852 C861 P867 I870	I845-I849 HydrophobicContact CG2-CD1 3.92Å; I845-I849 HydrophobicContact CG2-CG1 4.18Å; I845-I849 VanDerWaalsContact O-CG1 3.3Å; I845-I849 WeakPolarHBondContact O-CG1 3.37Å; I845-I849 PolarHBondContact O-N 3.39Å; I849-L852 PolarHBondContact O-N 3.33Å; I849-C861 HydrophobicContact CG1-CB 4.11Å; I849-P867 HydrophobicContact CG2-CB 3.37Å; I849-I870 HydrophobicContact CD1-CD1 3.77Å; I849-I870 HydrophobicContact CD1-CG1 3.74Å
850	F	84.4	Confident	80.3	Confident	168 Å²	168	74.3 Å²	74.3	74%	0.737	38%	0.384	S	S	*	.	H	α-helix	trans	-63.2	-40.9	174.5	-175.8	-97.5	0	0	0	112.3	D846 N847 Y848 L852 N853	D846-F850 VanDerWaalsContact O-CB 3.3Å; D846-F850 WeakPolarHBondContact O-CB 3.26Å; D846-F850 PolarHBondContact O-N 3.17Å; N847-F850 PolarHBondContact O-N 3.33Å; Y848-F850 VanDerWaalsContact C-N 3.26Å; Y848-F850 PolarHBondContact O-N 3.34Å; F850-L852 VanDerWaalsContact C-N 3.33Å; F850-L852 PolarHBondContact O-N 2.89Å; F850-N853 PolarHBondContact O-N 3.1Å
851	S	83.2	Confident	80.4	Confident	77 Å²	77	64.1 Å²	64.1	54%	0.538	35%	0.345	S	S	.	.	H	α-helix	trans	-67.2	-29.8	179.8	76.5	0	0	0	0	113.7	N847 Y848 N853	N847-S851 WeakPolarHBondContact O-CB 3.02Å; N847-S851 PolarHBondContact O-N 3.5Å; Y848-S851 PolarHBondContact O-N 2.88Å; Y848-S851 PolarHBondContact O-OG 2.65Å; S851-N853 PolarHBondContact O-N 2.8Å
852	L	82.5	Confident	80.6	Confident	33 Å²	33	63.7 Å²	63.7	17%	0.173	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.7	175	-74.2	170.3	0	0	0	112.5	Y848 I849 F850 C854 S855 C861	Y848-L852 HydrophobicContact CD1-CD1 4.09Å; Y848-L852 HydrophobicContact CE1-CD1 3.56Å; Y848-L852 HydrophobicContact CE1-CG 4.28Å; Y848-L852 HydrophobicContact CE2-CG 4.47Å; Y848-L852 PolarHBondContact O-N 3.31Å; I849-L852 PolarHBondContact O-N 3.33Å; F850-L852 VanDerWaalsContact C-N 3.33Å; F850-L852 PolarHBondContact O-N 2.89Å; L852-C854 PolarHBondContact O-N 3.33Å; L852-S855 PolarHBondContact O-N 3.27Å; L852-C861 HydrophobicContact CD1-CB 4.23Å
853	N	79.9	Confident	80.5	Confident	138 Å²	138	65.4 Å²	65.4	74%	0.738	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	16	-175.2	-161.3	22.1	0	0	0	114.4	F850 S851 S855	F850-N853 PolarHBondContact O-N 3.1Å; S851-N853 PolarHBondContact O-N 2.8Å; N853-S855 PolarHBondContact O-N 2.94Å
854	C	79.5	Confident	80.3	Confident	14 Å²	14	72 Å²	72	10%	0.095	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	38.5	36.5	-169.8	-65.5	0	0	0	0	115.6	L852 C862 P867	L852-C854 PolarHBondContact O-N 3.33Å; C854-C862 WeakPolarHBondContact CA-SG 3.35Å; C854-C862 HydrophobicContact CB-CB 3.65Å; C854-C862 WeakPolarHBondContact CB-SG 2.99Å; C854-C862 WeakPolarHBondContact SG-CB 3.46Å; C854-C862 CovalentContact SG-SG 2.05Å; C854-C862 PolarHBondContact SG-SG 2.9Å; C854-P867 WeakPolarHBondContact SG-CA 3.43Å; C854-P867 VanDerWaalsContact SG-N 3.44Å
855	S	75	Confident	79.9	Confident	90 Å²	90	74.2 Å²	74.2	63%	0.629	40%	0.398	S	S	*	.			trans	-84.9	-15.5	175.4	63.2	0	0	0	0	113	L852 N853	L852-S855 PolarHBondContact O-N 3.27Å; N853-S855 PolarHBondContact O-N 2.94Å
856	M	70.4	Confident	79.6	Confident	119 Å²	119	81.5 Å²	81.5	59%	0.586	43%	0.43	S	S	*	.			trans	-100.2	116.5	-179.5	-62.2	-68	-74.8	0	0	109.4	N858 S859	M856-N858 PolarHBondContact O-N 3.45Å; M856-S859 PolarHBondContact O-OG 2.92Å
857	D	66.9	Low	79.5	Confident	152 Å²	152	83 Å²	83	81%	0.813	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-15.4	-178.7	-73	-29.1	0	0	0	113.9
858	N	76.4	Confident	79.4	Confident	156 Å²	156	81.4 Å²	81.4	83%	0.834	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-5.3	-175.5	-76.4	0.1	0	0	0	114.6	M856	M856-N858 PolarHBondContact O-N 3.45Å
859	S	79.2	Confident	79.4	Confident	9 Å²	9	86.7 Å²	86.7	6%	0.063	46%	0.459	C	S	.	.			trans	-80.7	127.5	179.9	58.4	0	0	0	0	111.3	M856 C861 C862 E884	M856-S859 PolarHBondContact O-OG 2.92Å; S859-C861 PolarHBondContact O-N 3.46Å; S859-C862 PolarHBondContact O-N 3.35Å; S859-C862 VanDerWaalsContact O-N 3.16Å; S859-C862 VanDerWaalsContact OG-CB 3.31Å; S859-C862 WeakPolarHBondContact OG-CB 3.13Å; S859-C862 PolarHBondContact OG-SG 3.24Å; S859-C862 VanDerWaalsContact OG-SG 3.4Å; S859-E884 WeakPolarHBondContact CA-OE1 3.11Å; S859-E884 WeakPolarHBondContact CB-OE1 3.37Å
860	T	81.1	Confident	79.2	Confident	74 Å²	74	86.4 Å²	86.4	45%	0.454	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.8	174.2	63.9	0	0	0	0	112.5	C862 S880 E884	T860-C862 VanDerWaalsContact C-N 3.33Å; T860-S880 PolarHBondContact OG1-O 3.08Å; T860-E884 WeakPolarHBondContact CA-OE2 3.25Å; T860-E884 WeakPolarHBondContact CB-OE2 3.36Å; T860-E884 PolarHBondContact N-OE2 3.33Å; T860-E884 PolarHBondContact OG1-OE2 2.92Å
861	C	84	Confident	79.1	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-12.3	173.5	-69.2	0	0	0	0	115	I849 L852 S859 L868 C881 E884	I849-C861 HydrophobicContact CG1-CB 4.11Å; L852-C861 HydrophobicContact CD1-CB 4.23Å; S859-C861 PolarHBondContact O-N 3.46Å; C861-L868 WeakPolarHBondContact O-CB 3.41Å; C861-L868 PolarHBondContact O-N 3.12Å; C861-C881 VanDerWaalsContact CA-SG 3.52Å; C861-C881 HydrophobicContact CB-CB 3.95Å; C861-C881 WeakPolarHBondContact CB-SG 3.48Å; C861-C881 WeakPolarHBondContact SG-CA 3.3Å; C861-C881 WeakPolarHBondContact SG-CB 3.43Å; C861-C881 PolarHBondContact SG-O 3.01Å; C861-C881 VanDerWaalsContact SG-O 3.34Å; C861-C881 CovalentContact SG-SG 2.04Å; C861-C881 PolarHBondContact SG-SG 2.75Å; C861-E884 PolarHBondContact N-OE2 3.34Å
862	C	83.9	Confident	79.1	Confident	16 Å²	16	82.7 Å²	82.7	11%	0.108	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.3	-179.7	-68.3	0	0	0	0	110.1	C854 S859 T860 K866	C854-C862 WeakPolarHBondContact CA-SG 3.35Å; C854-C862 HydrophobicContact CB-CB 3.65Å; C854-C862 WeakPolarHBondContact CB-SG 2.99Å; C854-C862 WeakPolarHBondContact SG-CB 3.46Å; C854-C862 CovalentContact SG-SG 2.05Å; C854-C862 PolarHBondContact SG-SG 2.9Å; S859-C862 PolarHBondContact O-N 3.35Å; S859-C862 VanDerWaalsContact O-N 3.16Å; S859-C862 VanDerWaalsContact OG-CB 3.31Å; S859-C862 WeakPolarHBondContact OG-CB 3.13Å; S859-C862 PolarHBondContact OG-SG 3.24Å; S859-C862 VanDerWaalsContact OG-SG 3.4Å; T860-C862 VanDerWaalsContact C-N 3.33Å; C862-K866 WeakPolarHBondContact CA-O 3.4Å
863	Y	76.5	Confident	79.1	Confident	164 Å²	164	81.8 Å²	81.8	64%	0.643	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.9	179.5	-155.1	-101	0	0	0	109.5	G865 K866	Y863-G865 PolarHBondContact O-N 3.08Å; Y863-K866 PolarHBondContact N-O 3.35Å; Y863-K866 PolarHBondContact O-N 3.03Å; Y863-K866 VanDerWaalsContact O-N 3.1Å
864	H	74.7	Confident	79.3	Confident	162 Å²	162	78.6 Å²	78.6	75%	0.75	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	48.5	-177.4	-61.6	-59.2	0	0	0	113.9	K866	H864-K866 PolarHBondContact O-N 3.45Å; H864-K866 VanDerWaalsContact O-N 3.14Å
865	G	75	Confident	79.5	Confident	47 Å²	47	80.7 Å²	80.7	49%	0.485	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	6.6	179.6	0	0	0	0	0	114.8	Y863	Y863-G865 PolarHBondContact O-N 3.08Å
866	K	80.6	Confident	79.8	Confident	154 Å²	154	82.7 Å²	82.7	67%	0.67	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	139.5	174.6	-66.6	-178.3	-178.4	176.5	0	110.5	C862 Y863 H864	C862-K866 WeakPolarHBondContact CA-O 3.4Å; Y863-K866 PolarHBondContact N-O 3.35Å; Y863-K866 PolarHBondContact O-N 3.03Å; Y863-K866 VanDerWaalsContact O-N 3.1Å; H864-K866 PolarHBondContact O-N 3.45Å; H864-K866 VanDerWaalsContact O-N 3.14Å
867	P	83	Confident	80.4	Confident	77 Å²	77	78.8 Å²	78.8	50%	0.5	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	138.1	175.6	26.6	-33.7	0	0	0	110.7	I849 C854 Q869	I849-P867 HydrophobicContact CG2-CB 3.37Å; C854-P867 WeakPolarHBondContact SG-CA 3.43Å; C854-P867 VanDerWaalsContact SG-N 3.44Å; P867-Q869 PolarHBondContact O-N 3.11Å
868	L	83.1	Confident	81.4	Confident	27 Å²	27	71.6 Å²	71.6	14%	0.141	38%	0.382	C	S	.	.			trans	-62.2	125.1	177.3	-173.4	75.2	0	0	0	110.5	C861 I870 C881	C861-L868 WeakPolarHBondContact O-CB 3.41Å; C861-L868 PolarHBondContact O-N 3.12Å; L868-I870 PolarHBondContact O-N 3.28Å; L868-C881 HydrophobicContact CD2-CB 3.9Å
869	Q	83.6	Confident	81.7	Confident	134 Å²	134	65.2 Å²	65.2	63%	0.626	35%	0.348	S	S	*	.			trans	-74.3	93.5	170.7	-68.4	-172.2	-6.7	0	0	110	P867 Y871 N872 S873	P867-Q869 PolarHBondContact O-N 3.11Å; Q869-Y871 PolarHBondContact O-N 3.4Å; Q869-Y871 VanDerWaalsContact O-N 3.09Å; Q869-N872 HydrophobicContact CB-CB 4.39Å; Q869-N872 PolarHBondContact O-N 3.5Å; Q869-N872 VanDerWaalsContact O-N 3.13Å; Q869-N872 PolarHBondContact OE1-ND2 3.21Å; Q869-S873 WeakPolarHBondContact O-CB 3.41Å; Q869-S873 PolarHBondContact O-N 3.02Å; Q869-S873 PolarHBondContact O-OG 3.48Å
870	I	81.2	Confident	81.9	Confident	3 Å²	3	67.2 Å²	67.2	2%	0.015	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-43.9	-176.1	-61	-177.3	0	0	0	112.5	R790 F838 I845 D846 I849 L868 S873 F878	R790-I870 PolarHBondContact NH1-O 3.13Å; F838-I870 HydrophobicContact CD1-CG2 4.43Å; F838-I870 HydrophobicContact CE1-CG2 4.08Å; I845-I870 HydrophobicContact CB-CD1 3.81Å; I845-I870 HydrophobicContact CG2-CD1 3.51Å; I845-I870 HydrophobicContact CG2-CG1 4.5Å; D846-I870 WeakPolarHBondContact OD1-CD1 3.05Å; I849-I870 HydrophobicContact CD1-CD1 3.77Å; I849-I870 HydrophobicContact CD1-CG1 3.74Å; L868-I870 PolarHBondContact O-N 3.28Å; I870-S873 PolarHBondContact O-OG 2.82Å; I870-F878 HydrophobicContact CG2-CD2 3.84Å; I870-F878 HydrophobicContact CG2-CE2 3.57Å
871	Y	81.8	Confident	82.2	Confident	42 Å²	42	63.7 Å²	63.7	17%	0.165	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-15.6	-171	-51.8	-70.3	0	0	0	114.7	R790 L791 L794 F838 D846 Q869	R790-Y871 HydrophobicContact CB-CD1 4.36Å; L791-Y871 HydrophobicContact CD2-CD1 4.28Å; L791-Y871 HydrophobicContact CD2-CG 4.46Å; L794-Y871 HydrophobicContact CB-CE1 3.84Å; L794-Y871 HydrophobicContact CD1-CE1 4.43Å; L794-Y871 HydrophobicContact CD2-CD1 4.18Å; L794-Y871 HydrophobicContact CD2-CE1 3.74Å; L794-Y871 HydrophobicContact CD2-CE2 4.18Å; L794-Y871 HydrophobicContact CG-CE1 4.2Å; F838-Y871 HydrophobicContact CD1-CE1 4.16Å; D846-Y871 PolarHBondContact OD2-OH 2.99Å; Q869-Y871 PolarHBondContact O-N 3.4Å; Q869-Y871 VanDerWaalsContact O-N 3.09Å
872	N	83.5	Confident	82.3	Confident	125 Å²	125	63.8 Å²	63.8	67%	0.668	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-11.2	179.4	-70.3	-11.8	0	0	0	113.2	Q869	Q869-N872 HydrophobicContact CB-CB 4.39Å; Q869-N872 PolarHBondContact O-N 3.5Å; Q869-N872 VanDerWaalsContact O-N 3.13Å; Q869-N872 PolarHBondContact OE1-ND2 3.21Å
873	S	82.3	Confident	82.2	Confident	14 Å²	14	64.9 Å²	64.9	10%	0.098	35%	0.346	C	S	.	.	S	Bend	trans	-72.3	153	-176	63.1	0	0	0	0	113	R790 Q869 I870	R790-S873 PolarHBondContact NH1-O 2.98Å; R790-S873 PolarHBondContact NH1-OG 3.13Å; Q869-S873 WeakPolarHBondContact O-CB 3.41Å; Q869-S873 PolarHBondContact O-N 3.02Å; Q869-S873 PolarHBondContact O-OG 3.48Å; I870-S873 PolarHBondContact O-OG 2.82Å
874	S	84.3	Confident	82.5	Confident	72 Å²	72	58.9 Å²	58.9	50%	0.503	32%	0.323	S	S	.	.			trans	-57.3	156.8	174.2	76.6	0	0	0	0	111.8	L876 S877 F878	S874-L876 VanDerWaalsContact C-N 3.31Å; S874-L876 PolarHBondContact O-N 2.91Å; S874-S877 PolarHBondContact N-OG 3.4Å; S874-S877 PolarHBondContact O-N 3.41Å; S874-S877 PolarHBondContact O-OG 3.25Å; S874-S877 PolarHBondContact OG-N 3Å; S874-S877 PolarHBondContact OG-OG 3.49Å; S874-F878 PolarHBondContact O-N 3.44Å
875	V	82.5	Confident	83.1	Confident	57 Å²	57	51.4 Å²	51.4	35%	0.345	29%	0.288	S	S	.	.	H	α-helix	trans	-57.4	-45.3	179.1	175.3	0	0	0	0	111.6	T785 F878 I879	T785-V875 WeakPolarHBondContact OG1-CG1 3.48Å; V875-F878 PolarHBondContact O-N 2.95Å; V875-I879 HydrophobicContact CG1-CD1 3.81Å; V875-I879 HydrophobicContact CG1-CG1 4.46Å; V875-I879 WeakPolarHBondContact O-CG1 3.29Å; V875-I879 PolarHBondContact O-N 3.34Å
876	L	81.9	Confident	83.4	Confident	133 Å²	133	49.3 Å²	49.3	70%	0.696	27%	0.266	S	S	*	.	H	α-helix	trans	-64.2	-47.3	-177.3	-169.9	66.9	0	0	0	112.6	S874 F878 I879 S880	S874-L876 VanDerWaalsContact C-N 3.31Å; S874-L876 PolarHBondContact O-N 2.91Å; L876-F878 PolarHBondContact O-N 3.43Å; L876-I879 PolarHBondContact O-N 3.17Å; L876-S880 PolarHBondContact O-N 3.44Å; L876-S880 VanDerWaalsContact O-N 3.11Å; L876-S880 PolarHBondContact O-OG 3.16Å
877	S	83.2	Confident	83.3	Confident	36 Å²	36	45.4 Å²	45.4	25%	0.252	26%	0.258	S	S	.	.	H	α-helix	trans	-60.7	-35.1	178.3	49.6	0	0	0	0	112.7	S874 C881	S874-S877 PolarHBondContact N-OG 3.4Å; S874-S877 PolarHBondContact O-N 3.41Å; S874-S877 PolarHBondContact O-OG 3.25Å; S874-S877 PolarHBondContact OG-N 3Å; S874-S877 PolarHBondContact OG-OG 3.49Å; S877-C881 PolarHBondContact O-N 3.44Å
878	F	86.9	Confident	83.1	Confident	2 Å²	2	46 Å²	46	1%	0.009	25%	0.251	C	S	.	.	H	α-helix	trans	-70.8	-41.6	176.8	175.3	-105.7	0	0	0	112.2	R790 F838 I845 I870 S874 V875 L876 S880 C881 L882	R790-F878 VanDerWaalsContact CZ-CD1 3.45Å; F838-F878 HydrophobicContact CE1-CE2 4.13Å; F838-F878 AromaticContact CE1-CZ 3.92Å; F838-F878 HydrophobicContact CE1-CZ 3.92Å; F838-F878 AromaticContact CZ-CZ 3.86Å; F838-F878 HydrophobicContact CZ-CZ 3.86Å; I845-F878 HydrophobicContact CD1-CE2 4.31Å; I845-F878 HydrophobicContact CD1-CZ 4.39Å; I870-F878 HydrophobicContact CG2-CD2 3.84Å; I870-F878 HydrophobicContact CG2-CE2 3.57Å; S874-F878 PolarHBondContact O-N 3.44Å; V875-F878 PolarHBondContact O-N 2.95Å; L876-F878 PolarHBondContact O-N 3.43Å; F878-S880 VanDerWaalsContact C-N 3.32Å; F878-S880 PolarHBondContact O-N 2.79Å; F878-C881 PolarHBondContact O-N 3.45Å; F878-L882 HydrophobicContact CE1-CD2 4.09Å; F878-L882 HydrophobicContact CZ-CD1 4.32Å; F878-L882 HydrophobicContact CZ-CD2 4.44Å; F878-L882 WeakPolarHBondContact O-CB 3.15Å; F878-L882 PolarHBondContact O-N 3.03Å
879	I	83.8	Confident	82.8	Confident	21 Å²	21	45.4 Å²	45.4	11%	0.108	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-42.8	177.6	-68.5	168.1	0	0	0	110.7	T785 V875 L876 L882 N883 N907	T785-I879 HydrophobicContact CG2-CD1 4.04Å; T785-I879 HydrophobicContact CG2-CG1 3.8Å; V875-I879 HydrophobicContact CG1-CD1 3.81Å; V875-I879 HydrophobicContact CG1-CG1 4.46Å; V875-I879 WeakPolarHBondContact O-CG1 3.29Å; V875-I879 PolarHBondContact O-N 3.34Å; L876-I879 PolarHBondContact O-N 3.17Å; I879-L882 PolarHBondContact O-N 3.18Å; I879-N883 PolarHBondContact O-N 2.62Å; I879-N907 HydrophobicContact CG2-CB 4.47Å
880	S	82.7	Confident	82.1	Confident	51 Å²	51	40.6 Å²	40.6	36%	0.357	23%	0.226	S	C	.	.	H	α-helix	trans	-59.6	-50.5	176.3	-59	0	0	0	0	111.9	T860 L876 F878 L882 N883 E884	T860-S880 PolarHBondContact OG1-O 3.08Å; L876-S880 PolarHBondContact O-N 3.44Å; L876-S880 VanDerWaalsContact O-N 3.11Å; L876-S880 PolarHBondContact O-OG 3.16Å; F878-S880 VanDerWaalsContact C-N 3.32Å; F878-S880 PolarHBondContact O-N 2.79Å; S880-L882 VanDerWaalsContact C-N 3.31Å; S880-L882 PolarHBondContact O-N 2.59Å; S880-N883 PolarHBondContact O-N 2.89Å; S880-E884 PolarHBondContact O-N 3.36Å
881	C	87.4	Confident	81.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-35.5	177.2	175.9	0	0	0	0	112.8	C861 L868 S877 F878 E884 Y885	C861-C881 VanDerWaalsContact CA-SG 3.52Å; C861-C881 HydrophobicContact CB-CB 3.95Å; C861-C881 WeakPolarHBondContact CB-SG 3.48Å; C861-C881 WeakPolarHBondContact SG-CA 3.3Å; C861-C881 WeakPolarHBondContact SG-CB 3.43Å; C861-C881 PolarHBondContact SG-O 3.01Å; C861-C881 VanDerWaalsContact SG-O 3.34Å; C861-C881 CovalentContact SG-SG 2.04Å; C861-C881 PolarHBondContact SG-SG 2.75Å; L868-C881 HydrophobicContact CD2-CB 3.9Å; S877-C881 PolarHBondContact O-N 3.44Å; F878-C881 PolarHBondContact O-N 3.45Å; C881-E884 PolarHBondContact O-N 3.23Å; C881-Y885 PolarHBondContact O-N 3.01Å
882	L	86.5	Confident	80.1	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-43.9	177.5	-177.6	65.9	0	0	0	111.1	I845 F878 I879 S880 E884 Y885 I886 F898 P909	I845-L882 HydrophobicContact CD1-CD1 3.71Å; F878-L882 HydrophobicContact CE1-CD2 4.09Å; F878-L882 HydrophobicContact CZ-CD1 4.32Å; F878-L882 HydrophobicContact CZ-CD2 4.44Å; F878-L882 WeakPolarHBondContact O-CB 3.15Å; F878-L882 PolarHBondContact O-N 3.03Å; I879-L882 PolarHBondContact O-N 3.18Å; S880-L882 VanDerWaalsContact C-N 3.31Å; S880-L882 PolarHBondContact O-N 2.59Å; L882-E884 VanDerWaalsContact C-N 3.33Å; L882-E884 PolarHBondContact O-N 3.37Å; L882-Y885 HydrophobicContact CD1-CD1 4.28Å; L882-Y885 PolarHBondContact O-N 3.48Å; L882-I886 HydrophobicContact CD1-CD1 4.13Å; L882-I886 HydrophobicContact CD1-CG1 4.43Å; L882-I886 HydrophobicContact CD2-CD1 4.36Å; L882-I886 HydrophobicContact CG-CD1 3.69Å; L882-I886 HydrophobicContact CG-CG1 4.44Å; L882-I886 WeakPolarHBondContact O-CB 3.13Å; L882-I886 VanDerWaalsContact O-CD1 3.31Å; L882-I886 WeakPolarHBondContact O-CD1 3.49Å; L882-I886 WeakPolarHBondContact O-CG1 3.2Å; L882-I886 PolarHBondContact O-N 2.63Å; L882-F898 HydrophobicContact CD1-CD2 3.69Å; L882-F898 HydrophobicContact CD1-CE2 3.6Å; L882-F898 HydrophobicContact CD1-CZ 4.41Å; L882-F898 HydrophobicContact CD2-CD2 4.33Å; L882-F898 HydrophobicContact CD2-CE2 4.4Å; L882-F898 HydrophobicContact CD2-CG 4.47Å; L882-F898 HydrophobicContact CG-CD2 4.47Å; L882-P909 HydrophobicContact CD2-CG 4.49Å
883	N	82.1	Confident	79	Confident	40 Å²	40	43.4 Å²	43.4	21%	0.214	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-40.4	176.9	-72.5	-13.6	0	0	0	112.1	I879 S880 I886 S887	I879-N883 PolarHBondContact O-N 2.62Å; S880-N883 PolarHBondContact O-N 2.89Å; N883-I886 PolarHBondContact O-N 2.77Å; N883-S887 PolarHBondContact O-N 3.35Å; N883-S887 VanDerWaalsContact O-N 3.07Å
884	E	83.2	Confident	78	Confident	38 Å²	38	44 Å²	44	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-49.1	174.1	-175.7	-179.7	169.1	0	0	111.4	Y848 S859 T860 C861 S880 C881 L882 I886 S887 Y888	Y848-E884 HydrophobicContact CE1-CG 4.43Å; S859-E884 WeakPolarHBondContact CA-OE1 3.11Å; S859-E884 WeakPolarHBondContact CB-OE1 3.37Å; T860-E884 WeakPolarHBondContact CA-OE2 3.25Å; T860-E884 WeakPolarHBondContact CB-OE2 3.36Å; T860-E884 PolarHBondContact N-OE2 3.33Å; T860-E884 PolarHBondContact OG1-OE2 2.92Å; C861-E884 PolarHBondContact N-OE2 3.34Å; S880-E884 PolarHBondContact O-N 3.36Å; C881-E884 PolarHBondContact O-N 3.23Å; L882-E884 VanDerWaalsContact C-N 3.33Å; L882-E884 PolarHBondContact O-N 3.37Å; E884-I886 PolarHBondContact O-N 2.85Å; E884-S887 PolarHBondContact O-N 3.24Å; E884-S887 PolarHBondContact O-OG 3.23Å; E884-Y888 PolarHBondContact O-N 3.26Å
885	Y	85.4	Confident	77.3	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-43	176.8	162.2	-96	0	0	0	112.7	N843 I845 Y848 C881 L882 S887 Y888 E889	N843-Y885 PolarHBondContact O-OH 3.39Å; I845-Y885 HydrophobicContact CB-CD2 4.41Å; I845-Y885 HydrophobicContact CD1-CD1 4.27Å; I845-Y885 HydrophobicContact CD1-CE1 4.39Å; I845-Y885 HydrophobicContact CG1-CD1 3.66Å; I845-Y885 HydrophobicContact CG1-CD2 3.99Å; I845-Y885 HydrophobicContact CG1-CE1 3.69Å; I845-Y885 HydrophobicContact CG1-CE2 3.99Å; I845-Y885 HydrophobicContact CG1-CG 3.8Å; I845-Y885 HydrophobicContact CG2-CG 4.49Å; Y848-Y885 AromaticContact CD1-CD2 3.99Å; Y848-Y885 HydrophobicContact CD1-CD2 3.99Å; Y848-Y885 HydrophobicContact CD1-CG 4.49Å; Y848-Y885 AromaticContact CG-CD2 3.82Å; Y848-Y885 HydrophobicContact CG-CD2 3.82Å; C881-Y885 PolarHBondContact O-N 3.01Å; L882-Y885 HydrophobicContact CD1-CD1 4.28Å; L882-Y885 PolarHBondContact O-N 3.48Å; Y885-S887 VanDerWaalsContact C-N 3.3Å; Y885-S887 PolarHBondContact O-N 3.27Å; Y885-Y888 WeakPolarHBondContact O-CB 3.35Å; Y885-Y888 PolarHBondContact O-N 2.85Å; Y885-Y888 VanDerWaalsContact O-N 3.15Å; Y885-E889 PolarHBondContact O-N 3.41Å
886	I	81.3	Confident	77.1	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-38.6	178.3	-73.3	159.3	0	0	0	111.2	S85 L882 N883 E884 Y888 E889 N890 F898 F900	S85-I886 WeakPolarHBondContact O-CG2 3.27Å; L882-I886 HydrophobicContact CD1-CD1 4.13Å; L882-I886 HydrophobicContact CD1-CG1 4.43Å; L882-I886 HydrophobicContact CD2-CD1 4.36Å; L882-I886 HydrophobicContact CG-CD1 3.69Å; L882-I886 HydrophobicContact CG-CG1 4.44Å; L882-I886 WeakPolarHBondContact O-CB 3.13Å; L882-I886 VanDerWaalsContact O-CD1 3.31Å; L882-I886 WeakPolarHBondContact O-CD1 3.49Å; L882-I886 WeakPolarHBondContact O-CG1 3.2Å; L882-I886 PolarHBondContact O-N 2.63Å; N883-I886 PolarHBondContact O-N 2.77Å; E884-I886 PolarHBondContact O-N 2.85Å; I886-Y888 PolarHBondContact O-N 3.26Å; I886-E889 PolarHBondContact O-N 3.36Å; I886-N890 VanDerWaalsContact CG2-ND2 3.26Å; I886-N890 WeakPolarHBondContact CG2-ND2 3.5Å; I886-N890 WeakPolarHBondContact O-CB 3.21Å; I886-N890 PolarHBondContact O-N 3.34Å; I886-N890 PolarHBondContact O-ND2 3.26Å; I886-F898 HydrophobicContact CD1-CB 4.25Å; I886-F900 HydrophobicContact CD1-CE2 3.46Å; I886-F900 VanDerWaalsContact CD1-CE2 3.46Å; I886-F900 HydrophobicContact CD1-CZ 3.4Å; I886-F900 VanDerWaalsContact CD1-CZ 3.4Å
887	S	78.7	Confident	77.2	Confident	72 Å²	72	37.4 Å²	37.4	50%	0.503	20%	0.201	S	C	.	.	H	α-helix	trans	-62.5	-35.3	176.8	78.3	0	0	0	0	112.1	N883 E884 Y885	N883-S887 PolarHBondContact O-N 3.35Å; N883-S887 VanDerWaalsContact O-N 3.07Å; E884-S887 PolarHBondContact O-N 3.24Å; E884-S887 PolarHBondContact O-OG 3.23Å; Y885-S887 VanDerWaalsContact C-N 3.3Å; Y885-S887 PolarHBondContact O-N 3.27Å
888	Y	79.4	Confident	77.3	Confident	88 Å²	88	35.9 Å²	35.9	35%	0.345	19%	0.19	S	C	.	.	H	α-helix	trans	-70.9	-45.8	173.9	176	-100.8	0	0	0	111.8	Y848 E884 Y885 I886 N890 Q891 Y892	Y848-Y888 AromaticContact CD2-CD1 3.55Å; Y848-Y888 HydrophobicContact CD2-CD1 3.55Å; Y848-Y888 AromaticContact CD2-CE1 3.88Å; Y848-Y888 HydrophobicContact CD2-CE1 3.88Å; Y848-Y888 AromaticContact CD2-CG 3.92Å; Y848-Y888 HydrophobicContact CD2-CG 3.92Å; Y848-Y888 AromaticContact CE2-CD1 3.61Å; Y848-Y888 HydrophobicContact CE2-CD1 3.61Å; Y848-Y888 AromaticContact CE2-CD2 3.89Å; Y848-Y888 HydrophobicContact CE2-CD2 3.89Å; Y848-Y888 HydrophobicContact CE2-CE1 4.17Å; Y848-Y888 HydrophobicContact CE2-CE2 4.42Å; Y848-Y888 AromaticContact CE2-CG 3.44Å; Y848-Y888 HydrophobicContact CE2-CG 3.44Å; Y848-Y888 VanDerWaalsContact CE2-CG 3.44Å; E884-Y888 PolarHBondContact O-N 3.26Å; Y885-Y888 WeakPolarHBondContact O-CB 3.35Å; Y885-Y888 PolarHBondContact O-N 2.85Å; Y885-Y888 VanDerWaalsContact O-N 3.15Å; I886-Y888 PolarHBondContact O-N 3.26Å; Y888-N890 VanDerWaalsContact C-N 3.33Å; Y888-N890 PolarHBondContact O-N 3.45Å; Y888-Q891 WeakPolarHBondContact O-CB 3.11Å; Y888-Q891 PolarHBondContact O-N 3.49Å; Y888-Y892 HydrophobicContact CE1-CE2 4.01Å; Y888-Y892 HydrophobicContact CE2-CE2 4.49Å; Y888-Y892 AromaticContact CZ-CE2 3.93Å; Y888-Y892 PolarHBondContact OH-OH 3.2Å
889	E	76.9	Confident	77.2	Confident	16 Å²	16	36.5 Å²	36.5	8%	0.075	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-37.7	-177.5	-159.9	-162.8	167.9	0	0	112.7	W835 Y885 I886 Q891 Y892 Y894	W835-E889 WeakPolarHBondContact CZ2-OE1 3.2Å; W835-E889 WeakPolarHBondContact CZ2-OE2 3.37Å; W835-E889 PolarHBondContact NE1-OE1 3.24Å; Y885-E889 PolarHBondContact O-N 3.41Å; I886-E889 PolarHBondContact O-N 3.36Å; E889-Q891 PolarHBondContact O-N 2.68Å; E889-Y892 WeakPolarHBondContact O-CB 3.44Å; E889-Y892 PolarHBondContact O-N 3.49Å; E889-Y894 HydrophobicContact CG-CD2 4.36Å
890	N	68.6	Low	77	Confident	33 Å²	33	36 Å²	36	18%	0.176	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-59.7	-21.2	-179.4	-83.4	-51.9	0	0	0	114.2	S85 S86 I886 Y888 Y892 G893	S85-N890 WeakPolarHBondContact CB-OD1 3.37Å; S85-N890 PolarHBondContact O-ND2 2.96Å; S85-N890 PolarHBondContact OG-OD1 3.41Å; S86-N890 WeakPolarHBondContact CB-ND2 3.42Å; I886-N890 VanDerWaalsContact CG2-ND2 3.26Å; I886-N890 WeakPolarHBondContact CG2-ND2 3.5Å; I886-N890 WeakPolarHBondContact O-CB 3.21Å; I886-N890 PolarHBondContact O-N 3.34Å; I886-N890 PolarHBondContact O-ND2 3.26Å; Y888-N890 VanDerWaalsContact C-N 3.33Å; Y888-N890 PolarHBondContact O-N 3.45Å; N890-Y892 PolarHBondContact O-N 3Å; N890-G893 PolarHBondContact O-N 3.29Å
891	Q	62.6	Low	76.8	Confident	125 Å²	125	36.2 Å²	36.2	58%	0.584	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-62.2	-26.6	173.1	-63.8	-173.8	-9.9	0	0	112.4	Y888 E889	Y888-Q891 WeakPolarHBondContact O-CB 3.11Å; Y888-Q891 PolarHBondContact O-N 3.49Å; E889-Q891 PolarHBondContact O-N 2.68Å
892	Y	59.4	Low	75.7	Confident	66 Å²	66	42 Å²	42	26%	0.259	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-94.8	7	177.5	-59.5	-81	0	0	0	113	F113 Y888 E889 N890 Y894	F113-Y892 VanDerWaalsContact CD1-C 3.45Å; F113-Y892 WeakPolarHBondContact CD1-O 3.48Å; F113-Y892 WeakPolarHBondContact CE1-O 3.44Å; F113-Y892 WeakPolarHBondContact CG-O 3.29Å; Y888-Y892 HydrophobicContact CE1-CE2 4.01Å; Y888-Y892 HydrophobicContact CE2-CE2 4.49Å; Y888-Y892 AromaticContact CZ-CE2 3.93Å; Y888-Y892 PolarHBondContact OH-OH 3.2Å; E889-Y892 WeakPolarHBondContact O-CB 3.44Å; E889-Y892 PolarHBondContact O-N 3.49Å; N890-Y892 PolarHBondContact O-N 3Å; Y892-Y894 HydrophobicContact CG-CE2 4.07Å; Y892-Y894 PolarHBondContact O-N 3.41Å
893	G	60.2	Low	74.4	Confident	38 Å²	38	50.9 Å²	50.9	39%	0.392	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	9.6	170.1	0	0	0	0	0	117.7	F113 N890 M895	F113-G893 WeakPolarHBondContact CE1-O 3.22Å; F113-G893 WeakPolarHBondContact CZ-O 3.38Å; N890-G893 PolarHBondContact O-N 3.29Å; G893-M895 PolarHBondContact O-N 3.34Å
