A0A077ZL54_TRITR Loading...

Glutathione import ATP-binding protein GsiA

Has both L-asparaginase and beta-aspartyl peptidase activity. Does not have aspartylglucosaminidase activity and is inactive toward GlcNAc-L-Asn. Likewise, has no activity toward glutamine. Part of the ABC transporter complex GsiABCD involved in glutathione import. Responsible for energy coupling to the transport system.

AlphaFold DB , UniProt , Accession A0A077ZL54, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 900 aa.

						>A0A077ZL54_TRITR|A0A077ZL54
MGKAVIAIHGGAGAISRAQMSLQQELRYIEALSAIVETGQKMLEAGESALDVVTEAVRLLEECPLFNAGIGAVFTRDETHELDACVMDGNTLKAGAVAGVSHLRNPVLAARLVMEQSPHVMMIGEGAENFAFAHGMERVSPEIFSTPLRYEQLLAAREEGATVLDHSGAPLDEKQKMGTVGAVALDLDGNLAAATSTGGMTNKLPGRVGDSPLVGAGCYANNASVAVSCTGTGEVFIRALAAYDIAALMDYGGLSLAEACERVVMEKLPALGGSGGLIAIDHEGNVVLPFNTEGMYRAWGYAGDTPTTGIYREKGDTDQQKIAAVRNLSFSLQRGETLAIVGESGSGKSVTALALMRLLEQAGGLVQCDQTLLRRRSREVIELSEQSAAQMRHVRGADMAMIFQEPMTSLNPVFTVGEQIAESIRLHQNASREEAMVEAKRMLDQVRIPEAQTILSRYPHQLSGGMRQRVMIAMALSCRPAVLIADEPTTALDVTIQAQILQLIKVLQKEMSMGVIFITHDMGVVAEIADRVLVMYQGEAVETGSVEQIFHAPQHPYTRALLAAVPQLGAMKGETGPPIEQKTVVDGEPVLRVRNLVTRFPLRSGLLNRVTREVHAVEKVSFDLWPGETLSLVGESGSGKSTTGRALLRLVESQGGEIIFNGQRIDTLSPGKLQALRRDIQFIFQDPYASLDPRQTIGDSIIEPLRVHGLLPGKDAAARVAWLLERVGLLPEHAWRYPHEFSGGQRQRICIARALALNPKVIIADEAVSALDVSIRGQIINLLLDLQRDFGIAYLFISHDMAVVERISHRVAVMYLGQIVEIGPRRAVFENPQHPYTRKLLAAVPVAEPSRQRPQRVLLSDDLPSNIHLRGEEVAAVSLQCVGPGHYVAQPQSEYAFMRR
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.3	Very low	84.5	Confident	237 Å²	237	38.6 Å²	38.6	100%	1.167	22%	0.217	S	C	*	.				0	114.3	0	-86.4	168.6	169.1	0	0	105.5
2	G	52.9	Low	83.8	Confident	58 Å²	58	35.6 Å²	35.6	60%	0.598	20%	0.2	S	C	*	.			trans	-60.8	141.2	178	0	0	0	0	0	109.8	A4	G2-A4 PolarHBondContact O-N 3.42Å
3	K	74.7	Confident	82.7	Confident	120 Å²	120	33.6 Å²	33.6	52%	0.522	19%	0.192	S	C	.	.			trans	-81.1	94	179.6	-74.5	-176.2	175.9	-177.3	0	108.8	V5 Y301	K3-V5 PolarHBondContact O-N 3.38Å; K3-Y301 HydrophobicContact CB-CD1 3.78Å; K3-Y301 HydrophobicContact CB-CE1 3.69Å; K3-Y301 HydrophobicContact CD-CD1 4.2Å; K3-Y301 HydrophobicContact CD-CE1 3.69Å; K3-Y301 HydrophobicContact CG-CD1 4.37Å; K3-Y301 HydrophobicContact CG-CE1 4.25Å
4	A	94.1	Very high	80.8	Confident	4 Å²	4	32.3 Å²	32.3	3%	0.033	19%	0.188	C	C	.	.			trans	-63.8	132.1	170.6	0	0	0	0	0	109.8	G2 L43 L185 L187 Y301 A302	G2-A4 PolarHBondContact O-N 3.42Å; A4-L43 HydrophobicContact CB-CB 4.2Å; A4-L43 HydrophobicContact CB-CD1 4.49Å; A4-L43 HydrophobicContact CB-CD2 4.37Å; A4-L185 CarbonylContact C-O 3.57Å; A4-L185 VanDerWaalsContact CA-O 3.23Å; A4-L185 WeakPolarHBondContact CA-O 3.36Å; A4-L187 HydrophobicContact CB-CD2 3.77Å; A4-L187 HydrophobicContact CB-CG 4.13Å; A4-Y301 CarbonylContact O-C 3.47Å; A4-Y301 WeakPolarHBondContact O-CA 3.4Å; A4-A302 HydrophobicContact CB-CB 3.99Å; A4-A302 PolarHBondContact O-N 2.81Å
5	V	97.5	Very high	79.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	148.1	-170.2	57.2	0	0	0	0	111.7	K3 A184 L185 I280 V286 W299 Y301	K3-V5 PolarHBondContact O-N 3.38Å; V5-A184 CarbonylContact O-C 3.59Å; V5-A184 VanDerWaalsContact O-CA 3.23Å; V5-A184 WeakPolarHBondContact O-CA 3.5Å; V5-L185 HydrophobicContact CG1-CB 3.8Å; V5-L185 HydrophobicContact CG1-CD2 4.45Å; V5-L185 PolarHBondContact N-O 3.29Å; V5-L185 PolarHBondContact O-N 2.87Å; V5-I280 HydrophobicContact CG1-CD1 3.91Å; V5-I280 HydrophobicContact CG1-CG2 3.73Å; V5-I280 HydrophobicContact CG2-CD1 4.25Å; V5-V286 HydrophobicContact CG1-CG2 4.46Å; V5-V286 HydrophobicContact CG2-CG2 3.51Å; V5-W299 HydrophobicContact CG2-CE3 4.21Å; V5-Y301 HydrophobicContact CB-CD1 3.53Å; V5-Y301 HydrophobicContact CB-CE1 3.69Å; V5-Y301 HydrophobicContact CB-CG 4.46Å; V5-Y301 HydrophobicContact CG1-CD1 4.41Å; V5-Y301 HydrophobicContact CG1-CE1 4.15Å; V5-Y301 HydrophobicContact CG2-CD1 3.76Å; V5-Y301 HydrophobicContact CG2-CE1 3.76Å; V5-Y301 HydrophobicContact CG2-CG 4.35Å
6	I	98.3	Very high	78.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.5	172.1	-175	178.9	0	0	0	109.8	I8 V36 Q40 L43 V52 A56 V183 A184 W299 G300	I6-I8 HydrophobicContact CD1-CG2 4.15Å; I6-I8 HydrophobicContact CG1-CG2 4.26Å; I6-V36 HydrophobicContact CG2-CG1 3.99Å; I6-Q40 HydrophobicContact CG2-CG 4.08Å; I6-L43 HydrophobicContact CB-CD1 4.08Å; I6-L43 HydrophobicContact CG2-CD1 4.33Å; I6-V52 HydrophobicContact CB-CG1 4.45Å; I6-V52 HydrophobicContact CD1-CG1 3.64Å; I6-V52 HydrophobicContact CG1-CG1 4.25Å; I6-A56 HydrophobicContact CD1-CB 3.9Å; I6-V183 WeakPolarHBondContact CA-O 3.27Å; I6-A184 HydrophobicContact CB-CB 4.43Å; I6-A184 HydrophobicContact CG1-CB 4.42Å; I6-W299 CarbonylContact O-C 3.59Å; I6-W299 WeakPolarHBondContact O-CA 3.33Å; I6-W299 WeakPolarHBondContact O-CB 3.33Å; I6-G300 PolarHBondContact N-O 3.21Å; I6-G300 VanDerWaalsContact N-O 3.1Å; I6-G300 PolarHBondContact O-N 3.09Å
7	A	98	Very high	78.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	148.1	165.4	0	0	0	0	0	110	A182 V183 I278 I280 V286 L288 A298 W299	A7-A182 CarbonylContact O-C 3.54Å; A7-A182 VanDerWaalsContact O-CA 3.3Å; A7-A182 WeakPolarHBondContact O-CA 3.28Å; A7-V183 HydrophobicContact CB-CG2 3.84Å; A7-V183 PolarHBondContact N-O 3.03Å; A7-V183 PolarHBondContact O-N 3.21Å; A7-I278 HydrophobicContact CB-CB 4.29Å; A7-I278 HydrophobicContact CB-CD1 4.42Å; A7-I278 WeakPolarHBondContact O-CD1 3.33Å; A7-I280 HydrophobicContact CB-CD1 4.08Å; A7-I280 HydrophobicContact CB-CG1 4.45Å; A7-V286 HydrophobicContact CB-CG1 3.93Å; A7-L288 HydrophobicContact CB-CD2 4.47Å; A7-A298 CarbonylContact C-O 3.57Å; A7-A298 WeakPolarHBondContact CA-O 3.08Å; A7-W299 HydrophobicContact CB-CB 3.68Å
8	I	98.1	Very high	77.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	155	178.1	67.9	172.9	0	0	0	111.3	I6 L32 I35 V36 A56 L60 G181 A182 R297 A298	I6-I8 HydrophobicContact CD1-CG2 4.15Å; I6-I8 HydrophobicContact CG1-CG2 4.26Å; I8-L32 HydrophobicContact CD1-CB 4.46Å; I8-L32 HydrophobicContact CD1-CD2 3.84Å; I8-L32 HydrophobicContact CG1-CD2 4.23Å; I8-I35 HydrophobicContact CD1-CB 3.88Å; I8-I35 HydrophobicContact CD1-CG2 3.74Å; I8-V36 HydrophobicContact CD1-CG2 3.66Å; I8-V36 HydrophobicContact CG1-CG2 3.7Å; I8-V36 HydrophobicContact CG2-CG2 4.46Å; I8-A56 HydrophobicContact CG2-CB 4.18Å; I8-L60 HydrophobicContact CB-CD1 4.47Å; I8-G181 CarbonylContact C-O 3.56Å; I8-G181 WeakPolarHBondContact CA-O 3.44Å; I8-A182 HydrophobicContact CG2-CB 3.9Å; I8-R297 WeakPolarHBondContact O-CA 3.41Å; I8-A298 HydrophobicContact CD1-CB 4.31Å; I8-A298 HydrophobicContact CG1-CB 3.96Å; I8-A298 PolarHBondContact N-O 3.29Å; I8-A298 PolarHBondContact O-N 3.06Å
9	H	96	Very high	76.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	148.3	164.2	67.8	76.4	0	0	0	112.1	T179 V180 G181 S228 C229 I278 M295 Y296	H9-T179 PolarHBondContact CE1-O 3.25Å; H9-T179 PolarHBondContact ND1-O 3.38Å; H9-V180 VanDerWaalsContact O-CA 3.28Å; H9-V180 WeakPolarHBondContact O-CA 3.49Å; H9-G181 PolarHBondContact CE1-N 3.43Å; H9-G181 PolarHBondContact N-O 3.16Å; H9-G181 PolarHBondContact O-N 3.37Å; H9-S228 PolarHBondContact NE2-O 3.42Å; H9-S228 PolarHBondContact NE2-OG 2.83Å; H9-C229 PolarHBondContact CE1-O 3.16Å; H9-I278 HydrophobicContact CB-CG2 4.01Å; H9-M295 HydrophobicContact CB-CG 4.47Å; H9-M295 HydrophobicContact CB-SD 4.49Å; H9-Y296 CarbonylContact C-O 3.53Å; H9-Y296 WeakPolarHBondContact CA-O 3.49Å; H9-Y296 WeakPolarHBondContact CB-O 3.22Å
10	G	91	Very high	76.2	Confident	4 Å²	4	44 Å²	44	4%	0.041	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	4.4	173.9	0	0	0	0	0	114.1	T179 Y296	G10-T179 CarbonylContact C-O 3.59Å; G10-Y296 PolarHBondContact N-O 3.19Å
11	G	86.7	Confident	76.2	Confident	2 Å²	2	44.5 Å²	44.5	2%	0.021	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119.2	149	177.4	0	0	0	0	0	114.1	T179 T230 M295 Y296	G11-T179 WeakPolarHBondContact CA-O 3.34Å; G11-T179 PolarHBondContact N-O 3.09Å; G11-T230 WeakPolarHBondContact CA-OG1 3.39Å; G11-M295 WeakPolarHBondContact O-CA 3.24Å; G11-Y296 WeakPolarHBondContact O-CD2 3Å; G11-Y296 PolarHBondContact O-N 2.82Å; G11-Y296 VanDerWaalsContact O-N 3.08Å
12	A	75.4	Confident	77.7	Confident	2 Å²	2	39.3 Å²	39.3	2%	0.017	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.9	174.5	0	0	0	0	0	111.2	T230 T292 M295	A12-T230 HydrophobicContact CB-CG2 3.61Å; A12-T230 PolarHBondContact N-OG1 3.47Å; A12-T292 HydrophobicContact CB-CG2 4.42Å; A12-M295 HydrophobicContact CB-CB 3.94Å; A12-M295 HydrophobicContact CB-CG 3.88Å; A12-M295 HydrophobicContact CB-SD 4.18Å
13	G	69.7	Low	78.9	Confident	10 Å²	10	44 Å²	44	10%	0.103	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168	-162.3	177.8	0	0	0	0	0	114.3	I15 G294	G13-I15 PolarHBondContact O-N 2.93Å; G13-G294 PolarHBondContact N-O 2.74Å
14	A	56.9	Low	79.1	Confident	15 Å²	15	42.9 Å²	42.9	12%	0.124	23%	0.23	C	C	.	.			trans	-71.4	72.5	173.7	0	0	0	0	0	110.5	S16 L171	A14-S16 PolarHBondContact O-N 2.82Å; A14-L171 HydrophobicContact CB-CD2 4.35Å