894	Y	61.4	Low	73.1	Confident	27 Å²	27	51.4 Å²	51.4	11%	0.106	26%	0.258	C	S	.	.			trans	-55.8	134.7	-174.1	-64.3	-64.6	0	0	0	111.5	F113 E889 Y892 T896	F113-Y894 HydrophobicContact CD2-CD1 4.25Å; F113-Y894 HydrophobicContact CD2-CE1 4.03Å; F113-Y894 AromaticContact CE2-CD1 3.65Å; F113-Y894 HydrophobicContact CE2-CD1 3.65Å; F113-Y894 AromaticContact CE2-CE1 3.84Å; F113-Y894 HydrophobicContact CE2-CE1 3.84Å; F113-Y894 AromaticContact CZ-CD1 3.95Å; F113-Y894 HydrophobicContact CZ-CD1 3.95Å; E889-Y894 HydrophobicContact CG-CD2 4.36Å; Y892-Y894 HydrophobicContact CG-CE2 4.07Å; Y892-Y894 PolarHBondContact O-N 3.41Å; Y894-T896 WeakPolarHBondContact CB-OG1 3.35Å; Y894-T896 PolarHBondContact O-N 3.34Å; Y894-T896 VanDerWaalsContact O-N 3.17Å
895	M	69.5	Low	71.7	Confident	115 Å²	115	58 Å²	58	57%	0.567	29%	0.294	S	S	*	.	S	Bend	trans	-68.3	-7.6	172.9	-72.8	-171.8	164.2	0	0	112.8	L80 G893 R899	L80-M895 HydrophobicContact CD1-SD 4.44Å; G893-M895 PolarHBondContact O-N 3.34Å; M895-R899 PolarHBondContact O-NH2 2.96Å
896	T	77.5	Confident	70.4	Confident	7 Å²	7	62.1 Å²	62.1	4%	0.043	32%	0.316	C	S	.	.			trans	-87.4	169.2	-179.4	45.7	0	0	0	0	113.3	W835 Y894 I913 N915	W835-T896 HydrophobicContact CB-CG2 4.47Å; W835-T896 VanDerWaalsContact CD1-OG1 3.29Å; W835-T896 HydrophobicContact CD2-CG2 4.27Å; W835-T896 VanDerWaalsContact CD2-OG1 3.28Å; W835-T896 HydrophobicContact CE3-CG2 4.21Å; W835-T896 HydrophobicContact CG-CG2 4.34Å; W835-T896 PolarHBondContact NE1-OG1 3.22Å; Y894-T896 WeakPolarHBondContact CB-OG1 3.35Å; Y894-T896 PolarHBondContact O-N 3.34Å; Y894-T896 VanDerWaalsContact O-N 3.17Å; T896-I913 HydrophobicContact CG2-CG2 4.23Å; T896-N915 HydrophobicContact CG2-CB 3.62Å; T896-N915 VanDerWaalsContact CG2-CG 3.49Å; T896-N915 WeakPolarHBondContact CG2-ND2 3.42Å
897	G	83.7	Confident	69.7	Low	1 Å²	1	66.7 Å²	66.7	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	106.3	-165	173.5	0	0	0	0	0	115.3	I913	G897-I913 PolarHBondContact N-O 3.16Å; G897-I913 PolarHBondContact O-N 3.41Å
898	F	86.7	Confident	69.6	Low	4 Å²	4	66.6 Å²	66.6	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	139.9	-179.4	-69.3	-79.3	0	0	0	110.1	F784 P837 F838 L882 I886 F900 P909 G911 L912	F784-F898 HydrophobicContact CB-CE1 4.08Å; F784-F898 HydrophobicContact CG-CE1 4.31Å; P837-F898 HydrophobicContact CB-CE2 4.08Å; P837-F898 HydrophobicContact CG-CE2 4.15Å; P837-F898 HydrophobicContact CG-CZ 4.48Å; F838-F898 AromaticContact CE2-CZ 3.93Å; F838-F898 HydrophobicContact CE2-CZ 3.93Å; F838-F898 HydrophobicContact CZ-CZ 4.1Å; L882-F898 HydrophobicContact CD1-CD2 3.69Å; L882-F898 HydrophobicContact CD1-CE2 3.6Å; L882-F898 HydrophobicContact CD1-CZ 4.41Å; L882-F898 HydrophobicContact CD2-CD2 4.33Å; L882-F898 HydrophobicContact CD2-CE2 4.4Å; L882-F898 HydrophobicContact CD2-CG 4.47Å; L882-F898 HydrophobicContact CG-CD2 4.47Å; I886-F898 HydrophobicContact CD1-CB 4.25Å; F898-F900 HydrophobicContact CB-CE2 3.9Å; F898-F900 HydrophobicContact CB-CZ 4.07Å; F898-P909 HydrophobicContact CB-CB 3.92Å; F898-P909 HydrophobicContact CD1-CB 3.6Å; F898-P909 HydrophobicContact CD1-CG 3.79Å; F898-P909 HydrophobicContact CE1-CG 4.27Å; F898-P909 HydrophobicContact CG-CB 4.13Å; F898-G911 WeakPolarHBondContact CA-O 3.07Å; F898-L912 HydrophobicContact CD1-CB 4.38Å; F898-L912 HydrophobicContact CD1-CD1 3.83Å; F898-L912 HydrophobicContact CD2-CD1 4.29Å; F898-L912 HydrophobicContact CE1-CB 4.45Å; F898-L912 HydrophobicContact CE1-CD1 3.76Å; F898-L912 HydrophobicContact CE1-CD2 4.34Å; F898-L912 HydrophobicContact CE1-CG 4.4Å; F898-L912 HydrophobicContact CE2-CD1 4.21Å; F898-L912 HydrophobicContact CG-CD1 4.12Å; F898-L912 HydrophobicContact CZ-CD1 3.97Å
899	R	84.7	Confident	69.7	Low	15 Å²	15	62.8 Å²	62.8	6%	0.057	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.1	-175.6	-71.3	-58.5	-174	137.7	-9.5	111.2	L79 T83 M895 P909 V910 G911 I913	L79-R899 HydrophobicContact CD1-CB 4.35Å; L79-R899 HydrophobicContact CG-CG 4.42Å; T83-R899 PolarHBondContact O-NH1 2.99Å; T83-R899 WeakPolarHBondContact OG1-CB 3.44Å; T83-R899 WeakPolarHBondContact OG1-CD 3.45Å; T83-R899 WeakPolarHBondContact OG1-CG 3.49Å; M895-R899 PolarHBondContact O-NH2 2.96Å; R899-P909 CarbonylContact O-C 2.92Å; R899-V910 PolarHBondContact O-N 3.3Å; R899-G911 PolarHBondContact N-O 2.04Å; R899-G911 PolarHBondContact O-N 3Å; R899-I913 HydrophobicContact CG-CD1 4.04Å
900	F	79.9	Confident	69.9	Low	10 Å²	10	63.6 Å²	63.6	4%	0.044	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-122.9	144.5	-174.6	-58.9	-91	0	0	0	110.9	T83 S84 I886 F898 P909	T83-F900 WeakPolarHBondContact CA-O 3.04Å; T83-F900 WeakPolarHBondContact CB-O 3.32Å; S84-F900 PolarHBondContact N-O 3.32Å; S84-F900 PolarHBondContact O-N 3.25Å; I886-F900 HydrophobicContact CD1-CE2 3.46Å; I886-F900 VanDerWaalsContact CD1-CE2 3.46Å; I886-F900 HydrophobicContact CD1-CZ 3.4Å; I886-F900 VanDerWaalsContact CD1-CZ 3.4Å; F898-F900 HydrophobicContact CB-CE2 3.9Å; F898-F900 HydrophobicContact CB-CZ 4.07Å; F900-P909 HydrophobicContact CD1-CB 4.47Å; F900-P909 HydrophobicContact CE1-CB 3.84Å; F900-P909 HydrophobicContact CZ-CB 3.92Å
901	I	77.3	Confident	70.8	Confident	56 Å²	56	62 Å²	62	29%	0.287	32%	0.315	S	S	.	.			trans	-98.8	138.4	176.8	-69.4	-179	0	0	0	109.8	T83 L774 L776 K903 V910	T83-I901 HydrophobicContact CG2-CG1 3.79Å; L774-I901 HydrophobicContact CD2-CD1 4.14Å; L776-I901 HydrophobicContact CD1-CD1 3.39Å; I901-K903 PolarHBondContact O-N 3.46Å; I901-V910 HydrophobicContact CB-CG2 4.19Å; I901-V910 HydrophobicContact CD1-CB 4.07Å; I901-V910 HydrophobicContact CD1-CG1 3.63Å; I901-V910 HydrophobicContact CD1-CG2 3.92Å; I901-V910 HydrophobicContact CG1-CB 4.12Å; I901-V910 HydrophobicContact CG1-CG1 4.21Å; I901-V910 HydrophobicContact CG1-CG2 3.88Å
902	H	65.1	Low	72.1	Confident	122 Å²	122	56 Å²	56	57%	0.565	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-3.8	-173.4	-175.3	-71	0	0	0	116.1	F90	F90-H902 VanDerWaalsContact CB-CD2 3.49Å; F90-H902 WeakPolarHBondContact CB-CD2 3.21Å; F90-H902 WeakPolarHBondContact CB-NE2 3.43Å; F90-H902 AromaticContact CG-CD2 3.96Å
903	K	58.7	Low	73.6	Confident	188 Å²	188	53 Å²	53	82%	0.817	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.3	20.8	-160.5	-80.5	-175.5	178.2	172.9	0	117.4	I901	I901-K903 PolarHBondContact O-N 3.46Å
904	S	54.6	Low	75.1	Confident	51 Å²	51	51.2 Å²	51.2	36%	0.357	26%	0.257	S	S	.	.			trans	-118.3	133.8	171.7	49.3	0	0	0	0	110.3	I906	S904-I906 PolarHBondContact O-N 3.47Å; S904-I906 PolarHBondContact OG-O 3.07Å
905	D	54.9	Low	76.4	Confident	175 Å²	175	50.3 Å²	50.3	94%	0.936	25%	0.254	S	S	*	.	S	Bend	trans	-55.6	-3.7	164	-66.3	-36.6	0	0	0	113
906	I	58.1	Low	77.3	Confident	92 Å²	92	44.8 Å²	44.8	47%	0.472	23%	0.227	S	C	.	.			trans	-92	107.1	179.7	-47.7	175.4	0	0	0	107.8	S904 E908	S904-I906 PolarHBondContact O-N 3.47Å; S904-I906 PolarHBondContact OG-O 3.07Å; I906-E908 HydrophobicContact CG2-CB 3.6Å; I906-E908 HydrophobicContact CG2-CG 3.49Å; I906-E908 VanDerWaalsContact CG2-CG 3.49Å; I906-E908 PolarHBondContact O-N 2.88Å
907	N	67	Low	77.9	Confident	99 Å²	99	44.5 Å²	44.5	53%	0.529	23%	0.225	S	C	.	.			trans	-71.6	33.9	170.9	-73.8	-14.3	0	0	0	112.7	I879	I879-N907 HydrophobicContact CG2-CB 4.47Å
908	E	75.4	Confident	78.2	Confident	71 Å²	71	44.4 Å²	44.4	33%	0.332	22%	0.224	S	C	.	.			trans	-98.5	141.5	-178.8	-71.1	-179.8	172.3	0	0	111	I906 V910	I906-E908 HydrophobicContact CG2-CB 3.6Å; I906-E908 HydrophobicContact CG2-CG 3.49Å; I906-E908 VanDerWaalsContact CG2-CG 3.49Å; I906-E908 PolarHBondContact O-N 2.88Å; E908-V910 PolarHBondContact O-N 3Å
909	P	81.2	Confident	78.3	Confident	8 Å²	8	47.8 Å²	47.8	5%	0.052	24%	0.243	C	C	.	.			trans	-70.6	131.7	175.4	28.7	-33	0	0	0	110.3	F784 L882 F898 R899 F900	F784-P909 HydrophobicContact CB-CG 4.15Å; F784-P909 HydrophobicContact CD2-CB 4.34Å; F784-P909 HydrophobicContact CD2-CG 4.02Å; F784-P909 VanDerWaalsContact CD2-O 3.32Å; F784-P909 WeakPolarHBondContact CD2-O 3.26Å; F784-P909 HydrophobicContact CG-CG 4.5Å; L882-P909 HydrophobicContact CD2-CG 4.49Å; F898-P909 HydrophobicContact CB-CB 3.92Å; F898-P909 HydrophobicContact CD1-CB 3.6Å; F898-P909 HydrophobicContact CD1-CG 3.79Å; F898-P909 HydrophobicContact CE1-CG 4.27Å; F898-P909 HydrophobicContact CG-CB 4.13Å; R899-P909 CarbonylContact O-C 2.92Å; F900-P909 HydrophobicContact CD1-CB 4.47Å; F900-P909 HydrophobicContact CE1-CB 3.84Å; F900-P909 HydrophobicContact CZ-CB 3.92Å
910	V	82.2	Confident	78.4	Confident	32 Å²	32	48 Å²	48	19%	0.194	24%	0.244	C	C	.	.			trans	-91.7	-27.4	-178.6	178.9	0	0	0	0	111.8	G752 L776 R899 I901 E908	G752-V910 VanDerWaalsContact CA-O 3.3Å; G752-V910 WeakPolarHBondContact CA-O 2.92Å; L776-V910 HydrophobicContact CD1-CG1 3.6Å; L776-V910 HydrophobicContact CD2-CG1 3.26Å; L776-V910 HydrophobicContact CG-CG1 4.01Å; R899-V910 PolarHBondContact O-N 3.3Å; I901-V910 HydrophobicContact CB-CG2 4.19Å; I901-V910 HydrophobicContact CD1-CB 4.07Å; I901-V910 HydrophobicContact CD1-CG1 3.63Å; I901-V910 HydrophobicContact CD1-CG2 3.92Å; I901-V910 HydrophobicContact CG1-CB 4.12Å; I901-V910 HydrophobicContact CG1-CG1 4.21Å; I901-V910 HydrophobicContact CG1-CG2 3.88Å; E908-V910 PolarHBondContact O-N 3Å
911	G	87.1	Confident	78.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	159.5	177.6	0	0	0	0	0	112.8	W751 F898 R899	W751-G911 VanDerWaalsContact O-CA 3.24Å; W751-G911 WeakPolarHBondContact O-CA 3.01Å; F898-G911 WeakPolarHBondContact CA-O 3.07Å; R899-G911 PolarHBondContact N-O 2.04Å; R899-G911 PolarHBondContact O-N 3Å
912	L	89.4	Confident	78.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	127.6	174.1	175.4	64.5	0	0	0	109.2	I750 W751 F784 L793 P837 F898 I914	I750-L912 WeakPolarHBondContact CA-O 3.29Å; W751-L912 HydrophobicContact CE3-CD2 4.29Å; W751-L912 HydrophobicContact CE3-CG 4.41Å; W751-L912 PolarHBondContact N-O 3.44Å; W751-L912 PolarHBondContact O-N 3.48Å; F784-L912 HydrophobicContact CD1-CB 4.25Å; F784-L912 HydrophobicContact CD1-CD2 4.3Å; F784-L912 HydrophobicContact CE1-CB 3.73Å; F784-L912 HydrophobicContact CE1-CD2 4.28Å; F784-L912 HydrophobicContact CZ-CB 3.9Å; L793-L912 HydrophobicContact CD1-CD2 3.9Å; L793-L912 HydrophobicContact CD2-CD2 3.86Å; P837-L912 HydrophobicContact CG-CD1 4.19Å; F898-L912 HydrophobicContact CD1-CB 4.38Å; F898-L912 HydrophobicContact CD1-CD1 3.83Å; F898-L912 HydrophobicContact CD2-CD1 4.29Å; F898-L912 HydrophobicContact CE1-CB 4.45Å; F898-L912 HydrophobicContact CE1-CD1 3.76Å; F898-L912 HydrophobicContact CE1-CD2 4.34Å; F898-L912 HydrophobicContact CE1-CG 4.4Å; F898-L912 HydrophobicContact CE2-CD1 4.21Å; F898-L912 HydrophobicContact CG-CD1 4.12Å; F898-L912 HydrophobicContact CZ-CD1 3.97Å; L912-I914 HydrophobicContact CD1-CG1 4.48Å; L912-I914 HydrophobicContact CD2-CD1 4.19Å; L912-I914 HydrophobicContact CD2-CG1 4.41Å; L912-I914 HydrophobicContact CG-CG1 4.25Å
913	I	91	Very high	79	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.8	177.1	-55.2	165.7	0	0	0	108.9	F76 L79 L80 N748 W835 T896 G897 R899	F76-I913 HydrophobicContact CE2-CD1 4.03Å; F76-I913 HydrophobicContact CE2-CG1 4.42Å; F76-I913 HydrophobicContact CE2-CG2 4.12Å; L79-I913 HydrophobicContact CD2-CD1 3.9Å; L79-I913 HydrophobicContact CD2-CG1 3.89Å; L80-I913 HydrophobicContact CD2-CD1 3.84Å; N748-I913 HydrophobicContact CB-CG2 4.4Å; W835-I913 WeakPolarHBondContact CZ3-O 3.27Å; T896-I913 HydrophobicContact CG2-CG2 4.23Å; G897-I913 PolarHBondContact N-O 3.16Å; G897-I913 PolarHBondContact O-N 3.41Å; R899-I913 HydrophobicContact CG-CD1 4.04Å
914	I	91	Very high	79.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.8	173.1	-63.9	177.4	0	0	0	107.7	N748 F749 W751 F796 L800 W835 L912	N748-I914 CarbonylContact C-O 3.59Å; N748-I914 WeakPolarHBondContact CA-O 3.22Å; F749-I914 HydrophobicContact CB-CB 4.29Å; F749-I914 HydrophobicContact CD2-CG2 4.35Å; F749-I914 PolarHBondContact N-O 3.22Å; F749-I914 PolarHBondContact O-N 3.23Å; W751-I914 HydrophobicContact CH2-CD1 4.16Å; W751-I914 HydrophobicContact CZ3-CB 4.34Å; W751-I914 HydrophobicContact CZ3-CD1 3.73Å; W751-I914 HydrophobicContact CZ3-CG1 4.1Å; F796-I914 HydrophobicContact CD1-CD1 3.95Å; F796-I914 HydrophobicContact CE1-CD1 3.81Å; F796-I914 HydrophobicContact CE1-CG2 4.31Å; L800-I914 HydrophobicContact CD1-CG2 3.71Å; W835-I914 VanDerWaalsContact O-CG2 3.23Å; W835-I914 WeakPolarHBondContact O-CG2 3.36Å; L912-I914 HydrophobicContact CD1-CG1 4.48Å; L912-I914 HydrophobicContact CD2-CD1 4.19Å; L912-I914 HydrophobicContact CD2-CG1 4.41Å; L912-I914 HydrophobicContact CG-CG1 4.25Å
915	N	89.1	Confident	80.9	Confident	8 Å²	8	33.1 Å²	33.1	4%	0.043	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	152.6	178.6	79.1	19.3	0	0	0	112.7	I747 L829 W835 T896	I747-N915 CarbonylContact O-C 3.4Å; I747-N915 VanDerWaalsContact O-CA 3.27Å; I747-N915 WeakPolarHBondContact O-CA 3.48Å; L829-N915 VanDerWaalsContact CD2-ND2 3.25Å; L829-N915 WeakPolarHBondContact CD2-ND2 3.18Å; W835-N915 WeakPolarHBondContact CB-OD1 3.05Å; W835-N915 PolarHBondContact N-O 2.92Å; W835-N915 VanDerWaalsContact N-O 3.13Å; W835-N915 PolarHBondContact N-OD1 3.15Å; W835-N915 VanDerWaalsContact N-OD1 3.13Å; T896-N915 HydrophobicContact CG2-CB 3.62Å; T896-N915 VanDerWaalsContact CG2-CG 3.49Å; T896-N915 WeakPolarHBondContact CG2-ND2 3.42Å
916	A	90.1	Very high	82	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	134.6	169.4	0	0	0	0	0	110.3	I747 F749 M803 L806 P833	I747-A916 PolarHBondContact N-O 3.02Å; I747-A916 PolarHBondContact O-N 3.02Å; F749-A916 HydrophobicContact CE2-CB 4.18Å; M803-A916 HydrophobicContact SD-CB 3.89Å; L806-A916 HydrophobicContact CD1-CB 4.3Å; P833-A916 CarbonylContact O-C 3.6Å; P833-A916 WeakPolarHBondContact O-CA 3.3Å
917	L	88.7	Confident	83	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	138.8	174.5	-169.2	68.5	0	0	0	110	L744 F807 L829 I830 P833	L744-L917 HydrophobicContact CB-CD1 3.88Å; L744-L917 HydrophobicContact CD1-CD2 4.2Å; F807-L917 HydrophobicContact CB-CB 4.16Å; F807-L917 HydrophobicContact CB-CD2 4.21Å; F807-L917 HydrophobicContact CB-CG 4.08Å; F807-L917 VanDerWaalsContact CB-O 3.31Å; F807-L917 WeakPolarHBondContact CB-O 3.39Å; F807-L917 HydrophobicContact CD1-CD2 4.14Å; F807-L917 HydrophobicContact CG-CD2 4.04Å; F807-L917 HydrophobicContact CG-CG 4.39Å; F807-L917 PolarHBondContact N-O 3.39Å; L829-L917 HydrophobicContact CB-CB 4.43Å; L829-L917 HydrophobicContact CB-CD1 4.48Å; L829-L917 HydrophobicContact CB-CD2 4.3Å; I830-L917 HydrophobicContact CG1-CD2 3.89Å; P833-L917 HydrophobicContact CB-CB 4.29Å; P833-L917 PolarHBondContact O-N 3.3Å
918	T	90.2	Very high	83.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	162.9	-179.3	69.5	0	0	0	0	112.3	L745 I747 F805 I920 F933	L745-T918 WeakPolarHBondContact CB-OG1 3.07Å; L745-T918 PolarHBondContact O-N 2.86Å; L745-T918 VanDerWaalsContact O-N 3.12Å; L745-T918 PolarHBondContact O-OG1 2.57Å; I747-T918 HydrophobicContact CD1-CG2 3.43Å; I747-T918 VanDerWaalsContact CD1-CG2 3.43Å; I747-T918 HydrophobicContact CG1-CG2 3.88Å; F805-T918 CarbonylContact O-C 3.57Å; F805-T918 VanDerWaalsContact O-CA 3.22Å; F805-T918 WeakPolarHBondContact O-CA 3.42Å; F805-T918 WeakPolarHBondContact O-CB 3.47Å; T918-I920 PolarHBondContact O-N 3.41Å; T918-F933 HydrophobicContact CG2-CE2 3.76Å; T918-F933 HydrophobicContact CG2-CZ 3.82Å
919	N	87.9	Confident	84.3	Confident	75 Å²	75	25.5 Å²	25.5	40%	0.401	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	8	175.2	71.3	-11.8	0	0	0	114	Y740 F805 F807	Y740-N919 PolarHBondContact OH-O 3.27Å; F805-N919 WeakPolarHBondContact CB-OD1 3.49Å; F805-N919 PolarHBondContact O-N 2.93Å; F805-N919 PolarHBondContact O-OD1 3.34Å; F807-N919 HydrophobicContact CD2-CB 4.48Å
920	I	87.5	Confident	84.5	Confident	18 Å²	18	25.1 Å²	25.1	9%	0.092	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.9	-179.9	-56	-166.6	0	0	0	108.6	L745 F805 T918 F933	L745-I920 HydrophobicContact CD1-CB 4.29Å; L745-I920 HydrophobicContact CD1-CG2 3.98Å; L745-I920 PolarHBondContact N-O 3.45Å; F805-I920 HydrophobicContact CB-CD1 4.46Å; F805-I920 HydrophobicContact CB-CG1 4.48Å; F805-I920 HydrophobicContact CD1-CD1 3.83Å; F805-I920 HydrophobicContact CD1-CG1 4.25Å; F805-I920 HydrophobicContact CE1-CD1 4.21Å; F805-I920 HydrophobicContact CG-CD1 4.15Å; T918-I920 PolarHBondContact O-N 3.41Å; I920-F933 HydrophobicContact CD1-CB 3.5Å; I920-F933 HydrophobicContact CD1-CD1 4.38Å; I920-F933 HydrophobicContact CD1-CD2 3.25Å; I920-F933 HydrophobicContact CD1-CE2 3.9Å; I920-F933 HydrophobicContact CD1-CG 3.5Å; I920-F933 VanDerWaalsContact CD1-CG 3.5Å; I920-F933 HydrophobicContact CG1-CD2 4.14Å; I920-F933 HydrophobicContact CG1-CE2 4.32Å
921	S	83.4	Confident	84.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146.4	169.8	78.6	0	0	0	0	111.1	Y740 N743 I923 S924 S925	Y740-S921 VanDerWaalsContact CD2-OG 3.32Å; Y740-S921 WeakPolarHBondContact CD2-OG 3.07Å; Y740-S921 WeakPolarHBondContact O-CB 3.34Å; N743-S921 VanDerWaalsContact O-CA 3.23Å; N743-S921 WeakPolarHBondContact O-CA 3.3Å; N743-S921 WeakPolarHBondContact O-CB 2.94Å; S921-I923 PolarHBondContact O-N 2.97Å; S921-S924 PolarHBondContact OG-N 3Å; S921-S924 PolarHBondContact OG-OG 3.4Å; S921-S925 VanDerWaalsContact O-CB 3.3Å; S921-S925 WeakPolarHBondContact O-CB 3.43Å; S921-S925 PolarHBondContact O-N 2.86Å; S921-S925 PolarHBondContact O-OG 3.14Å
922	L	78.3	Confident	84.9	Confident	18 Å²	18	31.4 Å²	31.4	9%	0.094	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-28	-179.8	-171.2	66.7	0	0	0	112.8	H707 N743 L745 I930 L962	H707-L922 HydrophobicContact CB-CG 4.32Å; H707-L922 VanDerWaalsContact CD2-CD1 3.48Å; H707-L922 WeakPolarHBondContact CD2-CD1 3.46Å; H707-L922 PolarHBondContact ND1-O 3.26Å; N743-L922 HydrophobicContact CB-CB 4.38Å; N743-L922 PolarHBondContact O-N 3.17Å; L745-L922 HydrophobicContact CD2-CB 4.48Å; L922-I930 HydrophobicContact CD1-CD1 3.74Å; L922-L962 HydrophobicContact CD1-CD2 4.3Å
923	I	73.3	Confident	85	Confident	11 Å²	11	31.4 Å²	31.4	6%	0.056	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-37.9	-172	-68.5	177.3	0	0	0	112.3	Y708 I728 N729 H739 N743 S921	Y708-I923 HydrophobicContact CE2-CD1 4.36Å; Y708-I923 HydrophobicContact CE2-CG1 4.01Å; Y708-I923 HydrophobicContact CE2-CG2 4.2Å; Y708-I923 WeakPolarHBondContact OH-CD1 3.28Å; Y708-I923 WeakPolarHBondContact OH-CG1 3.34Å; I728-I923 HydrophobicContact CG2-CG2 4.34Å; N729-I923 WeakPolarHBondContact OD1-CG2 3.37Å; H739-I923 HydrophobicContact CB-CD1 3.59Å; N743-I923 HydrophobicContact CB-CD1 4.01Å; N743-I923 HydrophobicContact CB-CG1 4.17Å; N743-I923 WeakPolarHBondContact ND2-CD1 3.42Å; S921-I923 PolarHBondContact O-N 2.97Å
924	S	74.7	Confident	85	Confident	77 Å²	77	32.2 Å²	32.2	54%	0.538	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-19.1	-178.1	71	0	0	0	0	113.6	S921	S921-S924 PolarHBondContact OG-N 3Å; S921-S924 PolarHBondContact OG-OG 3.4Å
925	S	78.1	Confident	85	Confident	9 Å²	9	36.3 Å²	36.3	6%	0.063	19%	0.185	C	C	.	.	S	Bend	trans	-91.5	142.1	-175.8	61.3	0	0	0	0	112.9	S921 I930	S921-S925 VanDerWaalsContact O-CB 3.3Å; S921-S925 WeakPolarHBondContact O-CB 3.43Å; S921-S925 PolarHBondContact O-N 2.86Å; S921-S925 PolarHBondContact O-OG 3.14Å; S925-I930 WeakPolarHBondContact OG-CD1 3.3Å; S925-I930 VanDerWaalsContact OG-CG1 3.22Å; S925-I930 WeakPolarHBondContact OG-CG1 3.26Å
926	S	79.2	Confident	85.2	Confident	35 Å²	35	40.9 Å²	40.9	25%	0.245	21%	0.205	C	C	.	.			trans	-78.4	161.2	173.6	73.8	0	0	0	0	111.4	Y928 D929 I930	S926-Y928 PolarHBondContact O-N 2.89Å; S926-D929 WeakPolarHBondContact CB-OD2 3.19Å; S926-D929 PolarHBondContact N-OD2 2.75Å; S926-D929 PolarHBondContact O-N 2.96Å; S926-D929 PolarHBondContact OG-N 3.2Å; S926-D929 PolarHBondContact OG-OD2 3.18Å; S926-I930 PolarHBondContact O-N 3.18Å; S926-I930 VanDerWaalsContact O-N 3.14Å
927	H	78.6	Confident	85.3	Confident	18 Å²	18	40.9 Å²	40.9	8%	0.083	21%	0.205	C	C	.	.	H	α-helix	trans	-50.5	-41.7	174.1	-177.1	-72.9	0	0	0	112.3	I703 I930 E931 F965	I703-H927 HydrophobicContact CG2-CB 4.4Å; H927-I930 PolarHBondContact O-N 2.92Å; H927-E931 IonicContact CE1-OE2 3.49Å; H927-E931 IonicContact ND1-OE2 2.62Å; H927-E931 WeakPolarHBondContact O-CB 3.37Å; H927-E931 PolarHBondContact O-N 2.92Å; H927-F965 HydrophobicContact CB-CE2 4.31Å; H927-F965 AromaticContact CD2-CD2 3.83Å; H927-F965 AromaticContact CD2-CE2 3.33Å; H927-F965 WeakPolarHBondContact CD2-CE2 2.91Å; H927-F965 AromaticContact CE1-CE2 3.83Å; H927-F965 AromaticContact CE1-CZ 4Å; H927-F965 AromaticContact CG-CE2 3.62Å; H927-F965 AromaticContact ND1-CE2 3.92Å; H927-F965 AromaticContact NE2-CE2 3.49Å; H927-F965 WeakPolarHBondContact NE2-CE2 3.43Å; H927-F965 AromaticContact NE2-CZ 3.92Å
928	Y	83.1	Confident	85.5	Confident	152 Å²	152	42.7 Å²	42.7	60%	0.596	22%	0.216	S	C	*	.	H	α-helix	trans	-66.4	-37.1	178.9	177.8	-102.9	0	0	0	112.8	S926 K932	S926-Y928 PolarHBondContact O-N 2.89Å; Y928-K932 HydrophobicContact CE1-CD 4.28Å; Y928-K932 WeakPolarHBondContact O-CB 3.31Å; Y928-K932 PolarHBondContact O-N 3.32Å
929	D	85.9	Confident	85.6	Confident	72 Å²	72	47.6 Å²	47.6	39%	0.385	24%	0.241	S	C	.	.	H	α-helix	trans	-67.1	-42	178.8	-62.2	-45.7	0	0	0	111.3	S926 F933	S926-D929 WeakPolarHBondContact CB-OD2 3.19Å; S926-D929 PolarHBondContact N-OD2 2.75Å; S926-D929 PolarHBondContact O-N 2.96Å; S926-D929 PolarHBondContact OG-N 3.2Å; S926-D929 PolarHBondContact OG-OD2 3.18Å; D929-F933 WeakPolarHBondContact O-CB 3.29Å; D929-F933 PolarHBondContact O-N 3.14Å
930	I	86.6	Confident	85.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-44.1	176.2	-60.6	-172.2	0	0	0	111.1	H707 L922 S925 S926 H927 K932 F933 M934 L962 F965	H707-I930 WeakPolarHBondContact CE1-CD1 3.19Å; L922-I930 HydrophobicContact CD1-CD1 3.74Å; S925-I930 WeakPolarHBondContact OG-CD1 3.3Å; S925-I930 VanDerWaalsContact OG-CG1 3.22Å; S925-I930 WeakPolarHBondContact OG-CG1 3.26Å; S926-I930 PolarHBondContact O-N 3.18Å; S926-I930 VanDerWaalsContact O-N 3.14Å; H927-I930 PolarHBondContact O-N 2.92Å; I930-K932 PolarHBondContact O-N 2.68Å; I930-F933 WeakPolarHBondContact O-CB 3.41Å; I930-F933 PolarHBondContact O-N 3.43Å; I930-M934 HydrophobicContact CG2-CG 4.31Å; I930-M934 WeakPolarHBondContact O-CB 3.15Å; I930-M934 WeakPolarHBondContact O-CG 3.39Å; I930-M934 PolarHBondContact O-N 3.37Å; I930-L962 HydrophobicContact CD1-CD2 4.3Å; I930-L962 HydrophobicContact CG2-CD1 4.43Å; I930-L962 HydrophobicContact CG2-CD2 3.62Å; I930-F965 HydrophobicContact CB-CD2 4.26Å; I930-F965 HydrophobicContact CB-CE2 3.9Å; I930-F965 HydrophobicContact CB-CZ 4.11Å; I930-F965 HydrophobicContact CD1-CD2 4.31Å; I930-F965 HydrophobicContact CG2-CD1 3.94Å; I930-F965 HydrophobicContact CG2-CD2 4.03Å; I930-F965 HydrophobicContact CG2-CE1 3.83Å; I930-F965 HydrophobicContact CG2-CE2 3.89Å; I930-F965 HydrophobicContact CG2-CG 4.03Å; I930-F965 HydrophobicContact CG2-CZ 3.8Å
931	E	87.1	Confident	86.2	Confident	76 Å²	76	45.5 Å²	45.5	36%	0.355	23%	0.226	S	C	.	.	H	α-helix	trans	-61.5	-46.3	177.5	-171.7	-175.2	167.4	0	0	111.3	H927 F933 M934 N935 F965	H927-E931 IonicContact CE1-OE2 3.49Å; H927-E931 IonicContact ND1-OE2 2.62Å; H927-E931 WeakPolarHBondContact O-CB 3.37Å; H927-E931 PolarHBondContact O-N 2.92Å; E931-F933 VanDerWaalsContact C-N 3.3Å; E931-F933 PolarHBondContact O-N 3.14Å; E931-M934 PolarHBondContact O-N 3.23Å; E931-N935 WeakPolarHBondContact O-CB 3.39Å; E931-N935 PolarHBondContact O-N 2.81Å; E931-N935 PolarHBondContact O-ND2 3.31Å; E931-F965 HydrophobicContact CB-CZ 4.2Å
932	K	90.2	Very high	86.6	Confident	88 Å²	88	49.2 Å²	49.2	38%	0.383	25%	0.246	S	C	.	.	H	α-helix	trans	-61.1	-40.1	176.1	-178.3	179.1	179	-177.2	0	111.8	Y928 I930 K936	Y928-K932 HydrophobicContact CE1-CD 4.28Å; Y928-K932 WeakPolarHBondContact O-CB 3.31Å; Y928-K932 PolarHBondContact O-N 3.32Å; I930-K932 PolarHBondContact O-N 2.68Å; K932-K936 HydrophobicContact CG-CD 4.37Å; K932-K936 WeakPolarHBondContact O-CB 3.43Å; K932-K936 VanDerWaalsContact O-CG 3.28Å; K932-K936 WeakPolarHBondContact O-CG 3.38Å; K932-K936 PolarHBondContact O-N 3.08Å
933	F	91.1	Very high	87.3	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-53.2	174.6	157.4	-99.6	0	0	0	111.7	L745 I747 F805 T918 I920 D929 I930 E931 N935 K936 I937	L745-F933 HydrophobicContact CB-CZ 4.47Å; L745-F933 HydrophobicContact CD1-CD1 4.3Å; L745-F933 HydrophobicContact CD1-CE1 3.68Å; L745-F933 HydrophobicContact CD1-CZ 4.07Å; I747-F933 HydrophobicContact CD1-CE1 4.49Å; I747-F933 HydrophobicContact CD1-CE2 4.16Å; I747-F933 HydrophobicContact CD1-CZ 3.64Å; I747-F933 HydrophobicContact CG1-CZ 4.31Å; F805-F933 HydrophobicContact CB-CD2 3.92Å; F805-F933 HydrophobicContact CB-CE2 3.97Å; F805-F933 AromaticContact CD2-CD2 3.63Å; F805-F933 HydrophobicContact CD2-CD2 3.63Å; F805-F933 HydrophobicContact CD2-CE2 4.39Å; F805-F933 HydrophobicContact CE2-CB 4.44Å; F805-F933 HydrophobicContact CE2-CD2 4.23Å; F805-F933 AromaticContact CG-CD2 3.79Å; F805-F933 HydrophobicContact CG-CD2 3.79Å; F805-F933 HydrophobicContact CG-CE2 4.35Å; T918-F933 HydrophobicContact CG2-CE2 3.76Å; T918-F933 HydrophobicContact CG2-CZ 3.82Å; I920-F933 HydrophobicContact CD1-CB 3.5Å; I920-F933 HydrophobicContact CD1-CD1 4.38Å; I920-F933 HydrophobicContact CD1-CD2 3.25Å; I920-F933 HydrophobicContact CD1-CE2 3.9Å; I920-F933 HydrophobicContact CD1-CG 3.5Å; I920-F933 VanDerWaalsContact CD1-CG 3.5Å; I920-F933 HydrophobicContact CG1-CD2 4.14Å; I920-F933 HydrophobicContact CG1-CE2 4.32Å; D929-F933 WeakPolarHBondContact O-CB 3.29Å; D929-F933 PolarHBondContact O-N 3.14Å; I930-F933 WeakPolarHBondContact O-CB 3.41Å; I930-F933 PolarHBondContact O-N 3.43Å; E931-F933 VanDerWaalsContact C-N 3.3Å; E931-F933 PolarHBondContact O-N 3.14Å; F933-N935 VanDerWaalsContact C-N 3.35Å; F933-N935 PolarHBondContact O-N 3Å; F933-K936 PolarHBondContact O-N 3.28Å; F933-I937 HydrophobicContact CD1-CD1 4.47Å; F933-I937 HydrophobicContact CD2-CD1 3.32Å; F933-I937 HydrophobicContact CD2-CG1 4.27Å; F933-I937 HydrophobicContact CE1-CD1 4.2Å; F933-I937 HydrophobicContact CE2-CD1 3.03Å; F933-I937 HydrophobicContact CE2-CG1 4.35Å; F933-I937 HydrophobicContact CG-CD1 4.09Å; F933-I937 HydrophobicContact CZ-CD1 3.53Å; F933-I937 WeakPolarHBondContact O-CB 3.33Å; F933-I937 WeakPolarHBondContact O-CG1 3.46Å; F933-I937 PolarHBondContact O-N 3.06Å