15	I	65	Low	78.5	Confident	16 Å²	16	44.3 Å²	44.3	8%	0.082	24%	0.235	C	C	.	.			trans	-90.4	96.6	169.5	-51.1	171.7	0	0	0	104.3	G13 R17 M20 E293 Y296 I310 Y311	G13-I15 PolarHBondContact O-N 2.93Å; I15-R17 PolarHBondContact O-N 2.95Å; I15-M20 HydrophobicContact CG2-CE 3.79Å; I15-E293 WeakPolarHBondContact O-CG 3.13Å; I15-Y296 HydrophobicContact CD1-CD2 3.63Å; I15-Y296 HydrophobicContact CD1-CE1 4.34Å; I15-Y296 HydrophobicContact CD1-CE2 3.33Å; I15-Y296 HydrophobicContact CD1-CG 4.24Å; I15-Y296 HydrophobicContact CG1-CE2 3.99Å; I15-I310 HydrophobicContact CD1-CG2 4.19Å; I15-I310 HydrophobicContact CG2-CG2 3.94Å; I15-Y311 HydrophobicContact CB-CE1 4.26Å; I15-Y311 HydrophobicContact CG2-CE1 3.83Å; I15-Y311 WeakPolarHBondContact CG2-OH 3.18Å; I15-Y311 VanDerWaalsContact O-CE1 3.25Å; I15-Y311 WeakPolarHBondContact O-CE1 3.49Å
16	S	62.9	Low	77.8	Confident	9 Å²	9	48.1 Å²	48.1	6%	0.063	26%	0.255	C	S	.	.			trans	-80.1	118.2	-178.9	178.4	0	0	0	0	109.9	A14 A18 Q19 M20 E173 E293	A14-S16 PolarHBondContact O-N 2.82Å; S16-A18 PolarHBondContact O-N 3.35Å; S16-A18 VanDerWaalsContact O-N 3.16Å; S16-Q19 PolarHBondContact O-N 3.4Å; S16-M20 PolarHBondContact O-N 3.29Å; S16-E173 WeakPolarHBondContact CB-OE1 3.49Å; S16-E173 PolarHBondContact OG-OE1 2.81Å; S16-E293 WeakPolarHBondContact CA-OE1 3.42Å
17	R	67.9	Low	77.4	Confident	155 Å²	155	55 Å²	55	59%	0.585	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.2	177.3	-164.7	174.2	-172.6	177.3	7.6	111.9	I15 Q19 E293 Y311	I15-R17 PolarHBondContact O-N 2.95Å; R17-Q19 VanDerWaalsContact C-N 3.32Å; R17-E293 PolarHBondContact N-OE1 2.98Å; R17-Y311 WeakPolarHBondContact CA-OH 3.33Å; R17-Y311 HydrophobicContact CB-CD1 4.09Å; R17-Y311 HydrophobicContact CB-CE1 3.67Å; R17-Y311 HydrophobicContact CB-CE2 4.23Å; R17-Y311 HydrophobicContact CG-CD2 4.17Å; R17-Y311 HydrophobicContact CG-CE1 4.22Å; R17-Y311 HydrophobicContact CG-CE2 3.87Å
18	A	62.1	Low	77	Confident	98 Å²	98	55.7 Å²	55.7	81%	0.81	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-23.2	178	0	0	0	0	0	113.6	S16	S16-A18 PolarHBondContact O-N 3.35Å; S16-A18 VanDerWaalsContact O-N 3.16Å
19	Q	63.8	Low	76.5	Confident	118 Å²	118	58 Å²	58	55%	0.551	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-10.7	-176.6	-61.4	-175.4	-0.6	0	0	113.3	S16 R17 E173	S16-Q19 PolarHBondContact O-N 3.4Å; R17-Q19 VanDerWaalsContact C-N 3.32Å; Q19-E173 PolarHBondContact NE2-OE2 2.93Å
20	M	71.3	Confident	76.3	Confident	31 Å²	31	63.9 Å²	63.9	15%	0.153	32%	0.324	C	S	.	.			trans	-93.8	118.9	-179.5	-170.4	173.6	-83.4	0	0	111	I15 S16 Q24 E25 Y28 Y296 I310 Y311	I15-M20 HydrophobicContact CG2-CE 3.79Å; S16-M20 PolarHBondContact O-N 3.29Å; M20-Q24 HydrophobicContact CG-CB 4.09Å; M20-E25 HydrophobicContact CG-CB 4.08Å; M20-E25 HydrophobicContact SD-CB 3.77Å; M20-E25 HydrophobicContact SD-CG 3.98Å; M20-Y28 HydrophobicContact CE-CD2 4Å; M20-Y28 HydrophobicContact CE-CE2 3.94Å; M20-Y296 HydrophobicContact CE-CE1 3.92Å; M20-Y296 WeakPolarHBondContact CE-OH 3.47Å; M20-I310 HydrophobicContact SD-CD1 4.37Å; M20-Y311 PolarHBondContact SD-OH 3.45Å; M20-Y311 VanDerWaalsContact SD-OH 3.42Å
21	S	75.9	Confident	76.4	Confident	55 Å²	55	64.6 Å²	64.6	39%	0.385	33%	0.329	S	S	.	.			trans	-68.9	149.2	171.8	65.6	0	0	0	0	111.1	Q23 Q24 E25	S21-Q23 PolarHBondContact O-N 3.31Å; S21-Q24 VanDerWaalsContact N-OE1 3.12Å; S21-Q24 WeakPolarHBondContact O-CA 3.42Å; S21-Q24 WeakPolarHBondContact O-CB 3.24Å; S21-Q24 PolarHBondContact O-N 2.71Å; S21-Q24 WeakPolarHBondContact OG-CB 3.47Å; S21-Q24 VanDerWaalsContact OG-CD 3.24Å; S21-Q24 VanDerWaalsContact OG-CG 3.22Å; S21-Q24 WeakPolarHBondContact OG-CG 3.3Å; S21-Q24 PolarHBondContact OG-N 2.74Å; S21-Q24 PolarHBondContact OG-OE1 3.38Å; S21-E25 PolarHBondContact O-N 2.81Å
22	L	72.9	Confident	76.8	Confident	128 Å²	128	64.5 Å²	64.5	67%	0.67	33%	0.328	S	S	*	.	H	α-helix	trans	-54.2	-37.8	177.1	-175	70.7	0	0	0	112.4	E25 L26	L22-E25 PolarHBondContact O-N 3.46Å; L22-L26 HydrophobicContact CG-CD1 4.25Å; L22-L26 WeakPolarHBondContact O-CB 3.41Å; L22-L26 VanDerWaalsContact O-CG 3.28Å; L22-L26 WeakPolarHBondContact O-CG 3.36Å; L22-L26 PolarHBondContact O-N 2.9Å
23	Q	78.3	Confident	77.7	Confident	158 Å²	158	65.6 Å²	65.6	74%	0.738	34%	0.335	S	S	*	.	H	α-helix	trans	-66.2	-38.7	176.1	-73.5	-173	-11.6	0	0	112.6	S21 R27	S21-Q23 PolarHBondContact O-N 3.31Å; Q23-R27 WeakPolarHBondContact O-CG 3.49Å; Q23-R27 PolarHBondContact O-N 2.68Å
24	Q	79.3	Confident	78.9	Confident	96 Å²	96	67.4 Å²	67.4	45%	0.449	35%	0.35	S	S	.	.	H	α-helix	trans	-67.5	-43.8	174.6	-76.5	165	-35.4	0	0	110.9	M20 S21 L26 R27 Y28	M20-Q24 HydrophobicContact CG-CB 4.09Å; S21-Q24 VanDerWaalsContact N-OE1 3.12Å; S21-Q24 WeakPolarHBondContact O-CA 3.42Å; S21-Q24 WeakPolarHBondContact O-CB 3.24Å; S21-Q24 PolarHBondContact O-N 2.71Å; S21-Q24 WeakPolarHBondContact OG-CB 3.47Å; S21-Q24 VanDerWaalsContact OG-CD 3.24Å; S21-Q24 VanDerWaalsContact OG-CG 3.22Å; S21-Q24 WeakPolarHBondContact OG-CG 3.3Å; S21-Q24 PolarHBondContact OG-N 2.74Å; S21-Q24 PolarHBondContact OG-OE1 3.38Å; Q24-L26 PolarHBondContact O-N 3.09Å; Q24-R27 WeakPolarHBondContact O-CB 2.96Å; Q24-R27 PolarHBondContact O-N 3.4Å; Q24-Y28 VanDerWaalsContact O-CD2 3.23Å; Q24-Y28 WeakPolarHBondContact O-CD2 3.41Å; Q24-Y28 PolarHBondContact O-N 2.65Å
25	E	80.8	Confident	80.8	Confident	33 Å²	33	67.2 Å²	67.2	15%	0.154	35%	0.346	C	S	.	.	H	α-helix	trans	-56.2	-49.3	176.5	-165.8	176.5	177.3	0	0	111.3	M20 S21 L22 R27 Y28 I29 I310	M20-E25 HydrophobicContact CG-CB 4.08Å; M20-E25 HydrophobicContact SD-CB 3.77Å; M20-E25 HydrophobicContact SD-CG 3.98Å; S21-E25 PolarHBondContact O-N 2.81Å; L22-E25 PolarHBondContact O-N 3.46Å; E25-R27 VanDerWaalsContact C-N 3.32Å; E25-R27 PolarHBondContact O-N 3Å; E25-Y28 PolarHBondContact O-N 2.83Å; E25-Y28 VanDerWaalsContact O-N 3.15Å; E25-I29 HydrophobicContact CG-CD1 4.1Å; E25-I29 WeakPolarHBondContact O-CG1 3.33Å; E25-I29 PolarHBondContact O-N 2.94Å; E25-I310 HydrophobicContact CG-CD1 3.9Å
26	L	84.2	Confident	82.4	Confident	80 Å²	80	66.5 Å²	66.5	42%	0.419	34%	0.343	S	S	.	.	H	α-helix	trans	-57.9	-40.5	176.5	-75.2	168	0	0	0	112.7	L22 Q24 Y28 I29 E30	L22-L26 HydrophobicContact CG-CD1 4.25Å; L22-L26 WeakPolarHBondContact O-CB 3.41Å; L22-L26 VanDerWaalsContact O-CG 3.28Å; L22-L26 WeakPolarHBondContact O-CG 3.36Å; L22-L26 PolarHBondContact O-N 2.9Å; Q24-L26 PolarHBondContact O-N 3.09Å; L26-Y28 VanDerWaalsContact C-N 3.34Å; L26-Y28 PolarHBondContact O-N 2.96Å; L26-I29 PolarHBondContact O-N 2.8Å; L26-E30 WeakPolarHBondContact O-CB 3.3Å; L26-E30 WeakPolarHBondContact O-CG 3.44Å; L26-E30 PolarHBondContact O-N 2.93Å
27	R	89.3	Confident	83.9	Confident	145 Å²	145	69.7 Å²	69.7	55%	0.547	36%	0.356	S	S	.	.	H	α-helix	trans	-62.9	-38.4	177	-74.2	177.7	66.4	-176.2	0.6	113	Q23 Q24 E25 A31 L65	Q23-R27 WeakPolarHBondContact O-CG 3.49Å; Q23-R27 PolarHBondContact O-N 2.68Å; Q24-R27 WeakPolarHBondContact O-CB 2.96Å; Q24-R27 PolarHBondContact O-N 3.4Å; E25-R27 VanDerWaalsContact C-N 3.32Å; E25-R27 PolarHBondContact O-N 3Å; R27-A31 WeakPolarHBondContact O-CB 3.35Å; R27-A31 PolarHBondContact O-N 2.8Å; R27-A31 VanDerWaalsContact O-N 3.15Å; R27-L65 HydrophobicContact CB-CD1 4.3Å
28	Y	89.5	Confident	85.3	Confident	15 Å²	15	64.7 Å²	64.7	6%	0.059	34%	0.344	C	S	.	.	H	α-helix	trans	-67.8	-43.4	174.3	-78.7	-82.1	0	0	0	111.1	M20 Q24 E25 L26 A31 L32 L65 F66 K176 Y296	M20-Y28 HydrophobicContact CE-CD2 4Å; M20-Y28 HydrophobicContact CE-CE2 3.94Å; Q24-Y28 VanDerWaalsContact O-CD2 3.23Å; Q24-Y28 WeakPolarHBondContact O-CD2 3.41Å; Q24-Y28 PolarHBondContact O-N 2.65Å; E25-Y28 PolarHBondContact O-N 2.83Å; E25-Y28 VanDerWaalsContact O-N 3.15Å; L26-Y28 VanDerWaalsContact C-N 3.34Å; L26-Y28 PolarHBondContact O-N 2.96Å; Y28-A31 PolarHBondContact O-N 3.34Å; Y28-L32 WeakPolarHBondContact O-CB 3.41Å; Y28-L32 VanDerWaalsContact O-CG 3.25Å; Y28-L32 WeakPolarHBondContact O-CG 3.4Å; Y28-L32 PolarHBondContact O-N 3.42Å; Y28-L65 HydrophobicContact CD1-CB 4.12Å; Y28-L65 HydrophobicContact CD1-CD1 4.47Å; Y28-L65 HydrophobicContact CE1-CB 3.72Å; Y28-L65 WeakPolarHBondContact CE1-O 3.39Å; Y28-L65 PolarHBondContact OH-O 3.47Å; Y28-F66 HydrophobicContact CD1-CD1 4.32Å; Y28-F66 AromaticContact CD1-CE1 3.66Å; Y28-F66 HydrophobicContact CD1-CE1 3.66Å; Y28-F66 HydrophobicContact CD1-CZ 4.08Å; Y28-F66 HydrophobicContact CE1-CD1 4.28Å; Y28-F66 HydrophobicContact CE1-CE1 4.08Å; Y28-K176 PolarHBondContact OH-NZ 3.49Å; Y28-Y296 AromaticContact CD1-CD1 3.62Å; Y28-Y296 HydrophobicContact CD1-CD1 3.62Å; Y28-Y296 AromaticContact CD1-CE1 3.36Å; Y28-Y296 HydrophobicContact CD1-CE1 3.36Å; Y28-Y296 HydrophobicContact CD1-CG 4.33Å; Y28-Y296 AromaticContact CD1-CZ 3.87Å; Y28-Y296 AromaticContact CD2-CE1 3.79Å; Y28-Y296 HydrophobicContact CD2-CE1 3.79Å; Y28-Y296 HydrophobicContact CE1-CD1 4.23Å; Y28-Y296 AromaticContact CE1-CE1 3.68Å; Y28-Y296 HydrophobicContact CE1-CE1 3.68Å; Y28-Y296 HydrophobicContact CE1-CE2 4.19Å; Y28-Y296 AromaticContact CE1-CZ 3.67Å; Y28-Y296 HydrophobicContact CE2-CE1 4.14Å; Y28-Y296 AromaticContact CG-CD1 3.85Å; Y28-Y296 HydrophobicContact CG-CD1 3.85Å; Y28-Y296 AromaticContact CG-CE1 3.42Å; Y28-Y296 HydrophobicContact CG-CE1 3.42Å; Y28-Y296 VanDerWaalsContact CG-CE1 3.42Å; Y28-Y296 AromaticContact CZ-CZ 3.88Å