934	M	90.3	Very high	88.2	Confident	19 Å²	19	53.8 Å²	53.8	9%	0.094	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-42.5	-179.1	-75.1	-54.9	-70.6	0	0	111.8	I930 E931 T938 L957 V959 L962	I930-M934 HydrophobicContact CG2-CG 4.31Å; I930-M934 WeakPolarHBondContact O-CB 3.15Å; I930-M934 WeakPolarHBondContact O-CG 3.39Å; I930-M934 PolarHBondContact O-N 3.37Å; E931-M934 PolarHBondContact O-N 3.23Å; M934-T938 WeakPolarHBondContact O-CB 3.34Å; M934-T938 PolarHBondContact O-N 3.18Å; M934-T938 PolarHBondContact O-OG1 3.5Å; M934-L957 HydrophobicContact CE-CD2 3.86Å; M934-V959 HydrophobicContact CE-CG2 4.28Å; M934-V959 HydrophobicContact SD-CG2 4.14Å; M934-L962 HydrophobicContact CE-CD1 3.97Å; M934-L962 HydrophobicContact CG-CD1 3.81Å; M934-L962 HydrophobicContact SD-CD1 3.46Å; M934-L962 WeakPolarHBondContact SD-CD1 3.49Å
935	N	91.8	Very high	89	Confident	86 Å²	86	51.2 Å²	51.2	46%	0.46	25%	0.251	S	S	.	.	H	α-helix	trans	-62.9	-47.7	176.8	-75.6	-21.4	0	0	0	111.5	E931 F933 I937 T938 I939	E931-N935 WeakPolarHBondContact O-CB 3.39Å; E931-N935 PolarHBondContact O-N 2.81Å; E931-N935 PolarHBondContact O-ND2 3.31Å; F933-N935 VanDerWaalsContact C-N 3.35Å; F933-N935 PolarHBondContact O-N 3Å; N935-I937 PolarHBondContact O-N 3.19Å; N935-T938 PolarHBondContact O-N 3.01Å; N935-I939 WeakPolarHBondContact O-CB 3.32Å; N935-I939 WeakPolarHBondContact O-CD1 3.42Å; N935-I939 WeakPolarHBondContact O-CG1 3.3Å; N935-I939 PolarHBondContact O-N 2.98Å
936	K	93.4	Very high	89.6	Confident	105 Å²	105	57.4 Å²	57.4	46%	0.457	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-43.7	178.8	-78.9	-178.6	174.5	-164	0	112.7	F805 K932 F933 W940	F805-K936 HydrophobicContact CE2-CB 4.23Å; F805-K936 HydrophobicContact CE2-CD 3.85Å; F805-K936 HydrophobicContact CZ-CD 4.02Å; K932-K936 HydrophobicContact CG-CD 4.37Å; K932-K936 WeakPolarHBondContact O-CB 3.43Å; K932-K936 VanDerWaalsContact O-CG 3.28Å; K932-K936 WeakPolarHBondContact O-CG 3.38Å; K932-K936 PolarHBondContact O-N 3.08Å; F933-K936 PolarHBondContact O-N 3.28Å; K936-W940 WeakPolarHBondContact O-CB 3.43Å; K936-W940 PolarHBondContact O-N 2.73Å
937	I	92.7	Very high	90.1	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-70.2	-41.5	-179.4	-70.7	177.5	0	0	0	111.1	I747 M803 P804 F805 F933 N935 I939 W940 F941 L957	I747-I937 HydrophobicContact CD1-CD1 3.5Å; I747-I937 HydrophobicContact CD1-CG2 4.25Å; M803-I937 HydrophobicContact CE-CD1 3.86Å; M803-I937 HydrophobicContact CE-CG1 4.4Å; M803-I937 HydrophobicContact CE-CG2 4.13Å; P804-I937 HydrophobicContact CG-CG1 4Å; F805-I937 HydrophobicContact CD2-CD1 4.34Å; F805-I937 HydrophobicContact CD2-CG1 4.4Å; F933-I937 HydrophobicContact CD1-CD1 4.47Å; F933-I937 HydrophobicContact CD2-CD1 3.32Å; F933-I937 HydrophobicContact CD2-CG1 4.27Å; F933-I937 HydrophobicContact CE1-CD1 4.2Å; F933-I937 HydrophobicContact CE2-CD1 3.03Å; F933-I937 HydrophobicContact CE2-CG1 4.35Å; F933-I937 HydrophobicContact CG-CD1 4.09Å; F933-I937 HydrophobicContact CZ-CD1 3.53Å; F933-I937 WeakPolarHBondContact O-CB 3.33Å; F933-I937 WeakPolarHBondContact O-CG1 3.46Å; F933-I937 PolarHBondContact O-N 3.06Å; N935-I937 PolarHBondContact O-N 3.19Å; I937-I939 VanDerWaalsContact C-N 3.35Å; I937-I939 PolarHBondContact O-N 3.41Å; I937-W940 PolarHBondContact O-N 3.02Å; I937-F941 WeakPolarHBondContact O-CB 3.29Å; I937-F941 PolarHBondContact O-N 3.12Å; I937-L957 HydrophobicContact CG2-CD1 3.41Å; I937-L957 VanDerWaalsContact CG2-CD1 3.41Å
938	T	91.9	Very high	90.5	Very high	37 Å²	37	58.9 Å²	58.9	23%	0.227	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-43.2	177.9	-58.6	0	0	0	0	111.1	M934 N935 F941 N942	M934-T938 WeakPolarHBondContact O-CB 3.34Å; M934-T938 PolarHBondContact O-N 3.18Å; M934-T938 PolarHBondContact O-OG1 3.5Å; N935-T938 PolarHBondContact O-N 3.01Å; T938-F941 PolarHBondContact O-N 3.08Å; T938-N942 VanDerWaalsContact O-CB 3.31Å; T938-N942 WeakPolarHBondContact O-CB 3.46Å; T938-N942 PolarHBondContact O-N 3.49Å; T938-N942 PolarHBondContact O-ND2 3.29Å
939	I	93.5	Very high	90.7	Very high	104 Å²	104	53.1 Å²	53.1	53%	0.533	27%	0.274	S	S	.	.	H	α-helix	trans	-62.1	-46.3	175.3	-68.1	165	0	0	0	110.8	N935 I937 N942 N943	N935-I939 WeakPolarHBondContact O-CB 3.32Å; N935-I939 WeakPolarHBondContact O-CD1 3.42Å; N935-I939 WeakPolarHBondContact O-CG1 3.3Å; N935-I939 PolarHBondContact O-N 2.98Å; I937-I939 VanDerWaalsContact C-N 3.35Å; I937-I939 PolarHBondContact O-N 3.41Å; I939-N942 PolarHBondContact O-N 3.48Å; I939-N943 WeakPolarHBondContact O-CB 3.49Å; I939-N943 VanDerWaalsContact O-CG 3.22Å; I939-N943 PolarHBondContact O-N 2.84Å; I939-N943 PolarHBondContact O-ND2 2.94Å
940	W	94.1	Very high	90.3	Very high	44 Å²	44	56 Å²	56	17%	0.167	29%	0.289	C	S	.	.	H	α-helix	trans	-59.9	-47	177.6	169.8	83.7	0	0	0	112.2	F749 L800 M803 P804 K936 I937 N943 L944	F749-W940 AromaticContact CE1-CZ3 3.95Å; F749-W940 HydrophobicContact CE1-CZ3 3.95Å; F749-W940 HydrophobicContact CZ-CH2 4.49Å; F749-W940 AromaticContact CZ-CZ3 3.84Å; F749-W940 HydrophobicContact CZ-CZ3 3.84Å; L800-W940 HydrophobicContact CD2-CH2 3.9Å; M803-W940 HydrophobicContact CB-CH2 4.1Å; M803-W940 HydrophobicContact CB-CZ2 4.09Å; M803-W940 HydrophobicContact CG-CE3 4.45Å; M803-W940 HydrophobicContact CG-CH2 4.1Å; M803-W940 HydrophobicContact CG-CZ2 4.43Å; M803-W940 HydrophobicContact CG-CZ3 4.09Å; M803-W940 HydrophobicContact SD-CZ3 4.46Å; P804-W940 HydrophobicContact CG-CB 4.48Å; P804-W940 HydrophobicContact CG-CG 4.44Å; K936-W940 WeakPolarHBondContact O-CB 3.43Å; K936-W940 PolarHBondContact O-N 2.73Å; I937-W940 PolarHBondContact O-N 3.02Å; W940-N943 PolarHBondContact O-N 2.78Å; W940-L944 HydrophobicContact CD2-CD1 4Å; W940-L944 HydrophobicContact CE3-CD1 4.38Å; W940-L944 HydrophobicContact CH2-CD1 3.65Å; W940-L944 HydrophobicContact CZ2-CD1 3.23Å; W940-L944 HydrophobicContact CZ3-CD1 4.22Å; W940-L944 PolarHBondContact O-N 2.88Å
941	F	93.4	Very high	89.9	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.018	30%	0.304	C	S	.	.	H	α-helix	trans	-65.9	-44	-179.8	-179.5	-111.6	0	0	0	111.9	F749 W751 F796 I937 T938 N943 L944 L945 L957	F749-F941 AromaticContact CD1-CD2 3.5Å; F749-F941 HydrophobicContact CD1-CD2 3.5Å; F749-F941 AromaticContact CD1-CE2 3.41Å; F749-F941 HydrophobicContact CD1-CE2 3.41Å; F749-F941 VanDerWaalsContact CD1-CE2 3.41Å; F749-F941 HydrophobicContact CD1-CG 4.21Å; F749-F941 HydrophobicContact CD1-CZ 4.05Å; F749-F941 HydrophobicContact CE1-CB 4.45Å; F749-F941 AromaticContact CE1-CD2 3.52Å; F749-F941 HydrophobicContact CE1-CD2 3.52Å; F749-F941 AromaticContact CE1-CE2 3.96Å; F749-F941 HydrophobicContact CE1-CE2 3.96Å; F749-F941 HydrophobicContact CE1-CG 4.07Å; F749-F941 HydrophobicContact CG-CE2 4.36Å; W751-F941 HydrophobicContact CH2-CE2 4.33Å; W751-F941 HydrophobicContact CZ2-CE2 4.09Å; W751-F941 HydrophobicContact CZ2-CZ 4.16Å; F796-F941 HydrophobicContact CE2-CD2 4.04Å; F796-F941 AromaticContact CE2-CE2 3.86Å; F796-F941 HydrophobicContact CE2-CE2 3.86Å; F796-F941 HydrophobicContact CZ-CD2 4.4Å; F796-F941 HydrophobicContact CZ-CE2 4.06Å; I937-F941 WeakPolarHBondContact O-CB 3.29Å; I937-F941 PolarHBondContact O-N 3.12Å; T938-F941 PolarHBondContact O-N 3.08Å; F941-N943 VanDerWaalsContact C-N 3.34Å; F941-N943 PolarHBondContact O-N 3.31Å; F941-L944 PolarHBondContact O-N 3.49Å; F941-L944 VanDerWaalsContact O-N 3.16Å; F941-L945 HydrophobicContact CD1-CD1 4.4Å; F941-L945 HydrophobicContact CE1-CD1 3.61Å; F941-L945 HydrophobicContact CZ-CD1 3.8Å; F941-L945 VanDerWaalsContact O-CB 3.28Å; F941-L945 WeakPolarHBondContact O-CB 3.37Å; F941-L945 PolarHBondContact O-N 2.8Å; F941-L957 HydrophobicContact CD1-CB 4.48Å
942	N	91.9	Very high	89.7	Confident	78 Å²	78	55.3 Å²	55.3	42%	0.417	29%	0.288	S	S	.	.	H	α-helix	trans	-61.4	-41.7	177.5	-72.7	-15	0	0	0	111.6	T938 I939 L944 L945 L946	T938-N942 VanDerWaalsContact O-CB 3.31Å; T938-N942 WeakPolarHBondContact O-CB 3.46Å; T938-N942 PolarHBondContact O-N 3.49Å; T938-N942 PolarHBondContact O-ND2 3.29Å; I939-N942 PolarHBondContact O-N 3.48Å; N942-L944 VanDerWaalsContact C-N 3.3Å; N942-L944 PolarHBondContact O-N 2.97Å; N942-L945 PolarHBondContact O-N 3.36Å; N942-L946 WeakPolarHBondContact O-CG 3.4Å; N942-L946 PolarHBondContact O-N 2.86Å
943	N	92.8	Very high	89.5	Confident	98 Å²	98	53.6 Å²	53.6	52%	0.524	28%	0.283	S	S	.	.	H	α-helix	trans	-61.7	-37.4	176	-72.5	-15.7	0	0	0	112.5	I939 W940 F941	I939-N943 WeakPolarHBondContact O-CB 3.49Å; I939-N943 VanDerWaalsContact O-CG 3.22Å; I939-N943 PolarHBondContact O-N 2.84Å; I939-N943 PolarHBondContact O-ND2 2.94Å; W940-N943 PolarHBondContact O-N 2.78Å; F941-N943 VanDerWaalsContact C-N 3.34Å; F941-N943 PolarHBondContact O-N 3.31Å
944	L	91.8	Very high	89.2	Confident	28 Å²	28	56.6 Å²	56.6	15%	0.147	30%	0.297	C	S	.	.	H	α-helix	trans	-71.3	-40.4	174.5	-74	175	0	0	0	112.1	F796 E799 W940 F941 N942 L946 T947	F796-L944 HydrophobicContact CD2-CD1 4.47Å; F796-L944 HydrophobicContact CE2-CD1 4.46Å; E799-L944 HydrophobicContact CB-CD1 4.22Å; E799-L944 HydrophobicContact CB-CD2 4.28Å; E799-L944 HydrophobicContact CG-CD2 4.15Å; W940-L944 HydrophobicContact CD2-CD1 4Å; W940-L944 HydrophobicContact CE3-CD1 4.38Å; W940-L944 HydrophobicContact CH2-CD1 3.65Å; W940-L944 HydrophobicContact CZ2-CD1 3.23Å; W940-L944 HydrophobicContact CZ3-CD1 4.22Å; W940-L944 PolarHBondContact O-N 2.88Å; F941-L944 PolarHBondContact O-N 3.49Å; F941-L944 VanDerWaalsContact O-N 3.16Å; N942-L944 VanDerWaalsContact C-N 3.3Å; N942-L944 PolarHBondContact O-N 2.97Å; L944-L946 VanDerWaalsContact C-N 3.29Å; L944-L946 PolarHBondContact O-N 2.89Å; L944-T947 WeakPolarHBondContact O-CB 3.48Å; L944-T947 PolarHBondContact O-N 3.47Å; L944-T947 PolarHBondContact O-OG1 3Å
945	L	91.2	Very high	89.1	Confident	22 Å²	22	56.2 Å²	56.2	12%	0.115	30%	0.297	C	S	.	.	H	α-helix	trans	-67.4	-27.7	-178.6	-178	151.8	0	0	0	112.6	F941 N942 T947 A948 N953 G955	F941-L945 HydrophobicContact CD1-CD1 4.4Å; F941-L945 HydrophobicContact CE1-CD1 3.61Å; F941-L945 HydrophobicContact CZ-CD1 3.8Å; F941-L945 VanDerWaalsContact O-CB 3.28Å; F941-L945 WeakPolarHBondContact O-CB 3.37Å; F941-L945 PolarHBondContact O-N 2.8Å; N942-L945 PolarHBondContact O-N 3.36Å; L945-T947 PolarHBondContact O-N 3.41Å; L945-A948 WeakPolarHBondContact O-CB 2.68Å; L945-A948 PolarHBondContact O-N 2.9Å; L945-N953 HydrophobicContact CD2-CB 4.46Å; L945-N953 WeakPolarHBondContact CD2-O 3.26Å; L945-G955 WeakPolarHBondContact CD1-O 3.37Å
946	L	90.2	Very high	89.1	Confident	140 Å²	140	52.6 Å²	52.6	73%	0.733	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.2	168.5	-70.8	174	0	0	0	113.5	N942 L944	N942-L946 WeakPolarHBondContact O-CG 3.4Å; N942-L946 PolarHBondContact O-N 2.86Å; L944-L946 VanDerWaalsContact C-N 3.29Å; L944-L946 PolarHBondContact O-N 2.89Å
947	T	90.7	Very high	89	Confident	71 Å²	71	47.8 Å²	47.8	44%	0.436	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-2.4	176	73.4	0	0	0	0	113.5	W792 L944 L945	W792-T947 VanDerWaalsContact CD1-O 3.32Å; W792-T947 PolarHBondContact NE1-O 2.92Å; W792-T947 PolarHBondContact NE1-OG1 3.49Å; L944-T947 WeakPolarHBondContact O-CB 3.48Å; L944-T947 PolarHBondContact O-N 3.47Å; L944-T947 PolarHBondContact O-OG1 3Å; L945-T947 PolarHBondContact O-N 3.41Å
948	A	87.6	Confident	89	Confident	12 Å²	12	47.9 Å²	47.9	10%	0.099	26%	0.257	C	S	.	.	S	Bend	trans	-70.7	147.1	-179	0	0	0	0	0	111.4	W792 L945 L952	W792-A948 HydrophobicContact CD2-CB 4.16Å; W792-A948 HydrophobicContact CH2-CB 4.04Å; W792-A948 HydrophobicContact CZ2-CB 3.56Å; W792-A948 VanDerWaalsContact NE1-CA 3.34Å; L945-A948 WeakPolarHBondContact O-CB 2.68Å; L945-A948 PolarHBondContact O-N 2.9Å; A948-L952 HydrophobicContact CB-CB 4.12Å
949	P	86.8	Confident	88.9	Confident	31 Å²	31	46.6 Å²	46.6	20%	0.201	25%	0.25	C	C	.	.			trans	-59.4	155.8	167.7	27.2	-33.7	0	0	0	109.9	L951 L952 N953	P949-L951 PolarHBondContact O-N 3.45Å; P949-L952 HydrophobicContact CG-CB 4.2Å; P949-L952 HydrophobicContact CG-CD1 4.14Å; P949-L952 HydrophobicContact CG-CG 4.3Å; P949-L952 PolarHBondContact O-N 2.64Å; P949-N953 PolarHBondContact O-N 2.91Å
950	N	77	Confident	88.3	Confident	132 Å²	132	43.5 Å²	43.5	71%	0.706	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-17	-177.2	-69.8	-3	0	0	0	114.5	N953	N950-N953 PolarHBondContact O-OD1 3.14Å; N950-N953 VanDerWaalsContact O-OD1 3.08Å
951	L	77.6	Confident	87.7	Confident	61 Å²	61	43.5 Å²	43.5	32%	0.319	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-18.3	177.1	-59.6	107	0	0	0	114.5	M781 N783 P949	M781-L951 WeakPolarHBondContact O-CA 3.43Å; M781-L951 WeakPolarHBondContact O-CB 3.37Å; N783-L951 HydrophobicContact CB-CD2 4.11Å; P949-L951 PolarHBondContact O-N 3.45Å
952	L	84.1	Confident	87.3	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	3.6	-175.2	-70.1	179.5	0	0	0	113.9	W751 F784 W792 L793 A948 P949 H954	W751-L952 HydrophobicContact CG-CD2 4.41Å; W751-L952 PolarHBondContact NE1-O 2.84Å; W751-L952 VanDerWaalsContact NE1-O 3.13Å; F784-L952 HydrophobicContact CD1-CD2 3.78Å; F784-L952 HydrophobicContact CE1-CD2 3.65Å; W792-L952 HydrophobicContact CD2-CD1 4.5Å; W792-L952 HydrophobicContact CE3-CB 4.43Å; W792-L952 HydrophobicContact CE3-CD1 3.66Å; W792-L952 HydrophobicContact CZ3-CB 4.4Å; W792-L952 HydrophobicContact CZ3-CD1 4.15Å; L793-L952 HydrophobicContact CD2-CD1 4.49Å; L793-L952 HydrophobicContact CG-CD1 4.2Å; A948-L952 HydrophobicContact CB-CB 4.12Å; P949-L952 HydrophobicContact CG-CB 4.2Å; P949-L952 HydrophobicContact CG-CD1 4.14Å; P949-L952 HydrophobicContact CG-CG 4.3Å; P949-L952 PolarHBondContact O-N 2.64Å; L952-H954 PolarHBondContact O-N 3.47Å; L952-H954 VanDerWaalsContact O-N 3.15Å
953	N	84.7	Confident	86.6	Confident	53 Å²	53	44 Å²	44	28%	0.283	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	1.5	178.7	67.7	-11.1	0	0	0	114.1	L945 P949 N950	L945-N953 HydrophobicContact CD2-CB 4.46Å; L945-N953 WeakPolarHBondContact CD2-O 3.26Å; P949-N953 PolarHBondContact O-N 2.91Å; N950-N953 PolarHBondContact O-OD1 3.14Å; N950-N953 VanDerWaalsContact O-OD1 3.08Å
954	H	85.5	Confident	85.6	Confident	63 Å²	63	44.9 Å²	44.9	29%	0.292	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	13.9	-177.3	-64	-47.4	0	0	0	113.9	Y777 L952	Y777-H954 HydrophobicContact CD2-CB 4.4Å; Y777-H954 HydrophobicContact CE1-CB 4.47Å; Y777-H954 HydrophobicContact CE2-CB 3.7Å; Y777-H954 AromaticContact CZ-CG 3.85Å; L952-H954 PolarHBondContact O-N 3.47Å; L952-H954 VanDerWaalsContact O-N 3.15Å
955	G	88.3	Confident	85.1	Confident	10 Å²	10	43.9 Å²	43.9	10%	0.103	23%	0.229	C	C	.	.			trans	-63.5	149.7	174.1	0	0	0	0	0	112.6	I750 W751 L945	I750-G955 CarbonylContact O-C 3.53Å; I750-G955 WeakPolarHBondContact O-CA 3.34Å; W751-G955 VanDerWaalsContact CD1-CA 3.4Å; L945-G955 WeakPolarHBondContact CD1-O 3.37Å
956	F	91.9	Very high	84.8	Confident	11 Å²	11	43.2 Å²	43.2	5%	0.048	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	161	175.1	62	-91	0	0	0	111.7	R72 I750 P753 V958	R72-F956 HydrophobicContact CB-CD2 3.67Å; R72-F956 HydrophobicContact CB-CE2 3.74Å; R72-F956 HydrophobicContact CG-CB 4.41Å; R72-F956 HydrophobicContact CG-CD2 3.55Å; R72-F956 HydrophobicContact CG-CE2 4.02Å; R72-F956 HydrophobicContact CG-CG 4.11Å; I750-F956 HydrophobicContact CB-CE1 4.49Å; I750-F956 HydrophobicContact CB-CE2 4.16Å; I750-F956 HydrophobicContact CB-CZ 4.14Å; I750-F956 HydrophobicContact CD1-CD2 4.43Å; I750-F956 HydrophobicContact CD1-CE2 3.81Å; I750-F956 HydrophobicContact CD1-CZ 4.35Å; I750-F956 HydrophobicContact CG2-CE1 4.26Å; I750-F956 HydrophobicContact CG2-CE2 4.41Å; I750-F956 HydrophobicContact CG2-CZ 3.93Å; I750-F956 PolarHBondContact N-O 2.83Å; I750-F956 PolarHBondContact O-N 3.07Å; P753-F956 HydrophobicContact CG-CE1 3.93Å; P753-F956 HydrophobicContact CG-CZ 3.86Å; P753-F956 WeakPolarHBondContact O-CE1 3.2Å; F956-V958 HydrophobicContact CD2-CG2 3.71Å; F956-V958 HydrophobicContact CE2-CG2 3.51Å
957	L	92.5	Very high	84.4	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.016	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	134.2	-178.7	-178.8	149.3	0	0	0	110.4	R72 I747 F749 M934 I937 F941 V959	R72-L957 WeakPolarHBondContact CD-O 3.35Å; I747-L957 HydrophobicContact CG2-CD1 3.49Å; I747-L957 VanDerWaalsContact CG2-CD1 3.49Å; I747-L957 HydrophobicContact CG2-CD2 4.27Å; I747-L957 HydrophobicContact CG2-CG 3.67Å; F749-L957 HydrophobicContact CD1-CD1 4.19Å; F749-L957 HydrophobicContact CE1-CD1 3.65Å; F749-L957 HydrophobicContact CE1-CG 4.48Å; F749-L957 HydrophobicContact CZ-CD1 4.22Å; M934-L957 HydrophobicContact CE-CD2 3.86Å; I937-L957 HydrophobicContact CG2-CD1 3.41Å; I937-L957 VanDerWaalsContact CG2-CD1 3.41Å; F941-L957 HydrophobicContact CD1-CB 4.48Å; L957-V959 HydrophobicContact CD2-CG2 3.79Å
958	V	91.3	Very high	84	Confident	3 Å²	3	34 Å²	34	2%	0.018	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	137.3	175.9	172.5	0	0	0	0	110.2	R72 T73 F76 N748 I750 F956	R72-V958 HydrophobicContact CB-CG2 3.64Å; R72-V958 WeakPolarHBondContact O-CG2 3.15Å; T73-V958 HydrophobicContact CG2-CG1 4.03Å; F76-V958 HydrophobicContact CB-CG1 4.11Å; F76-V958 HydrophobicContact CB-CG2 4.14Å; F76-V958 HydrophobicContact CD1-CG1 3.9Å; F76-V958 HydrophobicContact CG-CG1 4.07Å; N748-V958 HydrophobicContact CB-CB 4.46Å; N748-V958 PolarHBondContact N-O 2.96Å; N748-V958 PolarHBondContact O-N 2.82Å; I750-V958 HydrophobicContact CD1-CB 3.65Å; I750-V958 HydrophobicContact CD1-CG1 4.49Å; I750-V958 HydrophobicContact CD1-CG2 3.44Å; I750-V958 VanDerWaalsContact CD1-CG2 3.44Å; F956-V958 HydrophobicContact CD2-CG2 3.71Å; F956-V958 HydrophobicContact CE2-CG2 3.51Å
959	V	89.4	Confident	83.8	Confident	10 Å²	10	35 Å²	35	6%	0.061	18%	0.178	C	C	.	.			trans	-128.3	108.4	168.4	-172.4	0	0	0	0	106.3	L745 I747 M934 L957 E961 L962	L745-V959 HydrophobicContact CB-CG1 4.25Å; L745-V959 HydrophobicContact CD2-CG1 4.15Å; I747-V959 HydrophobicContact CG1-CG2 3.88Å; M934-V959 HydrophobicContact CE-CG2 4.28Å; M934-V959 HydrophobicContact SD-CG2 4.14Å; L957-V959 HydrophobicContact CD2-CG2 3.79Å; V959-E961 VanDerWaalsContact C-N 3.29Å; V959-E961 PolarHBondContact O-N 3.39Å; V959-L962 HydrophobicContact CB-CB 4.4Å; V959-L962 HydrophobicContact CB-CD1 3.72Å; V959-L962 HydrophobicContact CB-CG 3.94Å; V959-L962 HydrophobicContact CG1-CB 4.41Å; V959-L962 HydrophobicContact CG1-CD1 3.83Å; V959-L962 HydrophobicContact CG1-CG 3.66Å; V959-L962 HydrophobicContact CG2-CD1 4.11Å; V959-L962 PolarHBondContact O-N 3.36Å
960	N	82.3	Confident	83.8	Confident	38 Å²	38	34.1 Å²	34.1	20%	0.203	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-70.1	-31.1	-171.8	-164.3	56.3	0	0	0	111.5	L962	N960-L962 PolarHBondContact O-N 3.43Å
961	E	81.7	Confident	84.3	Confident	45 Å²	45	28 Å²	28	21%	0.21	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-72.7	-10.7	-177	-61	74.4	-158.9	0	0	113.7	L745 K746 V959 E963	L745-E961 HydrophobicContact CD2-CB 3.88Å; K746-E961 WeakPolarHBondContact CD-OE1 3.41Å; K746-E961 WeakPolarHBondContact CE-OE1 3.13Å; K746-E961 WeakPolarHBondContact CG-OE1 3.28Å; K746-E961 IonicContact NZ-OE1 3.58Å; K746-E961 PolarHBondContact NZ-OE1 3.3Å; V959-E961 VanDerWaalsContact C-N 3.29Å; V959-E961 PolarHBondContact O-N 3.39Å; E961-E963 VanDerWaalsContact C-N 3.35Å
962	L	83.5	Confident	84.6	Confident	10 Å²	10	27.3 Å²	27.3	5%	0.052	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-86.6	4	-177	-71.1	-179.2	0	0	0	114.5	L745 L922 I930 M934 V959 N960 K964 F965 E966	L745-L962 HydrophobicContact CD1-CD2 4.22Å; L745-L962 HydrophobicContact CD2-CD2 4.03Å; L745-L962 HydrophobicContact CD2-CG 4.35Å; L922-L962 HydrophobicContact CD1-CD2 4.3Å; I930-L962 HydrophobicContact CD1-CD2 4.3Å; I930-L962 HydrophobicContact CG2-CD1 4.43Å; I930-L962 HydrophobicContact CG2-CD2 3.62Å; M934-L962 HydrophobicContact CE-CD1 3.97Å; M934-L962 HydrophobicContact CG-CD1 3.81Å; M934-L962 HydrophobicContact SD-CD1 3.46Å; M934-L962 WeakPolarHBondContact SD-CD1 3.49Å; V959-L962 HydrophobicContact CB-CB 4.4Å; V959-L962 HydrophobicContact CB-CD1 3.72Å; V959-L962 HydrophobicContact CB-CG 3.94Å; V959-L962 HydrophobicContact CG1-CB 4.41Å; V959-L962 HydrophobicContact CG1-CD1 3.83Å; V959-L962 HydrophobicContact CG1-CG 3.66Å; V959-L962 HydrophobicContact CG2-CD1 4.11Å; V959-L962 PolarHBondContact O-N 3.36Å; N960-L962 PolarHBondContact O-N 3.43Å; L962-K964 PolarHBondContact O-N 3.35Å; L962-F965 HydrophobicContact CB-CB 4.43Å; L962-F965 HydrophobicContact CD2-CB 3.89Å; L962-F965 HydrophobicContact CD2-CD1 4.18Å; L962-F965 HydrophobicContact CD2-CG 4.18Å; L962-F965 WeakPolarHBondContact O-CB 3.31Å; L962-F965 PolarHBondContact O-N 3.4Å; L962-E966 PolarHBondContact O-N 2.95Å
963	E	78	Confident	84.7	Confident	81 Å²	81	33 Å²	33	38%	0.379	16%	0.164	S	C	.	.	H	α-helix	trans	-54.3	-41.9	177.6	-177.2	171	-157.3	0	0	112.1	E961 E966 I967	E961-E963 VanDerWaalsContact C-N 3.35Å; E963-E966 WeakPolarHBondContact O-CB 3.43Å; E963-E966 PolarHBondContact O-N 2.87Å; E963-I967 PolarHBondContact O-N 2.84Å
964	K	72.3	Confident	84.9	Confident	117 Å²	117	31.2 Å²	31.2	51%	0.509	15%	0.154	S	C	.	.	H	α-helix	trans	-67.1	-38.2	176.3	-64.8	-174.8	-179.8	-175.5	0	112.9	L962 E966 I967 T968	L962-K964 PolarHBondContact O-N 3.35Å; K964-E966 VanDerWaalsContact C-N 3.34Å; K964-I967 PolarHBondContact O-N 3.16Å; K964-T968 PolarHBondContact O-OG1 2.91Å
965	F	80.2	Confident	85.1	Confident	7 Å²	7	29.2 Å²	29.2	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-67.7	-36.9	177.6	171.5	-102.5	0	0	0	111.7	H707 H927 I930 E931 L962 I967 T968 L969	H707-F965 AromaticContact NE2-CD2 3.29Å; H707-F965 VanDerWaalsContact NE2-CD2 3.29Å; H707-F965 WeakPolarHBondContact NE2-CD2 3.48Å; H707-F965 AromaticContact NE2-CG 3.86Å; H927-F965 HydrophobicContact CB-CE2 4.31Å; H927-F965 AromaticContact CD2-CD2 3.83Å; H927-F965 AromaticContact CD2-CE2 3.33Å; H927-F965 WeakPolarHBondContact CD2-CE2 2.91Å; H927-F965 AromaticContact CE1-CE2 3.83Å; H927-F965 AromaticContact CE1-CZ 4Å; H927-F965 AromaticContact CG-CE2 3.62Å; H927-F965 AromaticContact ND1-CE2 3.92Å; H927-F965 AromaticContact NE2-CE2 3.49Å; H927-F965 WeakPolarHBondContact NE2-CE2 3.43Å; H927-F965 AromaticContact NE2-CZ 3.92Å; I930-F965 HydrophobicContact CB-CD2 4.26Å; I930-F965 HydrophobicContact CB-CE2 3.9Å; I930-F965 HydrophobicContact CB-CZ 4.11Å; I930-F965 HydrophobicContact CD1-CD2 4.31Å; I930-F965 HydrophobicContact CG2-CD1 3.94Å; I930-F965 HydrophobicContact CG2-CD2 4.03Å; I930-F965 HydrophobicContact CG2-CE1 3.83Å; I930-F965 HydrophobicContact CG2-CE2 3.89Å; I930-F965 HydrophobicContact CG2-CG 4.03Å; I930-F965 HydrophobicContact CG2-CZ 3.8Å; E931-F965 HydrophobicContact CB-CZ 4.2Å; L962-F965 HydrophobicContact CB-CB 4.43Å; L962-F965 HydrophobicContact CD2-CB 3.89Å; L962-F965 HydrophobicContact CD2-CD1 4.18Å; L962-F965 HydrophobicContact CD2-CG 4.18Å; L962-F965 WeakPolarHBondContact O-CB 3.31Å; L962-F965 PolarHBondContact O-N 3.4Å; F965-I967 VanDerWaalsContact C-N 3.27Å; F965-I967 PolarHBondContact O-N 2.97Å; F965-T968 PolarHBondContact O-N 3.01Å; F965-T968 VanDerWaalsContact O-N 3.16Å; F965-T968 PolarHBondContact O-OG1 2.97Å; F965-L969 PolarHBondContact O-N 2.9Å
966	E	84.7	Confident	85.1	Confident	9 Å²	9	36.6 Å²	36.6	4%	0.042	17%	0.171	C	C	.	.	H	α-helix	trans	-59.5	-37.9	178.4	171.5	169.3	-163.1	0	0	112.2	A64 T67 L69 L962 E963 K964 T968 L969 N970	A64-E966 HydrophobicContact CB-CG 3.99Å; T67-E966 WeakPolarHBondContact CB-OE1 3.3Å; T67-E966 WeakPolarHBondContact CG2-OE1 3.42Å; T67-E966 PolarHBondContact OG1-OE1 3.38Å; L69-E966 WeakPolarHBondContact CB-OE2 3.36Å; L69-E966 HydrophobicContact CD1-CB 4.5Å; L69-E966 HydrophobicContact CD1-CG 4.45Å; L962-E966 PolarHBondContact O-N 2.95Å; E963-E966 WeakPolarHBondContact O-CB 3.43Å; E963-E966 PolarHBondContact O-N 2.87Å; K964-E966 VanDerWaalsContact C-N 3.34Å; E966-T968 PolarHBondContact O-N 2.77Å; E966-L969 PolarHBondContact O-N 2.91Å; E966-N970 VanDerWaalsContact CG-ND2 3.33Å; E966-N970 WeakPolarHBondContact CG-ND2 3.03Å; E966-N970 WeakPolarHBondContact O-CB 3.4Å; E966-N970 VanDerWaalsContact O-CG 3.26Å; E966-N970 PolarHBondContact O-N 3.18Å; E966-N970 PolarHBondContact O-ND2 3.41Å; E966-N970 VanDerWaalsContact O-ND2 3.12Å
967	I	82.9	Confident	85.1	Confident	11 Å²	11	38.7 Å²	38.7	6%	0.056	19%	0.185	C	C	.	.	H	α-helix	trans	-57.4	-51.5	174.8	-61.2	162.1	0	0	0	109.9	F62 I603 E963 K964 F965 L969 N970 I971 I1028	F62-I967 WeakPolarHBondContact O-CD1 3.37Å; I603-I967 HydrophobicContact CD1-CG2 4.09Å; E963-I967 PolarHBondContact O-N 2.84Å; K964-I967 PolarHBondContact O-N 3.16Å; F965-I967 VanDerWaalsContact C-N 3.27Å; F965-I967 PolarHBondContact O-N 2.97Å; I967-L969 VanDerWaalsContact C-N 3.32Å; I967-L969 PolarHBondContact O-N 2.73Å; I967-N970 PolarHBondContact O-N 3.39Å; I967-I971 HydrophobicContact CG2-CD1 3.95Å; I967-I971 HydrophobicContact CG2-CG1 4.48Å; I967-I971 VanDerWaalsContact O-CG1 3.22Å; I967-I971 WeakPolarHBondContact O-CG1 2.98Å; I967-I971 PolarHBondContact O-N 3.5Å; I967-I1028 HydrophobicContact CG2-CD1 3.6Å; I967-I1028 HydrophobicContact CG2-CG1 3.92Å