29	I	88	Confident	87	Confident	47 Å²	47	60.1 Å²	60.1	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-49.1	178.5	-71.1	169.7	0	0	0	111.2	E25 L26 A31 L32 S33 T308 I310	E25-I29 HydrophobicContact CG-CD1 4.1Å; E25-I29 WeakPolarHBondContact O-CG1 3.33Å; E25-I29 PolarHBondContact O-N 2.94Å; L26-I29 PolarHBondContact O-N 2.8Å; I29-A31 VanDerWaalsContact C-N 3.34Å; I29-A31 PolarHBondContact O-N 3.32Å; I29-L32 PolarHBondContact O-N 2.88Å; I29-S33 WeakPolarHBondContact O-CB 3.38Å; I29-S33 PolarHBondContact O-N 2.8Å; I29-T308 HydrophobicContact CG2-CG2 4.48Å; I29-T308 WeakPolarHBondContact CG2-OG1 3.27Å; I29-I310 HydrophobicContact CG1-CD1 4.19Å
30	E	91.2	Very high	88.6	Confident	125 Å²	125	54.9 Å²	54.9	58%	0.584	28%	0.281	S	S	*	.	H	α-helix	trans	-59.7	-43.5	177.8	-75.2	173.1	177.4	0	0	111.7	L26 S33 A34	L26-E30 WeakPolarHBondContact O-CB 3.3Å; L26-E30 WeakPolarHBondContact O-CG 3.44Å; L26-E30 PolarHBondContact O-N 2.93Å; E30-S33 PolarHBondContact O-N 2.78Å; E30-A34 WeakPolarHBondContact O-CB 3.47Å; E30-A34 PolarHBondContact O-N 3.34Å
31	A	93.2	Very high	89.8	Confident	19 Å²	19	59.4 Å²	59.4	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-46.5	177.6	0	0	0	0	0	112	R27 Y28 I29 A34 I35 L65 F66	R27-A31 WeakPolarHBondContact O-CB 3.35Å; R27-A31 PolarHBondContact O-N 2.8Å; R27-A31 VanDerWaalsContact O-N 3.15Å; Y28-A31 PolarHBondContact O-N 3.34Å; I29-A31 VanDerWaalsContact C-N 3.34Å; I29-A31 PolarHBondContact O-N 3.32Å; A31-A34 PolarHBondContact O-N 3.19Å; A31-I35 WeakPolarHBondContact O-CD1 3.47Å; A31-I35 VanDerWaalsContact O-CG1 3.23Å; A31-I35 WeakPolarHBondContact O-CG1 3.49Å; A31-I35 PolarHBondContact O-N 3.21Å; A31-L65 HydrophobicContact CB-CD1 4.1Å; A31-F66 HydrophobicContact CB-CE2 4.2Å; A31-F66 HydrophobicContact CB-CZ 4.38Å
32	L	94.6	Very high	90.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.1	-44.8	177.3	-70.3	167.5	0	0	0	111.6	I8 Y28 I29 I35 V36 F66 A298 T308	I8-L32 HydrophobicContact CD1-CB 4.46Å; I8-L32 HydrophobicContact CD1-CD2 3.84Å; I8-L32 HydrophobicContact CG1-CD2 4.23Å; Y28-L32 WeakPolarHBondContact O-CB 3.41Å; Y28-L32 VanDerWaalsContact O-CG 3.25Å; Y28-L32 WeakPolarHBondContact O-CG 3.4Å; Y28-L32 PolarHBondContact O-N 3.42Å; I29-L32 PolarHBondContact O-N 2.88Å; L32-I35 PolarHBondContact O-N 3.47Å; L32-V36 PolarHBondContact O-N 2.79Å; L32-V36 VanDerWaalsContact O-N 3.09Å; L32-F66 HydrophobicContact CD2-CE1 4.1Å; L32-F66 HydrophobicContact CD2-CZ 3.77Å; L32-F66 HydrophobicContact CG-CE1 4.45Å; L32-F66 HydrophobicContact CG-CZ 3.96Å; L32-A298 HydrophobicContact CB-CB 3.84Å; L32-T308 HydrophobicContact CB-CG2 4.2Å
33	S	94.2	Very high	91.9	Very high	24 Å²	24	52.4 Å²	52.4	17%	0.168	26%	0.259	C	S	.	.	H	α-helix	trans	-59.9	-48.8	178.7	-163.9	0	0	0	0	111.4	I29 E30 I35 V36 E37	I29-S33 WeakPolarHBondContact O-CB 3.38Å; I29-S33 PolarHBondContact O-N 2.8Å; E30-S33 PolarHBondContact O-N 2.78Å; S33-I35 VanDerWaalsContact C-N 3.28Å; S33-I35 PolarHBondContact O-N 2.78Å; S33-V36 PolarHBondContact O-N 3.17Å; S33-E37 WeakPolarHBondContact O-CG 3.42Å; S33-E37 PolarHBondContact O-N 2.79Å; S33-E37 PolarHBondContact OG-OE1 3.4Å
34	A	96.1	Very high	92.6	Very high	49 Å²	49	50 Å²	50	41%	0.405	25%	0.247	S	C	.	.	H	α-helix	trans	-61.8	-35.1	-178.6	0	0	0	0	0	113	E30 A31 T38	E30-A34 WeakPolarHBondContact O-CB 3.47Å; E30-A34 PolarHBondContact O-N 3.34Å; A31-A34 PolarHBondContact O-N 3.19Å; A34-T38 PolarHBondContact O-N 3.24Å; A34-T38 VanDerWaalsContact O-N 3.11Å; A34-T38 PolarHBondContact O-OG1 3.43Å
35	I	97.3	Very high	93.4	Very high	11 Å²	11	49.1 Å²	49.1	6%	0.056	26%	0.256	C	S	.	.	H	α-helix	trans	-70.9	-45.2	178	-65.4	167.9	0	0	0	110.4	I8 A31 L32 S33 T38 G39 A56 L59 L60	I8-I35 HydrophobicContact CD1-CB 3.88Å; I8-I35 HydrophobicContact CD1-CG2 3.74Å; A31-I35 WeakPolarHBondContact O-CD1 3.47Å; A31-I35 VanDerWaalsContact O-CG1 3.23Å; A31-I35 WeakPolarHBondContact O-CG1 3.49Å; A31-I35 PolarHBondContact O-N 3.21Å; L32-I35 PolarHBondContact O-N 3.47Å; S33-I35 VanDerWaalsContact C-N 3.28Å; S33-I35 PolarHBondContact O-N 2.78Å; I35-T38 PolarHBondContact O-N 2.91Å; I35-G39 PolarHBondContact O-N 2.9Å; I35-A56 HydrophobicContact CG2-CB 4.05Å; I35-L59 HydrophobicContact CD1-CB 4.25Å; I35-L59 HydrophobicContact CG1-CB 3.92Å; I35-L59 HydrophobicContact CG1-CD1 4.44Å; I35-L59 HydrophobicContact CG2-CB 4.32Å; I35-L59 HydrophobicContact CG2-CD1 4.41Å; I35-L60 HydrophobicContact CD1-CD2 3.54Å; I35-L60 HydrophobicContact CD1-CG 3.88Å
36	V	96.7	Very high	94	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-44	174.8	170.4	0	0	0	0	111.3	I6 I8 L32 S33 T38 G39 Q40 A298 P306	I6-V36 HydrophobicContact CG2-CG1 3.99Å; I8-V36 HydrophobicContact CD1-CG2 3.66Å; I8-V36 HydrophobicContact CG1-CG2 3.7Å; I8-V36 HydrophobicContact CG2-CG2 4.46Å; L32-V36 PolarHBondContact O-N 2.79Å; L32-V36 VanDerWaalsContact O-N 3.09Å; S33-V36 PolarHBondContact O-N 3.17Å; V36-T38 VanDerWaalsContact C-N 3.26Å; V36-T38 PolarHBondContact O-N 3.3Å; V36-G39 CarbonylContact O-C 3.36Å; V36-G39 PolarHBondContact O-N 3.3Å; V36-G39 VanDerWaalsContact O-N 3.1Å; V36-Q40 HydrophobicContact CG1-CG 4.16Å; V36-Q40 WeakPolarHBondContact O-CG 3.37Å; V36-Q40 PolarHBondContact O-N 2.73Å; V36-A298 HydrophobicContact CG2-CB 3.56Å; V36-P306 HydrophobicContact CB-CB 4.15Å; V36-P306 HydrophobicContact CB-CG 4.4Å; V36-P306 HydrophobicContact CG1-CB 3.77Å; V36-P306 HydrophobicContact CG1-CG 4.03Å
37	E	96.3	Very high	94.6	Very high	76 Å²	76	50.2 Å²	50.2	36%	0.355	27%	0.272	S	S	.	.	H	α-helix	trans	-59.7	-36.6	176.7	-74.7	173.8	-156.9	0	0	112.8	S33 K41 P306	S33-E37 WeakPolarHBondContact O-CG 3.42Å; S33-E37 PolarHBondContact O-N 2.79Å; S33-E37 PolarHBondContact OG-OE1 3.4Å; E37-K41 VanDerWaalsContact O-CG 3.29Å; E37-K41 WeakPolarHBondContact O-CG 3.44Å; E37-K41 PolarHBondContact O-N 2.97Å; E37-K41 VanDerWaalsContact O-N 3.08Å; E37-P306 HydrophobicContact CG-CG 3.5Å; E37-P306 VanDerWaalsContact CG-CG 3.5Å
38	T	97.3	Very high	95	Very high	51 Å²	51	45.2 Å²	45.2	31%	0.313	26%	0.259	S	S	.	.	H	α-helix	trans	-65.9	-46.2	175.2	-57.6	0	0	0	0	110.5	A34 I35 V36 Q40 K41 M42 L59	A34-T38 PolarHBondContact O-N 3.24Å; A34-T38 VanDerWaalsContact O-N 3.11Å; A34-T38 PolarHBondContact O-OG1 3.43Å; I35-T38 PolarHBondContact O-N 2.91Å; V36-T38 VanDerWaalsContact C-N 3.26Å; V36-T38 PolarHBondContact O-N 3.3Å; T38-Q40 PolarHBondContact O-N 3.02Å; T38-K41 PolarHBondContact O-N 2.86Å; T38-M42 WeakPolarHBondContact O-CG 3.28Å; T38-M42 PolarHBondContact O-N 2.71Å; T38-M42 VanDerWaalsContact O-N 3.08Å; T38-L59 HydrophobicContact CG2-CD1 3.89Å
39	G	97.2	Very high	95.4	Very high	2 Å²	2	44.5 Å²	44.5	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-41.8	175.7	0	0	0	0	0	113.3	I35 V36 M42 L43	I35-G39 PolarHBondContact O-N 2.9Å; V36-G39 CarbonylContact O-C 3.36Å; V36-G39 PolarHBondContact O-N 3.3Å; V36-G39 VanDerWaalsContact O-N 3.1Å; G39-M42 WeakPolarHBondContact O-CB 3.19Å; G39-M42 PolarHBondContact O-N 3.29Å; G39-L43 WeakPolarHBondContact O-CG 3.27Å; G39-L43 PolarHBondContact O-N 2.9Å
40	Q	96.4	Very high	95.9	Very high	7 Å²	7	43 Å²	43	3%	0.033	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-44.7	175.6	-71.8	170.6	-59.1	0	0	111.7	I6 V36 T38 M42 L43 E44 Y301 D304	I6-Q40 HydrophobicContact CG2-CG 4.08Å; V36-Q40 HydrophobicContact CG1-CG 4.16Å; V36-Q40 WeakPolarHBondContact O-CG 3.37Å; V36-Q40 PolarHBondContact O-N 2.73Å; T38-Q40 PolarHBondContact O-N 3.02Å; Q40-M42 VanDerWaalsContact C-N 3.31Å; Q40-M42 PolarHBondContact O-N 3.18Å; Q40-L43 WeakPolarHBondContact O-CB 3.43Å; Q40-L43 PolarHBondContact O-N 2.88Å; Q40-E44 VanDerWaalsContact O-CG 3.32Å; Q40-E44 WeakPolarHBondContact O-CG 3.4Å; Q40-E44 PolarHBondContact O-N 3.45Å; Q40-Y301 PolarHBondContact NE2-O 3.28Å; Q40-D304 PolarHBondContact NE2-O 3.49Å
41	K	96.4	Very high	96.2	Very high	126 Å²	126	39.5 Å²	39.5	55%	0.548	23%	0.234	S	C	.	.	H	α-helix	trans	-62	-37.3	176.3	-74.1	167.1	-174	158.6	0	112.7	E37 T38 E44 A45	E37-K41 VanDerWaalsContact O-CG 3.29Å; E37-K41 WeakPolarHBondContact O-CG 3.44Å; E37-K41 PolarHBondContact O-N 2.97Å; E37-K41 VanDerWaalsContact O-N 3.08Å; T38-K41 PolarHBondContact O-N 2.86Å; K41-E44 PolarHBondContact O-N 3.42Å; K41-A45 WeakPolarHBondContact O-CB 3.49Å; K41-A45 PolarHBondContact O-N 3.4Å
42	M	97.8	Very high	96.5	Very high	37 Å²	37	38.6 Å²	38.6	18%	0.182	23%	0.227	C	C	.	.	H	α-helix	trans	-65.8	-45.5	174.5	-71.6	176.3	70.6	0	0	111.3	T38 G39 Q40 E44 A45 G46 E47 D51 V52 E55	T38-M42 WeakPolarHBondContact O-CG 3.28Å; T38-M42 PolarHBondContact O-N 2.71Å; T38-M42 VanDerWaalsContact O-N 3.08Å; G39-M42 WeakPolarHBondContact O-CB 3.19Å; G39-M42 PolarHBondContact O-N 3.29Å; Q40-M42 VanDerWaalsContact C-N 3.31Å; Q40-M42 PolarHBondContact O-N 3.18Å; M42-E44 VanDerWaalsContact C-N 3.32Å; M42-E44 PolarHBondContact O-N 3.12Å; M42-A45 WeakPolarHBondContact O-CB 3.44Å; M42-A45 PolarHBondContact O-N 3.12Å; M42-A45 VanDerWaalsContact O-N 3.1Å; M42-G46 PolarHBondContact O-N 3.41Å; M42-E47 HydrophobicContact CB-CB 4.01Å; M42-E47 HydrophobicContact CB-CG 4Å; M42-E47 HydrophobicContact CE-CB 4.34Å; M42-E47 HydrophobicContact CE-CG 4.29Å; M42-E47 HydrophobicContact CG-CG 4.42Å; M42-E47 WeakPolarHBondContact O-CB 3.34Å; M42-E47 WeakPolarHBondContact O-CG 3.26Å; M42-E47 PolarHBondContact O-N 3.03Å; M42-D51 HydrophobicContact CE-CB 4.34Å; M42-V52 HydrophobicContact CB-CG2 3.75Å; M42-V52 HydrophobicContact CE-CG2 4.3Å; M42-E55 HydrophobicContact CE-CB 3.91Å; M42-E55 HydrophobicContact CE-CG 4.32Å; M42-E55 HydrophobicContact SD-CB 3.79Å; M42-E55 HydrophobicContact SD-CG 3.69Å
43	L	96.5	Very high	96.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-41.1	174.8	-70.6	168.8	0	0	0	111.9	A4 I6 G39 Q40 A45 G46 V52 D186 L187 A302	A4-L43 HydrophobicContact CB-CB 4.2Å; A4-L43 HydrophobicContact CB-CD1 4.49Å; A4-L43 HydrophobicContact CB-CD2 4.37Å; I6-L43 HydrophobicContact CB-CD1 4.08Å; I6-L43 HydrophobicContact CG2-CD1 4.33Å; G39-L43 WeakPolarHBondContact O-CG 3.27Å; G39-L43 PolarHBondContact O-N 2.9Å; Q40-L43 WeakPolarHBondContact O-CB 3.43Å; Q40-L43 PolarHBondContact O-N 2.88Å; L43-A45 VanDerWaalsContact C-N 3.3Å; L43-A45 PolarHBondContact O-N 3.37Å; L43-G46 PolarHBondContact O-N 3.46Å; L43-G46 VanDerWaalsContact O-N 3.14Å; L43-V52 HydrophobicContact CD1-CG1 4.39Å; L43-V52 HydrophobicContact CD2-CB 4.47Å; L43-V52 HydrophobicContact CD2-CG1 4.38Å; L43-V52 HydrophobicContact CD2-CG2 3.81Å; L43-V52 HydrophobicContact CG-CG1 4.12Å; L43-V52 HydrophobicContact CG-CG2 3.88Å; L43-D186 HydrophobicContact CD2-CB 4.06Å; L43-L187 VanDerWaalsContact O-CD1 3.3Å; L43-L187 WeakPolarHBondContact O-CD1 3.15Å; L43-A302 HydrophobicContact CB-CB 4.33Å
44	E	93.3	Very high	96.9	Very high	107 Å²	107	37.9 Å²	37.9	50%	0.5	22%	0.221	S	C	.	.	H	α-helix	trans	-64	-33.3	174.5	-73	170.1	-158.2	0	0	112.9	Q40 K41 M42 G46 A302 G303	Q40-E44 VanDerWaalsContact O-CG 3.32Å; Q40-E44 WeakPolarHBondContact O-CG 3.4Å; Q40-E44 PolarHBondContact O-N 3.45Å; K41-E44 PolarHBondContact O-N 3.42Å; M42-E44 VanDerWaalsContact C-N 3.32Å; M42-E44 PolarHBondContact O-N 3.12Å; E44-G46 PolarHBondContact O-N 3.11Å; E44-A302 HydrophobicContact CG-CB 3.87Å; E44-G303 VanDerWaalsContact OE1-CA 3.29Å; E44-G303 WeakPolarHBondContact OE1-CA 3.32Å; E44-G303 PolarHBondContact OE1-N 3.25Å
45	A	95.2	Very high	97	Very high	78 Å²	78	38 Å²	38	65%	0.645	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-5.7	175.8	0	0	0	0	0	113.4	K41 M42 L43	K41-A45 WeakPolarHBondContact O-CB 3.49Å; K41-A45 PolarHBondContact O-N 3.4Å; M42-A45 WeakPolarHBondContact O-CB 3.44Å; M42-A45 PolarHBondContact O-N 3.12Å; M42-A45 VanDerWaalsContact O-N 3.1Å; L43-A45 VanDerWaalsContact C-N 3.3Å; L43-A45 PolarHBondContact O-N 3.37Å
46	G	93.8	Very high	97	Very high	47 Å²	47	37.6 Å²	37.6	49%	0.485	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	21.1	-178.6	0	0	0	0	0	114.3	M42 L43 E44	M42-G46 PolarHBondContact O-N 3.41Å; L43-G46 PolarHBondContact O-N 3.46Å; L43-G46 VanDerWaalsContact O-N 3.14Å; E44-G46 PolarHBondContact O-N 3.11Å
47	E	96.9	Very high	97.1	Very high	89 Å²	89	37.6 Å²	37.6	42%	0.416	21%	0.212	S	C	.	.			trans	-67.2	150.2	171.1	-64.2	-71	177.4	0	0	110.9	M42 V52	M42-E47 HydrophobicContact CB-CB 4.01Å; M42-E47 HydrophobicContact CB-CG 4Å; M42-E47 HydrophobicContact CE-CB 4.34Å; M42-E47 HydrophobicContact CE-CG 4.29Å; M42-E47 HydrophobicContact CG-CG 4.42Å; M42-E47 WeakPolarHBondContact O-CB 3.34Å; M42-E47 WeakPolarHBondContact O-CG 3.26Å; M42-E47 PolarHBondContact O-N 3.03Å; E47-V52 HydrophobicContact CB-CG2 4.23Å
48	S	97.2	Very high	97.2	Very high	39 Å²	39	36.9 Å²	36.9	27%	0.273	21%	0.206	S	C	.	.			trans	-68.5	151.5	-179.3	77.8	0	0	0	0	111.9	L50 D51 V52	S48-L50 PolarHBondContact O-N 3.33Å; S48-L50 VanDerWaalsContact O-N 3.12Å; S48-D51 PolarHBondContact O-N 2.87Å; S48-D51 VanDerWaalsContact O-N 3.07Å; S48-D51 PolarHBondContact OG-N 3.23Å; S48-D51 PolarHBondContact OG-OD2 3.42Å; S48-V52 VanDerWaalsContact O-CG2 3.29Å; S48-V52 WeakPolarHBondContact O-CG2 3.43Å; S48-V52 PolarHBondContact O-N 2.92Å
49	A	97.8	Very high	97.2	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-55.3	-34.9	176.5	0	0	0	0	0	111.6	V52 V53 A184 D186 N190 A192	A49-V52 PolarHBondContact O-N 2.84Å; A49-V53 WeakPolarHBondContact O-CG1 3.38Å; A49-V53 WeakPolarHBondContact O-CG2 3.27Å; A49-V53 PolarHBondContact O-N 3.5Å; A49-A184 HydrophobicContact CB-CB 4.12Å; A49-D186 HydrophobicContact CB-CB 3.93Å; A49-D186 PolarHBondContact N-OD2 3.41Å; A49-N190 WeakPolarHBondContact CB-O 3.32Å; A49-A192 HydrophobicContact CB-CB 3.85Å
50	L	98.3	Very high	97.2	Very high	15 Å²	15	36.3 Å²	36.3	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-41.1	179.4	-173.9	67.1	0	0	0	112.5	S48 V53 T54 D88 R111 M114 A192	S48-L50 PolarHBondContact O-N 3.33Å; S48-L50 VanDerWaalsContact O-N 3.12Å; L50-V53 WeakPolarHBondContact O-CG2 3.41Å; L50-T54 WeakPolarHBondContact O-CB 3.4Å; L50-T54 PolarHBondContact O-N 3.26Å; L50-T54 VanDerWaalsContact O-N 3.14Å; L50-T54 PolarHBondContact O-OG1 2.99Å; L50-D88 HydrophobicContact CD1-CB 4Å; L50-D88 HydrophobicContact CD2-CB 4.13Å; L50-R111 VanDerWaalsContact CG-NH1 3.28Å; L50-R111 PolarHBondContact O-NH1 2.84Å; L50-M114 HydrophobicContact CD1-CE 4.04Å; L50-M114 HydrophobicContact CD1-SD 4.47Å; L50-M114 HydrophobicContact CD2-CE 3.57Å; L50-M114 HydrophobicContact CG-CE 4.28Å; L50-A192 HydrophobicContact CB-CB 4.12Å; L50-A192 HydrophobicContact CD1-CB 4.28Å
51	D	98.3	Very high	97.2	Very high	52 Å²	52	36 Å²	36	28%	0.278	20%	0.198	S	C	.	.	H	α-helix	trans	-70.8	-38	175.8	-59.5	-37.2	0	0	0	111.1	M42 S48 T54 E55 R111	M42-D51 HydrophobicContact CE-CB 4.34Å; S48-D51 PolarHBondContact O-N 2.87Å; S48-D51 VanDerWaalsContact O-N 3.07Å; S48-D51 PolarHBondContact OG-N 3.23Å; S48-D51 PolarHBondContact OG-OD2 3.42Å; D51-T54 PolarHBondContact O-N 3.45Å; D51-E55 WeakPolarHBondContact O-CB 3.39Å; D51-E55 PolarHBondContact O-N 2.95Å; D51-R111 IonicContact OD1-CZ 3.43Å; D51-R111 IonicContact OD1-NH1 3.44Å; D51-R111 PolarHBondContact OD1-NH1 3.19Å; D51-R111 IonicContact OD1-NH2 2.99Å; D51-R111 PolarHBondContact OD1-NH2 3.43Å
52	V	98.3	Very high	97.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-50.5	175.9	172.1	0	0	0	0	111.9	I6 M42 L43 E47 S48 A49 T54 E55 A56 A184	I6-V52 HydrophobicContact CB-CG1 4.45Å; I6-V52 HydrophobicContact CD1-CG1 3.64Å; I6-V52 HydrophobicContact CG1-CG1 4.25Å; M42-V52 HydrophobicContact CB-CG2 3.75Å; M42-V52 HydrophobicContact CE-CG2 4.3Å; L43-V52 HydrophobicContact CD1-CG1 4.39Å; L43-V52 HydrophobicContact CD2-CB 4.47Å; L43-V52 HydrophobicContact CD2-CG1 4.38Å; L43-V52 HydrophobicContact CD2-CG2 3.81Å; L43-V52 HydrophobicContact CG-CG1 4.12Å; L43-V52 HydrophobicContact CG-CG2 3.88Å; E47-V52 HydrophobicContact CB-CG2 4.23Å; S48-V52 VanDerWaalsContact O-CG2 3.29Å; S48-V52 WeakPolarHBondContact O-CG2 3.43Å; S48-V52 PolarHBondContact O-N 2.92Å; A49-V52 PolarHBondContact O-N 2.84Å; V52-T54 VanDerWaalsContact C-N 3.34Å; V52-T54 PolarHBondContact O-N 3.41Å; V52-E55 PolarHBondContact O-N 3.45Å; V52-A56 WeakPolarHBondContact O-CB 3.42Å; V52-A56 PolarHBondContact O-N 3.36Å; V52-A184 HydrophobicContact CB-CB 4.39Å; V52-A184 HydrophobicContact CG1-CB 3.97Å
53	V	98.5	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-68.3	-34.8	179	-61.8	0	0	0	0	112.2	A49 L50 V57 A182 A184 A192 A194	A49-V53 WeakPolarHBondContact O-CG1 3.38Å; A49-V53 WeakPolarHBondContact O-CG2 3.27Å; A49-V53 PolarHBondContact O-N 3.5Å; L50-V53 WeakPolarHBondContact O-CG2 3.41Å; V53-V57 WeakPolarHBondContact O-CG2 3.25Å; V53-V57 PolarHBondContact O-N 2.97Å; V53-A182 HydrophobicContact CB-CB 3.97Å; V53-A182 HydrophobicContact CG1-CB 4.09Å; V53-A184 HydrophobicContact CG1-CB 3.64Å; V53-A192 HydrophobicContact CG1-CB 4.31Å; V53-A192 HydrophobicContact CG2-CB 3.79Å; V53-A194 HydrophobicContact CB-CB 3.97Å; V53-A194 HydrophobicContact CG2-CB 3.9Å
54	T	98.6	Very high	96.6	Very high	9 Å²	9	34.6 Å²	34.6	6%	0.055	20%	0.201	C	C	.	.	H	α-helix	trans	-63	-47.3	177.1	-58.8	0	0	0	0	110.2	L50 D51 V52 R58 V107 L108 R111	L50-T54 WeakPolarHBondContact O-CB 3.4Å; L50-T54 PolarHBondContact O-N 3.26Å; L50-T54 VanDerWaalsContact O-N 3.14Å; L50-T54 PolarHBondContact O-OG1 2.99Å; D51-T54 PolarHBondContact O-N 3.45Å; V52-T54 VanDerWaalsContact C-N 3.34Å; V52-T54 PolarHBondContact O-N 3.41Å; T54-R58 WeakPolarHBondContact O-CB 3.37Å; T54-R58 PolarHBondContact O-N 3.46Å; T54-V107 HydrophobicContact CG2-CG2 4.49Å; T54-L108 HydrophobicContact CG2-CD2 3.71Å; T54-R111 HydrophobicContact CG2-CB 4.38Å; T54-R111 HydrophobicContact CG2-CG 4.47Å; T54-R111 PolarHBondContact OG1-NH1 3.3Å
55	E	98.5	Very high	96.3	Very high	51 Å²	51	31 Å²	31	24%	0.238	19%	0.185	C	C	.	.	H	α-helix	trans	-67.9	-41.6	179	-178.6	60.2	-170.5	0	0	112.1	M42 D51 V52 V57 R58 L59	M42-E55 HydrophobicContact CE-CB 3.91Å; M42-E55 HydrophobicContact CE-CG 4.32Å; M42-E55 HydrophobicContact SD-CB 3.79Å; M42-E55 HydrophobicContact SD-CG 3.69Å; D51-E55 WeakPolarHBondContact O-CB 3.39Å; D51-E55 PolarHBondContact O-N 2.95Å; V52-E55 PolarHBondContact O-N 3.45Å; E55-V57 PolarHBondContact O-N 3.24Å; E55-R58 WeakPolarHBondContact O-CB 3.3Å; E55-R58 PolarHBondContact O-N 2.95Å; E55-R58 IonicContact OE1-CZ 2.95Å; E55-R58 IonicContact OE1-NE 3.18Å; E55-R58 PolarHBondContact OE1-NE 3.17Å; E55-R58 IonicContact OE1-NH2 2.78Å; E55-R58 PolarHBondContact OE1-NH2 2.98Å; E55-R58 IonicContact OE2-CZ 3.27Å; E55-R58 IonicContact OE2-NE 2.81Å; E55-R58 PolarHBondContact OE2-NE 2.92Å; E55-R58 IonicContact OE2-NH2 3.7Å; E55-L59 HydrophobicContact CG-CD1 4.32Å; E55-L59 WeakPolarHBondContact O-CG 3.05Å; E55-L59 PolarHBondContact O-N 2.7Å