968	T	81.4	Confident	85	Confident	6 Å²	6	38.6 Å²	38.6	4%	0.037	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-42.1	-179.7	-21.3	0	0	0	0	111.9	I703 K964 F965 E966 I971 T972	I703-T968 HydrophobicContact CG2-CG2 4.04Å; K964-T968 PolarHBondContact O-OG1 2.91Å; F965-T968 PolarHBondContact O-N 3.01Å; F965-T968 VanDerWaalsContact O-N 3.16Å; F965-T968 PolarHBondContact O-OG1 2.97Å; E966-T968 PolarHBondContact O-N 2.77Å; T968-I971 PolarHBondContact O-N 2.9Å; T968-T972 WeakPolarHBondContact O-CG2 3.31Å; T968-T972 PolarHBondContact O-N 3.23Å
969	L	84.5	Confident	84.9	Confident	32 Å²	32	40.1 Å²	40.1	17%	0.168	19%	0.194	C	C	.	.	H	α-helix	trans	-60.9	-49	176.2	-175.1	70.4	0	0	0	111.1	F965 E966 I967 I971 T972 Q973	F965-L969 PolarHBondContact O-N 2.9Å; E966-L969 PolarHBondContact O-N 2.91Å; I967-L969 VanDerWaalsContact C-N 3.32Å; I967-L969 PolarHBondContact O-N 2.73Å; L969-I971 VanDerWaalsContact C-N 3.34Å; L969-I971 PolarHBondContact O-N 2.9Å; L969-T972 PolarHBondContact O-N 3.07Å; L969-T972 PolarHBondContact O-OG1 2.69Å; L969-Q973 WeakPolarHBondContact O-CG 3.45Å; L969-Q973 PolarHBondContact O-N 2.86Å
970	N	87	Confident	85	Confident	13 Å²	13	44.1 Å²	44.1	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-65.2	-35.8	-178.2	-73.1	-33.7	0	0	0	112.8	A64 S602 E966 I967 T972 Q973 Y974	A64-N970 WeakPolarHBondContact CB-ND2 3.06Å; S602-N970 WeakPolarHBondContact OG-CB 3.38Å; S602-N970 PolarHBondContact OG-ND2 3.47Å; S602-N970 VanDerWaalsContact OG-ND2 3.17Å; E966-N970 VanDerWaalsContact CG-ND2 3.33Å; E966-N970 WeakPolarHBondContact CG-ND2 3.03Å; E966-N970 WeakPolarHBondContact O-CB 3.4Å; E966-N970 VanDerWaalsContact O-CG 3.26Å; E966-N970 PolarHBondContact O-N 3.18Å; E966-N970 PolarHBondContact O-ND2 3.41Å; E966-N970 VanDerWaalsContact O-ND2 3.12Å; I967-N970 PolarHBondContact O-N 3.39Å; N970-T972 PolarHBondContact O-N 3.4Å; N970-Q973 PolarHBondContact O-N 3.38Å; N970-Y974 VanDerWaalsContact O-CB 3.29Å; N970-Y974 WeakPolarHBondContact O-CB 3.5Å; N970-Y974 PolarHBondContact O-N 3.42Å
971	I	86.5	Confident	85.4	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.026	22%	0.219	C	C	.	.	H	α-helix	trans	-57.8	-49.5	173.9	-68.2	165.6	0	0	0	110.4	I603 I967 T968 L969 Q973 Y974 I975 L1026 I1028	I603-I971 HydrophobicContact CD1-CD1 4.39Å; I603-I971 HydrophobicContact CD1-CG1 3.6Å; I967-I971 HydrophobicContact CG2-CD1 3.95Å; I967-I971 HydrophobicContact CG2-CG1 4.48Å; I967-I971 VanDerWaalsContact O-CG1 3.22Å; I967-I971 WeakPolarHBondContact O-CG1 2.98Å; I967-I971 PolarHBondContact O-N 3.5Å; T968-I971 PolarHBondContact O-N 2.9Å; L969-I971 VanDerWaalsContact C-N 3.34Å; L969-I971 PolarHBondContact O-N 2.9Å; I971-Q973 VanDerWaalsContact C-N 3.29Å; I971-Q973 PolarHBondContact O-N 3.13Å; I971-Y974 PolarHBondContact O-N 3.33Å; I971-I975 HydrophobicContact CG2-CD1 3.35Å; I971-I975 HydrophobicContact CG2-CG1 4.2Å; I971-I975 WeakPolarHBondContact O-CD1 3.3Å; I971-I975 VanDerWaalsContact O-CG1 3.26Å; I971-I975 WeakPolarHBondContact O-CG1 3.14Å; I971-I975 PolarHBondContact O-N 3.14Å; I971-I975 VanDerWaalsContact O-N 3.08Å; I971-L1026 HydrophobicContact CG2-CD1 4.35Å; I971-L1026 HydrophobicContact CG2-CD2 4.25Å; I971-L1026 HydrophobicContact CG2-CG 4.17Å; I971-I1028 HydrophobicContact CD1-CB 4.27Å; I971-I1028 HydrophobicContact CD1-CG1 3.39Å; I971-I1028 HydrophobicContact CG1-CG1 4.36Å
972	T	84.3	Confident	85.8	Confident	46 Å²	46	43.4 Å²	43.4	28%	0.282	21%	0.211	S	C	.	.	H	α-helix	trans	-64.2	-34.9	-178	63.9	0	0	0	0	112.6	I703 T968 L969 N970 L1026	I703-T972 HydrophobicContact CD1-CG2 3.85Å; I703-T972 HydrophobicContact CG1-CG2 4.1Å; T968-T972 WeakPolarHBondContact O-CG2 3.31Å; T968-T972 PolarHBondContact O-N 3.23Å; L969-T972 PolarHBondContact O-N 3.07Å; L969-T972 PolarHBondContact O-OG1 2.69Å; N970-T972 PolarHBondContact O-N 3.4Å; T972-L1026 HydrophobicContact CG2-CD2 3.88Å
973	Q	86.7	Confident	86	Confident	119 Å²	119	44 Å²	44	56%	0.556	22%	0.215	S	C	*	.	H	α-helix	trans	-72.9	-35.2	177.7	-69.1	-179.4	-3	0	0	112.7	L969 N970 I971 P977	L969-Q973 WeakPolarHBondContact O-CG 3.45Å; L969-Q973 PolarHBondContact O-N 2.86Å; N970-Q973 PolarHBondContact O-N 3.38Å; I971-Q973 VanDerWaalsContact C-N 3.29Å; I971-Q973 PolarHBondContact O-N 3.13Å; Q973-P977 WeakPolarHBondContact O-CD 3.3Å; Q973-P977 WeakPolarHBondContact O-CG 3.27Å
974	Y	88.5	Confident	86.6	Confident	17 Å²	17	45 Å²	45	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-81.2	-37.5	-175.6	163.9	-102.3	0	0	0	113.9	V597 N598 F600 N970 I971 Y976 P977 S978	V597-Y974 WeakPolarHBondContact O-CE2 3.5Å; V597-Y974 PolarHBondContact O-OH 3.07Å; N598-Y974 WeakPolarHBondContact CA-OH 3.48Å; N598-Y974 PolarHBondContact N-OH 3.03Å; N598-Y974 WeakPolarHBondContact OD1-CE1 3.03Å; N598-Y974 VanDerWaalsContact OD1-CZ 3.27Å; N598-Y974 PolarHBondContact OD1-OH 3.12Å; F600-Y974 HydrophobicContact CB-CD2 4.37Å; F600-Y974 HydrophobicContact CB-CE2 4.14Å; N970-Y974 VanDerWaalsContact O-CB 3.29Å; N970-Y974 WeakPolarHBondContact O-CB 3.5Å; N970-Y974 PolarHBondContact O-N 3.42Å; I971-Y974 PolarHBondContact O-N 3.33Å; Y974-Y976 PolarHBondContact O-N 3.1Å; Y974-P977 VanDerWaalsContact O-CD 3.22Å; Y974-P977 WeakPolarHBondContact O-CD 3.26Å; Y974-P977 VanDerWaalsContact O-CG 3.27Å; Y974-P977 WeakPolarHBondContact O-CG 3.45Å; Y974-S978 WeakPolarHBondContact O-CB 3.49Å; Y974-S978 PolarHBondContact O-N 3.16Å; Y974-S978 VanDerWaalsContact O-N 3.17Å; Y974-S978 PolarHBondContact O-OG 3.22Å; Y974-S978 WeakPolarHBondContact OH-CB 3.09Å; Y974-S978 PolarHBondContact OH-OG 3.11Å
975	I	90.3	Very high	87.4	Confident	20 Å²	20	41.6 Å²	41.6	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	-65.5	-42	-172.1	-70.2	165.9	0	0	0	112.9	I971 S978 V979 L1026 I1034	I971-I975 HydrophobicContact CG2-CD1 3.35Å; I971-I975 HydrophobicContact CG2-CG1 4.2Å; I971-I975 WeakPolarHBondContact O-CD1 3.3Å; I971-I975 VanDerWaalsContact O-CG1 3.26Å; I971-I975 WeakPolarHBondContact O-CG1 3.14Å; I971-I975 PolarHBondContact O-N 3.14Å; I971-I975 VanDerWaalsContact O-N 3.08Å; I975-S978 WeakPolarHBondContact CA-OG 3.34Å; I975-S978 PolarHBondContact O-N 3.27Å; I975-S978 PolarHBondContact O-OG 2.69Å; I975-V979 HydrophobicContact CG2-CG2 4.09Å; I975-V979 WeakPolarHBondContact O-CG2 2.7Å; I975-V979 PolarHBondContact O-N 3.4Å; I975-L1026 HydrophobicContact CD1-CD1 3.38Å; I975-L1026 HydrophobicContact CD1-CD2 4.14Å; I975-L1026 HydrophobicContact CD1-CG 4.21Å; I975-I1034 HydrophobicContact CG2-CG2 4.33Å
976	Y	88.1	Confident	87.7	Confident	166 Å²	166	41.4 Å²	41.4	65%	0.651	21%	0.208	S	C	*	.	H	α-helix	trans	-58.9	-54.4	-177.9	174.1	-99.7	0	0	0	112.8	Y974 S978 M980	Y974-Y976 PolarHBondContact O-N 3.1Å; Y976-S978 VanDerWaalsContact C-N 3.29Å; Y976-S978 PolarHBondContact O-N 2.93Å; Y976-M980 HydrophobicContact CD2-CE 4.45Å; Y976-M980 HydrophobicContact CE2-CE 3.73Å; Y976-M980 HydrophobicContact CE2-CG 4.37Å; Y976-M980 VanDerWaalsContact O-CG 3.29Å; Y976-M980 WeakPolarHBondContact O-CG 3.45Å; Y976-M980 PolarHBondContact O-N 2.69Å
977	P	90.9	Very high	87.7	Confident	54 Å²	54	42.6 Å²	42.6	35%	0.351	22%	0.217	S	C	.	.	H	α-helix	trans	-66	-32.3	176.9	25.7	-33.5	0	0	0	112	Q973 Y974 M980 I981	Q973-P977 WeakPolarHBondContact O-CD 3.3Å; Q973-P977 WeakPolarHBondContact O-CG 3.27Å; Y974-P977 VanDerWaalsContact O-CD 3.22Å; Y974-P977 WeakPolarHBondContact O-CD 3.26Å; Y974-P977 VanDerWaalsContact O-CG 3.27Å; Y974-P977 WeakPolarHBondContact O-CG 3.45Å; P977-M980 PolarHBondContact O-N 2.64Å; P977-I981 WeakPolarHBondContact O-CB 3.19Å; P977-I981 WeakPolarHBondContact O-CD1 3.31Å; P977-I981 WeakPolarHBondContact O-CG1 3.33Å; P977-I981 PolarHBondContact O-N 3.41Å
978	S	90.7	Very high	88	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.007	24%	0.237	C	C	.	.	H	α-helix	trans	-67.8	-46.3	-177.1	66.6	0	0	0	0	113.5	V597 Y974 I975 Y976 M980 I981 A982	V597-S978 VanDerWaalsContact CG1-CA 3.41Å; V597-S978 VanDerWaalsContact CG1-CB 3.47Å; Y974-S978 WeakPolarHBondContact O-CB 3.49Å; Y974-S978 PolarHBondContact O-N 3.16Å; Y974-S978 VanDerWaalsContact O-N 3.17Å; Y974-S978 PolarHBondContact O-OG 3.22Å; Y974-S978 WeakPolarHBondContact OH-CB 3.09Å; Y974-S978 PolarHBondContact OH-OG 3.11Å; I975-S978 WeakPolarHBondContact CA-OG 3.34Å; I975-S978 PolarHBondContact O-N 3.27Å; I975-S978 PolarHBondContact O-OG 2.69Å; Y976-S978 VanDerWaalsContact C-N 3.29Å; Y976-S978 PolarHBondContact O-N 2.93Å; S978-M980 VanDerWaalsContact C-N 3.29Å; S978-M980 PolarHBondContact O-N 3.21Å; S978-I981 PolarHBondContact O-N 2.05Å; S978-A982 WeakPolarHBondContact O-CB 3.45Å; S978-A982 PolarHBondContact O-N 3.24Å
979	V	90	Very high	88.4	Confident	35 Å²	35	47 Å²	47	21%	0.212	24%	0.24	C	C	.	.	H	α-helix	trans	-61.5	-41.2	175.4	175.6	0	0	0	0	110.5	I975 A982 V983 I1034	I975-V979 HydrophobicContact CG2-CG2 4.09Å; I975-V979 WeakPolarHBondContact O-CG2 2.7Å; I975-V979 PolarHBondContact O-N 3.4Å; V979-A982 PolarHBondContact O-N 3.39Å; V979-V983 HydrophobicContact CG1-CG2 4.45Å; V979-V983 WeakPolarHBondContact O-CG2 3.13Å; V979-V983 PolarHBondContact O-N 3.06Å; V979-I1034 HydrophobicContact CG2-CG2 3.79Å
980	M	90.2	Very high	88.5	Confident	94 Å²	94	45.5 Å²	45.5	46%	0.463	23%	0.232	S	C	.	.	H	α-helix	trans	-62.7	-46.9	177.9	-71.2	-63.5	170.3	0	0	112	Y976 P977 S978 A982 V983 I984	Y976-M980 HydrophobicContact CD2-CE 4.45Å; Y976-M980 HydrophobicContact CE2-CE 3.73Å; Y976-M980 HydrophobicContact CE2-CG 4.37Å; Y976-M980 VanDerWaalsContact O-CG 3.29Å; Y976-M980 WeakPolarHBondContact O-CG 3.45Å; Y976-M980 PolarHBondContact O-N 2.69Å; P977-M980 PolarHBondContact O-N 2.64Å; S978-M980 VanDerWaalsContact C-N 3.29Å; S978-M980 PolarHBondContact O-N 3.21Å; M980-A982 PolarHBondContact O-N 3.31Å; M980-V983 PolarHBondContact O-N 3.06Å; M980-I984 WeakPolarHBondContact O-CD1 3.41Å; M980-I984 VanDerWaalsContact O-CG1 3.24Å; M980-I984 WeakPolarHBondContact O-CG1 3.22Å; M980-I984 PolarHBondContact O-N 3.25Å
981	I	91	Very high	88.7	Confident	63 Å²	63	49.1 Å²	49.1	32%	0.323	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-43.8	177.6	-67.1	163.6	0	0	0	110.5	V597 P977 S978 V983 I984 I985	V597-I981 HydrophobicContact CG1-CB 4.14Å; V597-I981 HydrophobicContact CG1-CD1 4.42Å; V597-I981 HydrophobicContact CG1-CG2 4.25Å; V597-I981 HydrophobicContact CG2-CB 4.27Å; V597-I981 HydrophobicContact CG2-CG2 3.63Å; P977-I981 WeakPolarHBondContact O-CB 3.19Å; P977-I981 WeakPolarHBondContact O-CD1 3.31Å; P977-I981 WeakPolarHBondContact O-CG1 3.33Å; P977-I981 PolarHBondContact O-N 3.41Å; S978-I981 PolarHBondContact O-N 2.05Å; I981-V983 PolarHBondContact O-N 3.4Å; I981-I984 PolarHBondContact O-N 3.26Å; I981-I985 HydrophobicContact CG2-CD1 3.74Å; I981-I985 HydrophobicContact CG2-CG1 4.34Å; I981-I985 WeakPolarHBondContact O-CG1 3.5Å; I981-I985 PolarHBondContact O-N 3.31Å
982	A	89.3	Confident	88.7	Confident	5 Å²	5	54 Å²	54	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-42.7	179.4	0	0	0	0	0	112.2	S978 V979 M980 I985 A986 A1038	S978-A982 WeakPolarHBondContact O-CB 3.45Å; S978-A982 PolarHBondContact O-N 3.24Å; V979-A982 PolarHBondContact O-N 3.39Å; M980-A982 PolarHBondContact O-N 3.31Å; A982-I985 PolarHBondContact O-N 3.45Å; A982-A986 VanDerWaalsContact O-CB 3.29Å; A982-A986 WeakPolarHBondContact O-CB 3.46Å; A982-A986 PolarHBondContact O-N 3.43Å; A982-A1038 HydrophobicContact CB-CB 3.88Å
983	V	89.4	Confident	88.8	Confident	22 Å²	22	53.2 Å²	53.2	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-66.4	-38.2	175.4	173.8	0	0	0	0	111.8	V979 M980 I981 A986 S987 L1004 L1011 A1038	V979-V983 HydrophobicContact CG1-CG2 4.45Å; V979-V983 WeakPolarHBondContact O-CG2 3.13Å; V979-V983 PolarHBondContact O-N 3.06Å; M980-V983 PolarHBondContact O-N 3.06Å; I981-V983 PolarHBondContact O-N 3.4Å; V983-A986 WeakPolarHBondContact O-CB 3.39Å; V983-A986 PolarHBondContact O-N 2.68Å; V983-S987 WeakPolarHBondContact O-CB 3.43Å; V983-S987 PolarHBondContact O-N 3.04Å; V983-L1004 HydrophobicContact CG1-CD1 4.45Å; V983-L1011 HydrophobicContact CG2-CD1 3.94Å; V983-A1038 HydrophobicContact CG2-CB 4.08Å
984	I	89.4	Confident	88.6	Confident	104 Å²	104	47.8 Å²	47.8	53%	0.533	24%	0.242	S	C	.	.	H	α-helix	trans	-62.9	-47.2	175.5	-70.6	164.8	0	0	0	110.4	M980 I981 A986 S987 L988	M980-I984 WeakPolarHBondContact O-CD1 3.41Å; M980-I984 VanDerWaalsContact O-CG1 3.24Å; M980-I984 WeakPolarHBondContact O-CG1 3.22Å; M980-I984 PolarHBondContact O-N 3.25Å; I981-I984 PolarHBondContact O-N 3.26Å; I984-A986 PolarHBondContact O-N 3.38Å; I984-S987 PolarHBondContact O-N 2.84Å; I984-S987 PolarHBondContact O-OG 3.17Å; I984-L988 WeakPolarHBondContact O-CB 3.49Å; I984-L988 PolarHBondContact O-N 2.89Å
985	I	89.6	Confident	88.4	Confident	45 Å²	45	55.3 Å²	55.3	23%	0.231	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-47.2	178.2	-66.6	166.9	0	0	0	110.4	C593 V597 I981 A982 S987 L988 L989	C593-I985 HydrophobicContact CB-CD1 4.24Å; C593-I985 HydrophobicContact CB-CG2 3.72Å; V597-I985 HydrophobicContact CG2-CD1 4.19Å; I981-I985 HydrophobicContact CG2-CD1 3.74Å; I981-I985 HydrophobicContact CG2-CG1 4.34Å; I981-I985 WeakPolarHBondContact O-CG1 3.5Å; I981-I985 PolarHBondContact O-N 3.31Å; A982-I985 PolarHBondContact O-N 3.45Å; I985-S987 VanDerWaalsContact C-N 3.31Å; I985-S987 PolarHBondContact O-N 3.04Å; I985-L988 PolarHBondContact O-N 3.33Å; I985-L988 VanDerWaalsContact O-N 3.15Å; I985-L989 HydrophobicContact CG2-CD1 4.15Å; I985-L989 HydrophobicContact CG2-CG 4.34Å; I985-L989 WeakPolarHBondContact O-CG 3.45Å; I985-L989 PolarHBondContact O-N 2.7Å
986	A	86.3	Confident	87.9	Confident	2 Å²	2	56.8 Å²	56.8	2%	0.017	28%	0.283	C	S	.	.	H	α-helix	trans	-52	-48.1	173.4	0	0	0	0	0	112.2	A982 V983 I984 L988 L989 I990 L1007 I1042	A982-A986 VanDerWaalsContact O-CB 3.29Å; A982-A986 WeakPolarHBondContact O-CB 3.46Å; A982-A986 PolarHBondContact O-N 3.43Å; V983-A986 WeakPolarHBondContact O-CB 3.39Å; V983-A986 PolarHBondContact O-N 2.68Å; I984-A986 PolarHBondContact O-N 3.38Å; A986-L988 VanDerWaalsContact C-N 3.34Å; A986-L988 PolarHBondContact O-N 3.37Å; A986-L989 PolarHBondContact O-N 3.22Å; A986-I990 WeakPolarHBondContact O-CG1 3.47Å; A986-I990 PolarHBondContact O-N 3.23Å; A986-I990 VanDerWaalsContact O-N 3.14Å; A986-L1007 HydrophobicContact CB-CD2 3.8Å; A986-I1042 HydrophobicContact CB-CD1 3.35Å
987	S	85	Confident	87.8	Confident	34 Å²	34	54 Å²	54	24%	0.238	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-39.8	178.5	82.4	0	0	0	0	113	V983 I984 I985 I990 F991	V983-S987 WeakPolarHBondContact O-CB 3.43Å; V983-S987 PolarHBondContact O-N 3.04Å; I984-S987 PolarHBondContact O-N 2.84Å; I984-S987 PolarHBondContact O-OG 3.17Å; I985-S987 VanDerWaalsContact C-N 3.31Å; I985-S987 PolarHBondContact O-N 3.04Å; S987-I990 PolarHBondContact O-N 2.82Å; S987-F991 WeakPolarHBondContact O-CB 3.4Å; S987-F991 PolarHBondContact O-N 3.39Å
988	L	88.8	Confident	87.5	Confident	90 Å²	90	54.1 Å²	54.1	47%	0.471	28%	0.276	S	S	.	.	H	α-helix	trans	-68	-43.6	-179.3	-171.1	160.6	0	0	0	110	I984 I985 A986 F991 L992	I984-L988 WeakPolarHBondContact O-CB 3.49Å; I984-L988 PolarHBondContact O-N 2.89Å; I985-L988 PolarHBondContact O-N 3.33Å; I985-L988 VanDerWaalsContact O-N 3.15Å; A986-L988 VanDerWaalsContact C-N 3.34Å; A986-L988 PolarHBondContact O-N 3.37Å; L988-F991 PolarHBondContact O-N 2.96Å; L988-L992 HydrophobicContact CD2-CD1 3.38Å; L988-L992 HydrophobicContact CD2-CG 3.82Å; L988-L992 WeakPolarHBondContact O-CG 3.05Å; L988-L992 PolarHBondContact O-N 2.77Å
989	L	89.9	Confident	87.3	Confident	19 Å²	19	54.5 Å²	54.5	10%	0.099	28%	0.278	C	S	.	.	H	α-helix	trans	-58.2	-50.9	175.6	-69.5	176.9	0	0	0	110.7	L586 I589 I985 A986 F991 L992 I993	L586-L989 HydrophobicContact CD1-CB 4.38Å; L586-L989 HydrophobicContact CD1-CD2 3.96Å; I589-L989 HydrophobicContact CG2-CD1 4.48Å; I589-L989 HydrophobicContact CG2-CD2 4.25Å; I985-L989 HydrophobicContact CG2-CD1 4.15Å; I985-L989 HydrophobicContact CG2-CG 4.34Å; I985-L989 WeakPolarHBondContact O-CG 3.45Å; I985-L989 PolarHBondContact O-N 2.7Å; A986-L989 PolarHBondContact O-N 3.22Å; L989-F991 VanDerWaalsContact C-N 3.3Å; L989-F991 PolarHBondContact O-N 2.68Å; L989-L992 PolarHBondContact O-N 3.45Å; L989-I993 WeakPolarHBondContact O-CD1 3.48Å; L989-I993 WeakPolarHBondContact O-CG1 3.49Å; L989-I993 PolarHBondContact O-N 3.39Å
990	I	87.7	Confident	87.2	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-41.6	179.1	-58.9	172.4	0	0	0	111.6	A986 S987 I993 S994 S1003 I1042 C1045 A1049	A986-I990 WeakPolarHBondContact O-CG1 3.47Å; A986-I990 PolarHBondContact O-N 3.23Å; A986-I990 VanDerWaalsContact O-N 3.14Å; S987-I990 PolarHBondContact O-N 2.82Å; I990-I993 PolarHBondContact O-N 3.14Å; I990-S994 WeakPolarHBondContact O-CB 3.11Å; I990-S994 PolarHBondContact O-N 3.29Å; I990-S994 PolarHBondContact O-OG 2.65Å; I990-S1003 WeakPolarHBondContact CD1-OG 3.46Å; I990-S1003 WeakPolarHBondContact CG2-OG 3.32Å; I990-I1042 HydrophobicContact CD1-CD1 3.56Å; I990-I1042 HydrophobicContact CD1-CG1 4.01Å; I990-I1042 HydrophobicContact CG1-CD1 3.82Å; I990-I1042 HydrophobicContact CG1-CG1 4.42Å; I990-C1045 HydrophobicContact CD1-CB 4.2Å; I990-A1049 HydrophobicContact CG2-CB 4.24Å
991	F	89.1	Confident	87.2	Confident	90 Å²	90	53.5 Å²	53.5	40%	0.395	27%	0.274	S	S	.	.	H	α-helix	trans	-62.6	-47	177.5	176.3	-105.7	0	0	0	112.5	S987 L988 L989 I993 K995 I997	S987-F991 WeakPolarHBondContact O-CB 3.4Å; S987-F991 PolarHBondContact O-N 3.39Å; L988-F991 PolarHBondContact O-N 2.96Å; L989-F991 VanDerWaalsContact C-N 3.3Å; L989-F991 PolarHBondContact O-N 2.68Å; F991-I993 VanDerWaalsContact C-N 3.27Å; F991-I993 PolarHBondContact O-N 3.13Å; F991-K995 WeakPolarHBondContact O-CA 3.31Å; F991-K995 PolarHBondContact O-N 3.16Å; F991-I997 HydrophobicContact CD2-CG1 4.39Å; F991-I997 HydrophobicContact CE2-CG1 3.68Å
992	L	87.3	Confident	87.1	Confident	107 Å²	107	52 Å²	52	56%	0.56	27%	0.266	S	S	*	.	H	α-helix	trans	-60.5	-36.6	-179.8	-75.2	-179	0	0	0	112.8	L988 L989	L988-L992 HydrophobicContact CD2-CD1 3.38Å; L988-L992 HydrophobicContact CD2-CG 3.82Å; L988-L992 WeakPolarHBondContact O-CG 3.05Å; L988-L992 PolarHBondContact O-N 2.77Å; L989-L992 PolarHBondContact O-N 3.45Å
993	I	86	Confident	87.1	Confident	30 Å²	30	51.7 Å²	51.7	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-75.1	-54.6	-178.8	-59.6	147.8	0	0	0	111	L586 L989 I990 F991 K995 I1046 Y1050	L586-I993 HydrophobicContact CD1-CD1 3.84Å; L586-I993 HydrophobicContact CD1-CG1 4.08Å; L586-I993 HydrophobicContact CD2-CD1 2.98Å; L586-I993 HydrophobicContact CD2-CG1 3.5Å; L586-I993 HydrophobicContact CG-CD1 3.85Å; L586-I993 HydrophobicContact CG-CG1 4.39Å; L989-I993 WeakPolarHBondContact O-CD1 3.48Å; L989-I993 WeakPolarHBondContact O-CG1 3.49Å; L989-I993 PolarHBondContact O-N 3.39Å; I990-I993 PolarHBondContact O-N 3.14Å; F991-I993 VanDerWaalsContact C-N 3.27Å; F991-I993 PolarHBondContact O-N 3.13Å; I993-K995 VanDerWaalsContact C-N 3.31Å; I993-K995 PolarHBondContact O-N 3.14Å; I993-I1046 HydrophobicContact CD1-CG1 4.44Å; I993-Y1050 HydrophobicContact CG2-CD2 3.72Å; I993-Y1050 HydrophobicContact CG2-CG 4.36Å
994	S	83.5	Confident	87.1	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.028	27%	0.272	C	S	.	.	H	α-helix	trans	-73.9	-27.6	-170.1	59.1	0	0	0	0	112.3	I990 N996	I990-S994 WeakPolarHBondContact O-CB 3.11Å; I990-S994 PolarHBondContact O-N 3.29Å; I990-S994 PolarHBondContact O-OG 2.65Å; S994-N996 PolarHBondContact O-N 3.36Å; S994-N996 PolarHBondContact OG-N 2.92Å; S994-N996 PolarHBondContact OG-O 2.98Å
995	K	83.1	Confident	87.2	Confident	176 Å²	176	52 Å²	52	77%	0.765	27%	0.265	S	S	*	.			trans	50.1	18.8	-167	-59.2	-178.2	-179.7	178	0	113	F991 I993	F991-K995 WeakPolarHBondContact O-CA 3.31Å; F991-K995 PolarHBondContact O-N 3.16Å; I993-K995 VanDerWaalsContact C-N 3.31Å; I993-K995 PolarHBondContact O-N 3.14Å
996	N	81.3	Confident	87.4	Confident	51 Å²	51	49.9 Å²	49.9	27%	0.273	25%	0.254	S	S	.	.			trans	-124.1	108.3	-176	-175.4	-13.8	0	0	0	109.1	S994 L998 L999 S1000	S994-N996 PolarHBondContact O-N 3.36Å; S994-N996 PolarHBondContact OG-N 2.92Å; S994-N996 PolarHBondContact OG-O 2.98Å; N996-L998 PolarHBondContact O-N 3.16Å; N996-L998 WeakPolarHBondContact OD1-CB 3.36Å; N996-L998 PolarHBondContact OD1-N 2.99Å; N996-L999 HydrophobicContact CB-CB 4.16Å; N996-L999 PolarHBondContact O-N 2.85Å; N996-S1000 PolarHBondContact O-N 3.37Å; N996-S1000 VanDerWaalsContact O-N 3.11Å
997	I	85.4	Confident	87.7	Confident	108 Å²	108	49.9 Å²	49.9	55%	0.554	25%	0.254	S	S	*	.	H	α-helix	trans	-57.5	-38.4	-178.2	-61.1	165.1	0	0	0	111.2	F991 L999 S1000 L1001	F991-I997 HydrophobicContact CD2-CG1 4.39Å; F991-I997 HydrophobicContact CE2-CG1 3.68Å; I997-L999 PolarHBondContact O-N 3.42Å; I997-S1000 PolarHBondContact O-N 3.48Å; I997-S1000 PolarHBondContact O-OG 3.5Å; I997-L1001 HydrophobicContact CG2-CD1 3.89Å; I997-L1001 HydrophobicContact CG2-CG 4.28Å; I997-L1001 WeakPolarHBondContact O-CB 3.25Å; I997-L1001 VanDerWaalsContact O-CG 3.31Å; I997-L1001 WeakPolarHBondContact O-CG 3.41Å; I997-L1001 PolarHBondContact O-N 2.93Å
998	L	85.2	Confident	88	Confident	56 Å²	56	50.4 Å²	50.4	29%	0.293	26%	0.256	S	S	.	.	H	α-helix	trans	-65.4	-43.1	-178.9	-178.7	68.7	0	0	0	111.2	N996 L1001 L1002 V1067 F1139	N996-L998 PolarHBondContact O-N 3.16Å; N996-L998 WeakPolarHBondContact OD1-CB 3.36Å; N996-L998 PolarHBondContact OD1-N 2.99Å; L998-L1001 PolarHBondContact O-N 3.36Å; L998-L1002 HydrophobicContact CD1-CD1 4.31Å; L998-L1002 HydrophobicContact CD1-CG 4.41Å; L998-L1002 HydrophobicContact CG-CD1 4.05Å; L998-L1002 WeakPolarHBondContact O-CB 3.31Å; L998-L1002 VanDerWaalsContact O-CG 3.29Å; L998-L1002 WeakPolarHBondContact O-CG 3.41Å; L998-L1002 PolarHBondContact O-N 2.99Å; L998-V1067 HydrophobicContact CD2-CG2 3.76Å; L998-F1139 HydrophobicContact CD2-CD2 4.48Å; L998-F1139 HydrophobicContact CD2-CE2 3.66Å; L998-F1139 HydrophobicContact CD2-CZ 4.21Å
999	L	86.2	Confident	88.2	Confident	8 Å²	8	46.1 Å²	46.1	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-41	179	-179.1	57	0	0	0	111.1	N996 I997 S1003 A1049 L1132	N996-L999 HydrophobicContact CB-CB 4.16Å; N996-L999 PolarHBondContact O-N 2.85Å; I997-L999 PolarHBondContact O-N 3.42Å; L999-S1003 WeakPolarHBondContact O-CB 3.17Å; L999-S1003 PolarHBondContact O-N 3.27Å; L999-S1003 PolarHBondContact O-OG 3.32Å; L999-A1049 HydrophobicContact CD2-CB 3.97Å; L999-A1049 HydrophobicContact CG-CB 4.4Å; L999-L1132 HydrophobicContact CD1-CD1 4.06Å; L999-L1132 HydrophobicContact CD1-CD2 3.78Å; L999-L1132 HydrophobicContact CD1-CG 4.48Å
1000	S	88.1	Confident	88.4	Confident	15 Å²	15	45.2 Å²	45.2	11%	0.105	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-42.6	176.9	85.5	0	0	0	0	111.7	N996 I997 S1003 L1004	N996-S1000 PolarHBondContact O-N 3.37Å; N996-S1000 VanDerWaalsContact O-N 3.11Å; I997-S1000 PolarHBondContact O-N 3.48Å; I997-S1000 PolarHBondContact O-OG 3.5Å; S1000-S1003 WeakPolarHBondContact CA-OG 3.12Å; S1000-S1003 PolarHBondContact O-N 3.21Å; S1000-S1003 PolarHBondContact O-OG 3.41Å; S1000-L1004 WeakPolarHBondContact O-CB 3.48Å; S1000-L1004 PolarHBondContact O-N 3.13Å
1001	L	89.2	Confident	88.7	Confident	94 Å²	94	45.9 Å²	45.9	49%	0.492	23%	0.232	S	C	.	.	H	α-helix	trans	-63.2	-45.9	177	-72.9	173.4	0	0	0	112.6	I997 L998 S1003 L1004 I1005	I997-L1001 HydrophobicContact CG2-CD1 3.89Å; I997-L1001 HydrophobicContact CG2-CG 4.28Å; I997-L1001 WeakPolarHBondContact O-CB 3.25Å; I997-L1001 VanDerWaalsContact O-CG 3.31Å; I997-L1001 WeakPolarHBondContact O-CG 3.41Å; I997-L1001 PolarHBondContact O-N 2.93Å; L998-L1001 PolarHBondContact O-N 3.36Å; L1001-S1003 PolarHBondContact O-N 3.01Å; L1001-L1004 PolarHBondContact O-N 3.29Å; L1001-I1005 WeakPolarHBondContact O-CG1 3.42Å; L1001-I1005 PolarHBondContact O-N 3.36Å; L1001-I1005 VanDerWaalsContact O-N 3.1Å
1002	L	88.8	Confident	88.9	Confident	30 Å²	30	44.7 Å²	44.7	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-43	178.4	-70.8	174.6	0	0	0	111.6	L998 L1004 I1005 C1006 L1128 I1131 L1132	L998-L1002 HydrophobicContact CD1-CD1 4.31Å; L998-L1002 HydrophobicContact CD1-CG 4.41Å; L998-L1002 HydrophobicContact CG-CD1 4.05Å; L998-L1002 WeakPolarHBondContact O-CB 3.31Å; L998-L1002 VanDerWaalsContact O-CG 3.29Å; L998-L1002 WeakPolarHBondContact O-CG 3.41Å; L998-L1002 PolarHBondContact O-N 2.99Å; L1002-L1004 VanDerWaalsContact C-N 3.3Å; L1002-L1004 PolarHBondContact O-N 2.84Å; L1002-I1005 PolarHBondContact O-N 2.73Å; L1002-C1006 PolarHBondContact O-N 3.29Å; L1002-C1006 PolarHBondContact O-SG 2.75Å; L1002-L1128 HydrophobicContact CB-CD1 4.24Å; L1002-I1131 HydrophobicContact CD1-CG2 4.18Å; L1002-I1131 HydrophobicContact CD2-CG2 3.7Å; L1002-I1131 HydrophobicContact CG-CG2 4.44Å; L1002-L1132 HydrophobicContact CD1-CD2 4.06Å
1003	S	89.7	Confident	89.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-34.4	176.7	71.1	0	0	0	0	112.8	I990 L999 S1000 L1001 C1006 L1007	I990-S1003 WeakPolarHBondContact CD1-OG 3.46Å; I990-S1003 WeakPolarHBondContact CG2-OG 3.32Å; L999-S1003 WeakPolarHBondContact O-CB 3.17Å; L999-S1003 PolarHBondContact O-N 3.27Å; L999-S1003 PolarHBondContact O-OG 3.32Å; S1000-S1003 WeakPolarHBondContact CA-OG 3.12Å; S1000-S1003 PolarHBondContact O-N 3.21Å; S1000-S1003 PolarHBondContact O-OG 3.41Å; L1001-S1003 PolarHBondContact O-N 3.01Å; S1003-C1006 PolarHBondContact O-N 2.87Å; S1003-L1007 VanDerWaalsContact O-CB 3.32Å; S1003-L1007 WeakPolarHBondContact O-CB 3.23Å; S1003-L1007 PolarHBondContact O-N 3.03Å