56	A	98.1	Very high	96.1	Very high	2 Å²	2	27.3 Å²	27.3	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-44.7	177.2	0	0	0	0	0	112.2	I6 I8 I35 V52 L59 L60 A182	I6-A56 HydrophobicContact CD1-CB 3.9Å; I8-A56 HydrophobicContact CG2-CB 4.18Å; I35-A56 HydrophobicContact CG2-CB 4.05Å; V52-A56 WeakPolarHBondContact O-CB 3.42Å; V52-A56 PolarHBondContact O-N 3.36Å; A56-L59 PolarHBondContact O-N 3.08Å; A56-L60 WeakPolarHBondContact O-CG 3.3Å; A56-L60 PolarHBondContact O-N 3.15Å; A56-A182 HydrophobicContact CB-CB 3.84Å
57	V	98.3	Very high	95.9	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.7	-37.2	175.5	174.3	0	0	0	0	111.6	V53 E55 L59 L60 E61 V107 V180 A182 A194	V53-V57 WeakPolarHBondContact O-CG2 3.25Å; V53-V57 PolarHBondContact O-N 2.97Å; E55-V57 PolarHBondContact O-N 3.24Å; V57-L59 VanDerWaalsContact C-N 3.3Å; V57-L59 PolarHBondContact O-N 3.44Å; V57-L60 WeakPolarHBondContact O-CB 3.22Å; V57-L60 PolarHBondContact O-N 2.8Å; V57-L60 VanDerWaalsContact O-N 3.12Å; V57-E61 HydrophobicContact CG1-CG 4.41Å; V57-E61 WeakPolarHBondContact O-CG 3.37Å; V57-E61 PolarHBondContact O-N 3.44Å; V57-V107 HydrophobicContact CB-CB 4.28Å; V57-V107 HydrophobicContact CB-CG1 4.31Å; V57-V107 HydrophobicContact CB-CG2 3.95Å; V57-V107 HydrophobicContact CG1-CB 3.68Å; V57-V107 HydrophobicContact CG1-CG1 4.02Å; V57-V107 HydrophobicContact CG1-CG2 3.73Å; V57-V180 HydrophobicContact CG1-CG2 4.26Å; V57-A182 HydrophobicContact CG2-CB 3.87Å; V57-A194 HydrophobicContact CB-CB 4.39Å; V57-A194 HydrophobicContact CG2-CB 3.66Å
58	R	98.1	Very high	95.6	Very high	61 Å²	61	21.1 Å²	21.1	23%	0.23	11%	0.113	C	C	.	.	H	α-helix	trans	-59.2	-42.6	174.1	-168.4	-165.1	69.5	73.1	1.2	111.2	T54 E55 L60 E61 E62 N105 V107 L108	T54-R58 WeakPolarHBondContact O-CB 3.37Å; T54-R58 PolarHBondContact O-N 3.46Å; E55-R58 WeakPolarHBondContact O-CB 3.3Å; E55-R58 PolarHBondContact O-N 2.95Å; E55-R58 IonicContact OE1-CZ 2.95Å; E55-R58 IonicContact OE1-NE 3.18Å; E55-R58 PolarHBondContact OE1-NE 3.17Å; E55-R58 IonicContact OE1-NH2 2.78Å; E55-R58 PolarHBondContact OE1-NH2 2.98Å; E55-R58 IonicContact OE2-CZ 3.27Å; E55-R58 IonicContact OE2-NE 2.81Å; E55-R58 PolarHBondContact OE2-NE 2.92Å; E55-R58 IonicContact OE2-NH2 3.7Å; R58-L60 VanDerWaalsContact C-N 3.35Å; R58-E61 WeakPolarHBondContact O-CB 3.48Å; R58-E61 PolarHBondContact O-N 3.14Å; R58-E62 WeakPolarHBondContact O-CG 3.33Å; R58-E62 PolarHBondContact O-N 3.3Å; R58-N105 HydrophobicContact CG-CB 4.18Å; R58-V107 HydrophobicContact CB-CG1 4.05Å; R58-L108 HydrophobicContact CG-CD1 4.41Å; R58-L108 HydrophobicContact CG-CG 4.47Å
59	L	97.8	Very high	95.4	Very high	41 Å²	41	19.2 Å²	19.2	22%	0.215	10%	0.1	C	C	.	.	H	α-helix	trans	-66.2	-35.3	175.5	-67	170.5	0	0	0	112.4	I35 T38 E55 A56 V57 E62 C63	I35-L59 HydrophobicContact CD1-CB 4.25Å; I35-L59 HydrophobicContact CG1-CB 3.92Å; I35-L59 HydrophobicContact CG1-CD1 4.44Å; I35-L59 HydrophobicContact CG2-CB 4.32Å; I35-L59 HydrophobicContact CG2-CD1 4.41Å; T38-L59 HydrophobicContact CG2-CD1 3.89Å; E55-L59 HydrophobicContact CG-CD1 4.32Å; E55-L59 WeakPolarHBondContact O-CG 3.05Å; E55-L59 PolarHBondContact O-N 2.7Å; A56-L59 PolarHBondContact O-N 3.08Å; V57-L59 VanDerWaalsContact C-N 3.3Å; V57-L59 PolarHBondContact O-N 3.44Å; L59-E62 PolarHBondContact O-N 3.31Å; L59-C63 WeakPolarHBondContact O-CB 3.26Å; L59-C63 PolarHBondContact O-N 3.07Å
60	L	96.2	Very high	95.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.3	-39.1	172.1	-69.9	163	0	0	0	111.7	I8 I35 A56 V57 R58 C63 F66 V180	I8-L60 HydrophobicContact CB-CD1 4.47Å; I35-L60 HydrophobicContact CD1-CD2 3.54Å; I35-L60 HydrophobicContact CD1-CG 3.88Å; A56-L60 WeakPolarHBondContact O-CG 3.3Å; A56-L60 PolarHBondContact O-N 3.15Å; V57-L60 WeakPolarHBondContact O-CB 3.22Å; V57-L60 PolarHBondContact O-N 2.8Å; V57-L60 VanDerWaalsContact O-N 3.12Å; R58-L60 VanDerWaalsContact C-N 3.35Å; L60-C63 PolarHBondContact O-N 3.26Å; L60-F66 HydrophobicContact CD2-CD2 3.59Å; L60-F66 HydrophobicContact CD2-CE2 3.62Å; L60-F66 HydrophobicContact CD2-CG 4.17Å; L60-F66 HydrophobicContact CD2-CZ 4.19Å; L60-V180 HydrophobicContact CB-CB 3.92Å; L60-V180 HydrophobicContact CB-CG1 4.22Å; L60-V180 HydrophobicContact CB-CG2 3.82Å; L60-V180 HydrophobicContact CD1-CB 3.9Å; L60-V180 HydrophobicContact CD1-CG2 4.31Å; L60-V180 HydrophobicContact CG-CB 4.34Å
61	E	96.3	Very high	94.7	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-67.4	-32.7	175.1	-71.4	173.9	163.4	0	0	113.1	V57 R58 C63 A68 G69 I70 N105 P106 V107 S196	V57-E61 HydrophobicContact CG1-CG 4.41Å; V57-E61 WeakPolarHBondContact O-CG 3.37Å; V57-E61 PolarHBondContact O-N 3.44Å; R58-E61 WeakPolarHBondContact O-CB 3.48Å; R58-E61 PolarHBondContact O-N 3.14Å; E61-C63 VanDerWaalsContact C-N 3.25Å; E61-C63 PolarHBondContact O-N 3.03Å; E61-A68 HydrophobicContact CG-CB 4.14Å; E61-G69 CarbonylContact O-C 3.48Å; E61-G69 WeakPolarHBondContact O-CA 3.38Å; E61-I70 PolarHBondContact O-N 3.36Å; E61-N105 WeakPolarHBondContact OE2-CA 3.44Å; E61-N105 VanDerWaalsContact OE2-CB 3.29Å; E61-N105 WeakPolarHBondContact OE2-CB 3.25Å; E61-P106 WeakPolarHBondContact OE1-CD 3.43Å; E61-V107 PolarHBondContact OE1-N 2.84Å; E61-V107 WeakPolarHBondContact OE2-CG1 3.28Å; E61-S196 VanDerWaalsContact OE1-CB 3.28Å; E61-S196 WeakPolarHBondContact OE1-CB 3.12Å; E61-S196 PolarHBondContact OE1-OG 2.93Å
62	E	95.9	Very high	94.4	Very high	49 Å²	49	17.5 Å²	17.5	23%	0.229	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-9.1	174.6	-68.9	-66.4	149.6	0	0	113	R58 L59 R104 N105	R58-E62 WeakPolarHBondContact O-CG 3.33Å; R58-E62 PolarHBondContact O-N 3.3Å; L59-E62 PolarHBondContact O-N 3.31Å; E62-R104 IonicContact OE1-CZ 3.62Å; E62-R104 IonicContact OE1-NE 2.79Å; E62-R104 PolarHBondContact OE1-NE 3.24Å; E62-R104 IonicContact OE1-NH2 3.54Å; E62-R104 IonicContact OE2-CZ 2.95Å; E62-R104 IonicContact OE2-NE 3.55Å; E62-R104 PolarHBondContact OE2-NE 3.26Å; E62-R104 IonicContact OE2-NH2 3.98Å; E62-R104 PolarHBondContact OE2-NH2 2.88Å; E62-N105 PolarHBondContact OE1-ND2 2.97Å; E62-N105 PolarHBondContact OE1-OD1 3.35Å
63	C	92.7	Very high	94	Very high	20 Å²	20	17.6 Å²	17.6	14%	0.135	9%	0.091	C	C	.	.			trans	-96.6	115	-178.1	-172.4	0	0	0	0	111.1	L59 L60 E61 L65 F66	L59-C63 WeakPolarHBondContact O-CB 3.26Å; L59-C63 PolarHBondContact O-N 3.07Å; L60-C63 PolarHBondContact O-N 3.26Å; E61-C63 VanDerWaalsContact C-N 3.25Å; E61-C63 PolarHBondContact O-N 3.03Å; C63-L65 PolarHBondContact O-N 2.88Å; C63-F66 HydrophobicContact CB-CD2 3.83Å; C63-F66 HydrophobicContact CB-CE2 4.19Å; C63-F66 PolarHBondContact O-N 2.91Å
64	P	90.3	Very high	93.6	Very high	66 Å²	66	18 Å²	18	43%	0.429	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-5.9	-177.3	28	-36	0	0	0	114.3	I70 T146	P64-I70 HydrophobicContact CB-CG2 4.06Å; P64-T146 HydrophobicContact CB-CG2 4.41Å
65	L	87.1	Confident	93.2	Very high	30 Å²	30	17.7 Å²	17.7	16%	0.157	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-29.6	179.1	-63.8	177.9	0	0	0	112.6	R27 Y28 A31 C63	R27-L65 HydrophobicContact CB-CD1 4.3Å; Y28-L65 HydrophobicContact CD1-CB 4.12Å; Y28-L65 HydrophobicContact CD1-CD1 4.47Å; Y28-L65 HydrophobicContact CE1-CB 3.72Å; Y28-L65 WeakPolarHBondContact CE1-O 3.39Å; Y28-L65 PolarHBondContact OH-O 3.47Å; A31-L65 HydrophobicContact CB-CD1 4.1Å; C63-L65 PolarHBondContact O-N 2.88Å
66	F	90.5	Very high	92.6	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.009	10%	0.099	C	C	.	.	S	Bend	trans	-101.8	155.1	-173.9	-55.5	-69.7	0	0	0	111.8	Y28 A31 L32 L60 C63 A68 G71 V180 Y296	Y28-F66 HydrophobicContact CD1-CD1 4.32Å; Y28-F66 AromaticContact CD1-CE1 3.66Å; Y28-F66 HydrophobicContact CD1-CE1 3.66Å; Y28-F66 HydrophobicContact CD1-CZ 4.08Å; Y28-F66 HydrophobicContact CE1-CD1 4.28Å; Y28-F66 HydrophobicContact CE1-CE1 4.08Å; A31-F66 HydrophobicContact CB-CE2 4.2Å; A31-F66 HydrophobicContact CB-CZ 4.38Å; L32-F66 HydrophobicContact CD2-CE1 4.1Å; L32-F66 HydrophobicContact CD2-CZ 3.77Å; L32-F66 HydrophobicContact CG-CE1 4.45Å; L32-F66 HydrophobicContact CG-CZ 3.96Å; L60-F66 HydrophobicContact CD2-CD2 3.59Å; L60-F66 HydrophobicContact CD2-CE2 3.62Å; L60-F66 HydrophobicContact CD2-CG 4.17Å; L60-F66 HydrophobicContact CD2-CZ 4.19Å; C63-F66 HydrophobicContact CB-CD2 3.83Å; C63-F66 HydrophobicContact CB-CE2 4.19Å; C63-F66 PolarHBondContact O-N 2.91Å; F66-A68 PolarHBondContact O-N 3.45Å; F66-G71 CarbonylContact O-C 3.56Å; F66-G71 VanDerWaalsContact O-CA 3.22Å; F66-G71 WeakPolarHBondContact O-CA 3.46Å; F66-V180 HydrophobicContact CB-CG1 3.55Å; F66-V180 HydrophobicContact CG-CG1 4.25Å; F66-Y296 HydrophobicContact CE1-CG 4.31Å
67	N	90	Very high	92.2	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.027	12%	0.124	C	C	.	.	S	Bend	trans	-83.2	64.8	179.8	-179.9	35.2	0	0	0	111.5	V73 G178 T197 G198 G199	N67-V73 WeakPolarHBondContact OD1-CG1 3.37Å; N67-V73 PolarHBondContact OD1-N 2.89Å; N67-V73 VanDerWaalsContact OD1-N 3.12Å; N67-G178 WeakPolarHBondContact CB-O 3.3Å; N67-G178 PolarHBondContact ND2-O 3.49Å; N67-T197 WeakPolarHBondContact O-CA 3.25Å; N67-G198 PolarHBondContact O-N 3.1Å; N67-G199 PolarHBondContact ND2-O 3.36Å
68	A	91.7	Very high	91.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-157.3	154.9	173.4	0	0	0	0	0	108.7	E61 F66 I70 G71 V180	E61-A68 HydrophobicContact CG-CB 4.14Å; F66-A68 PolarHBondContact O-N 3.45Å; A68-I70 PolarHBondContact O-N 3.21Å; A68-I70 VanDerWaalsContact O-N 3.15Å; A68-G71 PolarHBondContact O-N 2.95Å; A68-V180 HydrophobicContact CB-CB 4.31Å; A68-V180 HydrophobicContact CB-CG1 3.85Å; A68-V180 HydrophobicContact CB-CG2 3.47Å; A68-V180 VanDerWaalsContact CB-CG2 3.47Å
69	G	93.2	Very high	91.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	47	-121.4	-179	0	0	0	0	0	112.4	E61 G71 A72 F144	E61-G69 CarbonylContact O-C 3.48Å; E61-G69 WeakPolarHBondContact O-CA 3.38Å; G69-G71 PolarHBondContact O-N 3.47Å; G69-G71 VanDerWaalsContact O-N 3.11Å; G69-A72 VanDerWaalsContact O-CB 3.23Å; G69-A72 WeakPolarHBondContact O-CB 3.34Å; G69-A72 PolarHBondContact O-N 3.2Å; G69-F144 VanDerWaalsContact C-CD1 3.4Å; G69-F144 WeakPolarHBondContact O-CD1 3.49Å
70	I	92.8	Very high	91.3	Very high	32 Å²	32	26.9 Å²	26.9	16%	0.164	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-57	-29.1	-175.9	-62.2	-179	0	0	0	112.7	E61 P64 A68 F144 T146	E61-I70 PolarHBondContact O-N 3.36Å; P64-I70 HydrophobicContact CB-CG2 4.06Å; A68-I70 PolarHBondContact O-N 3.21Å; A68-I70 VanDerWaalsContact O-N 3.15Å; I70-F144 CarbonylContact O-C 3.13Å; I70-F144 VanDerWaalsContact O-O 3.05Å; I70-T146 WeakPolarHBondContact O-CG2 3.33Å
71	G	88.3	Confident	91.2	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-96.4	14.5	-179.4	0	0	0	0	0	115	F66 A68 G69 R149	F66-G71 CarbonylContact O-C 3.56Å; F66-G71 VanDerWaalsContact O-CA 3.22Å; F66-G71 WeakPolarHBondContact O-CA 3.46Å; A68-G71 PolarHBondContact O-N 2.95Å; G69-G71 PolarHBondContact O-N 3.47Å; G69-G71 VanDerWaalsContact O-N 3.11Å; G71-R149 PolarHBondContact O-NE 3.31Å; G71-R149 PolarHBondContact O-NH2 2.82Å
72	A	91.5	Very high	91.2	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-62.3	149.5	-176.8	0	0	0	0	0	114	G69 L82 F144 R149	G69-A72 VanDerWaalsContact O-CB 3.23Å; G69-A72 WeakPolarHBondContact O-CB 3.34Å; G69-A72 PolarHBondContact O-N 3.2Å; A72-L82 HydrophobicContact CB-CD2 3.37Å; A72-F144 HydrophobicContact CB-CB 4.29Å; A72-R149 WeakPolarHBondContact O-CG 3.36Å
73	V	89.4	Confident	91.2	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.006	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-80	167	175.3	-67.5	0	0	0	0	112.1	N67 H80 G198 G199 M200 T201	N67-V73 WeakPolarHBondContact OD1-CG1 3.37Å; N67-V73 PolarHBondContact OD1-N 2.89Å; N67-V73 VanDerWaalsContact OD1-N 3.12Å; V73-H80 PolarHBondContact O-ND1 2.92Å; V73-G198 WeakPolarHBondContact CG2-O 3.46Å; V73-G199 WeakPolarHBondContact CG2-O 3.47Å; V73-M200 VanDerWaalsContact CG2-C 3.5Å; V73-T201 WeakPolarHBondContact CG1-OG1 3.37Å
74	F	90.4	Very high	91.5	Very high	10 Å²	10	24.7 Å²	24.7	4%	0.044	12%	0.124	C	C	.	.	P	Polyproline II helix	trans	-94.2	139	176.3	-67.3	-90.1	0	0	0	111.6	H80 S145 R149 Y150 L153 N202	F74-H80 AromaticContact CD1-CE1 3.61Å; F74-H80 AromaticContact CD1-NE2 3.85Å; F74-H80 AromaticContact CE1-CE1 3.44Å; F74-H80 VanDerWaalsContact CE1-CE1 3.44Å; F74-H80 WeakPolarHBondContact CE1-CE1 3.48Å; F74-H80 AromaticContact CE1-NE2 3.36Å; F74-H80 WeakPolarHBondContact CE1-NE2 3.39Å; F74-H80 AromaticContact CE2-CE1 4Å; F74-H80 AromaticContact CG-CE1 3.99Å; F74-H80 AromaticContact CZ-CE1 3.65Å; F74-H80 AromaticContact CZ-NE2 3.77Å; F74-S145 WeakPolarHBondContact CE1-OG 3.38Å; F74-S145 WeakPolarHBondContact CZ-OG 3.13Å; F74-R149 HydrophobicContact CD2-CB 4.12Å; F74-R149 HydrophobicContact CE2-CB 3.9Å; F74-Y150 HydrophobicContact CE1-CD2 4.45Å; F74-Y150 HydrophobicContact CE2-CD2 4.1Å; F74-Y150 HydrophobicContact CZ-CD2 4.02Å; F74-L153 HydrophobicContact CB-CB 4.19Å; F74-L153 HydrophobicContact CB-CD1 4.18Å; F74-L153 HydrophobicContact CB-CD2 3.72Å; F74-L153 HydrophobicContact CB-CG 4.23Å; F74-L153 HydrophobicContact CD2-CB 4.43Å; F74-L153 HydrophobicContact CG-CD2 4.09Å; F74-N202 PolarHBondContact O-N 3.13Å
75	T	89.9	Confident	91.9	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	10%	0.104	C	C	.	.	P	Polyproline II helix	trans	-66.8	169.9	161.3	63.5	0	0	0	0	110.8	D77 E78 T79 E81 K203	T75-D77 PolarHBondContact O-N 3.13Å; T75-D77 PolarHBondContact OG1-N 2.96Å; T75-E78 PolarHBondContact O-N 3.2Å; T75-E78 VanDerWaalsContact O-N 3.13Å; T75-T79 HydrophobicContact CG2-CG2 4.28Å; T75-T79 WeakPolarHBondContact CG2-O 3.32Å; T75-T79 PolarHBondContact N-O 3.37Å; T75-T79 WeakPolarHBondContact OG1-CG2 3.48Å; T75-T79 PolarHBondContact OG1-N 3.35Å; T75-T79 PolarHBondContact OG1-O 3.01Å; T75-E81 HydrophobicContact CG2-CB 4.18Å; T75-E81 HydrophobicContact CG2-CG 3.91Å; T75-K203 HydrophobicContact CG2-CG 4.06Å
76	R	87	Confident	92.4	Very high	111 Å²	111	20.1 Å²	20.1	42%	0.419	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-29.3	174.3	-172.5	179.1	68.2	-179.1	-3.1	113.1	E78 R157 K203	R76-E78 VanDerWaalsContact C-N 3.27Å; R76-E78 PolarHBondContact O-N 2.77Å; R76-R157 PolarHBondContact O-NH2 2.99Å; R76-K203 WeakPolarHBondContact CB-O 3.46Å; R76-K203 PolarHBondContact N-O 2.99Å
77	D	89.7	Confident	92.8	Very high	100 Å²	100	20.4 Å²	20.4	54%	0.535	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	18.6	-176.6	-64.6	9.2	0	0	0	112	T75 T79 P205	T75-D77 PolarHBondContact O-N 3.13Å; T75-D77 PolarHBondContact OG1-N 2.96Å; D77-T79 PolarHBondContact O-N 3.44Å; D77-P205 HydrophobicContact CB-CG 3.98Å; D77-P205 WeakPolarHBondContact OD2-CG 3.47Å
78	E	91.4	Very high	93.2	Very high	87 Å²	87	21.2 Å²	21.2	41%	0.407	10%	0.103	S	C	.	.	S	Bend	trans	61.1	26.4	178.3	-47.6	-169.7	-158.4	0	0	114.2	T75 R76 L153 R157	T75-E78 PolarHBondContact O-N 3.2Å; T75-E78 VanDerWaalsContact O-N 3.13Å; R76-E78 VanDerWaalsContact C-N 3.27Å; R76-E78 PolarHBondContact O-N 2.77Å; E78-L153 HydrophobicContact CG-CD2 3.97Å; E78-R157 IonicContact OE1-CZ 3.95Å; E78-R157 VanDerWaalsContact OE1-CZ 3.27Å; E78-R157 IonicContact OE1-NH1 3.42Å; E78-R157 PolarHBondContact OE1-NH1 2.81Å; E78-R157 IonicContact OE1-NH2 3.73Å; E78-R157 PolarHBondContact OE1-NH2 3.18Å
79	T	91	Very high	93.4	Very high	49 Å²	49	21.3 Å²	21.3	30%	0.301	10%	0.103	S	C	.	.			trans	-114.9	175.7	172.8	-169.5	0	0	0	0	111.7	T75 D77	T75-T79 HydrophobicContact CG2-CG2 4.28Å; T75-T79 WeakPolarHBondContact CG2-O 3.32Å; T75-T79 PolarHBondContact N-O 3.37Å; T75-T79 WeakPolarHBondContact OG1-CG2 3.48Å; T75-T79 PolarHBondContact OG1-N 3.35Å; T75-T79 PolarHBondContact OG1-O 3.01Å; D77-T79 PolarHBondContact O-N 3.44Å
80	H	92.8	Very high	93.6	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.009	13%	0.127	C	C	.	.			trans	-112.3	139.8	178.7	-59	-74.4	0	0	0	111.1	V73 F74 S101 P141 F144 S145	V73-H80 PolarHBondContact O-ND1 2.92Å; F74-H80 AromaticContact CD1-CE1 3.61Å; F74-H80 AromaticContact CD1-NE2 3.85Å; F74-H80 AromaticContact CE1-CE1 3.44Å; F74-H80 VanDerWaalsContact CE1-CE1 3.44Å; F74-H80 WeakPolarHBondContact CE1-CE1 3.48Å; F74-H80 AromaticContact CE1-NE2 3.36Å; F74-H80 WeakPolarHBondContact CE1-NE2 3.39Å; F74-H80 AromaticContact CE2-CE1 4Å; F74-H80 AromaticContact CG-CE1 3.99Å; F74-H80 AromaticContact CZ-CE1 3.65Å; F74-H80 AromaticContact CZ-NE2 3.77Å; H80-S101 WeakPolarHBondContact O-CB 3.44Å; H80-S101 PolarHBondContact O-OG 2.7Å; H80-P141 PolarHBondContact CD2-O 3.1Å; H80-P141 VanDerWaalsContact CD2-O 3.25Å; H80-F144 HydrophobicContact CB-CB 4.43Å; H80-F144 HydrophobicContact CB-CD2 4.26Å; H80-S145 PolarHBondContact NE2-OG 3.03Å
81	E	94.1	Very high	93.7	Very high	22 Å²	22	27.7 Å²	27.7	10%	0.103	14%	0.141	C	C	.	.			trans	-132.6	105.9	174.4	-78.3	-179.3	177.9	0	0	108.4	T75 K203 P205 G206	T75-E81 HydrophobicContact CG2-CB 4.18Å; T75-E81 HydrophobicContact CG2-CG 3.91Å; E81-K203 VanDerWaalsContact CB-NZ 3.3Å; E81-K203 VanDerWaalsContact OE2-CE 3.27Å; E81-K203 WeakPolarHBondContact OE2-CE 3.35Å; E81-K203 IonicContact OE2-NZ 3.28Å; E81-K203 PolarHBondContact OE2-NZ 3.3Å; E81-P205 WeakPolarHBondContact OE1-CA 3.4Å; E81-P205 WeakPolarHBondContact OE1-CB 3.06Å; E81-G206 VanDerWaalsContact CD-N 3.29Å; E81-G206 PolarHBondContact OE1-N 3.39Å; E81-G206 PolarHBondContact OE2-N 3.41Å; E81-G206 VanDerWaalsContact OE2-N 3.1Å