1004	L	90.3	Very high	89.6	Confident	56 Å²	56	39.1 Å²	39.1	29%	0.293	20%	0.202	S	C	.	.	H	α-helix	trans	-68.1	-40.9	176.1	-179.9	137.4	0	0	0	112.1	V983 S1000 L1001 L1002 C1006 L1007 T1008	V983-L1004 HydrophobicContact CG1-CD1 4.45Å; S1000-L1004 WeakPolarHBondContact O-CB 3.48Å; S1000-L1004 PolarHBondContact O-N 3.13Å; L1001-L1004 PolarHBondContact O-N 3.29Å; L1002-L1004 VanDerWaalsContact C-N 3.3Å; L1002-L1004 PolarHBondContact O-N 2.84Å; L1004-C1006 VanDerWaalsContact C-N 3.35Å; L1004-L1007 PolarHBondContact O-N 2.99Å; L1004-T1008 HydrophobicContact CD2-CG2 4.5Å; L1004-T1008 WeakPolarHBondContact O-CG2 3.47Å; L1004-T1008 PolarHBondContact O-N 3.38Å; L1004-T1008 PolarHBondContact O-OG1 3.07Å
1005	I	91.2	Very high	90	Very high	75 Å²	75	40.5 Å²	40.5	39%	0.385	21%	0.209	S	C	.	.	H	α-helix	trans	-63.7	-43.1	174.7	-63.4	167.4	0	0	0	110.3	I684 L1001 L1002 T1008 C1009	I684-I1005 HydrophobicContact CD1-CG2 4.18Å; I684-I1005 HydrophobicContact CG2-CG2 4.09Å; L1001-I1005 WeakPolarHBondContact O-CG1 3.42Å; L1001-I1005 PolarHBondContact O-N 3.36Å; L1001-I1005 VanDerWaalsContact O-N 3.1Å; L1002-I1005 PolarHBondContact O-N 2.73Å; I1005-T1008 WeakPolarHBondContact CA-OG1 3.3Å; I1005-T1008 PolarHBondContact O-OG1 3.19Å; I1005-C1009 WeakPolarHBondContact O-CB 3.33Å; I1005-C1009 PolarHBondContact O-N 2.96Å
1006	C	93	Very high	90.4	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.007	17%	0.173	C	C	.	.	H	α-helix	trans	-64.7	-42.3	175.9	-69.2	0	0	0	0	112.3	L1002 S1003 L1004 C1009 C1010	L1002-C1006 PolarHBondContact O-N 3.29Å; L1002-C1006 PolarHBondContact O-SG 2.75Å; S1003-C1006 PolarHBondContact O-N 2.87Å; L1004-C1006 VanDerWaalsContact C-N 3.35Å; C1006-C1009 PolarHBondContact O-N 3.24Å; C1006-C1010 WeakPolarHBondContact O-CB 3.38Å; C1006-C1010 PolarHBondContact O-N 3.46Å
1007	L	92.8	Very high	91	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.016	18%	0.176	C	C	.	.	H	α-helix	trans	-63.9	-46.1	178.7	-177.2	65.3	0	0	0	111.5	A986 S1003 L1004 C1009 C1010 L1011 A1041 I1042	A986-L1007 HydrophobicContact CB-CD2 3.8Å; S1003-L1007 VanDerWaalsContact O-CB 3.32Å; S1003-L1007 WeakPolarHBondContact O-CB 3.23Å; S1003-L1007 PolarHBondContact O-N 3.03Å; L1004-L1007 PolarHBondContact O-N 2.99Å; L1007-C1009 VanDerWaalsContact C-N 3.33Å; L1007-C1009 PolarHBondContact O-N 2.74Å; L1007-C1010 VanDerWaalsContact O-CB 3.31Å; L1007-C1010 WeakPolarHBondContact O-CB 3.3Å; L1007-C1010 PolarHBondContact O-N 3Å; L1007-L1011 HydrophobicContact CG-CD1 4.32Å; L1007-L1011 WeakPolarHBondContact O-CG 3.42Å; L1007-L1011 PolarHBondContact O-N 2.88Å; L1007-A1041 HydrophobicContact CD1-CB 4.01Å; L1007-I1042 HydrophobicContact CD1-CB 4.29Å; L1007-I1042 HydrophobicContact CD2-CD1 4.34Å
1008	T	91.6	Very high	91.3	Very high	45 Å²	45	28 Å²	28	28%	0.276	15%	0.151	S	C	.	.	H	α-helix	trans	-61.8	-41.2	176.7	51.2	0	0	0	0	112	L1004 I1005 L1011 L1012	L1004-T1008 HydrophobicContact CD2-CG2 4.5Å; L1004-T1008 WeakPolarHBondContact O-CG2 3.47Å; L1004-T1008 PolarHBondContact O-N 3.38Å; L1004-T1008 PolarHBondContact O-OG1 3.07Å; I1005-T1008 WeakPolarHBondContact CA-OG1 3.3Å; I1005-T1008 PolarHBondContact O-OG1 3.19Å; T1008-L1011 PolarHBondContact O-N 3.49Å; T1008-L1012 WeakPolarHBondContact O-CG 3.37Å; T1008-L1012 PolarHBondContact O-N 3.09Å
1009	C	93.4	Very high	91.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-40	173.8	-172.2	0	0	0	0	112.4	T687 L688 I1005 C1006 L1007 S1013 F1123	T687-C1009 PolarHBondContact OG1-SG 3.32Å; L688-C1009 HydrophobicContact CD2-CB 4.48Å; I1005-C1009 WeakPolarHBondContact O-CB 3.33Å; I1005-C1009 PolarHBondContact O-N 2.96Å; C1006-C1009 PolarHBondContact O-N 3.24Å; L1007-C1009 VanDerWaalsContact C-N 3.33Å; L1007-C1009 PolarHBondContact O-N 2.74Å; C1009-S1013 VanDerWaalsContact O-CB 3.24Å; C1009-S1013 WeakPolarHBondContact O-CB 3.42Å; C1009-S1013 PolarHBondContact O-N 3.12Å; C1009-F1123 HydrophobicContact CB-CD1 4.29Å; C1009-F1123 HydrophobicContact CB-CE1 4.47Å; C1009-F1123 WeakPolarHBondContact SG-CE1 3.38Å
1010	C	94.6	Very high	91.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.2	-50.8	174.5	-179.2	0	0	0	0	111.3	C1006 L1007 S1013 S1014 C1119 S1120 F1123	C1006-C1010 WeakPolarHBondContact O-CB 3.38Å; C1006-C1010 PolarHBondContact O-N 3.46Å; L1007-C1010 VanDerWaalsContact O-CB 3.31Å; L1007-C1010 WeakPolarHBondContact O-CB 3.3Å; L1007-C1010 PolarHBondContact O-N 3Å; C1010-S1013 PolarHBondContact O-N 3.04Å; C1010-S1014 PolarHBondContact O-N 3.09Å; C1010-S1014 PolarHBondContact O-OG 2.94Å; C1010-C1119 VanDerWaalsContact SG-C 3.54Å; C1010-S1120 VanDerWaalsContact SG-CA 3.52Å; C1010-S1120 PolarHBondContact SG-N 3.36Å; C1010-S1120 VanDerWaalsContact SG-N 3.41Å; C1010-F1123 HydrophobicContact CB-CB 3.9Å; C1010-F1123 HydrophobicContact CB-CD2 4.26Å; C1010-F1123 HydrophobicContact CB-CG 4.38Å
1011	L	93.6	Very high	91.6	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.079	17%	0.174	C	C	.	.	H	α-helix	trans	-65.4	-42.9	-177.6	-64.6	175.3	0	0	0	112.5	V983 L1007 T1008 S1014 I1015 A1037 A1038 A1041 L1116	V983-L1011 HydrophobicContact CG2-CD1 3.94Å; L1007-L1011 HydrophobicContact CG-CD1 4.32Å; L1007-L1011 WeakPolarHBondContact O-CG 3.42Å; L1007-L1011 PolarHBondContact O-N 2.88Å; T1008-L1011 PolarHBondContact O-N 3.49Å; L1011-S1014 WeakPolarHBondContact CA-OG 3.37Å; L1011-S1014 PolarHBondContact O-N 3.46Å; L1011-S1014 PolarHBondContact O-OG 2.79Å; L1011-I1015 WeakPolarHBondContact O-CD1 3.31Å; L1011-I1015 VanDerWaalsContact O-CG1 3.27Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.46Å; L1011-I1015 PolarHBondContact O-N 3.38Å; L1011-I1015 VanDerWaalsContact O-N 3.11Å; L1011-A1037 HydrophobicContact CD2-CB 3.57Å; L1011-A1038 HydrophobicContact CD1-CB 3.89Å; L1011-A1041 HydrophobicContact CD2-CB 4.36Å; L1011-L1116 HydrophobicContact CD2-CD1 4.36Å
1012	L	92.9	Very high	91.2	Very high	65 Å²	65	30.4 Å²	30.4	34%	0.34	17%	0.166	S	C	.	.	H	α-helix	trans	-64.3	-42.6	176.2	-71.3	171	0	0	0	111.3	L688 T691 L695 T1008 I1015 T1016	L688-L1012 HydrophobicContact CD2-CD1 3.76Å; T691-L1012 HydrophobicContact CG2-CB 4.22Å; L695-L1012 HydrophobicContact CD1-CD2 4.07Å; T1008-L1012 WeakPolarHBondContact O-CG 3.37Å; T1008-L1012 PolarHBondContact O-N 3.09Å; L1012-I1015 PolarHBondContact O-N 3.15Å; L1012-T1016 WeakPolarHBondContact O-CG2 3.3Å; L1012-T1016 PolarHBondContact O-N 2.76Å; L1012-T1016 PolarHBondContact O-OG1 3.39Å
1013	S	93.8	Very high	90.9	Very high	17 Å²	17	35 Å²	35	12%	0.119	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-44.9	177.2	-172.1	0	0	0	0	111.9	C1009 C1010 I1015 T1016 L1017	C1009-S1013 VanDerWaalsContact O-CB 3.24Å; C1009-S1013 WeakPolarHBondContact O-CB 3.42Å; C1009-S1013 PolarHBondContact O-N 3.12Å; C1010-S1013 PolarHBondContact O-N 3.04Å; S1013-I1015 PolarHBondContact O-N 3.09Å; S1013-T1016 WeakPolarHBondContact CA-OG1 3.47Å; S1013-T1016 PolarHBondContact O-N 3.47Å; S1013-T1016 PolarHBondContact O-OG1 3.15Å; S1013-L1017 WeakPolarHBondContact O-CG 3.16Å; S1013-L1017 PolarHBondContact O-N 3.05Å
1014	S	93.9	Very high	90.6	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.014	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-44.5	179.4	60.1	0	0	0	0	111.7	C1010 L1011 T1016 L1017 L1018	C1010-S1014 PolarHBondContact O-N 3.09Å; C1010-S1014 PolarHBondContact O-OG 2.94Å; L1011-S1014 WeakPolarHBondContact CA-OG 3.37Å; L1011-S1014 PolarHBondContact O-N 3.46Å; L1011-S1014 PolarHBondContact O-OG 2.79Å; S1014-T1016 VanDerWaalsContact C-N 3.32Å; S1014-T1016 PolarHBondContact O-N 2.84Å; S1014-L1017 PolarHBondContact O-N 3.44Å; S1014-L1018 WeakPolarHBondContact O-CG 3.45Å; S1014-L1018 PolarHBondContact O-N 3.03Å
1015	I	92.4	Very high	90.2	Very high	34 Å²	34	36.4 Å²	36.4	17%	0.174	19%	0.194	C	C	.	.	H	α-helix	trans	-60.9	-43.4	176.3	-64.9	166.7	0	0	0	110.1	L695 L1011 L1012 S1013 L1017 L1018 T1019 I1034	L695-I1015 HydrophobicContact CD1-CG2 4.48Å; L695-I1015 HydrophobicContact CD2-CG2 4.03Å; L1011-I1015 WeakPolarHBondContact O-CD1 3.31Å; L1011-I1015 VanDerWaalsContact O-CG1 3.27Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.46Å; L1011-I1015 PolarHBondContact O-N 3.38Å; L1011-I1015 VanDerWaalsContact O-N 3.11Å; L1012-I1015 PolarHBondContact O-N 3.15Å; S1013-I1015 PolarHBondContact O-N 3.09Å; I1015-L1017 PolarHBondContact O-N 3.44Å; I1015-L1018 PolarHBondContact O-N 3.01Å; I1015-T1019 HydrophobicContact CG2-CG2 4.38Å; I1015-T1019 VanDerWaalsContact O-CG2 3.28Å; I1015-T1019 WeakPolarHBondContact O-CG2 3.49Å; I1015-T1019 PolarHBondContact O-N 3.11Å; I1015-T1019 PolarHBondContact O-OG1 3.48Å; I1015-I1034 HydrophobicContact CD1-CG2 4.25Å; I1015-I1034 HydrophobicContact CG1-CG1 4.44Å
1016	T	92	Very high	89.8	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.025	18%	0.18	C	C	.	.	H	α-helix	trans	-64.7	-39.7	178.8	55.2	0	0	0	0	114	T691 Q694 L695 L1012 S1013 S1014 T1019 C1020	T691-T1016 HydrophobicContact CG2-CG2 3.76Å; Q694-T1016 HydrophobicContact CB-CG2 4.24Å; L695-T1016 HydrophobicContact CD1-CG2 3.77Å; L695-T1016 HydrophobicContact CD2-CG2 3.75Å; L695-T1016 HydrophobicContact CG-CG2 3.51Å; L1012-T1016 WeakPolarHBondContact O-CG2 3.3Å; L1012-T1016 PolarHBondContact O-N 2.76Å; L1012-T1016 PolarHBondContact O-OG1 3.39Å; S1013-T1016 WeakPolarHBondContact CA-OG1 3.47Å; S1013-T1016 PolarHBondContact O-N 3.47Å; S1013-T1016 PolarHBondContact O-OG1 3.15Å; S1014-T1016 VanDerWaalsContact C-N 3.32Å; S1014-T1016 PolarHBondContact O-N 2.84Å; T1016-T1019 WeakPolarHBondContact CA-OG1 3.32Å; T1016-T1019 PolarHBondContact O-N 3.46Å; T1016-T1019 PolarHBondContact O-OG1 3.25Å; T1016-C1020 WeakPolarHBondContact O-CB 3.38Å; T1016-C1020 PolarHBondContact O-N 3.17Å; T1016-C1020 PolarHBondContact O-SG 3.03Å
1017	L	93	Very high	89.2	Confident	63 Å²	63	33.9 Å²	33.9	33%	0.33	18%	0.182	S	C	.	.	H	α-helix	trans	-64.3	-46.2	177.2	-72.9	171.7	0	0	0	110.9	S1013 S1014 I1015 T1019 C1020 I1021	S1013-L1017 WeakPolarHBondContact O-CG 3.16Å; S1013-L1017 PolarHBondContact O-N 3.05Å; S1014-L1017 PolarHBondContact O-N 3.44Å; I1015-L1017 PolarHBondContact O-N 3.44Å; L1017-T1019 VanDerWaalsContact C-N 3.33Å; L1017-T1019 PolarHBondContact O-N 3.01Å; L1017-C1020 PolarHBondContact O-N 3.33Å; L1017-C1020 VanDerWaalsContact O-N 3.14Å; L1017-I1021 HydrophobicContact CB-CD1 4.41Å; L1017-I1021 WeakPolarHBondContact O-CB 3.15Å; L1017-I1021 VanDerWaalsContact O-CG1 3.29Å; L1017-I1021 WeakPolarHBondContact O-CG1 3.49Å; L1017-I1021 PolarHBondContact O-N 3.45Å
1018	L	92.2	Very high	88.9	Confident	6 Å²	6	34 Å²	34	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-59.1	-43.2	176.9	-70.6	168.1	0	0	0	112.1	S1014 I1015 C1020 D1022 W1024 A1111 F1112 T1115	S1014-L1018 WeakPolarHBondContact O-CG 3.45Å; S1014-L1018 PolarHBondContact O-N 3.03Å; I1015-L1018 PolarHBondContact O-N 3.01Å; L1018-C1020 VanDerWaalsContact C-N 3.33Å; L1018-C1020 PolarHBondContact O-N 3.07Å; L1018-D1022 PolarHBondContact O-N 2.77Å; L1018-W1024 HydrophobicContact CB-CD2 3.99Å; L1018-W1024 HydrophobicContact CB-CE3 4.25Å; L1018-W1024 HydrophobicContact CB-CG 4.22Å; L1018-W1024 HydrophobicContact CD1-CE3 4.27Å; L1018-W1024 HydrophobicContact CD1-CH2 4.17Å; L1018-W1024 HydrophobicContact CD1-CZ2 4.49Å; L1018-W1024 HydrophobicContact CD1-CZ3 4.03Å; L1018-W1024 HydrophobicContact CD2-CD2 4.47Å; L1018-W1024 HydrophobicContact CD2-CH2 4.26Å; L1018-W1024 HydrophobicContact CD2-CZ2 3.8Å; L1018-A1111 HydrophobicContact CD2-CB 4.22Å; L1018-F1112 HydrophobicContact CD1-CD2 4.18Å; L1018-T1115 HydrophobicContact CD2-CG2 4Å; L1018-T1115 WeakPolarHBondContact CD2-OG1 3.46Å; L1018-T1115 HydrophobicContact CG-CG2 4.45Å
1019	T	89.4	Confident	88.7	Confident	4 Å²	4	32.7 Å²	32.7	3%	0.025	17%	0.174	C	C	.	.	H	α-helix	trans	-68.6	-28.6	177	59.7	0	0	0	0	113.9	F701 I1015 T1016 L1017 N1023 W1024	F701-T1019 HydrophobicContact CB-CG2 4.05Å; F701-T1019 HydrophobicContact CD2-CG2 3.58Å; F701-T1019 HydrophobicContact CE2-CG2 4.45Å; F701-T1019 HydrophobicContact CG-CG2 4.21Å; I1015-T1019 HydrophobicContact CG2-CG2 4.38Å; I1015-T1019 VanDerWaalsContact O-CG2 3.28Å; I1015-T1019 WeakPolarHBondContact O-CG2 3.49Å; I1015-T1019 PolarHBondContact O-N 3.11Å; I1015-T1019 PolarHBondContact O-OG1 3.48Å; T1016-T1019 WeakPolarHBondContact CA-OG1 3.32Å; T1016-T1019 PolarHBondContact O-N 3.46Å; T1016-T1019 PolarHBondContact O-OG1 3.25Å; L1017-T1019 VanDerWaalsContact C-N 3.33Å; L1017-T1019 PolarHBondContact O-N 3.01Å; T1019-N1023 WeakPolarHBondContact O-CA 3.4Å; T1019-W1024 HydrophobicContact CG2-CB 4.39Å
1020	C	89.3	Confident	88.4	Confident	50 Å²	50	33.6 Å²	33.6	34%	0.338	18%	0.179	S	C	.	.	H	α-helix	trans	-87.2	-31.4	-177.8	-70.4	0	0	0	0	113.5	K700 T1016 L1017 L1018	K700-C1020 PolarHBondContact NZ-SG 3.17Å; K700-C1020 VanDerWaalsContact NZ-SG 3.44Å; T1016-C1020 WeakPolarHBondContact O-CB 3.38Å; T1016-C1020 PolarHBondContact O-N 3.17Å; T1016-C1020 PolarHBondContact O-SG 3.03Å; L1017-C1020 PolarHBondContact O-N 3.33Å; L1017-C1020 VanDerWaalsContact O-N 3.14Å; L1018-C1020 VanDerWaalsContact C-N 3.33Å; L1018-C1020 PolarHBondContact O-N 3.07Å
1021	I	87.4	Confident	88.1	Confident	110 Å²	110	33.7 Å²	33.7	56%	0.564	18%	0.179	S	C	*	.	H	α-helix	trans	-84.9	-54.1	-177.1	-61.9	168.5	0	0	0	109.9	L1017	L1017-I1021 HydrophobicContact CB-CD1 4.41Å; L1017-I1021 WeakPolarHBondContact O-CB 3.15Å; L1017-I1021 VanDerWaalsContact O-CG1 3.29Å; L1017-I1021 WeakPolarHBondContact O-CG1 3.49Å; L1017-I1021 PolarHBondContact O-N 3.45Å
1022	D	79.4	Confident	87.9	Confident	58 Å²	58	33 Å²	33	31%	0.31	18%	0.176	S	C	.	.	S	Bend	trans	-107.5	7	-169.2	-67.4	-27.1	0	0	0	113.1	L1018 W1024 H1107 A1111	L1018-D1022 PolarHBondContact O-N 2.77Å; D1022-W1024 VanDerWaalsContact C-N 3.31Å; D1022-W1024 PolarHBondContact O-N 3.26Å; D1022-H1107 IonicContact OD1-NE2 2.77Å; D1022-H1107 IonicContact OD2-NE2 3.67Å; D1022-A1111 WeakPolarHBondContact OD2-CB 3.03Å
1023	N	83.4	Confident	87.8	Confident	127 Å²	127	30 Å²	30	68%	0.679	16%	0.16	S	C	*	.			trans	52.8	43	-177.6	-65.4	-44.6	0	0	0	113.8	T1019 K1025	T1019-N1023 WeakPolarHBondContact O-CA 3.4Å; N1023-K1025 PolarHBondContact O-N 3.46Å
1024	W	83.1	Confident	87.7	Confident	10 Å²	10	30.1 Å²	30.1	4%	0.038	16%	0.159	C	C	.	.			trans	-55.7	128.5	-179.6	-79.7	32.9	0	0	0	112.3	L1018 T1019 D1022 E1030 V1033 Q1108 F1112	L1018-W1024 HydrophobicContact CB-CD2 3.99Å; L1018-W1024 HydrophobicContact CB-CE3 4.25Å; L1018-W1024 HydrophobicContact CB-CG 4.22Å; L1018-W1024 HydrophobicContact CD1-CE3 4.27Å; L1018-W1024 HydrophobicContact CD1-CH2 4.17Å; L1018-W1024 HydrophobicContact CD1-CZ2 4.49Å; L1018-W1024 HydrophobicContact CD1-CZ3 4.03Å; L1018-W1024 HydrophobicContact CD2-CD2 4.47Å; L1018-W1024 HydrophobicContact CD2-CH2 4.26Å; L1018-W1024 HydrophobicContact CD2-CZ2 3.8Å; T1019-W1024 HydrophobicContact CG2-CB 4.39Å; D1022-W1024 VanDerWaalsContact C-N 3.31Å; D1022-W1024 PolarHBondContact O-N 3.26Å; W1024-E1030 HydrophobicContact CD2-CG 3.96Å; W1024-E1030 HydrophobicContact CE3-CB 3.9Å; W1024-E1030 HydrophobicContact CE3-CG 3.37Å; W1024-E1030 HydrophobicContact CZ3-CB 4.05Å; W1024-E1030 HydrophobicContact CZ3-CG 3.72Å; W1024-V1033 HydrophobicContact CH2-CG1 4.21Å; W1024-V1033 HydrophobicContact CZ3-CG1 4.2Å; W1024-Q1108 HydrophobicContact CH2-CB 4.16Å; W1024-Q1108 HydrophobicContact CZ2-CB 3.75Å; W1024-Q1108 HydrophobicContact CZ2-CG 3.96Å; W1024-Q1108 WeakPolarHBondContact CZ2-O 3.43Å; W1024-F1112 HydrophobicContact CH2-CB 4.05Å
1025	K	81.8	Confident	87.5	Confident	75 Å²	75	30 Å²	30	33%	0.326	16%	0.159	S	C	.	.			trans	-108.2	158.4	168.3	-65.1	-179.5	-175.7	171.8	0	108.8	P704 N1023 G1027 E1030	P704-K1025 HydrophobicContact CB-CD 4.46Å; N1023-K1025 PolarHBondContact O-N 3.46Å; K1025-G1027 PolarHBondContact O-N 2.84Å; K1025-G1027 VanDerWaalsContact O-N 3.11Å; K1025-E1030 VanDerWaalsContact O-CD 3.29Å; K1025-E1030 WeakPolarHBondContact O-CG 3.3Å
1026	L	82.3	Confident	87.4	Confident	18 Å²	18	28.8 Å²	28.8	9%	0.094	15%	0.152	C	C	.	.			trans	-73.6	107.6	-178.4	-176.5	68.3	0	0	0	111.3	F701 N702 I703 P704 I971 T972 I975	F701-L1026 HydrophobicContact CE1-CB 4.34Å; F701-L1026 HydrophobicContact CE1-CD1 4.1Å; F701-L1026 HydrophobicContact CE2-CB 4.4Å; F701-L1026 HydrophobicContact CZ-CB 3.94Å; F701-L1026 HydrophobicContact CZ-CD1 3.59Å; F701-L1026 HydrophobicContact CZ-CG 4.31Å; N702-L1026 PolarHBondContact O-N 2.95Å; I703-L1026 HydrophobicContact CG1-CD2 4.41Å; P704-L1026 WeakPolarHBondContact CD-O 3.17Å; I971-L1026 HydrophobicContact CG2-CD1 4.35Å; I971-L1026 HydrophobicContact CG2-CD2 4.25Å; I971-L1026 HydrophobicContact CG2-CG 4.17Å; T972-L1026 HydrophobicContact CG2-CD2 3.88Å; I975-L1026 HydrophobicContact CD1-CD1 3.38Å; I975-L1026 HydrophobicContact CD1-CD2 4.14Å; I975-L1026 HydrophobicContact CD1-CG 4.21Å
1027	G	82.2	Confident	87.5	Confident	5 Å²	5	28.8 Å²	28.8	5%	0.052	15%	0.153	C	C	.	.			trans	-122.9	-166.7	170.5	0	0	0	0	0	112.6	K1025 E1030 G1031	K1025-G1027 PolarHBondContact O-N 2.84Å; K1025-G1027 VanDerWaalsContact O-N 3.11Å; G1027-E1030 WeakPolarHBondContact CA-OE2 3.02Å; G1027-E1030 PolarHBondContact N-OE2 3.09Å; G1027-E1030 VanDerWaalsContact N-OE2 3.07Å; G1027-G1031 PolarHBondContact O-N 3.16Å
1028	I	84.7	Confident	87.3	Confident	6 Å²	6	25.9 Å²	25.9	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-70.1	-43.8	-174.8	-61.6	162.7	0	0	0	110.7	F62 I462 I606 S710 I967 I971 L1032	F62-I1028 HydrophobicContact CD1-CD1 3.31Å; F62-I1028 HydrophobicContact CD1-CG1 4.42Å; F62-I1028 HydrophobicContact CD1-CG2 4.17Å; F62-I1028 HydrophobicContact CE1-CB 4.23Å; F62-I1028 HydrophobicContact CE1-CD1 3.68Å; F62-I1028 HydrophobicContact CE1-CG2 3.8Å; F62-I1028 HydrophobicContact CG-CD1 4.35Å; I462-I1028 HydrophobicContact CD1-CG2 4.19Å; I606-I1028 HydrophobicContact CD1-CG2 4.16Å; I606-I1028 HydrophobicContact CG1-CG2 4.19Å; S710-I1028 WeakPolarHBondContact O-CD1 3.42Å; I967-I1028 HydrophobicContact CG2-CD1 3.6Å; I967-I1028 HydrophobicContact CG2-CG1 3.92Å; I971-I1028 HydrophobicContact CD1-CB 4.27Å; I971-I1028 HydrophobicContact CD1-CG1 3.39Å; I971-I1028 HydrophobicContact CG1-CG1 4.36Å; I1028-L1032 WeakPolarHBondContact O-CB 3.36Å; I1028-L1032 PolarHBondContact O-N 3.23Å
1029	I	87.2	Confident	87.2	Confident	17 Å²	17	25.9 Å²	25.9	9%	0.087	14%	0.139	C	C	.	.	H	α-helix	trans	-71.8	-45.1	-179.5	-60.2	176.4	0	0	0	109.8	I462 L465 G1031 L1032 V1033 C1105	I462-I1029 HydrophobicContact CD1-CG1 4.48Å; L465-I1029 HydrophobicContact CD1-CG2 4.14Å; I1029-G1031 VanDerWaalsContact C-N 3.3Å; I1029-G1031 PolarHBondContact O-N 3.39Å; I1029-L1032 PolarHBondContact O-N 3.35Å; I1029-V1033 HydrophobicContact CG2-CG2 4.11Å; I1029-V1033 VanDerWaalsContact O-CB 3.26Å; I1029-V1033 WeakPolarHBondContact O-CB 3.21Å; I1029-V1033 WeakPolarHBondContact O-CG2 3.15Å; I1029-V1033 PolarHBondContact O-N 3.21Å; I1029-C1105 HydrophobicContact CD1-CB 3.43Å; I1029-C1105 VanDerWaalsContact CD1-CB 3.43Å
1030	E	88.2	Confident	87.2	Confident	20 Å²	20	26 Å²	26	9%	0.093	14%	0.14	C	C	.	.	H	α-helix	trans	-61.4	-41.2	177.8	-59.9	86.3	167.7	0	0	110.9	W1024 K1025 G1027 V1033 I1034 Q1108	W1024-E1030 HydrophobicContact CD2-CG 3.96Å; W1024-E1030 HydrophobicContact CE3-CB 3.9Å; W1024-E1030 HydrophobicContact CE3-CG 3.37Å; W1024-E1030 HydrophobicContact CZ3-CB 4.05Å; W1024-E1030 HydrophobicContact CZ3-CG 3.72Å; K1025-E1030 VanDerWaalsContact O-CD 3.29Å; K1025-E1030 WeakPolarHBondContact O-CG 3.3Å; G1027-E1030 WeakPolarHBondContact CA-OE2 3.02Å; G1027-E1030 PolarHBondContact N-OE2 3.09Å; G1027-E1030 VanDerWaalsContact N-OE2 3.07Å; E1030-V1033 PolarHBondContact O-N 2.76Å; E1030-I1034 VanDerWaalsContact O-CB 3.32Å; E1030-I1034 WeakPolarHBondContact O-CB 3.38Å; E1030-I1034 WeakPolarHBondContact O-CD1 3.41Å; E1030-I1034 WeakPolarHBondContact O-CG1 3.28Å; E1030-I1034 PolarHBondContact O-N 3.06Å; E1030-Q1108 PolarHBondContact OE1-NE2 2.88Å
1031	G	88.3	Confident	87.4	Confident	2 Å²	2	23.6 Å²	23.6	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-61.2	-46.5	174.4	0	0	0	0	0	113.6	G1027 I1029 S1035	G1027-G1031 PolarHBondContact O-N 3.16Å; I1029-G1031 VanDerWaalsContact C-N 3.3Å; I1029-G1031 PolarHBondContact O-N 3.39Å; G1031-S1035 PolarHBondContact O-N 3.38Å; G1031-S1035 VanDerWaalsContact O-N 3.16Å
1032	L	89.8	Confident	87.6	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-60.5	-49.8	175.2	176	152.3	0	0	0	110.7	I462 I606 F609 I1028 I1029 I1034 S1035 L1036	I462-L1032 HydrophobicContact CG2-CD1 4.02Å; I606-L1032 HydrophobicContact CG1-CD1 4.37Å; F609-L1032 HydrophobicContact CB-CD1 4.41Å; F609-L1032 HydrophobicContact CD1-CD1 3.52Å; F609-L1032 HydrophobicContact CD1-CD2 4.35Å; F609-L1032 HydrophobicContact CD1-CG 4.19Å; F609-L1032 HydrophobicContact CE1-CD1 3.89Å; F609-L1032 HydrophobicContact CE1-CD2 3.85Å; F609-L1032 HydrophobicContact CE1-CG 4.1Å; F609-L1032 HydrophobicContact CG-CD1 3.92Å; F609-L1032 HydrophobicContact CZ-CD2 4.07Å; I1028-L1032 WeakPolarHBondContact O-CB 3.36Å; I1028-L1032 PolarHBondContact O-N 3.23Å; I1029-L1032 PolarHBondContact O-N 3.35Å; L1032-I1034 PolarHBondContact O-N 2.99Å; L1032-S1035 PolarHBondContact O-N 3.09Å; L1032-S1035 PolarHBondContact O-OG 2.66Å; L1032-L1036 HydrophobicContact CD2-CD1 3.57Å; L1032-L1036 HydrophobicContact CG-CD1 4.25Å; L1032-L1036 VanDerWaalsContact O-CG 3.3Å; L1032-L1036 WeakPolarHBondContact O-CG 3.49Å; L1032-L1036 PolarHBondContact O-N 3.18Å
1033	V	90.7	Very high	88.1	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.3	-43.6	-178.3	165.2	0	0	0	0	112.2	W1024 I1029 E1030 S1035 L1036 A1037 I1109 F1112	W1024-V1033 HydrophobicContact CH2-CG1 4.21Å; W1024-V1033 HydrophobicContact CZ3-CG1 4.2Å; I1029-V1033 HydrophobicContact CG2-CG2 4.11Å; I1029-V1033 VanDerWaalsContact O-CB 3.26Å; I1029-V1033 WeakPolarHBondContact O-CB 3.21Å; I1029-V1033 WeakPolarHBondContact O-CG2 3.15Å; I1029-V1033 PolarHBondContact O-N 3.21Å; E1030-V1033 PolarHBondContact O-N 2.76Å; V1033-S1035 VanDerWaalsContact C-N 3.33Å; V1033-S1035 PolarHBondContact O-N 2.82Å; V1033-L1036 PolarHBondContact O-N 2.98Å; V1033-A1037 PolarHBondContact O-N 3.42Å; V1033-A1037 VanDerWaalsContact O-N 3.1Å; V1033-I1109 HydrophobicContact CG2-CD1 3.9Å; V1033-F1112 HydrophobicContact CB-CG 4.45Å; V1033-F1112 HydrophobicContact CG1-CB 3.71Å; V1033-F1112 HydrophobicContact CG1-CD1 3.51Å; V1033-F1112 HydrophobicContact CG1-CD2 3.02Å; V1033-F1112 HydrophobicContact CG1-CE1 3.73Å; V1033-F1112 HydrophobicContact CG1-CE2 3.26Å; V1033-F1112 HydrophobicContact CG1-CG 3.1Å; V1033-F1112 HydrophobicContact CG1-CZ 3.57Å; V1033-F1112 HydrophobicContact CG2-CD1 4.48Å; V1033-F1112 WeakPolarHBondContact O-CZ 3.37Å
1034	I	90.6	Very high	88.4	Confident	20 Å²	20	10.2 Å²	10.2	10%	0.103	5%	0.053	C	C	.	.	H	α-helix	trans	-63	-39.6	177.7	-71.8	165.9	0	0	0	111.3	F701 I975 V979 I1015 E1030 L1032 L1036 A1037	F701-I1034 HydrophobicContact CE1-CD1 4.34Å; F701-I1034 HydrophobicContact CE2-CD1 4.12Å; F701-I1034 HydrophobicContact CZ-CD1 3.52Å; I975-I1034 HydrophobicContact CG2-CG2 4.33Å; V979-I1034 HydrophobicContact CG2-CG2 3.79Å; I1015-I1034 HydrophobicContact CD1-CG2 4.25Å; I1015-I1034 HydrophobicContact CG1-CG1 4.44Å; E1030-I1034 VanDerWaalsContact O-CB 3.32Å; E1030-I1034 WeakPolarHBondContact O-CB 3.38Å; E1030-I1034 WeakPolarHBondContact O-CD1 3.41Å; E1030-I1034 WeakPolarHBondContact O-CG1 3.28Å; E1030-I1034 PolarHBondContact O-N 3.06Å; L1032-I1034 PolarHBondContact O-N 2.99Å; I1034-L1036 VanDerWaalsContact C-N 3.3Å; I1034-L1036 PolarHBondContact O-N 3.21Å; I1034-A1037 WeakPolarHBondContact O-CB 3.06Å; I1034-A1037 PolarHBondContact O-N 3Å
1035	S	90.4	Very high	88.8	Confident	1 Å²	1	9.8 Å²	9.8	1%	0.007	5%	0.052	C	C	.	.	H	α-helix	trans	-65.5	-32.1	177.5	76.5	0	0	0	0	113.1	N598 G1031 L1032 V1033	N598-S1035 VanDerWaalsContact CG-OG 3.26Å; N598-S1035 PolarHBondContact ND2-OG 3.2Å; N598-S1035 PolarHBondContact OD1-OG 2.89Å; G1031-S1035 PolarHBondContact O-N 3.38Å; G1031-S1035 VanDerWaalsContact O-N 3.16Å; L1032-S1035 PolarHBondContact O-N 3.09Å; L1032-S1035 PolarHBondContact O-OG 2.66Å; V1033-S1035 VanDerWaalsContact C-N 3.33Å; V1033-S1035 PolarHBondContact O-N 2.82Å
1036	L	90.7	Very high	89.3	Confident	7 Å²	7	6.2 Å²	6.2	4%	0.037	4%	0.036	C	C	.	.	H	α-helix	trans	-80.7	-23.4	179.9	-64.7	173.3	0	0	0	113.3	L595 N598 F609 L1032 V1033 I1034 A1038 G1039 L1040	L595-L1036 HydrophobicContact CB-CD2 4.17Å; L595-L1036 HydrophobicContact CD2-CD1 4.14Å; L595-L1036 HydrophobicContact CD2-CD2 3.24Å; L595-L1036 HydrophobicContact CD2-CG 4.33Å; L595-L1036 HydrophobicContact CG-CD2 3.55Å; N598-L1036 WeakPolarHBondContact ND2-CD2 3.33Å; F609-L1036 HydrophobicContact CE1-CD1 3.9Å; F609-L1036 HydrophobicContact CZ-CD1 4.19Å; L1032-L1036 HydrophobicContact CD2-CD1 3.57Å; L1032-L1036 HydrophobicContact CG-CD1 4.25Å; L1032-L1036 VanDerWaalsContact O-CG 3.3Å; L1032-L1036 WeakPolarHBondContact O-CG 3.49Å; L1032-L1036 PolarHBondContact O-N 3.18Å; V1033-L1036 PolarHBondContact O-N 2.98Å; I1034-L1036 VanDerWaalsContact C-N 3.3Å; I1034-L1036 PolarHBondContact O-N 3.21Å; L1036-A1038 VanDerWaalsContact C-N 3.26Å; L1036-A1038 PolarHBondContact O-N 3.32Å; L1036-A1038 VanDerWaalsContact O-N 3.17Å; L1036-G1039 PolarHBondContact O-N 2.99Å; L1036-L1040 HydrophobicContact CB-CD1 4.19Å; L1036-L1040 PolarHBondContact O-N 2.87Å
1037	A	93	Very high	89.6	Confident	5 Å²	5	5.5 Å²	5.5	4%	0.041	3%	0.032	C	C	.	.	H	α-helix	trans	-54.4	-39.8	-171.3	0	0	0	0	0	113.3	L1011 V1033 I1034 G1039 L1040 A1041 F1112 L1116	L1011-A1037 HydrophobicContact CD2-CB 3.57Å; V1033-A1037 PolarHBondContact O-N 3.42Å; V1033-A1037 VanDerWaalsContact O-N 3.1Å; I1034-A1037 WeakPolarHBondContact O-CB 3.06Å; I1034-A1037 PolarHBondContact O-N 3Å; A1037-G1039 PolarHBondContact O-N 2.9Å; A1037-L1040 PolarHBondContact O-N 2.91Å; A1037-A1041 WeakPolarHBondContact O-CB 3.48Å; A1037-A1041 PolarHBondContact O-N 3.31Å; A1037-F1112 HydrophobicContact CB-CE2 3.89Å; A1037-F1112 HydrophobicContact CB-CZ 4.07Å; A1037-L1116 HydrophobicContact CB-CD1 4.03Å; A1037-L1116 HydrophobicContact CB-CD2 4.36Å