82	L	95.5	Very high	94.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	142	-175.8	-46.9	173.9	0	0	0	110	A72 G99 V100 P106 F144 T197	A72-L82 HydrophobicContact CB-CD2 3.37Å; L82-G99 PolarHBondContact O-N 3.08Å; L82-G99 VanDerWaalsContact O-N 3.1Å; L82-V100 HydrophobicContact CB-CG2 4.01Å; L82-V100 WeakPolarHBondContact CB-O 3.33Å; L82-V100 PolarHBondContact N-O 3.27Å; L82-V100 WeakPolarHBondContact O-CG2 3.35Å; L82-V100 PolarHBondContact O-N 2.97Å; L82-V100 VanDerWaalsContact O-N 3.09Å; L82-P106 HydrophobicContact CB-CB 4.35Å; L82-P106 HydrophobicContact CB-CG 3.55Å; L82-P106 HydrophobicContact CD1-CG 3.58Å; L82-P106 HydrophobicContact CG-CG 4.18Å; L82-F144 HydrophobicContact CD1-CD1 4.14Å; L82-F144 HydrophobicContact CD1-CD2 4.23Å; L82-F144 HydrophobicContact CD1-CE1 3.76Å; L82-F144 HydrophobicContact CD1-CE2 3.91Å; L82-F144 HydrophobicContact CD1-CG 4.35Å; L82-F144 HydrophobicContact CD1-CZ 3.65Å; L82-T197 WeakPolarHBondContact CA-O 3.48Å
83	D	96.9	Very high	94.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.7	177.5	-52.6	-34.9	0	0	0	109.4	V97 A98 G99 S196 T197 P212	D83-V97 CarbonylContact C-O 3.25Å; D83-V97 WeakPolarHBondContact CA-O 3.48Å; D83-A98 HydrophobicContact CB-CB 4.42Å; D83-A98 WeakPolarHBondContact OD1-CA 3.43Å; D83-A98 WeakPolarHBondContact OD1-CB 3.48Å; D83-G99 PolarHBondContact OD1-N 3.33Å; D83-S196 CarbonylContact O-C 3.59Å; D83-S196 VanDerWaalsContact O-CA 3.27Å; D83-S196 WeakPolarHBondContact O-CA 3.41Å; D83-S196 PolarHBondContact O-OG 2.91Å; D83-T197 HydrophobicContact CB-CG2 3.91Å; D83-T197 PolarHBondContact N-O 3.24Å; D83-T197 PolarHBondContact O-N 3.27Å; D83-P212 HydrophobicContact CB-CB 4.13Å; D83-P212 HydrophobicContact CB-CG 3.86Å
84	A	98	Very high	94.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	154.5	173.4	0	0	0	0	0	112.6	A96 V97 P106 V107 A110 T195	A84-A96 CarbonylContact O-C 3.52Å; A84-A96 WeakPolarHBondContact O-CA 3.41Å; A84-V97 HydrophobicContact CB-CG2 4.17Å; A84-V97 PolarHBondContact N-O 2.99Å; A84-V97 PolarHBondContact O-N 3.26Å; A84-P106 HydrophobicContact CB-CB 3.72Å; A84-V107 HydrophobicContact CB-CB 4.44Å; A84-A110 HydrophobicContact CB-CB 4.22Å; A84-T195 CarbonylContact C-O 3.56Å; A84-T195 WeakPolarHBondContact CA-O 3.17Å; A84-T195 WeakPolarHBondContact CB-O 3.46Å
85	C	98.4	Very high	95.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	145.7	172.9	179.5	0	0	0	0	110.8	G95 A96 A194 T195 S211 C218	C85-G95 CarbonylContact C-O 3.47Å; C85-G95 VanDerWaalsContact CA-O 3.31Å; C85-G95 WeakPolarHBondContact CA-O 3.09Å; C85-A96 HydrophobicContact CB-CB 4.1Å; C85-A194 CarbonylContact O-C 3.37Å; C85-A194 VanDerWaalsContact O-CA 3.22Å; C85-A194 WeakPolarHBondContact O-CA 3.24Å; C85-T195 PolarHBondContact N-O 3.25Å; C85-T195 PolarHBondContact O-N 3.41Å; C85-S211 WeakPolarHBondContact CB-O 3.16Å; C85-C218 HydrophobicContact CB-CB 4.03Å
86	V	98.4	Very high	95.5	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	145	167.7	-55.6	0	0	0	0	109.4	A94 G95 V107 A110 R111 M114 A193 A194	V86-A94 CarbonylContact O-C 3.6Å; V86-A94 VanDerWaalsContact O-CA 3.23Å; V86-A94 WeakPolarHBondContact O-CA 3.37Å; V86-G95 PolarHBondContact N-O 2.84Å; V86-G95 PolarHBondContact O-N 2.85Å; V86-V107 HydrophobicContact CG1-CG2 3.45Å; V86-V107 VanDerWaalsContact CG1-CG2 3.45Å; V86-A110 HydrophobicContact CG1-CB 4.32Å; V86-A110 HydrophobicContact CG2-CB 4.44Å; V86-R111 HydrophobicContact CG2-CB 4.28Å; V86-M114 HydrophobicContact CG2-CB 4.43Å; V86-M114 HydrophobicContact CG2-CE 4.44Å; V86-M114 HydrophobicContact CG2-SD 3.98Å; V86-A193 CarbonylContact C-O 3.38Å; V86-A193 WeakPolarHBondContact CA-O 3.48Å; V86-A194 HydrophobicContact CB-CB 4.49Å; V86-A194 HydrophobicContact CG1-CB 3.91Å
87	M	98.4	Very high	96	Very high	9 Å²	9	32.7 Å²	32.7	4%	0.044	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	131.4	177.1	-172.1	170.5	-175.9	0	0	111.2	L92 K93 A94 A192 A193 V214 Y219 A220	M87-L92 HydrophobicContact CE-CB 4.44Å; M87-L92 HydrophobicContact CE-CD2 4.11Å; M87-K93 WeakPolarHBondContact CA-O 3.13Å; M87-A94 HydrophobicContact CB-CB 4.16Å; M87-A94 HydrophobicContact CG-CB 4.03Å; M87-A192 WeakPolarHBondContact O-CA 3.39Å; M87-A193 PolarHBondContact N-O 3.45Å; M87-A193 PolarHBondContact O-N 3.16Å; M87-V214 HydrophobicContact CE-CG1 4.27Å; M87-V214 HydrophobicContact SD-CG1 3.69Å; M87-Y219 HydrophobicContact CE-CD2 4.32Å; M87-Y219 HydrophobicContact CE-CE2 4.19Å; M87-Y219 HydrophobicContact SD-CD2 4.07Å; M87-A220 HydrophobicContact CB-CB 4.3Å; M87-A220 VanDerWaalsContact CE-O 3.23Å; M87-A220 WeakPolarHBondContact CE-O 3.12Å; M87-A220 HydrophobicContact CG-CB 4.15Å; M87-A220 PolarHBondContact SD-N 3.16Å
88	D	98.1	Very high	96.4	Very high	22 Å²	22	28 Å²	28	12%	0.118	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	117.6	172.7	175.8	8.8	0	0	0	109.8	L50 N90 T91 L92 K93	L50-D88 HydrophobicContact CD1-CB 4Å; L50-D88 HydrophobicContact CD2-CB 4.13Å; D88-N90 VanDerWaalsContact C-N 3.29Å; D88-N90 PolarHBondContact O-N 2.9Å; D88-N90 WeakPolarHBondContact OD1-CB 3.09Å; D88-N90 PolarHBondContact OD1-N 3.4Å; D88-T91 WeakPolarHBondContact OD2-CB 3.38Å; D88-T91 VanDerWaalsContact OD2-CG2 3.29Å; D88-T91 WeakPolarHBondContact OD2-CG2 3.44Å; D88-T91 PolarHBondContact OD2-N 3.22Å; D88-T91 PolarHBondContact OD2-OG1 3.46Å; D88-L92 WeakPolarHBondContact O-CA 3.41Å; D88-L92 PolarHBondContact O-N 2.93Å; D88-K93 PolarHBondContact N-O 2.85Å
89	G	97	Very high	96.6	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.01	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-20.5	179.7	0	0	0	0	0	114.2	L191 N222	G89-L191 WeakPolarHBondContact CA-O 3.31Å; G89-L191 PolarHBondContact N-O 3.47Å; G89-N222 PolarHBondContact O-N 2.81Å; G89-N222 PolarHBondContact O-OD1 3.45Å
90	N	96.1	Very high	96.8	Very high	95 Å²	95	22.5 Å²	22.5	51%	0.508	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-47.6	178.9	-175.6	25.4	0	0	0	111.6	D88 N190 N222	D88-N90 VanDerWaalsContact C-N 3.29Å; D88-N90 PolarHBondContact O-N 2.9Å; D88-N90 WeakPolarHBondContact OD1-CB 3.09Å; D88-N90 PolarHBondContact OD1-N 3.4Å; N90-N190 HydrophobicContact CB-CB 4.29Å; N90-N190 WeakPolarHBondContact CB-OD1 3.29Å; N90-N190 VanDerWaalsContact CG-OD1 3.29Å; N90-N190 PolarHBondContact ND2-OD1 3.32Å; N90-N222 WeakPolarHBondContact CA-ND2 3.5Å; N90-N222 WeakPolarHBondContact CB-ND2 3.41Å; N90-N222 PolarHBondContact N-OD1 3.04Å
91	T	96	Very high	96.9	Very high	72 Å²	72	23.2 Å²	23.2	44%	0.442	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-9.8	-177.8	65.6	0	0	0	0	114	D88 K93	D88-T91 WeakPolarHBondContact OD2-CB 3.38Å; D88-T91 VanDerWaalsContact OD2-CG2 3.29Å; D88-T91 WeakPolarHBondContact OD2-CG2 3.44Å; D88-T91 PolarHBondContact OD2-N 3.22Å; D88-T91 PolarHBondContact OD2-OG1 3.46Å; T91-K93 PolarHBondContact O-N 2.98Å; T91-K93 VanDerWaalsContact O-N 3.13Å; T91-K93 WeakPolarHBondContact OG1-CB 3.48Å; T91-K93 WeakPolarHBondContact OG1-CG 3.45Å; T91-K93 PolarHBondContact OG1-N 3.47Å
92	L	95.2	Very high	97.1	Very high	91 Å²	91	24.3 Å²	24.3	48%	0.476	13%	0.133	S	C	.	.			trans	57.2	14.8	-169.5	-57.1	176.6	0	0	0	113.7	M87 D88 N221	M87-L92 HydrophobicContact CE-CB 4.44Å; M87-L92 HydrophobicContact CE-CD2 4.11Å; D88-L92 WeakPolarHBondContact O-CA 3.41Å; D88-L92 PolarHBondContact O-N 2.93Å; L92-N221 HydrophobicContact CD2-CB 4Å
93	K	97.4	Very high	97.1	Very high	124 Å²	124	24.3 Å²	24.3	54%	0.539	13%	0.133	S	C	.	.			trans	-71.7	140.8	173	-71.5	-176.4	175.8	-174.5	0	109.4	M87 D88 T91 M114	M87-K93 WeakPolarHBondContact CA-O 3.13Å; D88-K93 PolarHBondContact N-O 2.85Å; T91-K93 PolarHBondContact O-N 2.98Å; T91-K93 VanDerWaalsContact O-N 3.13Å; T91-K93 WeakPolarHBondContact OG1-CB 3.48Å; T91-K93 WeakPolarHBondContact OG1-CG 3.45Å; T91-K93 PolarHBondContact OG1-N 3.47Å; K93-M114 HydrophobicContact CB-CG 3.82Å; K93-M114 HydrophobicContact CB-SD 4.07Å
94	A	97.7	Very high	97	Very high	12 Å²	12	28.7 Å²	28.7	10%	0.099	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152.1	175.1	0	0	0	0	0	110.1	V86 M87 V120 V214	V86-A94 CarbonylContact O-C 3.6Å; V86-A94 VanDerWaalsContact O-CA 3.23Å; V86-A94 WeakPolarHBondContact O-CA 3.37Å; M87-A94 HydrophobicContact CB-CB 4.16Å; M87-A94 HydrophobicContact CG-CB 4.03Å; A94-V120 HydrophobicContact CB-CG1 4.08Å; A94-V214 HydrophobicContact CB-CG2 3.63Å
95	G	98.3	Very high	97	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.5	171.1	0	0	0	0	0	110	C85 V86 A110 V120	C85-G95 CarbonylContact C-O 3.47Å; C85-G95 VanDerWaalsContact CA-O 3.31Å; C85-G95 WeakPolarHBondContact CA-O 3.09Å; V86-G95 PolarHBondContact N-O 2.84Å; V86-G95 PolarHBondContact O-N 2.85Å; G95-A110 CarbonylContact C-O 3.56Å; G95-A110 WeakPolarHBondContact CA-O 3.34Å; G95-V120 CarbonylContact C-O 3.59Å; G95-V120 VanDerWaalsContact CA-O 3.28Å; G95-V120 WeakPolarHBondContact CA-O 3.45Å
96	A	98.4	Very high	96.9	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	146.7	-178.5	0	0	0	0	0	111.7	A84 C85 V120 M121 M122 P212	A84-A96 CarbonylContact O-C 3.52Å; A84-A96 WeakPolarHBondContact O-CA 3.41Å; C85-A96 HydrophobicContact CB-CB 4.1Å; A96-V120 PolarHBondContact N-O 3.16Å; A96-M121 HydrophobicContact CB-CB 4.14Å; A96-M121 HydrophobicContact CB-CG 3.96Å; A96-M121 WeakPolarHBondContact O-CA 3.2Å; A96-M122 PolarHBondContact O-N 3.36Å; A96-P212 HydrophobicContact CB-CB 4.3Å; A96-P212 VanDerWaalsContact CB-O 3.3Å; A96-P212 WeakPolarHBondContact CB-O 3.45Å