1038	A	89.8	Confident	89.9	Confident	2 Å²	2	5.4 Å²	5.4	2%	0.017	3%	0.031	C	C	.	.	H	α-helix	trans	-64.6	-38.9	179.1	0	0	0	0	0	112.8	A982 V983 L1011 L1036 I1042	A982-A1038 HydrophobicContact CB-CB 3.88Å; V983-A1038 HydrophobicContact CG2-CB 4.08Å; L1011-A1038 HydrophobicContact CD1-CB 3.89Å; L1036-A1038 VanDerWaalsContact C-N 3.26Å; L1036-A1038 PolarHBondContact O-N 3.32Å; L1036-A1038 VanDerWaalsContact O-N 3.17Å; A1038-I1042 WeakPolarHBondContact O-CG2 3.42Å
1039	G	88.6	Confident	90.1	Very high	5 Å²	5	5.2 Å²	5.2	5%	0.052	3%	0.03	C	C	.	.	H	α-helix	trans	-72.5	-28.4	-179.9	0	0	0	0	0	113.6	T591 L1036 A1037 I1042	T591-G1039 WeakPolarHBondContact CG2-O 3.39Å; L1036-G1039 PolarHBondContact O-N 2.99Å; A1037-G1039 PolarHBondContact O-N 2.9Å; G1039-I1042 WeakPolarHBondContact O-CG2 3.43Å
1040	L	90.7	Very high	90.2	Very high	7 Å²	7	6.7 Å²	6.7	4%	0.037	4%	0.035	C	C	.	.	H	α-helix	trans	-90.9	-31.6	-179.9	-61.4	170	0	0	0	113.3	L469 L473 T591 L1036 A1037 I1042 F1112 L1116 M1117	L469-L1040 HydrophobicContact CD1-CD1 3.75Å; L469-L1040 HydrophobicContact CD1-CD2 3.93Å; L473-L1040 HydrophobicContact CD1-CD2 3.5Å; L473-L1040 HydrophobicContact CD2-CD2 3.79Å; L473-L1040 HydrophobicContact CG-CD2 4.13Å; T591-L1040 HydrophobicContact CG2-CD2 4.07Å; L1036-L1040 HydrophobicContact CB-CD1 4.19Å; L1036-L1040 PolarHBondContact O-N 2.87Å; A1037-L1040 PolarHBondContact O-N 2.91Å; L1040-I1042 VanDerWaalsContact C-N 3.33Å; L1040-I1042 PolarHBondContact O-N 3.34Å; L1040-F1112 HydrophobicContact CD1-CE1 3.82Å; L1040-F1112 HydrophobicContact CD1-CZ 4.06Å; L1040-L1116 HydrophobicContact CB-CD2 3.73Å; L1040-L1116 HydrophobicContact CD1-CD2 4.37Å; L1040-M1117 HydrophobicContact CB-CE 4.03Å
1041	A	93.4	Very high	90.1	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-79.9	-13.3	-176	0	0	0	0	0	114.4	L1007 L1011 A1037 L1116 S1120 C1124	L1007-A1041 HydrophobicContact CD1-CB 4.01Å; L1011-A1041 HydrophobicContact CD2-CB 4.36Å; A1037-A1041 WeakPolarHBondContact O-CB 3.48Å; A1037-A1041 PolarHBondContact O-N 3.31Å; A1041-L1116 HydrophobicContact CB-CD1 3.93Å; A1041-L1116 HydrophobicContact CB-CD2 4.35Å; A1041-L1116 HydrophobicContact CB-CG 4.17Å; A1041-S1120 WeakPolarHBondContact O-CB 3.48Å; A1041-C1124 PolarHBondContact O-SG 3.38Å; A1041-C1124 VanDerWaalsContact O-SG 3.32Å
1042	I	91.6	Very high	90	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.036	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-14.2	-172.1	-173.6	166.4	0	0	0	113.7	S590 A986 I990 L1007 A1038 G1039 L1040 C1045 I1046	S590-I1042 WeakPolarHBondContact OG-CG2 3.22Å; A986-I1042 HydrophobicContact CB-CD1 3.35Å; I990-I1042 HydrophobicContact CD1-CD1 3.56Å; I990-I1042 HydrophobicContact CD1-CG1 4.01Å; I990-I1042 HydrophobicContact CG1-CD1 3.82Å; I990-I1042 HydrophobicContact CG1-CG1 4.42Å; L1007-I1042 HydrophobicContact CD1-CB 4.29Å; L1007-I1042 HydrophobicContact CD2-CD1 4.34Å; A1038-I1042 WeakPolarHBondContact O-CG2 3.42Å; G1039-I1042 WeakPolarHBondContact O-CG2 3.43Å; L1040-I1042 VanDerWaalsContact C-N 3.33Å; L1040-I1042 PolarHBondContact O-N 3.34Å; I1042-C1045 HydrophobicContact CG1-CB 4.12Å; I1042-C1045 WeakPolarHBondContact O-CA 3.09Å; I1042-C1045 VanDerWaalsContact O-CB 3.25Å; I1042-C1045 WeakPolarHBondContact O-CB 3.32Å; I1042-C1045 PolarHBondContact O-N 3.14Å; I1042-I1046 HydrophobicContact CD1-CD1 4.18Å; I1042-I1046 HydrophobicContact CD1-CG1 4.39Å; I1042-I1046 HydrophobicContact CG1-CD1 3.89Å; I1042-I1046 HydrophobicContact CG1-CG1 3.99Å; I1042-I1046 HydrophobicContact CG2-CD1 4.06Å; I1042-I1046 PolarHBondContact O-N 3.01Å
1043	D	89.2	Confident	89.7	Confident	8 Å²	8	7.3 Å²	7.3	4%	0.043	4%	0.041	C	C	.	.	H	α-helix	trans	-54	-46.2	-174.7	-60.9	-27.9	0	0	0	113.2	T587 C1045 I1046 H1047	T587-D1043 WeakPolarHBondContact CB-OD1 3.41Å; T587-D1043 HydrophobicContact CG2-CB 4.1Å; D1043-C1045 VanDerWaalsContact C-N 3.31Å; D1043-C1045 PolarHBondContact O-N 3.45Å; D1043-I1046 PolarHBondContact O-N 3.43Å; D1043-H1047 PolarHBondContact O-CD2 2.5Å; D1043-H1047 PolarHBondContact O-N 3.15Å
1044	P	90.4	Very high	89.3	Confident	6 Å²	6	10.4 Å²	10.4	4%	0.039	6%	0.057	C	C	.	.	H	α-helix	trans	-59.9	-36.9	173.9	-24.6	35.5	0	0	0	113.9	L1048 I1084 C1124	P1044-L1048 WeakPolarHBondContact O-CB 3.42Å; P1044-L1048 PolarHBondContact O-N 3.47Å; P1044-L1048 VanDerWaalsContact O-N 3.09Å; P1044-I1084 HydrophobicContact CB-CG2 3.62Å; P1044-I1084 HydrophobicContact CG-CG2 4.15Å; P1044-C1124 HydrophobicContact CB-CB 4Å; P1044-C1124 HydrophobicContact CG-CB 4.44Å
1045	C	91.5	Very high	88.7	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65.8	-44.2	176.9	-81.5	0	0	0	0	111.1	I990 I1042 D1043 A1049 C1124 L1128	I990-C1045 HydrophobicContact CD1-CB 4.2Å; I1042-C1045 HydrophobicContact CG1-CB 4.12Å; I1042-C1045 WeakPolarHBondContact O-CA 3.09Å; I1042-C1045 VanDerWaalsContact O-CB 3.25Å; I1042-C1045 WeakPolarHBondContact O-CB 3.32Å; I1042-C1045 PolarHBondContact O-N 3.14Å; D1043-C1045 VanDerWaalsContact C-N 3.31Å; D1043-C1045 PolarHBondContact O-N 3.45Å; C1045-A1049 WeakPolarHBondContact O-CB 3.49Å; C1045-A1049 PolarHBondContact O-N 3.47Å; C1045-C1124 WeakPolarHBondContact SG-CB 3.01Å; C1045-L1128 HydrophobicContact CB-CD2 4.48Å
1046	I	91.1	Very high	87.8	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62.9	-51.5	179.5	-82.9	164.3	0	0	0	110.8	L586 T587 I993 I1042 D1043 L1048 A1049 Y1050	L586-I1046 HydrophobicContact CB-CG2 4.35Å; L586-I1046 HydrophobicContact CD2-CB 4.31Å; L586-I1046 HydrophobicContact CD2-CG1 4.22Å; L586-I1046 HydrophobicContact CD2-CG2 3.27Å; L586-I1046 HydrophobicContact CG-CD1 4.25Å; L586-I1046 HydrophobicContact CG-CG1 4.46Å; L586-I1046 HydrophobicContact CG-CG2 3.88Å; T587-I1046 HydrophobicContact CG2-CB 4.39Å; T587-I1046 HydrophobicContact CG2-CG2 3.8Å; I993-I1046 HydrophobicContact CD1-CG1 4.44Å; I1042-I1046 HydrophobicContact CD1-CD1 4.18Å; I1042-I1046 HydrophobicContact CD1-CG1 4.39Å; I1042-I1046 HydrophobicContact CG1-CD1 3.89Å; I1042-I1046 HydrophobicContact CG1-CG1 3.99Å; I1042-I1046 HydrophobicContact CG2-CD1 4.06Å; I1042-I1046 PolarHBondContact O-N 3.01Å; D1043-I1046 PolarHBondContact O-N 3.43Å; I1046-L1048 VanDerWaalsContact C-N 3.32Å; I1046-L1048 PolarHBondContact O-N 2.96Å; I1046-A1049 PolarHBondContact O-N 2.87Å; I1046-Y1050 WeakPolarHBondContact O-CB 3.44Å; I1046-Y1050 PolarHBondContact O-N 3.28Å
1047	H	89.7	Confident	86.5	Confident	4 Å²	4	18.3 Å²	18.3	2%	0.019	10%	0.099	C	C	.	.	H	α-helix	trans	-59.5	-43.9	179.9	-72.8	-55.4	0	0	0	112	D476 S583 T587 D1043 A1051 I1084	D476-H1047 IonicContact OD1-NE2 3.94Å; D476-H1047 IonicContact OD2-NE2 3.85Å; S583-H1047 PolarHBondContact OG-CE1 3.39Å; S583-H1047 VanDerWaalsContact OG-CE1 3.3Å; S583-H1047 PolarHBondContact OG-ND1 2.95Å; T587-H1047 WeakPolarHBondContact CG2-NE2 3.41Å; D1043-H1047 PolarHBondContact O-CD2 2.5Å; D1043-H1047 PolarHBondContact O-N 3.15Å; H1047-A1051 WeakPolarHBondContact O-CB 3.29Å; H1047-A1051 PolarHBondContact O-N 3.22Å; H1047-I1084 HydrophobicContact CB-CD1 3.74Å; H1047-I1084 HydrophobicContact CB-CG1 3.84Å
1048	L	89.1	Confident	84.8	Confident	3 Å²	3	24 Å²	24	2%	0.016	13%	0.133	C	C	.	.	H	α-helix	trans	-68	-46.5	178.3	-176.6	68.5	0	0	0	111.7	P1044 I1046 Y1050 A1051 V1052 V1076 L1077 L1128 T1129 L1132	P1044-L1048 WeakPolarHBondContact O-CB 3.42Å; P1044-L1048 PolarHBondContact O-N 3.47Å; P1044-L1048 VanDerWaalsContact O-N 3.09Å; I1046-L1048 VanDerWaalsContact C-N 3.32Å; I1046-L1048 PolarHBondContact O-N 2.96Å; L1048-Y1050 PolarHBondContact O-N 3.17Å; L1048-A1051 PolarHBondContact O-N 3.07Å; L1048-V1052 HydrophobicContact CD1-CG2 4.23Å; L1048-V1052 HydrophobicContact CG-CG2 4.35Å; L1048-V1052 WeakPolarHBondContact O-CB 3.46Å; L1048-V1052 VanDerWaalsContact O-CG2 3.26Å; L1048-V1052 WeakPolarHBondContact O-CG2 3.49Å; L1048-V1052 PolarHBondContact O-N 3Å; L1048-V1076 HydrophobicContact CD1-CG1 4.09Å; L1048-L1077 HydrophobicContact CD1-CD2 4.25Å; L1048-L1128 HydrophobicContact CD2-CD2 3.89Å; L1048-L1128 HydrophobicContact CD2-CG 4.07Å; L1048-T1129 HydrophobicContact CD1-CG2 4.03Å; L1048-T1129 HydrophobicContact CD2-CG2 3.4Å; L1048-T1129 VanDerWaalsContact CD2-CG2 3.4Å; L1048-T1129 HydrophobicContact CG-CG2 4.37Å; L1048-L1132 HydrophobicContact CD2-CD1 4.46Å
1049	A	88.3	Confident	82.7	Confident	2 Å²	2	26 Å²	26	2%	0.017	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-42.1	-177.6	0	0	0	0	0	111.9	I990 L999 C1045 I1046 S1053	I990-A1049 HydrophobicContact CG2-CB 4.24Å; L999-A1049 HydrophobicContact CD2-CB 3.97Å; L999-A1049 HydrophobicContact CG-CB 4.4Å; C1045-A1049 WeakPolarHBondContact O-CB 3.49Å; C1045-A1049 PolarHBondContact O-N 3.47Å; I1046-A1049 PolarHBondContact O-N 2.87Å; A1049-S1053 WeakPolarHBondContact O-CB 3.02Å; A1049-S1053 PolarHBondContact O-N 3.36Å; A1049-S1053 PolarHBondContact O-OG 3.09Å
1050	Y	88.4	Confident	80.3	Confident	48 Å²	48	28.3 Å²	28.3	19%	0.188	18%	0.178	C	C	.	.	H	α-helix	trans	-59.4	-51.3	174.3	-178.6	-108.8	0	0	0	110.9	H579 P582 I993 I1046 L1048 V1052 S1053 D1054	H579-Y1050 WeakPolarHBondContact O-CE1 3.27Å; P582-Y1050 HydrophobicContact CB-CE2 4.22Å; I993-Y1050 HydrophobicContact CG2-CD2 3.72Å; I993-Y1050 HydrophobicContact CG2-CG 4.36Å; I1046-Y1050 WeakPolarHBondContact O-CB 3.44Å; I1046-Y1050 PolarHBondContact O-N 3.28Å; L1048-Y1050 PolarHBondContact O-N 3.17Å; Y1050-V1052 PolarHBondContact O-N 3.47Å; Y1050-S1053 PolarHBondContact O-N 2.96Å; Y1050-S1053 VanDerWaalsContact O-N 3.15Å; Y1050-S1053 PolarHBondContact O-OG 3.31Å; Y1050-D1054 WeakPolarHBondContact O-CB 3.36Å; Y1050-D1054 PolarHBondContact O-N 3.13Å
1051	A	86.3	Confident	77.9	Confident	7 Å²	7	39 Å²	39	6%	0.058	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-34.5	-177.4	0	0	0	0	0	114.4	H1047 L1048 K1055 V1076 L1080	H1047-A1051 WeakPolarHBondContact O-CB 3.29Å; H1047-A1051 PolarHBondContact O-N 3.22Å; L1048-A1051 PolarHBondContact O-N 3.07Å; A1051-K1055 PolarHBondContact O-N 3.04Å; A1051-V1076 HydrophobicContact CB-CG1 3.67Å; A1051-L1080 HydrophobicContact CB-CD1 3.17Å
1052	V	86.5	Confident	75.1	Confident	13 Å²	13	51.1 Å²	51.1	8%	0.079	26%	0.264	C	S	.	.	H	α-helix	trans	-67.7	-45.8	172	171.9	0	0	0	0	109.7	L1048 Y1050 D1054 K1055 C1056 C1068 L1073 V1076	L1048-V1052 HydrophobicContact CD1-CG2 4.23Å; L1048-V1052 HydrophobicContact CG-CG2 4.35Å; L1048-V1052 WeakPolarHBondContact O-CB 3.46Å; L1048-V1052 VanDerWaalsContact O-CG2 3.26Å; L1048-V1052 WeakPolarHBondContact O-CG2 3.49Å; L1048-V1052 PolarHBondContact O-N 3Å; Y1050-V1052 PolarHBondContact O-N 3.47Å; V1052-D1054 VanDerWaalsContact C-N 3.32Å; V1052-D1054 PolarHBondContact O-N 3.24Å; V1052-K1055 PolarHBondContact O-N 3.4Å; V1052-C1056 VanDerWaalsContact O-CB 3.31Å; V1052-C1056 WeakPolarHBondContact O-CB 3.49Å; V1052-C1056 PolarHBondContact O-N 3.01Å; V1052-C1056 PolarHBondContact O-SG 3.28Å; V1052-C1068 HydrophobicContact CG1-CB 3.97Å; V1052-L1073 HydrophobicContact CG2-CD1 4.11Å; V1052-V1076 HydrophobicContact CG2-CG1 4.37Å
1053	S	84.5	Confident	72.9	Confident	15 Å²	15	54.5 Å²	54.5	11%	0.105	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-39.4	179.6	73.8	0	0	0	0	112.8	A1049 Y1050 N1057	A1049-S1053 WeakPolarHBondContact O-CB 3.02Å; A1049-S1053 PolarHBondContact O-N 3.36Å; A1049-S1053 PolarHBondContact O-OG 3.09Å; Y1050-S1053 PolarHBondContact O-N 2.96Å; Y1050-S1053 VanDerWaalsContact O-N 3.15Å; Y1050-S1053 PolarHBondContact O-OG 3.31Å; S1053-N1057 VanDerWaalsContact O-CB 3.23Å; S1053-N1057 WeakPolarHBondContact O-CB 3.34Å; S1053-N1057 PolarHBondContact O-N 3.39Å; S1053-N1057 PolarHBondContact O-ND2 2.02Å; S1053-N1057 VanDerWaalsContact O-ND2 3.12Å
1054	D	81.1	Confident	70.9	Confident	65 Å²	65	61.2 Å²	61.2	35%	0.348	32%	0.318	S	S	.	.	H	α-helix	trans	-67.7	-46.1	-178.8	-171.1	44	0	0	0	111.7	H579 Y1050 V1052	H579-D1054 IonicContact CE1-OD2 3.04Å; H579-D1054 PolarHBondContact CE1-OD2 3.03Å; H579-D1054 IonicContact ND1-OD2 3.06Å; H579-D1054 PolarHBondContact ND1-OD2 3.27Å; Y1050-D1054 WeakPolarHBondContact O-CB 3.36Å; Y1050-D1054 PolarHBondContact O-N 3.13Å; V1052-D1054 VanDerWaalsContact C-N 3.32Å; V1052-D1054 PolarHBondContact O-N 3.24Å
1055	K	77.8	Confident	69	Low	62 Å²	62	69.9 Å²	69.9	27%	0.27	36%	0.358	S	S	.	.	H	α-helix	trans	-73.9	-36.8	179.6	-66.7	-163.5	-161.9	171.1	0	113.4	A1051 V1052 T1058 I1075 V1076 S1079	A1051-K1055 PolarHBondContact O-N 3.04Å; V1052-K1055 PolarHBondContact O-N 3.4Å; K1055-T1058 PolarHBondContact O-OG1 3.35Å; K1055-I1075 PolarHBondContact NZ-O 3.47Å; K1055-V1076 HydrophobicContact CB-CG2 4.44Å; K1055-V1076 HydrophobicContact CD-CG2 3.61Å; K1055-V1076 HydrophobicContact CG-CG2 4.23Å; K1055-S1079 PolarHBondContact NZ-OG 3.28Å; K1055-S1079 VanDerWaalsContact NZ-OG 3.09Å
1056	C	72	Confident	67.1	Low	31 Å²	31	73.1 Å²	73.1	21%	0.209	38%	0.38	C	S	.	.	H	α-helix	trans	-91.1	-14.7	-168.4	-39.4	0	0	0	0	113.3	V1052 T1058 C1068	V1052-C1056 VanDerWaalsContact O-CB 3.31Å; V1052-C1056 WeakPolarHBondContact O-CB 3.49Å; V1052-C1056 PolarHBondContact O-N 3.01Å; V1052-C1056 PolarHBondContact O-SG 3.28Å; C1056-T1058 VanDerWaalsContact C-N 3.32Å; C1056-T1058 PolarHBondContact O-N 3.05Å; C1056-C1068 HydrophobicContact CB-CB 3.86Å; C1056-C1068 WeakPolarHBondContact CB-SG 3.28Å; C1056-C1068 WeakPolarHBondContact SG-CB 2.97Å; C1056-C1068 CovalentContact SG-SG 2.03Å; C1056-C1068 PolarHBondContact SG-SG 3.2Å
1057	N	63.7	Low	65.7	Low	102 Å²	102	74 Å²	74	55%	0.545	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	1.5	174.8	-75.1	-22.5	0	0	0	114.6	S1053 G1059	S1053-N1057 VanDerWaalsContact O-CB 3.23Å; S1053-N1057 WeakPolarHBondContact O-CB 3.34Å; S1053-N1057 PolarHBondContact O-N 3.39Å; S1053-N1057 PolarHBondContact O-ND2 2.02Å; S1053-N1057 VanDerWaalsContact O-ND2 3.12Å; N1057-G1059 PolarHBondContact O-N 2.99Å
1058	T	56.3	Low	64.8	Low	124 Å²	124	74.7 Å²	74.7	76%	0.761	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-1.7	-178.9	53.8	0	0	0	0	114.1	K1055 C1056	K1055-T1058 PolarHBondContact O-OG1 3.35Å; C1056-T1058 VanDerWaalsContact C-N 3.32Å; C1056-T1058 PolarHBondContact O-N 3.05Å
1059	G	46.7	Very low	64.3	Low	43 Å²	43	76.9 Å²	76.9	44%	0.443	41%	0.406	S	S	.	.	S	Bend	trans	-95	136.5	168.8	0	0	0	0	0	111.6	N1057	N1057-G1059 PolarHBondContact O-N 2.99Å
1060	G	38.2	Very low	64	Low	55 Å²	55	80.7 Å²	80.7	57%	0.567	42%	0.42	S	S	*	.			trans	-47.9	163.5	-171.6	0	0	0	0	0	116.9	R1062 C1063	G1060-R1062 PolarHBondContact O-N 3.34Å; G1060-C1063 PolarHBondContact O-N 2.93Å
1061	W	40.3	Very low	63.8	Low	230 Å²	230	84.2 Å²	84.2	87%	0.871	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-47.4	-22.6	-168.6	-71.2	52	0	0	0	115.9	C1063	W1061-C1063 PolarHBondContact O-N 3.34Å
1062	R	35	Very low	63.7	Low	256 Å²	256	86.9 Å²	86.9	97%	0.966	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-70.3	-7.4	175.7	-83.9	-178.3	169.6	162.6	-2.8	115.1	G1060	G1060-R1062 PolarHBondContact O-N 3.34Å
1063	C	45.8	Very low	63.6	Low	70 Å²	70	86.4 Å²	86.4	47%	0.473	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-107.1	14.7	-177.3	-68.2	0	0	0	0	115.2	G1060 W1061 Q1065 S1066	G1060-C1063 PolarHBondContact O-N 2.93Å; W1061-C1063 PolarHBondContact O-N 3.34Å; C1063-Q1065 PolarHBondContact O-N 3.1Å; C1063-S1066 PolarHBondContact O-N 2.93Å; C1063-S1066 VanDerWaalsContact O-N 3.07Å; C1063-S1066 PolarHBondContact O-OG 3.45Å; C1063-S1066 VanDerWaalsContact O-OG 3.07Å
1064	Q	46.6	Very low	63.7	Low	149 Å²	149	87.3 Å²	87.3	70%	0.696	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-2	-175.5	-93.3	172.4	-34.8	0	0	116.7
1065	Q	49.4	Very low	63.9	Low	188 Å²	188	88.7 Å²	88.7	88%	0.879	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	2.4	176.9	-89.1	166.5	-19.9	0	0	114.7	C1063 V1067	C1063-Q1065 PolarHBondContact O-N 3.1Å; Q1065-V1067 PolarHBondContact O-N 3.07Å
1066	S	52.7	Low	64.3	Low	68 Å²	68	85.8 Å²	85.8	48%	0.476	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-81.4	121.9	179.8	56.2	0	0	0	0	112	C1063	C1063-S1066 PolarHBondContact O-N 2.93Å; C1063-S1066 VanDerWaalsContact O-N 3.07Å; C1063-S1066 PolarHBondContact O-OG 3.45Å; C1063-S1066 VanDerWaalsContact O-OG 3.07Å
1067	V	61.7	Low	65.1	Low	20 Å²	20	84.4 Å²	84.4	12%	0.121	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-56	142	165.3	-177.5	0	0	0	0	109.2	L998 Q1065 S1069 A1135 D1136 F1139	L998-V1067 HydrophobicContact CD2-CG2 3.76Å; Q1065-V1067 PolarHBondContact O-N 3.07Å; V1067-S1069 PolarHBondContact O-N 2.91Å; V1067-A1135 HydrophobicContact CG1-CB 4.28Å; V1067-D1136 HydrophobicContact CB-CB 4.48Å; V1067-D1136 HydrophobicContact CG1-CB 3.87Å; V1067-F1139 HydrophobicContact CG2-CD2 3.57Å; V1067-F1139 HydrophobicContact CG2-CE2 4.08Å; V1067-F1139 HydrophobicContact CG2-CG 4.3Å
1068	C	71	Confident	66.1	Low	18 Å²	18	82.3 Å²	82.3	12%	0.122	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-65.7	133	-175.7	-159.9	0	0	0	0	111.5	V1052 C1056 N1072	V1052-C1068 HydrophobicContact CG1-CB 3.97Å; C1056-C1068 HydrophobicContact CB-CB 3.86Å; C1056-C1068 WeakPolarHBondContact CB-SG 3.28Å; C1056-C1068 WeakPolarHBondContact SG-CB 2.97Å; C1056-C1068 CovalentContact SG-SG 2.03Å; C1056-C1068 PolarHBondContact SG-SG 3.2Å; C1068-N1072 WeakPolarHBondContact SG-CB 3.23Å
1069	S	78.7	Confident	67.4	Low	48 Å²	48	76.7 Å²	76.7	34%	0.336	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-59.3	144.7	-179.4	74.4	0	0	0	0	111.4	V1067 N1071 N1072 L1073	V1067-S1069 PolarHBondContact O-N 2.91Å; S1069-N1071 PolarHBondContact O-N 3.42Å; S1069-N1071 VanDerWaalsContact O-N 3.09Å; S1069-N1072 PolarHBondContact O-N 2.94Å; S1069-N1072 VanDerWaalsContact OG-CG 3.32Å; S1069-N1072 PolarHBondContact OG-N 3.31Å; S1069-N1072 PolarHBondContact OG-ND2 3.03Å; S1069-L1073 PolarHBondContact O-N 3.41Å
1070	R	82.4	Confident	69.2	Low	83 Å²	83	75.8 Å²	75.8	31%	0.313	38%	0.38	S	S	.	.	H	α-helix	trans	-47.9	-37.7	175.2	-75.6	169.4	171.5	178.2	-10.7	114.4	I674 N677 L1073 L1074 D1136	I674-R1070 HydrophobicContact CG2-CB 4.18Å; I674-R1070 HydrophobicContact CG2-CG 3.95Å; N677-R1070 PolarHBondContact ND2-NH2 3.3Å; R1070-L1073 PolarHBondContact O-N 2.75Å; R1070-L1074 WeakPolarHBondContact O-CB 3.25Å; R1070-L1074 PolarHBondContact O-N 3.47Å; R1070-D1136 WeakPolarHBondContact CG-OD2 3.47Å; R1070-D1136 PolarHBondContact N-OD2 3.04Å; R1070-D1136 VanDerWaalsContact N-OD2 3.09Å
1071	N	82.4	Confident	71.6	Confident	122 Å²	122	73.2 Å²	73.2	65%	0.652	35%	0.354	S	S	*	.	H	α-helix	trans	-67	-44.8	178.4	-72.3	-7	0	0	0	111.3	S1069 L1073 L1074 I1075	S1069-N1071 PolarHBondContact O-N 3.42Å; S1069-N1071 VanDerWaalsContact O-N 3.09Å; N1071-L1073 VanDerWaalsContact C-N 3.33Å; N1071-L1073 PolarHBondContact O-N 2.85Å; N1071-L1074 PolarHBondContact O-N 3.37Å; N1071-I1075 VanDerWaalsContact O-CG1 3.26Å; N1071-I1075 WeakPolarHBondContact O-CG1 3.47Å; N1071-I1075 PolarHBondContact O-N 2.9Å
1072	N	84.2	Confident	73.8	Confident	63 Å²	63	63.3 Å²	63.3	34%	0.337	32%	0.319	S	S	.	.	H	α-helix	trans	-64.9	-40	176.8	-71.3	-6.9	0	0	0	111.1	C1068 S1069 L1074 I1075 V1076	C1068-N1072 WeakPolarHBondContact SG-CB 3.23Å; S1069-N1072 PolarHBondContact O-N 2.94Å; S1069-N1072 VanDerWaalsContact OG-CG 3.32Å; S1069-N1072 PolarHBondContact OG-N 3.31Å; S1069-N1072 PolarHBondContact OG-ND2 3.03Å; N1072-L1074 PolarHBondContact O-N 3.37Å; N1072-I1075 PolarHBondContact O-N 3.43Å; N1072-V1076 WeakPolarHBondContact O-CG2 3.31Å; N1072-V1076 PolarHBondContact O-N 3.35Å
1073	L	85.5	Confident	76.4	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-60.2	-44.9	174.3	-172.2	68.8	0	0	0	111.5	I674 V1052 S1069 R1070 N1071 I1075 V1076 L1077 L1132 A1133	I674-L1073 HydrophobicContact CG1-CD2 4.5Å; V1052-L1073 HydrophobicContact CG2-CD1 4.11Å; S1069-L1073 PolarHBondContact O-N 3.41Å; R1070-L1073 PolarHBondContact O-N 2.75Å; N1071-L1073 VanDerWaalsContact C-N 3.33Å; N1071-L1073 PolarHBondContact O-N 2.85Å; L1073-I1075 VanDerWaalsContact C-N 3.3Å; L1073-I1075 PolarHBondContact O-N 3.34Å; L1073-V1076 WeakPolarHBondContact O-CB 3.33Å; L1073-V1076 PolarHBondContact O-N 2.89Å; L1073-V1076 VanDerWaalsContact O-N 3.15Å; L1073-L1077 HydrophobicContact CG-CD1 4.3Å; L1073-L1077 WeakPolarHBondContact O-CG 3.31Å; L1073-L1077 PolarHBondContact O-N 3.24Å; L1073-L1132 HydrophobicContact CD1-CD1 4.46Å; L1073-L1132 HydrophobicContact CD2-CB 4.35Å; L1073-A1133 HydrophobicContact CD2-CB 4.14Å
1074	L	87.1	Confident	78.6	Confident	34 Å²	34	47.9 Å²	47.9	18%	0.178	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-39.2	176	-176.9	63.6	0	0	0	112.1	N670 K671 I674 R1070 N1071 N1072 L1077 N1078	N670-L1074 HydrophobicContact CB-CD1 3.92Å; K671-L1074 HydrophobicContact CG-CD1 4.23Å; K671-L1074 HydrophobicContact CG-CD2 4.38Å; I674-L1074 HydrophobicContact CD1-CB 3.73Å; I674-L1074 HydrophobicContact CD1-CD1 4Å; I674-L1074 HydrophobicContact CD1-CG 4.41Å; R1070-L1074 WeakPolarHBondContact O-CB 3.25Å; R1070-L1074 PolarHBondContact O-N 3.47Å; N1071-L1074 PolarHBondContact O-N 3.37Å; N1072-L1074 PolarHBondContact O-N 3.37Å; L1074-L1077 PolarHBondContact O-N 3.47Å; L1074-N1078 WeakPolarHBondContact O-CB 3.49Å; L1074-N1078 VanDerWaalsContact O-CG 3.29Å; L1074-N1078 PolarHBondContact O-N 2.03Å; L1074-N1078 PolarHBondContact O-ND2 3.11Å
1075	I	85	Confident	80.6	Confident	93 Å²	93	42.3 Å²	42.3	48%	0.477	23%	0.228	S	C	.	.	H	α-helix	trans	-65.8	-39.9	176.2	-61.5	164.3	0	0	0	110.4	K1055 N1071 N1072 L1073 S1079	K1055-I1075 PolarHBondContact NZ-O 3.47Å; N1071-I1075 VanDerWaalsContact O-CG1 3.26Å; N1071-I1075 WeakPolarHBondContact O-CG1 3.47Å; N1071-I1075 PolarHBondContact O-N 2.9Å; N1072-I1075 PolarHBondContact O-N 3.43Å; L1073-I1075 VanDerWaalsContact C-N 3.3Å; L1073-I1075 PolarHBondContact O-N 3.34Å; I1075-S1079 PolarHBondContact O-N 2.94Å; I1075-S1079 VanDerWaalsContact O-N 3.15Å; I1075-S1079 PolarHBondContact O-OG 2.89Å
1076	V	86.6	Confident	82.5	Confident	2 Å²	2	34 Å²	34	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-60.5	-49.8	173.2	175.1	0	0	0	0	111.1	L1048 A1051 V1052 K1055 N1072 L1073 N1078 S1079 L1080	L1048-V1076 HydrophobicContact CD1-CG1 4.09Å; A1051-V1076 HydrophobicContact CB-CG1 3.67Å; V1052-V1076 HydrophobicContact CG2-CG1 4.37Å; K1055-V1076 HydrophobicContact CB-CG2 4.44Å; K1055-V1076 HydrophobicContact CD-CG2 3.61Å; K1055-V1076 HydrophobicContact CG-CG2 4.23Å; N1072-V1076 WeakPolarHBondContact O-CG2 3.31Å; N1072-V1076 PolarHBondContact O-N 3.35Å; L1073-V1076 WeakPolarHBondContact O-CB 3.33Å; L1073-V1076 PolarHBondContact O-N 2.89Å; L1073-V1076 VanDerWaalsContact O-N 3.15Å; V1076-N1078 PolarHBondContact O-N 3.45Å; V1076-S1079 WeakPolarHBondContact CA-OG 3.32Å; V1076-S1079 PolarHBondContact O-N 2.98Å; V1076-S1079 VanDerWaalsContact O-N 3.1Å; V1076-S1079 PolarHBondContact O-OG 3.39Å; V1076-L1080 PolarHBondContact O-N 2.93Å
1077	L	87.4	Confident	84.3	Confident	1 Å²	1	31 Å²	31	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-41.2	-178.8	-67.5	172.7	0	0	0	112.7	N670 I674 L1048 L1073 L1074 S1079 G1081 Y1125 T1129	N670-L1077 HydrophobicContact CB-CB 4.33Å; I674-L1077 HydrophobicContact CD1-CD1 4.21Å; I674-L1077 HydrophobicContact CG1-CD1 4.41Å; L1048-L1077 HydrophobicContact CD1-CD2 4.25Å; L1073-L1077 HydrophobicContact CG-CD1 4.3Å; L1073-L1077 WeakPolarHBondContact O-CG 3.31Å; L1073-L1077 PolarHBondContact O-N 3.24Å; L1074-L1077 PolarHBondContact O-N 3.47Å; L1077-S1079 VanDerWaalsContact C-N 3.28Å; L1077-S1079 PolarHBondContact O-N 3.08Å; L1077-G1081 WeakPolarHBondContact O-CA 3.19Å; L1077-G1081 PolarHBondContact O-N 3.04Å; L1077-Y1125 HydrophobicContact CD2-CE2 3.62Å; L1077-T1129 HydrophobicContact CD2-CG2 3.55Å
1078	N	85.3	Confident	85.7	Confident	59 Å²	59	30.3 Å²	30.3	32%	0.316	17%	0.168	S	C	.	.	H	α-helix	trans	-69.5	-28	176.9	-70.1	-20.4	0	0	0	112.4	L667 N670 L1074 V1076	L667-N1078 WeakPolarHBondContact CD1-ND2 3.23Å; N670-N1078 PolarHBondContact ND2-OD1 3.07Å; L1074-N1078 WeakPolarHBondContact O-CB 3.49Å; L1074-N1078 VanDerWaalsContact O-CG 3.29Å; L1074-N1078 PolarHBondContact O-N 2.03Å; L1074-N1078 PolarHBondContact O-ND2 3.11Å; V1076-N1078 PolarHBondContact O-N 3.45Å
1079	S	82.8	Confident	86.7	Confident	6 Å²	6	34.5 Å²	34.5	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-77.2	-50.7	177.1	50.7	0	0	0	0	113.6	Q483 Q487 K1055 I1075 V1076 L1077	Q483-S1079 WeakPolarHBondContact CG-O 3.31Å; Q483-S1079 PolarHBondContact NE2-O 2.7Å; Q487-S1079 VanDerWaalsContact OE1-CB 3.23Å; K1055-S1079 PolarHBondContact NZ-OG 3.28Å; K1055-S1079 VanDerWaalsContact NZ-OG 3.09Å; I1075-S1079 PolarHBondContact O-N 2.94Å; I1075-S1079 VanDerWaalsContact O-N 3.15Å; I1075-S1079 PolarHBondContact O-OG 2.89Å; V1076-S1079 WeakPolarHBondContact CA-OG 3.32Å; V1076-S1079 PolarHBondContact O-N 2.98Å; V1076-S1079 VanDerWaalsContact O-N 3.1Å; V1076-S1079 PolarHBondContact O-OG 3.39Å; L1077-S1079 VanDerWaalsContact C-N 3.28Å; L1077-S1079 PolarHBondContact O-N 3.08Å
1080	L	86	Confident	87.3	Confident	23 Å²	23	32.4 Å²	32.4	12%	0.12	17%	0.167	C	C	.	.	H	α-helix	trans	-109.9	-17.5	-169.2	-74.7	162.7	0	0	0	114	I484 A1051 V1076 P1082 A1083 I1084	I484-L1080 HydrophobicContact CD1-CD2 4.3Å; I484-L1080 HydrophobicContact CG1-CD2 4.1Å; A1051-L1080 HydrophobicContact CB-CD1 3.17Å; V1076-L1080 PolarHBondContact O-N 2.93Å; L1080-P1082 VanDerWaalsContact C-CD 3.5Å; L1080-P1082 VanDerWaalsContact C-N 3.34Å; L1080-A1083 WeakPolarHBondContact O-CB 3.41Å; L1080-A1083 PolarHBondContact O-N 2.89Å; L1080-I1084 HydrophobicContact CB-CD1 4.26Å; L1080-I1084 PolarHBondContact O-N 3.37Å
1081	G	87	Confident	87.8	Confident	2 Å²	2	28.7 Å²	28.7	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-52.8	-42.5	179.6	0	0	0	0	0	114.1	L1077 A1083 I1084 S1085 Y1125	L1077-G1081 WeakPolarHBondContact O-CA 3.19Å; L1077-G1081 PolarHBondContact O-N 3.04Å; G1081-A1083 PolarHBondContact O-N 3.47Å; G1081-I1084 PolarHBondContact O-N 3.5Å; G1081-S1085 VanDerWaalsContact O-CB 3.24Å; G1081-S1085 WeakPolarHBondContact O-CB 3.37Å; G1081-S1085 PolarHBondContact O-N 3.24Å; G1081-S1085 PolarHBondContact O-OG 2.94Å; G1081-Y1125 VanDerWaalsContact CA-OH 3.23Å; G1081-Y1125 WeakPolarHBondContact CA-OH 3.35Å
1082	P	87.1	Confident	88.3	Confident	22 Å²	22	23 Å²	23	14%	0.143	12%	0.124	C	C	.	.	H	α-helix	trans	-57.3	-47	174.2	-26.6	35.8	0	0	0	112.7	W425 I666 L1080 S1085 G1086	W425-P1082 WeakPolarHBondContact CH2-O 2.64Å; W425-P1082 VanDerWaalsContact CZ2-C 3.49Å; W425-P1082 WeakPolarHBondContact CZ2-O 3.35Å; I666-P1082 HydrophobicContact CD1-CG 4.47Å; L1080-P1082 VanDerWaalsContact C-CD 3.5Å; L1080-P1082 VanDerWaalsContact C-N 3.34Å; P1082-S1085 PolarHBondContact O-OG 2.8Å; P1082-G1086 PolarHBondContact O-N 3.42Å
1083	A	89.4	Confident	88.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.8	-51.4	179.6	0	0	0	0	0	112.1	V480 Q483 L1080 G1081 S1085 G1086 S1087	V480-A1083 HydrophobicContact CG2-CB 4.3Å; Q483-A1083 HydrophobicContact CB-CB 3.83Å; Q483-A1083 HydrophobicContact CG-CB 4.02Å; L1080-A1083 WeakPolarHBondContact O-CB 3.41Å; L1080-A1083 PolarHBondContact O-N 2.89Å; G1081-A1083 PolarHBondContact O-N 3.47Å; A1083-S1085 PolarHBondContact O-N 3.42Å; A1083-G1086 PolarHBondContact O-N 3.44Å; A1083-S1087 WeakPolarHBondContact O-CB 3.35Å; A1083-S1087 PolarHBondContact O-N 2.99Å; A1083-S1087 PolarHBondContact O-OG 3.41Å
1084	I	91.4	Very high	88.9	Confident	2 Å²	2	22.2 Å²	22.2	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-62.9	-44.8	-179.2	-61.6	169.4	0	0	0	111.1	P1044 H1047 L1080 G1081 S1087 A1088 Y1125	P1044-I1084 HydrophobicContact CB-CG2 3.62Å; P1044-I1084 HydrophobicContact CG-CG2 4.15Å; H1047-I1084 HydrophobicContact CB-CD1 3.74Å; H1047-I1084 HydrophobicContact CB-CG1 3.84Å; L1080-I1084 HydrophobicContact CB-CD1 4.26Å; L1080-I1084 PolarHBondContact O-N 3.37Å; G1081-I1084 PolarHBondContact O-N 3.5Å; I1084-S1087 PolarHBondContact O-OG 3.33Å; I1084-S1087 VanDerWaalsContact O-OG 3.11Å; I1084-A1088 PolarHBondContact O-N 3.44Å; I1084-Y1125 HydrophobicContact CB-CD2 4.46Å; I1084-Y1125 HydrophobicContact CD1-CD2 4.32Å; I1084-Y1125 HydrophobicContact CD1-CE2 4.35Å; I1084-Y1125 HydrophobicContact CG2-CD2 3.93Å; I1084-Y1125 HydrophobicContact CG2-CG 4.23Å
1085	S	90.3	Very high	89	Confident	32 Å²	32	20.6 Å²	20.6	22%	0.224	11%	0.111	C	C	.	.	H	α-helix	trans	-64.8	-47.5	-178.7	61.5	0	0	0	0	111.2	G1081 P1082 A1083 A1088 W1089	G1081-S1085 VanDerWaalsContact O-CB 3.24Å; G1081-S1085 WeakPolarHBondContact O-CB 3.37Å; G1081-S1085 PolarHBondContact O-N 3.24Å; G1081-S1085 PolarHBondContact O-OG 2.94Å; P1082-S1085 PolarHBondContact O-OG 2.8Å; A1083-S1085 PolarHBondContact O-N 3.42Å; S1085-A1088 PolarHBondContact O-N 3.25Å; S1085-W1089 PolarHBondContact O-N 2.78Å
1086	G	89.5	Confident	89.4	Confident	12 Å²	12	19.6 Å²	19.6	12%	0.124	11%	0.106	C	C	.	.	H	α-helix	trans	-78.9	-20.7	-177.1	0	0	0	0	0	113.3	W425 P1082 A1083 W1089 T1090	W425-G1086 VanDerWaalsContact CH2-C 3.48Å; P1082-G1086 PolarHBondContact O-N 3.42Å; A1083-G1086 PolarHBondContact O-N 3.44Å; G1086-W1089 PolarHBondContact O-N 2.01Å; G1086-T1090 WeakPolarHBondContact O-CB 3.06Å; G1086-T1090 VanDerWaalsContact O-CG2 3.22Å; G1086-T1090 WeakPolarHBondContact O-CG2 3.03Å; G1086-T1090 PolarHBondContact O-N 3.14Å; G1086-T1090 PolarHBondContact O-OG1 2.03Å
1087	S	89.9	Confident	89.7	Confident	6 Å²	6	20.2 Å²	20.2	4%	0.042	11%	0.11	C	C	.	.	H	α-helix	trans	-67.7	-39.6	169.9	65.6	0	0	0	0	112.6	D476 A1083 I1084 T1090 S1091	D476-S1087 WeakPolarHBondContact OD1-CB 3.37Å; D476-S1087 PolarHBondContact OD1-OG 3.48Å; A1083-S1087 WeakPolarHBondContact O-CB 3.35Å; A1083-S1087 PolarHBondContact O-N 2.99Å; A1083-S1087 PolarHBondContact O-OG 3.41Å; I1084-S1087 PolarHBondContact O-OG 3.33Å; I1084-S1087 VanDerWaalsContact O-OG 3.11Å; S1087-T1090 WeakPolarHBondContact CA-OG1 3.31Å; S1087-T1090 PolarHBondContact O-OG1 2.93Å; S1087-S1091 WeakPolarHBondContact O-CB 3.46Å; S1087-S1091 PolarHBondContact O-N 3.07Å; S1087-S1091 PolarHBondContact O-OG 2.93Å
1088	A	91.7	Very high	89.9	Confident	5 Å²	5	20.2 Å²	20.2	4%	0.041	11%	0.11	C	C	.	.	H	α-helix	trans	-62.6	-46.7	171.1	0	0	0	0	0	111.5	I1084 S1085 S1091 A1092 M1117 W1121	I1084-A1088 PolarHBondContact O-N 3.44Å; S1085-A1088 PolarHBondContact O-N 3.25Å; A1088-S1091 PolarHBondContact O-N 3.25Å; A1088-A1092 WeakPolarHBondContact O-CB 3.39Å; A1088-A1092 PolarHBondContact O-N 2.93Å; A1088-M1117 WeakPolarHBondContact O-CB 3.43Å; A1088-W1121 HydrophobicContact CB-CB 3.94Å; A1088-W1121 HydrophobicContact CB-CG 4.47Å
1089	W	91.5	Very high	90.2	Very high	106 Å²	106	19.8 Å²	19.8	40%	0.402	11%	0.107	S	C	.	.	H	α-helix	trans	-72	-33.1	-179.4	-81.8	102.5	0	0	0	113.8	S1085 G1086 S1091 A1092 I1093 F1118 W1121	S1085-W1089 PolarHBondContact O-N 2.78Å; G1086-W1089 PolarHBondContact O-N 2.01Å; W1089-S1091 VanDerWaalsContact C-N 3.35Å; W1089-A1092 PolarHBondContact O-N 3.13Å; W1089-I1093 HydrophobicContact CE3-CD1 4.33Å; W1089-I1093 HydrophobicContact CE3-CG1 4.31Å; W1089-I1093 WeakPolarHBondContact O-CB 3.11Å; W1089-I1093 WeakPolarHBondContact O-CD1 3.23Å; W1089-I1093 WeakPolarHBondContact O-CG1 3.03Å; W1089-I1093 PolarHBondContact O-N 3.11Å; W1089-F1118 HydrophobicContact CH2-CD2 4.13Å; W1089-F1118 HydrophobicContact CH2-CE2 4.4Å; W1089-F1118 HydrophobicContact CZ2-CD2 4.16Å; W1089-F1118 HydrophobicContact CZ2-CE2 4.34Å; W1089-W1121 HydrophobicContact CZ2-CZ3 4.4Å; W1089-W1121 AromaticContact NE1-CD2 3.87Å; W1089-W1121 AromaticContact NE1-CE2 3.89Å
1090	T	91.9	Very high	90.6	Very high	5 Å²	5	26.2 Å²	26.2	3%	0.031	14%	0.135	C	C	.	.	H	α-helix	trans	-61.8	-48.1	172.7	48.2	0	0	0	0	109.9	L421 W425 L479 G1086 S1087 A1092 I1093 T1094	L421-T1090 HydrophobicContact CB-CG2 4.16Å; L421-T1090 HydrophobicContact CD1-CG2 4.32Å; W425-T1090 HydrophobicContact CZ3-CG2 4.44Å; L479-T1090 HydrophobicContact CD1-CG2 4.21Å; G1086-T1090 WeakPolarHBondContact O-CB 3.06Å; G1086-T1090 VanDerWaalsContact O-CG2 3.22Å; G1086-T1090 WeakPolarHBondContact O-CG2 3.03Å; G1086-T1090 PolarHBondContact O-N 3.14Å; G1086-T1090 PolarHBondContact O-OG1 2.03Å; S1087-T1090 WeakPolarHBondContact CA-OG1 3.31Å; S1087-T1090 PolarHBondContact O-OG1 2.93Å; T1090-A1092 VanDerWaalsContact C-N 3.35Å; T1090-A1092 PolarHBondContact O-N 3.09Å; T1090-I1093 PolarHBondContact O-N 3.27Å; T1090-T1094 WeakPolarHBondContact O-CB 3.31Å; T1090-T1094 VanDerWaalsContact O-CG2 3.3Å; T1090-T1094 WeakPolarHBondContact O-CG2 3.45Å; T1090-T1094 PolarHBondContact O-N 2.83Å; T1090-T1094 PolarHBondContact O-OG1 3.04Å
1091	S	91.5	Very high	90.8	Very high	4 Å²	4	25.6 Å²	25.6	3%	0.028	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-42.6	178.4	-57.8	0	0	0	0	112.4	G472 S1087 A1088 W1089 T1094 G1095	G472-S1091 PolarHBondContact O-OG 3.14Å; G472-S1091 VanDerWaalsContact O-OG 3.04Å; S1087-S1091 WeakPolarHBondContact O-CB 3.46Å; S1087-S1091 PolarHBondContact O-N 3.07Å; S1087-S1091 PolarHBondContact O-OG 2.93Å; A1088-S1091 PolarHBondContact O-N 3.25Å; W1089-S1091 VanDerWaalsContact C-N 3.35Å; S1091-T1094 WeakPolarHBondContact CA-OG1 3.49Å; S1091-T1094 PolarHBondContact O-OG1 3.22Å; S1091-G1095 PolarHBondContact O-N 3.31Å
1092	A	92.7	Very high	90.9	Very high	4 Å²	4	28.9 Å²	28.9	3%	0.033	15%	0.149	C	C	.	.	H	α-helix	trans	-64.1	-46.5	176.7	0	0	0	0	0	112.2	A1088 W1089 T1090 G1095 L1096 M1117	A1088-A1092 WeakPolarHBondContact O-CB 3.39Å; A1088-A1092 PolarHBondContact O-N 2.93Å; W1089-A1092 PolarHBondContact O-N 3.13Å; T1090-A1092 VanDerWaalsContact C-N 3.35Å; T1090-A1092 PolarHBondContact O-N 3.09Å; A1092-G1095 PolarHBondContact O-N 3.26Å; A1092-L1096 PolarHBondContact O-N 3.44Å; A1092-M1117 HydrophobicContact CB-CB 4Å
1093	I	92.3	Very high	90.9	Very high	47 Å²	47	28 Å²	28	24%	0.241	14%	0.143	C	C	.	.	H	α-helix	trans	-71.5	-35.2	-177.2	-64.6	165.8	0	0	0	111	L421 W1089 T1090 G1095 L1096 P1097	L421-I1093 HydrophobicContact CD1-CB 3.84Å; L421-I1093 HydrophobicContact CD1-CD1 4.26Å; L421-I1093 HydrophobicContact CD1-CG2 3.69Å; L421-I1093 HydrophobicContact CD2-CD1 4.17Å; W1089-I1093 HydrophobicContact CE3-CD1 4.33Å; W1089-I1093 HydrophobicContact CE3-CG1 4.31Å; W1089-I1093 WeakPolarHBondContact O-CB 3.11Å; W1089-I1093 WeakPolarHBondContact O-CD1 3.23Å; W1089-I1093 WeakPolarHBondContact O-CG1 3.03Å; W1089-I1093 PolarHBondContact O-N 3.11Å; T1090-I1093 PolarHBondContact O-N 3.27Å; I1093-G1095 PolarHBondContact O-N 3.13Å; I1093-L1096 HydrophobicContact CB-CD1 4.43Å; I1093-L1096 HydrophobicContact CG1-CD1 4.4Å; I1093-L1096 HydrophobicContact CG2-CD1 4.27Å; I1093-L1096 WeakPolarHBondContact O-CB 3.41Å; I1093-L1096 PolarHBondContact O-N 3.37Å; I1093-L1096 VanDerWaalsContact O-N 3.11Å; I1093-P1097 WeakPolarHBondContact O-CD 3.41Å
1094	T	90.2	Very high	90.8	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-63.6	-25.5	173.8	49	0	0	0	0	113.1	S414 L418 T1090 S1091 P1097	S414-T1094 WeakPolarHBondContact CB-O 3.46Å; S414-T1094 PolarHBondContact OG-O 3.31Å; L418-T1094 HydrophobicContact CB-CG2 3.67Å; L418-T1094 HydrophobicContact CD1-CG2 3.63Å; L418-T1094 HydrophobicContact CG-CG2 4.19Å; T1090-T1094 WeakPolarHBondContact O-CB 3.31Å; T1090-T1094 VanDerWaalsContact O-CG2 3.3Å; T1090-T1094 WeakPolarHBondContact O-CG2 3.45Å; T1090-T1094 PolarHBondContact O-N 2.83Å; T1090-T1094 PolarHBondContact O-OG1 3.04Å; S1091-T1094 WeakPolarHBondContact CA-OG1 3.49Å; S1091-T1094 PolarHBondContact O-OG1 3.22Å; T1094-P1097 WeakPolarHBondContact O-CD 3.35Å
1095	G	89.9	Confident	90.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-77.6	-20	174	0	0	0	0	0	114.4	S1091 A1092 I1093 M1098	S1091-G1095 PolarHBondContact O-N 3.31Å; A1092-G1095 PolarHBondContact O-N 3.26Å; I1093-G1095 PolarHBondContact O-N 3.13Å; G1095-M1098 WeakPolarHBondContact O-CB 3.4Å; G1095-M1098 PolarHBondContact O-N 3.1Å
1096	L	92.4	Very high	90.5	Very high	71 Å²	71	28.2 Å²	28.2	37%	0.372	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-60.4	-45.9	-176.2	-79.5	168.3	0	0	0	114.5	A1092 I1093 M1098 L1099 L1114	A1092-L1096 PolarHBondContact O-N 3.44Å; I1093-L1096 HydrophobicContact CB-CD1 4.43Å; I1093-L1096 HydrophobicContact CG1-CD1 4.4Å; I1093-L1096 HydrophobicContact CG2-CD1 4.27Å; I1093-L1096 WeakPolarHBondContact O-CB 3.41Å; I1093-L1096 PolarHBondContact O-N 3.37Å; I1093-L1096 VanDerWaalsContact O-N 3.11Å; L1096-M1098 PolarHBondContact O-N 3.12Å; L1096-M1098 VanDerWaalsContact O-N 3.11Å; L1096-L1099 HydrophobicContact CD2-CD1 3.95Å; L1096-L1099 WeakPolarHBondContact O-CB 3.07Å; L1096-L1099 PolarHBondContact O-N 3.49Å; L1096-L1099 VanDerWaalsContact O-N 3.12Å; L1096-L1114 HydrophobicContact CD1-CD1 4.36Å; L1096-L1114 HydrophobicContact CD2-CD1 3.27Å; L1096-L1114 HydrophobicContact CG-CD1 3.54Å
1097	P	93.5	Very high	90.6	Very high	15 Å²	15	29.9 Å²	29.9	10%	0.097	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-57.4	-28	179.2	-27.4	36.9	0	0	0	113.5	W410 I413 I1093 T1094 L1099 F1100	W410-P1097 HydrophobicContact CE3-CB 4.34Å; I413-P1097 HydrophobicContact CB-CB 4.44Å; I413-P1097 HydrophobicContact CG2-CB 3.99Å; I413-P1097 HydrophobicContact CG2-CG 4.14Å; I1093-P1097 WeakPolarHBondContact O-CD 3.41Å; T1094-P1097 WeakPolarHBondContact O-CD 3.35Å; P1097-L1099 VanDerWaalsContact C-N 3.3Å; P1097-L1099 PolarHBondContact O-N 3Å; P1097-F1100 PolarHBondContact O-N 3.26Å
1098	M	91.3	Very high	90.6	Very high	2 Å²	2	30 Å²	30	1%	0.01	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-73.2	-22.4	-177.9	-64	163.9	161.8	0	0	113.3	L411 V468 G1095 L1096 F1100 S1101	L411-M1098 HydrophobicContact CD2-CE 3.26Å; V468-M1098 HydrophobicContact CB-CE 3.57Å; V468-M1098 HydrophobicContact CB-SD 4.1Å; V468-M1098 HydrophobicContact CG1-CE 3.3Å; V468-M1098 HydrophobicContact CG1-SD 3.2Å; V468-M1098 WeakPolarHBondContact CG1-SD 3.32Å; V468-M1098 HydrophobicContact CG2-CE 3.18Å; V468-M1098 HydrophobicContact CG2-SD 3.97Å; G1095-M1098 WeakPolarHBondContact O-CB 3.4Å; G1095-M1098 PolarHBondContact O-N 3.1Å; L1096-M1098 PolarHBondContact O-N 3.12Å; L1096-M1098 VanDerWaalsContact O-N 3.11Å; M1098-F1100 PolarHBondContact O-N 2.71Å; M1098-F1100 VanDerWaalsContact O-N 3.14Å; M1098-S1101 WeakPolarHBondContact O-CB 3.22Å; M1098-S1101 PolarHBondContact O-N 2.82Å; M1098-S1101 VanDerWaalsContact O-N 3.07Å; M1098-S1101 PolarHBondContact O-OG 2.76Å
1099	L	91.8	Very high	90.5	Very high	49 Å²	49	30.1 Å²	30.1	26%	0.257	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-61.4	-22.3	175.9	-65.9	176.5	0	0	0	112.7	L1096 P1097 H1107 A1111	L1096-L1099 HydrophobicContact CD2-CD1 3.95Å; L1096-L1099 WeakPolarHBondContact O-CB 3.07Å; L1096-L1099 PolarHBondContact O-N 3.49Å; L1096-L1099 VanDerWaalsContact O-N 3.12Å; P1097-L1099 VanDerWaalsContact C-N 3.3Å; P1097-L1099 PolarHBondContact O-N 3Å; L1099-H1107 PolarHBondContact O-ND1 2.88Å; L1099-A1111 HydrophobicContact CD2-CB 3.69Å
1100	F	91.6	Very high	90.5	Very high	141 Å²	141	25 Å²	25	62%	0.618	13%	0.127	S	C	*	.	G	3₁₀ helix	trans	-90.9	2.4	179.1	-57	-72.6	0	0	0	114.1	W410 P1097 M1098	W410-F1100 HydrophobicContact CE3-CB 4.44Å; W410-F1100 HydrophobicContact CH2-CB 3.73Å; W410-F1100 HydrophobicContact CH2-CG 4.46Å; W410-F1100 HydrophobicContact CZ2-CB 3.83Å; W410-F1100 HydrophobicContact CZ3-CB 4.05Å; W410-F1100 HydrophobicContact CZ3-CD2 4.48Å; P1097-F1100 PolarHBondContact O-N 3.26Å; M1098-F1100 PolarHBondContact O-N 2.71Å; M1098-F1100 VanDerWaalsContact O-N 3.14Å
1101	S	90.5	Very high	90.5	Very high	11 Å²	11	25 Å²	25	8%	0.077	13%	0.127	C	C	.	.			trans	-72.3	152.1	173.3	63	0	0	0	0	111.7	M1098 L1103 F1106 H1107	M1098-S1101 WeakPolarHBondContact O-CB 3.22Å; M1098-S1101 PolarHBondContact O-N 2.82Å; M1098-S1101 VanDerWaalsContact O-N 3.07Å; M1098-S1101 PolarHBondContact O-OG 2.76Å; S1101-L1103 PolarHBondContact OG-O 2.98Å; S1101-F1106 WeakPolarHBondContact OG-CB 3.33Å; S1101-H1107 PolarHBondContact OG-N 3.29Å; S1101-H1107 VanDerWaalsContact OG-N 3.13Å
1102	N	87.7	Confident	90.6	Very high	70 Å²	70	25 Å²	25	37%	0.374	13%	0.127	S	C	.	.	S	Bend	trans	-88.9	-22	175.9	-58.8	-72.8	0	0	0	111.8	R406 D407 P715	R406-N1102 PolarHBondContact NH2-ND2 3.01Å; D407-N1102 WeakPolarHBondContact OD2-CA 3.45Å; D407-N1102 PolarHBondContact OD2-N 3.19Å; P715-N1102 WeakPolarHBondContact CD-O 3.35Å
1103	L	88	Confident	90.6	Very high	3 Å²	3	25 Å²	25	2%	0.016	13%	0.126	C	C	.	.	S	Bend	trans	-72.6	126.8	171.6	-74.5	178.4	0	0	0	111.1	V400 L403 L404 D407 S1101 C1105 F1106 H1107	V400-L1103 HydrophobicContact CG1-CD2 4.23Å; L403-L1103 HydrophobicContact CB-CD2 4.02Å; L403-L1103 HydrophobicContact CB-CG 4.19Å; L404-L1103 VanDerWaalsContact CA-CD1 3.46Å; L404-L1103 HydrophobicContact CB-CD1 3.94Å; L404-L1103 HydrophobicContact CG-CD1 4.43Å; D407-L1103 HydrophobicContact CB-CD1 4.27Å; D407-L1103 PolarHBondContact OD2-N 3.37Å; S1101-L1103 PolarHBondContact OG-O 2.98Å; L1103-C1105 VanDerWaalsContact C-N 3.26Å; L1103-C1105 PolarHBondContact O-N 3.32Å; L1103-F1106 HydrophobicContact CB-CD2 4.39Å; L1103-F1106 HydrophobicContact CD1-CD2 4.22Å; L1103-F1106 HydrophobicContact CD1-CE2 4.17Å; L1103-F1106 PolarHBondContact O-N 3.48Å; L1103-H1107 PolarHBondContact O-N 3.4Å; L1103-H1107 VanDerWaalsContact O-N 3.11Å
1104	L	86.9	Confident	90.6	Very high	30 Å²	30	25.3 Å²	25.3	16%	0.157	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-37.2	-179	-174.2	63.8	0	0	0	111.6	F713 F1106 H1107 Q1108	F713-L1104 VanDerWaalsContact O-CB 3.25Å; F713-L1104 WeakPolarHBondContact O-CB 3.38Å; F713-L1104 PolarHBondContact O-N 3.26Å; L1104-F1106 PolarHBondContact O-N 3.05Å; L1104-H1107 PolarHBondContact O-N 3.32Å; L1104-Q1108 HydrophobicContact CD1-CG 3.91Å; L1104-Q1108 HydrophobicContact CG-CG 4.01Å; L1104-Q1108 VanDerWaalsContact O-CB 3.26Å; L1104-Q1108 WeakPolarHBondContact O-CB 3.44Å; L1104-Q1108 WeakPolarHBondContact O-CG 3.43Å; L1104-Q1108 PolarHBondContact O-N 3.38Å
1105	C	86.6	Confident	90.8	Very high	6 Å²	6	25.9 Å²	25.9	4%	0.041	13%	0.132	C	C	.	.	H	α-helix	trans	-61.9	-41.2	-179.1	62.4	0	0	0	0	113	L465 I1029 L1103 I1109	L465-C1105 HydrophobicContact CD2-CB 4.21Å; L465-C1105 WeakPolarHBondContact CD2-O 3.17Å; I1029-C1105 HydrophobicContact CD1-CB 3.43Å; I1029-C1105 VanDerWaalsContact CD1-CB 3.43Å; L1103-C1105 VanDerWaalsContact C-N 3.26Å; L1103-C1105 PolarHBondContact O-N 3.32Å; C1105-I1109 WeakPolarHBondContact O-CG2 3.29Å; C1105-I1109 PolarHBondContact O-N 3.39Å
1106	F	89.7	Confident	91	Very high	3 Å²	3	25.9 Å²	25.9	1%	0.013	13%	0.132	C	C	.	.	H	α-helix	trans	-74.4	-41.7	177.1	-72.1	-16.9	0	0	0	112.1	D407 L411 L464 L465 V468 S1101 L1103 L1104 Q1108 I1109 G1110	D407-F1106 HydrophobicContact CB-CD2 3.94Å; D407-F1106 HydrophobicContact CB-CE2 4.15Å; L411-F1106 HydrophobicContact CD1-CZ 4.45Å; L464-F1106 HydrophobicContact CB-CE1 4Å; L464-F1106 HydrophobicContact CB-CZ 4.18Å; L464-F1106 HydrophobicContact CD1-CZ 4.33Å; L465-F1106 HydrophobicContact CD2-CD1 4.04Å; L465-F1106 HydrophobicContact CD2-CE1 4.4Å; V468-F1106 HydrophobicContact CG2-CD1 4.41Å; S1101-F1106 WeakPolarHBondContact OG-CB 3.33Å; L1103-F1106 HydrophobicContact CB-CD2 4.39Å; L1103-F1106 HydrophobicContact CD1-CD2 4.22Å; L1103-F1106 HydrophobicContact CD1-CE2 4.17Å; L1103-F1106 PolarHBondContact O-N 3.48Å; L1104-F1106 PolarHBondContact O-N 3.05Å; F1106-Q1108 PolarHBondContact O-N 3.39Å; F1106-I1109 VanDerWaalsContact O-CG2 3.24Å; F1106-I1109 WeakPolarHBondContact O-CG2 3.07Å; F1106-G1110 PolarHBondContact O-N 2.03Å
1107	H	90.5	Very high	91.1	Very high	48 Å²	48	23 Å²	23	22%	0.222	12%	0.116	C	C	.	.	H	α-helix	trans	-59.2	-48.2	174.5	175.1	86.6	0	0	0	111.5	D1022 L1099 S1101 L1103 L1104 G1110 A1111	D1022-H1107 IonicContact OD1-NE2 2.77Å; D1022-H1107 IonicContact OD2-NE2 3.67Å; L1099-H1107 PolarHBondContact O-ND1 2.88Å; S1101-H1107 PolarHBondContact OG-N 3.29Å; S1101-H1107 VanDerWaalsContact OG-N 3.13Å; L1103-H1107 PolarHBondContact O-N 3.4Å; L1103-H1107 VanDerWaalsContact O-N 3.11Å; L1104-H1107 PolarHBondContact O-N 3.32Å; H1107-G1110 PolarHBondContact O-N 3.44Å; H1107-A1111 PolarHBondContact O-N 3.19Å
1108	Q	90	Very high	91.1	Very high	9 Å²	9	26.7 Å²	26.7	4%	0.042	13%	0.131	C	C	.	.	H	α-helix	trans	-64.1	-44.5	-178.5	-75.7	179.3	-17.9	0	0	113	W1024 E1030 L1104 F1106 G1110 A1111 F1112	W1024-Q1108 HydrophobicContact CH2-CB 4.16Å; W1024-Q1108 HydrophobicContact CZ2-CB 3.75Å; W1024-Q1108 HydrophobicContact CZ2-CG 3.96Å; W1024-Q1108 WeakPolarHBondContact CZ2-O 3.43Å; E1030-Q1108 PolarHBondContact OE1-NE2 2.88Å; L1104-Q1108 HydrophobicContact CD1-CG 3.91Å; L1104-Q1108 HydrophobicContact CG-CG 4.01Å; L1104-Q1108 VanDerWaalsContact O-CB 3.26Å; L1104-Q1108 WeakPolarHBondContact O-CB 3.44Å; L1104-Q1108 WeakPolarHBondContact O-CG 3.43Å; L1104-Q1108 PolarHBondContact O-N 3.38Å; F1106-Q1108 PolarHBondContact O-N 3.39Å; Q1108-G1110 VanDerWaalsContact C-N 3.31Å; Q1108-G1110 PolarHBondContact O-N 3.04Å; Q1108-A1111 PolarHBondContact O-N 3.23Å; Q1108-F1112 WeakPolarHBondContact O-CB 3.32Å; Q1108-F1112 PolarHBondContact O-N 3Å
1109	I	90.2	Very high	91.3	Very high	6 Å²	6	26.7 Å²	26.7	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-66.5	-35.7	177.8	-167.1	69.5	0	0	0	111.4	L465 V468 V1033 C1105 F1106 F1112 L1113	L465-I1109 HydrophobicContact CD2-CB 4.07Å; L465-I1109 HydrophobicContact CD2-CG2 3.8Å; V468-I1109 HydrophobicContact CB-CG1 4.39Å; V468-I1109 HydrophobicContact CB-CG2 4.22Å; V468-I1109 HydrophobicContact CG1-CB 4.42Å; V468-I1109 HydrophobicContact CG1-CG1 3.8Å; V468-I1109 HydrophobicContact CG1-CG2 3.72Å; V468-I1109 HydrophobicContact CG2-CG2 4.15Å; V1033-I1109 HydrophobicContact CG2-CD1 3.9Å; C1105-I1109 WeakPolarHBondContact O-CG2 3.29Å; C1105-I1109 PolarHBondContact O-N 3.39Å; F1106-I1109 VanDerWaalsContact O-CG2 3.24Å; F1106-I1109 WeakPolarHBondContact O-CG2 3.07Å; I1109-F1112 HydrophobicContact CD1-CD1 3.91Å; I1109-F1112 PolarHBondContact O-N 2.99Å; I1109-L1113 HydrophobicContact CG1-CD1 4.41Å; I1109-L1113 HydrophobicContact CG1-CG 4.49Å; I1109-L1113 WeakPolarHBondContact O-CG 3.41Å; I1109-L1113 PolarHBondContact O-N 2.79Å
1110	G	91.5	Very high	91.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.2	-47.8	174.9	0	0	0	0	0	112.1	F1106 H1107 Q1108 F1112 L1113 L1114	F1106-G1110 PolarHBondContact O-N 2.03Å; H1107-G1110 PolarHBondContact O-N 3.44Å; Q1108-G1110 VanDerWaalsContact C-N 3.31Å; Q1108-G1110 PolarHBondContact O-N 3.04Å; G1110-F1112 VanDerWaalsContact C-N 3.33Å; G1110-F1112 PolarHBondContact O-N 3.12Å; G1110-L1113 PolarHBondContact O-N 3.32Å; G1110-L1114 WeakPolarHBondContact O-CB 3.08Å; G1110-L1114 PolarHBondContact O-N 3.47Å
1111	A	92.4	Very high	91.6	Very high	4 Å²	4	19.7 Å²	19.7	3%	0.033	10%	0.097	C	C	.	.	H	α-helix	trans	-61.3	-41.7	175.4	0	0	0	0	0	111.9	L1018 D1022 L1099 H1107 Q1108 T1115	L1018-A1111 HydrophobicContact CD2-CB 4.22Å; D1022-A1111 WeakPolarHBondContact OD2-CB 3.03Å; L1099-A1111 HydrophobicContact CD2-CB 3.69Å; H1107-A1111 PolarHBondContact O-N 3.19Å; Q1108-A1111 PolarHBondContact O-N 3.23Å; A1111-T1115 WeakPolarHBondContact O-CB 3.4Å; A1111-T1115 VanDerWaalsContact O-CG2 3.24Å; A1111-T1115 WeakPolarHBondContact O-CG2 3.24Å; A1111-T1115 PolarHBondContact O-N 3.18Å; A1111-T1115 PolarHBondContact O-OG1 3.24Å
1112	F	93.3	Very high	91.8	Very high	4 Å²	4	22 Å²	22	2%	0.018	11%	0.107	C	C	.	.	H	α-helix	trans	-61.9	-53.2	175.5	165.8	-109.4	0	0	0	112.9	L1018 W1024 V1033 A1037 L1040 Q1108 I1109 G1110 L1114 T1115 L1116	L1018-F1112 HydrophobicContact CD1-CD2 4.18Å; W1024-F1112 HydrophobicContact CH2-CB 4.05Å; V1033-F1112 HydrophobicContact CB-CG 4.45Å; V1033-F1112 HydrophobicContact CG1-CB 3.71Å; V1033-F1112 HydrophobicContact CG1-CD1 3.51Å; V1033-F1112 HydrophobicContact CG1-CD2 3.02Å; V1033-F1112 HydrophobicContact CG1-CE1 3.73Å; V1033-F1112 HydrophobicContact CG1-CE2 3.26Å; V1033-F1112 HydrophobicContact CG1-CG 3.1Å; V1033-F1112 HydrophobicContact CG1-CZ 3.57Å; V1033-F1112 HydrophobicContact CG2-CD1 4.48Å; V1033-F1112 WeakPolarHBondContact O-CZ 3.37Å; A1037-F1112 HydrophobicContact CB-CE2 3.89Å; A1037-F1112 HydrophobicContact CB-CZ 4.07Å; L1040-F1112 HydrophobicContact CD1-CE1 3.82Å; L1040-F1112 HydrophobicContact CD1-CZ 4.06Å; Q1108-F1112 WeakPolarHBondContact O-CB 3.32Å; Q1108-F1112 PolarHBondContact O-N 3Å; I1109-F1112 HydrophobicContact CD1-CD1 3.91Å; I1109-F1112 PolarHBondContact O-N 2.99Å; G1110-F1112 VanDerWaalsContact C-N 3.33Å; G1110-F1112 PolarHBondContact O-N 3.12Å; F1112-L1114 VanDerWaalsContact C-N 3.29Å; F1112-L1114 PolarHBondContact O-N 3.22Å; F1112-T1115 PolarHBondContact O-N 3.18Å; F1112-T1115 PolarHBondContact O-OG1 3.37Å; F1112-T1115 VanDerWaalsContact O-OG1 3.09Å; F1112-L1116 HydrophobicContact CD2-CB 4.29Å; F1112-L1116 HydrophobicContact CE1-CD2 4.16Å; F1112-L1116 HydrophobicContact CE2-CB 4.09Å; F1112-L1116 HydrophobicContact CE2-CD1 4.28Å; F1112-L1116 HydrophobicContact CE2-CD2 3.79Å; F1112-L1116 HydrophobicContact CE2-CG 4.27Å; F1112-L1116 HydrophobicContact CZ-CB 4.46Å; F1112-L1116 HydrophobicContact CZ-CD2 3.49Å; F1112-L1116 VanDerWaalsContact CZ-CD2 3.49Å; F1112-L1116 HydrophobicContact CZ-CG 4.43Å; F1112-L1116 WeakPolarHBondContact O-CB 3.22Å; F1112-L1116 PolarHBondContact O-N 3.42Å
1113	L	91.8	Very high	92.1	Very high	4 Å²	4	19 Å²	19	2%	0.021	9%	0.09	C	C	.	.	H	α-helix	trans	-61	-42.2	-178.2	-73	177.8	0	0	0	110.9	V468 L469 I1109 G1110 M1117	V468-L1113 HydrophobicContact CG1-CD1 3.69Å; L469-L1113 HydrophobicContact CD1-CD2 4.08Å; I1109-L1113 HydrophobicContact CG1-CD1 4.41Å; I1109-L1113 HydrophobicContact CG1-CG 4.49Å; I1109-L1113 WeakPolarHBondContact O-CG 3.41Å; I1109-L1113 PolarHBondContact O-N 2.79Å; G1110-L1113 PolarHBondContact O-N 3.32Å; L1113-M1117 WeakPolarHBondContact O-CB 3.24Å; L1113-M1117 WeakPolarHBondContact O-CG 3.44Å; L1113-M1117 PolarHBondContact O-N 3.39Å
1114	L	93.9	Very high	92.3	Very high	53 Å²	53	18.8 Å²	18.8	28%	0.277	9%	0.089	S	C	.	.	H	α-helix	trans	-60.7	-51.9	176.1	-178.7	121.6	0	0	0	112.3	L1096 G1110 F1112 F1118	L1096-L1114 HydrophobicContact CD1-CD1 4.36Å; L1096-L1114 HydrophobicContact CD2-CD1 3.27Å; L1096-L1114 HydrophobicContact CG-CD1 3.54Å; G1110-L1114 WeakPolarHBondContact O-CB 3.08Å; G1110-L1114 PolarHBondContact O-N 3.47Å; F1112-L1114 VanDerWaalsContact C-N 3.29Å; F1112-L1114 PolarHBondContact O-N 3.22Å; L1114-F1118 VanDerWaalsContact O-CB 3.3Å; L1114-F1118 WeakPolarHBondContact O-CB 3.38Å; L1114-F1118 PolarHBondContact O-N 3.49Å; L1114-F1118 VanDerWaalsContact O-N 3.07Å
1115	T	93.6	Very high	92.6	Very high	14 Å²	14	17.6 Å²	17.6	9%	0.086	8%	0.082	C	C	.	.	H	α-helix	trans	-68.5	-40.8	-177	54.5	0	0	0	0	112.3	L1018 A1111 F1112 C1119	L1018-T1115 HydrophobicContact CD2-CG2 4Å; L1018-T1115 WeakPolarHBondContact CD2-OG1 3.46Å; L1018-T1115 HydrophobicContact CG-CG2 4.45Å; A1111-T1115 WeakPolarHBondContact O-CB 3.4Å; A1111-T1115 VanDerWaalsContact O-CG2 3.24Å; A1111-T1115 WeakPolarHBondContact O-CG2 3.24Å; A1111-T1115 PolarHBondContact O-N 3.18Å; A1111-T1115 PolarHBondContact O-OG1 3.24Å; F1112-T1115 PolarHBondContact O-N 3.18Å; F1112-T1115 PolarHBondContact O-OG1 3.37Å; F1112-T1115 VanDerWaalsContact O-OG1 3.09Å; T1115-C1119 WeakPolarHBondContact O-CB 3.47Å; T1115-C1119 PolarHBondContact O-N 3.11Å; T1115-C1119 PolarHBondContact O-SG 2.99Å
1116	L	94.7	Very high	92.9	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-67.7	-44.7	179.4	-171.5	73.6	0	0	0	111.5	L1011 A1037 L1040 A1041 F1112 C1119 S1120	L1011-L1116 HydrophobicContact CD2-CD1 4.36Å; A1037-L1116 HydrophobicContact CB-CD1 4.03Å; A1037-L1116 HydrophobicContact CB-CD2 4.36Å; L1040-L1116 HydrophobicContact CB-CD2 3.73Å; L1040-L1116 HydrophobicContact CD1-CD2 4.37Å; A1041-L1116 HydrophobicContact CB-CD1 3.93Å; A1041-L1116 HydrophobicContact CB-CD2 4.35Å; A1041-L1116 HydrophobicContact CB-CG 4.17Å; F1112-L1116 HydrophobicContact CD2-CB 4.29Å; F1112-L1116 HydrophobicContact CE1-CD2 4.16Å; F1112-L1116 HydrophobicContact CE2-CB 4.09Å; F1112-L1116 HydrophobicContact CE2-CD1 4.28Å; F1112-L1116 HydrophobicContact CE2-CD2 3.79Å; F1112-L1116 HydrophobicContact CE2-CG 4.27Å; F1112-L1116 HydrophobicContact CZ-CB 4.46Å; F1112-L1116 HydrophobicContact CZ-CD2 3.49Å; F1112-L1116 VanDerWaalsContact CZ-CD2 3.49Å; F1112-L1116 HydrophobicContact CZ-CG 4.43Å; F1112-L1116 WeakPolarHBondContact O-CB 3.22Å; F1112-L1116 PolarHBondContact O-N 3.42Å; L1116-C1119 PolarHBondContact O-N 3.19Å; L1116-S1120 VanDerWaalsContact O-CB 3.29Å; L1116-S1120 WeakPolarHBondContact O-CB 3.5Å; L1116-S1120 PolarHBondContact O-N 3.29Å; L1116-S1120 PolarHBondContact O-OG 3.11Å
1117	M	94	Very high	93	Very high	10 Å²	10	17.8 Å²	17.8	5%	0.049	8%	0.083	C	C	.	.	H	α-helix	trans	-69.2	-35.9	-179.3	-65.8	-65.1	135.1	0	0	111.6	L1040 A1088 A1092 L1113 S1120 W1121	L1040-M1117 HydrophobicContact CB-CE 4.03Å; A1088-M1117 WeakPolarHBondContact O-CB 3.43Å; A1092-M1117 HydrophobicContact CB-CB 4Å; L1113-M1117 WeakPolarHBondContact O-CB 3.24Å; L1113-M1117 WeakPolarHBondContact O-CG 3.44Å; L1113-M1117 PolarHBondContact O-N 3.39Å; M1117-S1120 WeakPolarHBondContact CA-OG 3.4Å; M1117-S1120 PolarHBondContact O-OG 3.39Å; M1117-W1121 WeakPolarHBondContact O-CB 3.45Å; M1117-W1121 PolarHBondContact O-N 2.65Å
1118	F	94.1	Very high	93.1	Very high	93 Å²	93	15.6 Å²	15.6	41%	0.408	7%	0.073	S	C	.	.	H	α-helix	trans	-64.8	-47.3	171	-179.1	-98.1	0	0	0	112.3	W1089 L1114 W1121 F1122	W1089-F1118 HydrophobicContact CH2-CD2 4.13Å; W1089-F1118 HydrophobicContact CH2-CE2 4.4Å; W1089-F1118 HydrophobicContact CZ2-CD2 4.16Å; W1089-F1118 HydrophobicContact CZ2-CE2 4.34Å; L1114-F1118 VanDerWaalsContact O-CB 3.3Å; L1114-F1118 WeakPolarHBondContact O-CB 3.38Å; L1114-F1118 PolarHBondContact O-N 3.49Å; L1114-F1118 VanDerWaalsContact O-N 3.07Å; F1118-W1121 PolarHBondContact O-N 2.76Å; F1118-F1122 WeakPolarHBondContact O-CB 3.43Å; F1118-F1122 PolarHBondContact O-N 2.88Å
1119	C	95	Very high	93.1	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.02	7%	0.071	C	C	.	.	H	α-helix	trans	-64.7	-41	178.4	-71	0	0	0	0	112.2	C1010 T1115 L1116 F1122 F1123	C1010-C1119 VanDerWaalsContact SG-C 3.54Å; T1115-C1119 WeakPolarHBondContact O-CB 3.47Å; T1115-C1119 PolarHBondContact O-N 3.11Å; T1115-C1119 PolarHBondContact O-SG 2.99Å; L1116-C1119 PolarHBondContact O-N 3.19Å; C1119-F1122 PolarHBondContact O-N 3.3Å; C1119-F1123 HydrophobicContact CB-CD2 4.42Å; C1119-F1123 WeakPolarHBondContact O-CD2 3.44Å; C1119-F1123 PolarHBondContact O-N 3.29Å
1120	S	94.9	Very high	93.1	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.007	7%	0.069	C	C	.	.	H	α-helix	trans	-66.6	-43.1	178.5	62.7	0	0	0	0	111	C1010 A1041 L1116 M1117 F1122 C1124 Y1125	C1010-S1120 VanDerWaalsContact SG-CA 3.52Å; C1010-S1120 PolarHBondContact SG-N 3.36Å; C1010-S1120 VanDerWaalsContact SG-N 3.41Å; A1041-S1120 WeakPolarHBondContact O-CB 3.48Å; L1116-S1120 VanDerWaalsContact O-CB 3.29Å; L1116-S1120 WeakPolarHBondContact O-CB 3.5Å; L1116-S1120 PolarHBondContact O-N 3.29Å; L1116-S1120 PolarHBondContact O-OG 3.11Å; M1117-S1120 WeakPolarHBondContact CA-OG 3.4Å; M1117-S1120 PolarHBondContact O-OG 3.39Å; S1120-F1122 VanDerWaalsContact C-N 3.29Å; S1120-F1122 PolarHBondContact O-N 3.27Å; S1120-C1124 VanDerWaalsContact O-CA 3.31Å; S1120-C1124 WeakPolarHBondContact O-CA 3.45Å; S1120-C1124 WeakPolarHBondContact O-CB 3.17Å; S1120-C1124 PolarHBondContact O-N 2.83Å; S1120-Y1125 PolarHBondContact O-N 3.13Å
1121	W	94.1	Very high	93	Very high	41 Å²	41	15.6 Å²	15.6	16%	0.155	7%	0.073	C	C	.	.	I	π-helix	trans	-58.7	-41.4	172.3	178.2	72.3	0	0	0	112.2	F669 A1088 W1089 M1117 F1118 Y1125 I1126	F669-W1121 HydrophobicContact CE1-CZ2 4.36Å; F669-W1121 HydrophobicContact CZ-CH2 4.23Å; F669-W1121 AromaticContact CZ-CZ2 3.96Å; F669-W1121 HydrophobicContact CZ-CZ2 3.96Å; A1088-W1121 HydrophobicContact CB-CB 3.94Å; A1088-W1121 HydrophobicContact CB-CG 4.47Å; W1089-W1121 HydrophobicContact CZ2-CZ3 4.4Å; W1089-W1121 AromaticContact NE1-CD2 3.87Å; W1089-W1121 AromaticContact NE1-CE2 3.89Å; M1117-W1121 WeakPolarHBondContact O-CB 3.45Å; M1117-W1121 PolarHBondContact O-N 2.65Å; F1118-W1121 PolarHBondContact O-N 2.76Å; W1121-Y1125 AromaticContact CD1-CD1 3.92Å; W1121-Y1125 AromaticContact NE1-CD1 3.71Å; W1121-Y1125 VanDerWaalsContact O-CB 3.31Å; W1121-Y1125 WeakPolarHBondContact O-CB 3.29Å; W1121-Y1125 PolarHBondContact O-N 3.12Å; W1121-I1126 HydrophobicContact CD2-CD1 4.15Å; W1121-I1126 HydrophobicContact CE3-CD1 4Å; W1121-I1126 HydrophobicContact CH2-CD1 3.66Å; W1121-I1126 HydrophobicContact CZ2-CD1 3.79Å; W1121-I1126 HydrophobicContact CZ3-CD1 3.76Å; W1121-I1126 PolarHBondContact O-N 3.2Å
1122	F	94.4	Very high	92.9	Very high	61 Å²	61	16.1 Å²	16.1	27%	0.268	8%	0.075	S	C	.	.	I	π-helix	trans	-69.4	-54.4	178.1	-174.9	-101.6	0	0	0	112.8	I683 F1118 C1119 S1120 I1126 V1127	I683-F1122 HydrophobicContact CG2-CE1 3.99Å; I683-F1122 HydrophobicContact CG2-CZ 4.18Å; F1118-F1122 WeakPolarHBondContact O-CB 3.43Å; F1118-F1122 PolarHBondContact O-N 2.88Å; C1119-F1122 PolarHBondContact O-N 3.3Å; S1120-F1122 VanDerWaalsContact C-N 3.29Å; S1120-F1122 PolarHBondContact O-N 3.27Å; F1122-I1126 HydrophobicContact CD2-CD1 4.22Å; F1122-I1126 VanDerWaalsContact O-CB 3.31Å; F1122-I1126 WeakPolarHBondContact O-CB 3.39Å; F1122-I1126 PolarHBondContact O-N 3.27Å; F1122-V1127 HydrophobicContact CD1-CG2 4.1Å; F1122-V1127 HydrophobicContact CE1-CG2 3.83Å; F1122-V1127 HydrophobicContact CZ-CG2 4.23Å; F1122-V1127 WeakPolarHBondContact O-CG2 3.45Å; F1122-V1127 PolarHBondContact O-N 3.29Å
1123	F	94.2	Very high	92.6	Very high	5 Å²	5	16 Å²	16	2%	0.022	8%	0.075	C	C	.	.	I	π-helix	trans	-83.2	-46.5	-173.4	-72	-72.3	0	0	0	113.6	I683 T687 C1009 C1010 C1119 V1127 L1128	I683-F1123 HydrophobicContact CG2-CE1 4.39Å; T687-F1123 HydrophobicContact CG2-CE1 3.99Å; T687-F1123 HydrophobicContact CG2-CZ 3.72Å; C1009-F1123 HydrophobicContact CB-CD1 4.29Å; C1009-F1123 HydrophobicContact CB-CE1 4.47Å; C1009-F1123 WeakPolarHBondContact SG-CE1 3.38Å; C1010-F1123 HydrophobicContact CB-CB 3.9Å; C1010-F1123 HydrophobicContact CB-CD2 4.26Å; C1010-F1123 HydrophobicContact CB-CG 4.38Å; C1119-F1123 HydrophobicContact CB-CD2 4.42Å; C1119-F1123 WeakPolarHBondContact O-CD2 3.44Å; C1119-F1123 PolarHBondContact O-N 3.29Å; F1123-V1127 HydrophobicContact CD1-CB 4.36Å; F1123-V1127 HydrophobicContact CD1-CG1 4.47Å; F1123-V1127 HydrophobicContact CD1-CG2 3.96Å; F1123-V1127 HydrophobicContact CE1-CG2 4.47Å; F1123-V1127 WeakPolarHBondContact O-CB 3.33Å; F1123-L1128 PolarHBondContact O-N 2.91Å; F1123-L1128 VanDerWaalsContact O-N 3.11Å
1124	C	93.1	Very high	92.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.086	C	C	.	.	I	π-helix	trans	-78.1	-27.1	-175.4	-60.2	0	0	0	0	112.7	A1041 P1044 C1045 S1120 L1128	A1041-C1124 PolarHBondContact O-SG 3.38Å; A1041-C1124 VanDerWaalsContact O-SG 3.32Å; P1044-C1124 HydrophobicContact CB-CB 4Å; P1044-C1124 HydrophobicContact CG-CB 4.44Å; C1045-C1124 WeakPolarHBondContact SG-CB 3.01Å; S1120-C1124 VanDerWaalsContact O-CA 3.31Å; S1120-C1124 WeakPolarHBondContact O-CA 3.45Å; S1120-C1124 WeakPolarHBondContact O-CB 3.17Å; S1120-C1124 PolarHBondContact O-N 2.83Å; C1124-L1128 VanDerWaalsContact O-CB 3.25Å; C1124-L1128 WeakPolarHBondContact O-CB 3Å; C1124-L1128 WeakPolarHBondContact O-CD2 3.2Å
1125	Y	92.1	Very high	92.1	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.016	8%	0.077	C	C	.	.	I	π-helix	trans	-103.4	-62.5	176.1	176.3	-107.4	0	0	0	112.5	F669 N670 L1077 G1081 I1084 S1120 W1121 T1129	F669-Y1125 HydrophobicContact CE1-CE1 4.48Å; N670-Y1125 PolarHBondContact OD1-OH 3.35Å; L1077-Y1125 HydrophobicContact CD2-CE2 3.62Å; G1081-Y1125 VanDerWaalsContact CA-OH 3.23Å; G1081-Y1125 WeakPolarHBondContact CA-OH 3.35Å; I1084-Y1125 HydrophobicContact CB-CD2 4.46Å; I1084-Y1125 HydrophobicContact CD1-CD2 4.32Å; I1084-Y1125 HydrophobicContact CD1-CE2 4.35Å; I1084-Y1125 HydrophobicContact CG2-CD2 3.93Å; I1084-Y1125 HydrophobicContact CG2-CG 4.23Å; S1120-Y1125 PolarHBondContact O-N 3.13Å; W1121-Y1125 AromaticContact CD1-CD1 3.92Å; W1121-Y1125 AromaticContact NE1-CD1 3.71Å; W1121-Y1125 VanDerWaalsContact O-CB 3.31Å; W1121-Y1125 WeakPolarHBondContact O-CB 3.29Å; W1121-Y1125 PolarHBondContact O-N 3.12Å; Y1125-T1129 WeakPolarHBondContact O-CB 3.44Å; Y1125-T1129 WeakPolarHBondContact O-CG2 3.26Å; Y1125-T1129 PolarHBondContact O-N 3.41Å; Y1125-T1129 VanDerWaalsContact O-N 3.17Å; Y1125-T1129 PolarHBondContact O-OG1 3.19Å
1126	I	92.6	Very high	91.5	Very high	14 Å²	14	17.6 Å²	17.6	7%	0.072	8%	0.082	C	C	.	.	I	π-helix	trans	-69.6	-53.1	-173.6	-56.5	172	0	0	0	112	F669 I673 F680 W1121 F1122 T1129 G1130	F669-I1126 HydrophobicContact CZ-CD1 3.8Å; F669-I1126 HydrophobicContact CZ-CG1 4.15Å; I673-I1126 HydrophobicContact CD1-CG1 4.39Å; I673-I1126 HydrophobicContact CD1-CG2 4.07Å; I673-I1126 HydrophobicContact CG1-CG2 4.09Å; F680-I1126 HydrophobicContact CE1-CG2 3.72Å; F680-I1126 HydrophobicContact CZ-CG2 4.12Å; W1121-I1126 HydrophobicContact CD2-CD1 4.15Å; W1121-I1126 HydrophobicContact CE3-CD1 4Å; W1121-I1126 HydrophobicContact CH2-CD1 3.66Å; W1121-I1126 HydrophobicContact CZ2-CD1 3.79Å; W1121-I1126 HydrophobicContact CZ3-CD1 3.76Å; W1121-I1126 PolarHBondContact O-N 3.2Å; F1122-I1126 HydrophobicContact CD2-CD1 4.22Å; F1122-I1126 VanDerWaalsContact O-CB 3.31Å; F1122-I1126 WeakPolarHBondContact O-CB 3.39Å; F1122-I1126 PolarHBondContact O-N 3.27Å; I1126-T1129 PolarHBondContact O-N 3.47Å; I1126-T1129 PolarHBondContact O-OG1 3.29Å; I1126-G1130 PolarHBondContact O-N 2.85Å
1127	V	93.2	Very high	90.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.103	C	C	.	.	I	π-helix	trans	-67.8	-42.8	-176	173.2	0	0	0	0	110.9	F680 I683 I684 F1122 F1123 T1129 G1130 I1131	F680-V1127 HydrophobicContact CB-CG1 4.33Å; F680-V1127 HydrophobicContact CD1-CB 4.33Å; F680-V1127 HydrophobicContact CD1-CG2 4.04Å; I683-V1127 HydrophobicContact CG2-CG2 4.47Å; I684-V1127 HydrophobicContact CD1-CG1 3.77Å; I684-V1127 HydrophobicContact CG1-CG1 3.7Å; F1122-V1127 HydrophobicContact CD1-CG2 4.1Å; F1122-V1127 HydrophobicContact CE1-CG2 3.83Å; F1122-V1127 HydrophobicContact CZ-CG2 4.23Å; F1122-V1127 WeakPolarHBondContact O-CG2 3.45Å; F1122-V1127 PolarHBondContact O-N 3.29Å; F1123-V1127 HydrophobicContact CD1-CB 4.36Å; F1123-V1127 HydrophobicContact CD1-CG1 4.47Å; F1123-V1127 HydrophobicContact CD1-CG2 3.96Å; F1123-V1127 HydrophobicContact CE1-CG2 4.47Å; F1123-V1127 WeakPolarHBondContact O-CB 3.33Å; V1127-T1129 VanDerWaalsContact C-N 3.34Å; V1127-T1129 PolarHBondContact O-N 3.38Å; V1127-G1130 PolarHBondContact O-N 2.97Å; V1127-I1131 HydrophobicContact CG1-CD1 3.59Å; V1127-I1131 HydrophobicContact CG1-CG1 4.35Å; V1127-I1131 VanDerWaalsContact O-CG1 3.3Å; V1127-I1131 WeakPolarHBondContact O-CG1 3.3Å; V1127-I1131 PolarHBondContact O-N 3.5Å
1128	L	91.8	Very high	90.4	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-58.8	-44.1	176.6	-178.2	57.3	0	0	0	112.2	L1002 C1045 L1048 F1123 C1124 I1131 L1132	L1002-L1128 HydrophobicContact CB-CD1 4.24Å; C1045-L1128 HydrophobicContact CB-CD2 4.48Å; L1048-L1128 HydrophobicContact CD2-CD2 3.89Å; L1048-L1128 HydrophobicContact CD2-CG 4.07Å; F1123-L1128 PolarHBondContact O-N 2.91Å; F1123-L1128 VanDerWaalsContact O-N 3.11Å; C1124-L1128 VanDerWaalsContact O-CB 3.25Å; C1124-L1128 WeakPolarHBondContact O-CB 3Å; C1124-L1128 WeakPolarHBondContact O-CD2 3.2Å; L1128-I1131 PolarHBondContact O-N 3.18Å; L1128-L1132 HydrophobicContact CD1-CD1 4.49Å; L1128-L1132 HydrophobicContact CD1-CG 4.44Å; L1128-L1132 HydrophobicContact CG-CD1 4.3Å; L1128-L1132 WeakPolarHBondContact O-CG 3.41Å; L1128-L1132 PolarHBondContact O-N 3.16Å
1129	T	89.8	Confident	89.5	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-67.1	-39.2	178.8	54.7	0	0	0	0	112.1	I673 L1048 L1077 Y1125 I1126 V1127 L1132 A1133	I673-T1129 WeakPolarHBondContact CG2-OG1 3.34Å; L1048-T1129 HydrophobicContact CD1-CG2 4.03Å; L1048-T1129 HydrophobicContact CD2-CG2 3.4Å; L1048-T1129 VanDerWaalsContact CD2-CG2 3.4Å; L1048-T1129 HydrophobicContact CG-CG2 4.37Å; L1077-T1129 HydrophobicContact CD2-CG2 3.55Å; Y1125-T1129 WeakPolarHBondContact O-CB 3.44Å; Y1125-T1129 WeakPolarHBondContact O-CG2 3.26Å; Y1125-T1129 PolarHBondContact O-N 3.41Å; Y1125-T1129 VanDerWaalsContact O-N 3.17Å; Y1125-T1129 PolarHBondContact O-OG1 3.19Å; I1126-T1129 PolarHBondContact O-N 3.47Å; I1126-T1129 PolarHBondContact O-OG1 3.29Å; V1127-T1129 VanDerWaalsContact C-N 3.34Å; V1127-T1129 PolarHBondContact O-N 3.38Å; T1129-L1132 PolarHBondContact O-N 3.43Å; T1129-A1133 PolarHBondContact O-N 3.37Å
1130	G	90.7	Very high	88.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.1	-42.6	171.9	0	0	0	0	0	113.4	I1126 V1127 A1133 F1134	I1126-G1130 PolarHBondContact O-N 2.85Å; V1127-G1130 PolarHBondContact O-N 2.97Å; G1130-A1133 PolarHBondContact O-N 3.36Å; G1130-F1134 PolarHBondContact O-N 2.82Å
1131	I	90.2	Very high	87.1	Confident	15 Å²	15	33.4 Å²	33.4	8%	0.077	16%	0.163	C	C	.	.	H	α-helix	trans	-70.8	-37	178.6	-67.2	164.7	0	0	0	111.8	F680 I684 L1002 V1127 L1128 A1133 F1134 A1135	F680-I1131 HydrophobicContact CB-CG1 4.03Å; I684-I1131 HydrophobicContact CD1-CD1 3.2Å; I684-I1131 HydrophobicContact CG1-CD1 4.13Å; L1002-I1131 HydrophobicContact CD1-CG2 4.18Å; L1002-I1131 HydrophobicContact CD2-CG2 3.7Å; L1002-I1131 HydrophobicContact CG-CG2 4.44Å; V1127-I1131 HydrophobicContact CG1-CD1 3.59Å; V1127-I1131 HydrophobicContact CG1-CG1 4.35Å; V1127-I1131 VanDerWaalsContact O-CG1 3.3Å; V1127-I1131 WeakPolarHBondContact O-CG1 3.3Å; V1127-I1131 PolarHBondContact O-N 3.5Å; L1128-I1131 PolarHBondContact O-N 3.18Å; I1131-A1133 VanDerWaalsContact C-N 3.32Å; I1131-A1133 PolarHBondContact O-N 3.28Å; I1131-F1134 WeakPolarHBondContact O-CB 3.13Å; I1131-F1134 PolarHBondContact O-N 3.26Å; I1131-A1135 WeakPolarHBondContact O-CB 3.37Å; I1131-A1135 PolarHBondContact O-N 3.2Å
1132	L	88.8	Confident	85.7	Confident	15 Å²	15	37.8 Å²	37.8	8%	0.079	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-41.7	172.5	-70.7	170.6	0	0	0	111.3	L999 L1002 L1048 L1073 L1128 T1129 F1134 A1135 D1136	L999-L1132 HydrophobicContact CD1-CD1 4.06Å; L999-L1132 HydrophobicContact CD1-CD2 3.78Å; L999-L1132 HydrophobicContact CD1-CG 4.48Å; L1002-L1132 HydrophobicContact CD1-CD2 4.06Å; L1048-L1132 HydrophobicContact CD2-CD1 4.46Å; L1073-L1132 HydrophobicContact CD1-CD1 4.46Å; L1073-L1132 HydrophobicContact CD2-CB 4.35Å; L1128-L1132 HydrophobicContact CD1-CD1 4.49Å; L1128-L1132 HydrophobicContact CD1-CG 4.44Å; L1128-L1132 HydrophobicContact CG-CD1 4.3Å; L1128-L1132 WeakPolarHBondContact O-CG 3.41Å; L1128-L1132 PolarHBondContact O-N 3.16Å; T1129-L1132 PolarHBondContact O-N 3.43Å; L1132-F1134 VanDerWaalsContact C-N 3.3Å; L1132-F1134 PolarHBondContact O-N 3.36Å; L1132-A1135 PolarHBondContact O-N 3.39Å; L1132-D1136 PolarHBondContact O-N 2.61Å
1133	A	87.3	Confident	84.3	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-67.8	-27.3	174.5	0	0	0	0	0	113.4	I674 N677 L1073 T1129 G1130 I1131 Q1137	I674-A1133 HydrophobicContact CG2-CB 4.22Å; N677-A1133 HydrophobicContact CB-CB 4Å; N677-A1133 PolarHBondContact ND2-O 3.2Å; L1073-A1133 HydrophobicContact CD2-CB 4.14Å; T1129-A1133 PolarHBondContact O-N 3.37Å; G1130-A1133 PolarHBondContact O-N 3.36Å; I1131-A1133 VanDerWaalsContact C-N 3.32Å; I1131-A1133 PolarHBondContact O-N 3.28Å; A1133-Q1137 PolarHBondContact O-N 3.39Å
1134	F	88.9	Confident	82.6	Confident	60 Å²	60	44.6 Å²	44.6	26%	0.263	22%	0.219	S	C	.	.	H	α-helix	trans	-73.8	-47	171.5	177.8	-102.2	0	0	0	111.7	N677 L678 P681 G1130 I1131 L1132 D1136 Q1137 V1138	N677-F1134 HydrophobicContact CB-CB 4.19Å; N677-F1134 WeakPolarHBondContact ND2-CA 3.5Å; L678-F1134 HydrophobicContact CD1-CD2 4.31Å; L678-F1134 HydrophobicContact CD1-CE2 3.75Å; P681-F1134 HydrophobicContact CG-CD1 3.95Å; P681-F1134 HydrophobicContact CG-CE1 4.2Å; P681-F1134 HydrophobicContact CG-CG 4.13Å; G1130-F1134 PolarHBondContact O-N 2.82Å; I1131-F1134 WeakPolarHBondContact O-CB 3.13Å; I1131-F1134 PolarHBondContact O-N 3.26Å; L1132-F1134 VanDerWaalsContact C-N 3.3Å; L1132-F1134 PolarHBondContact O-N 3.36Å; F1134-D1136 VanDerWaalsContact C-N 3.32Å; F1134-D1136 PolarHBondContact O-N 2.71Å; F1134-Q1137 WeakPolarHBondContact O-CB 3.36Å; F1134-Q1137 PolarHBondContact O-N 3.13Å; F1134-Q1137 VanDerWaalsContact O-N 3.1Å; F1134-V1138 HydrophobicContact CD1-CG2 4.19Å; F1134-V1138 HydrophobicContact CD2-CG2 4.4Å; F1134-V1138 HydrophobicContact CE1-CG2 3.72Å; F1134-V1138 HydrophobicContact CE2-CG2 3.95Å; F1134-V1138 HydrophobicContact CZ-CG2 3.59Å; F1134-V1138 WeakPolarHBondContact O-CG2 3.34Å; F1134-V1138 PolarHBondContact O-N 2.64Å
1135	A	85.9	Confident	80.9	Confident	10 Å²	10	47.6 Å²	47.6	8%	0.083	24%	0.236	C	C	.	.	H	α-helix	trans	-57.8	-44.2	176.6	0	0	0	0	0	111.3	V1067 I1131 L1132 Q1137 V1138 F1139	V1067-A1135 HydrophobicContact CG1-CB 4.28Å; I1131-A1135 WeakPolarHBondContact O-CB 3.37Å; I1131-A1135 PolarHBondContact O-N 3.2Å; L1132-A1135 PolarHBondContact O-N 3.39Å; A1135-Q1137 VanDerWaalsContact C-N 3.31Å; A1135-Q1137 PolarHBondContact O-N 3.44Å; A1135-V1138 PolarHBondContact O-N 2.78Å; A1135-F1139 HydrophobicContact CB-CD2 4.29Å; A1135-F1139 HydrophobicContact CB-CE2 4.38Å; A1135-F1139 WeakPolarHBondContact O-CB 3.33Å; A1135-F1139 WeakPolarHBondContact O-CD2 3.47Å; A1135-F1139 PolarHBondContact O-N 3.06Å
1136	D	82.7	Confident	79.1	Confident	36 Å²	36	57.4 Å²	57.4	19%	0.193	27%	0.273	C	S	.	.	H	α-helix	trans	-57.5	-42.9	175.4	-172.5	41.2	0	0	0	111.9	V1067 R1070 L1132 F1134 G1140	V1067-D1136 HydrophobicContact CB-CB 4.48Å; V1067-D1136 HydrophobicContact CG1-CB 3.87Å; R1070-D1136 WeakPolarHBondContact CG-OD2 3.47Å; R1070-D1136 PolarHBondContact N-OD2 3.04Å; R1070-D1136 VanDerWaalsContact N-OD2 3.09Å; L1132-D1136 PolarHBondContact O-N 2.61Å; F1134-D1136 VanDerWaalsContact C-N 3.32Å; F1134-D1136 PolarHBondContact O-N 2.71Å; D1136-G1140 WeakPolarHBondContact O-CA 3.23Å; D1136-G1140 PolarHBondContact O-N 2.67Å
1137	Q	81.9	Confident	77.3	Confident	94 Å²	94	62.3 Å²	62.3	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-64	-43.8	177	-173.1	176.4	-11.6	0	0	112.5	N677 A1133 F1134 A1135 Y1141	N677-Q1137 PolarHBondContact ND2-OE1 3.11Å; A1133-Q1137 PolarHBondContact O-N 3.39Å; F1134-Q1137 WeakPolarHBondContact O-CB 3.36Å; F1134-Q1137 PolarHBondContact O-N 3.13Å; F1134-Q1137 VanDerWaalsContact O-N 3.1Å; A1135-Q1137 VanDerWaalsContact C-N 3.31Å; A1135-Q1137 PolarHBondContact O-N 3.44Å; Q1137-Y1141 WeakPolarHBondContact O-CB 2.96Å; Q1137-Y1141 PolarHBondContact O-N 3.48Å
1138	V	81.9	Confident	75.1	Confident	48 Å²	48	71.8 Å²	71.8	29%	0.291	34%	0.34	S	S	.	.	H	α-helix	trans	-68.3	-49.8	-178.7	174.8	0	0	0	0	110.7	F1134 A1135 G1140 Y1141 F1142	F1134-V1138 HydrophobicContact CD1-CG2 4.19Å; F1134-V1138 HydrophobicContact CD2-CG2 4.4Å; F1134-V1138 HydrophobicContact CE1-CG2 3.72Å; F1134-V1138 HydrophobicContact CE2-CG2 3.95Å; F1134-V1138 HydrophobicContact CZ-CG2 3.59Å; F1134-V1138 WeakPolarHBondContact O-CG2 3.34Å; F1134-V1138 PolarHBondContact O-N 2.64Å; A1135-V1138 PolarHBondContact O-N 2.78Å; V1138-G1140 VanDerWaalsContact C-N 3.32Å; V1138-G1140 PolarHBondContact O-N 3.31Å; V1138-Y1141 WeakPolarHBondContact O-CB 3.42Å; V1138-Y1141 PolarHBondContact O-N 2.77Å; V1138-F1142 HydrophobicContact CG1-CD2 3.88Å; V1138-F1142 HydrophobicContact CG1-CE2 3.7Å; V1138-F1142 VanDerWaalsContact O-CD2 3.24Å; V1138-F1142 WeakPolarHBondContact O-CD2 2.89Å; V1138-F1142 PolarHBondContact O-N 2.82Å
1139	F	77	Confident	72.6	Confident	108 Å²	108	81.2 Å²	81.2	47%	0.474	39%	0.39	S	S	.	.	H	α-helix	trans	-66.5	-34.6	177.7	-75.3	-68.7	0	0	0	112.3	L998 V1067 A1135 F1142 K1143	L998-F1139 HydrophobicContact CD2-CD2 4.48Å; L998-F1139 HydrophobicContact CD2-CE2 3.66Å; L998-F1139 HydrophobicContact CD2-CZ 4.21Å; V1067-F1139 HydrophobicContact CG2-CD2 3.57Å; V1067-F1139 HydrophobicContact CG2-CE2 4.08Å; V1067-F1139 HydrophobicContact CG2-CG 4.3Å; A1135-F1139 HydrophobicContact CB-CD2 4.29Å; A1135-F1139 HydrophobicContact CB-CE2 4.38Å; A1135-F1139 WeakPolarHBondContact O-CB 3.33Å; A1135-F1139 WeakPolarHBondContact O-CD2 3.47Å; A1135-F1139 PolarHBondContact O-N 3.06Å; F1139-F1142 PolarHBondContact O-N 3.19Å; F1139-K1143 WeakPolarHBondContact O-CB 3.43Å; F1139-K1143 PolarHBondContact O-N 3.15Å
1140	G	70.5	Confident	71.8	Confident	37 Å²	37	85.3 Å²	85.3	38%	0.381	41%	0.409	S	S	.	.	H	α-helix	trans	-61	-42.3	171.5	0	0	0	0	0	112.5	D1136 V1138 K1143 S1144	D1136-G1140 WeakPolarHBondContact O-CA 3.23Å; D1136-G1140 PolarHBondContact O-N 2.67Å; V1138-G1140 VanDerWaalsContact C-N 3.32Å; V1138-G1140 PolarHBondContact O-N 3.31Å; G1140-K1143 PolarHBondContact O-N 3.12Å; G1140-S1144 PolarHBondContact O-N 3.24Å
1141	Y	67.9	Low	70.8	Confident	152 Å²	152	89.8 Å²	89.8	60%	0.596	43%	0.431	S	S	*	.	H	α-helix	trans	-63.8	-43.9	175.1	-173	-98.9	0	0	0	112.1	Q1137 V1138 S1144 N1145	Q1137-Y1141 WeakPolarHBondContact O-CB 2.96Å; Q1137-Y1141 PolarHBondContact O-N 3.48Å; V1138-Y1141 WeakPolarHBondContact O-CB 3.42Å; V1138-Y1141 PolarHBondContact O-N 2.77Å; Y1141-S1144 PolarHBondContact O-N 2.91Å; Y1141-N1145 WeakPolarHBondContact CE1-ND2 2.65Å; Y1141-N1145 PolarHBondContact O-N 2.75Å
1142	F	65.4	Low	69.7	Low	132 Å²	132	93.9 Å²	93.9	58%	0.579	45%	0.45	S	S	*	.	H	α-helix	trans	-64.4	-40.4	175.1	-81.7	-69.2	0	0	0	112.9	V1138 F1139 S1144 N1145 R1146	V1138-F1142 HydrophobicContact CG1-CD2 3.88Å; V1138-F1142 HydrophobicContact CG1-CE2 3.7Å; V1138-F1142 VanDerWaalsContact O-CD2 3.24Å; V1138-F1142 WeakPolarHBondContact O-CD2 2.89Å; V1138-F1142 PolarHBondContact O-N 2.82Å; F1139-F1142 PolarHBondContact O-N 3.19Å; F1142-S1144 VanDerWaalsContact C-N 3.31Å; F1142-S1144 PolarHBondContact O-N 3.24Å; F1142-N1145 PolarHBondContact O-N 2.91Å; F1142-R1146 WeakPolarHBondContact O-CB 3.43Å; F1142-R1146 PolarHBondContact O-N 3.29Å
1143	K	63.7	Low	68.6	Low	154 Å²	154	98.6 Å²	98.6	67%	0.67	47%	0.472	S	S	*	.	H	α-helix	trans	-64.3	-38	176.6	-167.5	175.9	-177.7	179.9	0	111.3	F1139 G1140 V1147	F1139-K1143 WeakPolarHBondContact O-CB 3.43Å; F1139-K1143 PolarHBondContact O-N 3.15Å; G1140-K1143 PolarHBondContact O-N 3.12Å; K1143-V1147 VanDerWaalsContact O-CG2 3.28Å; K1143-V1147 WeakPolarHBondContact O-CG2 3.45Å; K1143-V1147 PolarHBondContact O-N 3.2Å
1144	S	58.9	Low	67.4	Low	55 Å²	55	104.7 Å²	104.7	39%	0.385	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-51	173.5	-169.6	0	0	0	0	111	G1140 Y1141 F1142 R1146 V1147 Y1148	G1140-S1144 PolarHBondContact O-N 3.24Å; Y1141-S1144 PolarHBondContact O-N 2.91Å; F1142-S1144 VanDerWaalsContact C-N 3.31Å; F1142-S1144 PolarHBondContact O-N 3.24Å; S1144-R1146 VanDerWaalsContact C-N 3.29Å; S1144-R1146 PolarHBondContact O-N 3.32Å; S1144-V1147 PolarHBondContact O-N 3.03Å; S1144-Y1148 WeakPolarHBondContact O-CD2 3.47Å; S1144-Y1148 PolarHBondContact O-N 2.85Å
1145	N	58.2	Low	66	Low	63 Å²	63	107.7 Å²	107.7	34%	0.337	52%	0.517	S	S	.	.	H	α-helix	trans	-65.8	-28.3	-178.6	-78.2	-0.7	0	0	0	113.7	Y1141 F1142 V1147 Y1148 L1149	Y1141-N1145 WeakPolarHBondContact CE1-ND2 2.65Å; Y1141-N1145 PolarHBondContact O-N 2.75Å; F1142-N1145 PolarHBondContact O-N 2.91Å; N1145-V1147 VanDerWaalsContact C-N 3.28Å; N1145-V1147 PolarHBondContact O-N 2.67Å; N1145-Y1148 PolarHBondContact O-N 2.67Å; N1145-L1149 PolarHBondContact O-N 3.01Å
1146	R	53.7	Low	64.6	Low	211 Å²	211	114.6 Å²	114.6	80%	0.796	55%	0.548	S	S	*	.	H	α-helix	trans	-78.3	-9.9	175.1	-143.3	-174.9	-150.6	179.4	6.5	114	F1142 S1144	F1142-R1146 WeakPolarHBondContact O-CB 3.43Å; F1142-R1146 PolarHBondContact O-N 3.29Å; S1144-R1146 VanDerWaalsContact C-N 3.29Å; S1144-R1146 PolarHBondContact O-N 3.32Å
1147	V	54.8	Low	63.2	Low	117 Å²	117	120.7 Å²	120.7	71%	0.709	58%	0.575	S	S	*	*	H	α-helix	trans	-96.6	-17.4	172.2	174	0	0	0	0	110.7	K1143 S1144 N1145	K1143-V1147 VanDerWaalsContact O-CG2 3.28Å; K1143-V1147 WeakPolarHBondContact O-CG2 3.45Å; K1143-V1147 PolarHBondContact O-N 3.2Å; S1144-V1147 PolarHBondContact O-N 3.03Å; N1145-V1147 VanDerWaalsContact C-N 3.28Å; N1145-V1147 PolarHBondContact O-N 2.67Å
1148	Y	47.9	Very low	61.6	Low	198 Å²	198	122.9 Å²	122.9	78%	0.776	59%	0.587	S	S	*	*	H	α-helix	trans	-92.3	-13	173.2	-76.8	-72.2	0	0	0	114.1	S1144 N1145	S1144-Y1148 WeakPolarHBondContact O-CD2 3.47Å; S1144-Y1148 PolarHBondContact O-N 2.85Å; N1145-Y1148 PolarHBondContact O-N 2.67Å
1149	L	39.4	Very low	59.8	Low	200 Å²	200	129.7 Å²	129.7	100%	1.047	61%	0.614	S	S	*	*			trans	-95.6	0	164.5	-82.1	159.3	0	0	0	109	N1145	N1145-L1149 PolarHBondContact O-N 3.01Å

Retrieved 1,149 of 1,149 residues in 342.1 ms (Link to these results)

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