97	V	98.1	Very high	96.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	144.1	168.8	-64	0	0	0	0	109.6	D83 A84 V100 P106 A109 A110 V113 M122 A127	D83-V97 CarbonylContact C-O 3.25Å; D83-V97 WeakPolarHBondContact CA-O 3.48Å; A84-V97 HydrophobicContact CB-CG2 4.17Å; A84-V97 PolarHBondContact N-O 2.99Å; A84-V97 PolarHBondContact O-N 3.26Å; V97-V100 HydrophobicContact CB-CG1 4.21Å; V97-V100 HydrophobicContact CG2-CG2 4.34Å; V97-P106 HydrophobicContact CG2-CB 4.11Å; V97-P106 WeakPolarHBondContact CG2-O 3.43Å; V97-A109 HydrophobicContact CG1-CB 3.93Å; V97-A109 HydrophobicContact CG2-CB 4.26Å; V97-A110 HydrophobicContact CG2-CB 4.42Å; V97-V113 HydrophobicContact CG1-CG2 3.96Å; V97-M122 VanDerWaalsContact CA-O 3.26Å; V97-M122 WeakPolarHBondContact CA-O 3.4Å; V97-A127 HydrophobicContact CB-CB 4.35Å; V97-A127 HydrophobicContact CG1-CB 4.06Å
98	A	97	Very high	96.9	Very high	1 Å²	1	32 Å²	32	1%	0.008	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	146.6	174.6	0	0	0	0	0	112.5	D83 V100 M121 M122 I123 G124 V208 P212	D83-A98 HydrophobicContact CB-CB 4.42Å; D83-A98 WeakPolarHBondContact OD1-CA 3.43Å; D83-A98 WeakPolarHBondContact OD1-CB 3.48Å; A98-V100 VanDerWaalsContact C-N 3.32Å; A98-V100 PolarHBondContact O-N 2.64Å; A98-M121 HydrophobicContact CB-CE 3.53Å; A98-M122 PolarHBondContact N-O 3.18Å; A98-M122 VanDerWaalsContact N-O 3.15Å; A98-I123 HydrophobicContact CB-CG2 3.97Å; A98-I123 CarbonylContact O-C 2.82Å; A98-I123 VanDerWaalsContact O-CA 3.25Å; A98-I123 WeakPolarHBondContact O-CA 3.39Å; A98-G124 PolarHBondContact O-N 3.19Å; A98-V208 HydrophobicContact CB-CG1 3.97Å; A98-V208 HydrophobicContact CB-CG2 4.1Å; A98-P212 HydrophobicContact CB-CB 4.17Å; A98-P212 HydrophobicContact CB-CG 4.02Å
99	G	95.1	Very high	96.9	Very high	20 Å²	20	31 Å²	31	21%	0.206	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.9	33.9	178.7	0	0	0	0	0	113.6	L82 D83 G124	L82-G99 PolarHBondContact O-N 3.08Å; L82-G99 VanDerWaalsContact O-N 3.1Å; D83-G99 PolarHBondContact OD1-N 3.33Å; G99-G124 WeakPolarHBondContact O-CA 3.4Å
100	V	96.4	Very high	96.9	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	146	175.4	-59.1	0	0	0	0	110.5	L82 V97 A98 L103 P106 A127 E128	L82-V100 HydrophobicContact CB-CG2 4.01Å; L82-V100 WeakPolarHBondContact CB-O 3.33Å; L82-V100 PolarHBondContact N-O 3.27Å; L82-V100 WeakPolarHBondContact O-CG2 3.35Å; L82-V100 PolarHBondContact O-N 2.97Å; L82-V100 VanDerWaalsContact O-N 3.09Å; V97-V100 HydrophobicContact CB-CG1 4.21Å; V97-V100 HydrophobicContact CG2-CG2 4.34Å; A98-V100 VanDerWaalsContact C-N 3.32Å; A98-V100 PolarHBondContact O-N 2.64Å; V100-L103 HydrophobicContact CB-CD1 3.97Å; V100-L103 HydrophobicContact CB-CG 4.39Å; V100-L103 HydrophobicContact CG1-CD1 3.95Å; V100-L103 HydrophobicContact CG2-CB 4.32Å; V100-L103 HydrophobicContact CG2-CD1 4.05Å; V100-P106 HydrophobicContact CG2-CB 4.32Å; V100-P106 HydrophobicContact CG2-CG 4.28Å; V100-A127 HydrophobicContact CG1-CB 3.75Å; V100-E128 HydrophobicContact CB-CG 4.1Å; V100-E128 HydrophobicContact CG1-CG 4.02Å
101	S	95.5	Very high	97	Very high	18 Å²	18	27.9 Å²	27.9	13%	0.126	14%	0.142	C	C	.	.	S	Bend	trans	-131	-9.3	-172.3	-53.3	0	0	0	0	113.5	H80 E128 F144	H80-S101 WeakPolarHBondContact O-CB 3.44Å; H80-S101 PolarHBondContact O-OG 2.7Å; S101-E128 PolarHBondContact N-OE1 2.93Å; S101-F144 WeakPolarHBondContact O-CE2 3.27Å
102	H	96.8	Very high	97.1	Very high	44 Å²	44	25.8 Å²	25.8	20%	0.204	13%	0.128	C	C	.	.	S	Bend	trans	-126.5	16.2	-174	-54.1	94.6	0	0	0	113.3	E128 F132 R138 V139	H102-E128 WeakPolarHBondContact CB-OE1 3.36Å; H102-E128 IonicContact CE1-OE2 2.81Å; H102-E128 IonicContact CG-OE1 2.83Å; H102-E128 IonicContact CG-OE2 3.35Å; H102-E128 PolarHBondContact N-OE1 2.65Å; H102-E128 VanDerWaalsContact ND1-CD 3.29Å; H102-E128 IonicContact ND1-OE1 2.7Å; H102-E128 PolarHBondContact ND1-OE1 2.89Å; H102-E128 IonicContact ND1-OE2 2.99Å; H102-E128 PolarHBondContact ND1-OE2 3.33Å; H102-F132 HydrophobicContact CB-CZ 3.92Å; H102-R138 HydrophobicContact CB-CG 4.07Å; H102-V139 WeakPolarHBondContact O-CG2 3.48Å; H102-V139 PolarHBondContact O-N 3.1Å; H102-V139 VanDerWaalsContact O-N 3.1Å
103	L	96.1	Very high	97.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.106	C	C	.	.	B	Isolated β-bridge	trans	-111.1	117	178.5	-62.1	177.1	0	0	0	109.6	V100 N105 A109 E128 A131 F132 M136 F144	V100-L103 HydrophobicContact CB-CD1 3.97Å; V100-L103 HydrophobicContact CB-CG 4.39Å; V100-L103 HydrophobicContact CG1-CD1 3.95Å; V100-L103 HydrophobicContact CG2-CB 4.32Å; V100-L103 HydrophobicContact CG2-CD1 4.05Å; L103-N105 VanDerWaalsContact C-N 3.31Å; L103-N105 PolarHBondContact O-N 3.3Å; L103-A109 HydrophobicContact CD1-CB 3.68Å; L103-E128 HydrophobicContact CD1-CG 4.35Å; L103-E128 HydrophobicContact CG-CG 4.31Å; L103-A131 HydrophobicContact CD1-CB 3.9Å; L103-A131 HydrophobicContact CD2-CB 3.61Å; L103-A131 HydrophobicContact CG-CB 4.44Å; L103-F132 HydrophobicContact CD2-CD1 4.1Å; L103-F132 HydrophobicContact CD2-CE1 3.47Å; L103-F132 VanDerWaalsContact CD2-CE1 3.47Å; L103-F132 HydrophobicContact CD2-CZ 4.04Å; L103-M136 HydrophobicContact CD2-CB 4.42Å; L103-M136 HydrophobicContact CD2-CE 4.43Å; L103-F144 VanDerWaalsContact O-CZ 3.28Å; L103-F144 WeakPolarHBondContact O-CZ 3.17Å
104	R	95.5	Very high	97.2	Very high	93 Å²	93	16.3 Å²	16.3	35%	0.351	8%	0.084	S	C	.	.	S	Bend	trans	-57.4	-43.8	-177.4	-174	-179.3	-178.8	100.9	4.7	112.7	E62 V139 I143	E62-R104 IonicContact OE1-CZ 3.62Å; E62-R104 IonicContact OE1-NE 2.79Å; E62-R104 PolarHBondContact OE1-NE 3.24Å; E62-R104 IonicContact OE1-NH2 3.54Å; E62-R104 IonicContact OE2-CZ 2.95Å; E62-R104 IonicContact OE2-NE 3.55Å; E62-R104 PolarHBondContact OE2-NE 3.26Å; E62-R104 IonicContact OE2-NH2 3.98Å; E62-R104 PolarHBondContact OE2-NH2 2.88Å; R104-V139 HydrophobicContact CB-CG1 4.09Å; R104-V139 HydrophobicContact CB-CG2 4.15Å; R104-I143 HydrophobicContact CB-CD1 4.23Å; R104-I143 HydrophobicContact CG-CD1 3.92Å
105	N	96.8	Very high	97.2	Very high	16 Å²	16	20.4 Å²	20.4	9%	0.086	10%	0.101	C	C	.	.			trans	-125.8	86.4	-177.6	-54.6	106.8	0	0	0	110.4	R58 E61 E62 L103 V107 L108 A109	R58-N105 HydrophobicContact CG-CB 4.18Å; E61-N105 WeakPolarHBondContact OE2-CA 3.44Å; E61-N105 VanDerWaalsContact OE2-CB 3.29Å; E61-N105 WeakPolarHBondContact OE2-CB 3.25Å; E62-N105 PolarHBondContact OE1-ND2 2.97Å; E62-N105 PolarHBondContact OE1-OD1 3.35Å; L103-N105 VanDerWaalsContact C-N 3.31Å; L103-N105 PolarHBondContact O-N 3.3Å; N105-V107 PolarHBondContact O-N 3.29Å; N105-L108 HydrophobicContact CB-CB 4.32Å; N105-L108 HydrophobicContact CB-CD1 3.89Å; N105-L108 HydrophobicContact CB-CG 3.92Å; N105-L108 PolarHBondContact O-N 3.02Å; N105-A109 PolarHBondContact O-N 3.09Å
106	P	97.3	Very high	97.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-51.2	-34.5	178.4	-28.5	34	0	0	0	114.3	E61 L82 A84 V97 V100 L108 A109 A110	E61-P106 WeakPolarHBondContact OE1-CD 3.43Å; L82-P106 HydrophobicContact CB-CB 4.35Å; L82-P106 HydrophobicContact CB-CG 3.55Å; L82-P106 HydrophobicContact CD1-CG 3.58Å; L82-P106 HydrophobicContact CG-CG 4.18Å; A84-P106 HydrophobicContact CB-CB 3.72Å; V97-P106 HydrophobicContact CG2-CB 4.11Å; V97-P106 WeakPolarHBondContact CG2-O 3.43Å; V100-P106 HydrophobicContact CG2-CB 4.32Å; V100-P106 HydrophobicContact CG2-CG 4.28Å; P106-L108 VanDerWaalsContact C-N 3.3Å; P106-L108 PolarHBondContact O-N 3.09Å; P106-A109 WeakPolarHBondContact O-CB 3.43Å; P106-A109 PolarHBondContact O-N 3.08Å; P106-A109 VanDerWaalsContact O-N 3.11Å; P106-A110 PolarHBondContact O-N 3.45Å
107	V	98	Very high	97	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-35.1	177.5	75.5	0	0	0	0	113.2	T54 V57 R58 E61 A84 V86 N105 A109 A110 R111 A194	T54-V107 HydrophobicContact CG2-CG2 4.49Å; V57-V107 HydrophobicContact CB-CB 4.28Å; V57-V107 HydrophobicContact CB-CG1 4.31Å; V57-V107 HydrophobicContact CB-CG2 3.95Å; V57-V107 HydrophobicContact CG1-CB 3.68Å; V57-V107 HydrophobicContact CG1-CG1 4.02Å; V57-V107 HydrophobicContact CG1-CG2 3.73Å; R58-V107 HydrophobicContact CB-CG1 4.05Å; E61-V107 PolarHBondContact OE1-N 2.84Å; E61-V107 WeakPolarHBondContact OE2-CG1 3.28Å; A84-V107 HydrophobicContact CB-CB 4.44Å; V86-V107 HydrophobicContact CG1-CG2 3.45Å; V86-V107 VanDerWaalsContact CG1-CG2 3.45Å; N105-V107 PolarHBondContact O-N 3.29Å; V107-A109 VanDerWaalsContact C-N 3.32Å; V107-A110 WeakPolarHBondContact O-CB 3.47Å; V107-A110 PolarHBondContact O-N 2.98Å; V107-R111 PolarHBondContact O-N 2.89Å; V107-A194 HydrophobicContact CG2-CB 4.31Å
108	L	98.1	Very high	96.8	Very high	62 Å²	62	32.6 Å²	32.6	33%	0.325	17%	0.17	S	C	.	.	H	α-helix	trans	-69.5	-34.3	175.9	-64.2	-176.5	0	0	0	111.2	T54 R58 N105 P106 R111 L112 M136	T54-L108 HydrophobicContact CG2-CD2 3.71Å; R58-L108 HydrophobicContact CG-CD1 4.41Å; R58-L108 HydrophobicContact CG-CG 4.47Å; N105-L108 HydrophobicContact CB-CB 4.32Å; N105-L108 HydrophobicContact CB-CD1 3.89Å; N105-L108 HydrophobicContact CB-CG 3.92Å; N105-L108 PolarHBondContact O-N 3.02Å; P106-L108 VanDerWaalsContact C-N 3.3Å; P106-L108 PolarHBondContact O-N 3.09Å; L108-R111 PolarHBondContact O-N 2.78Å; L108-L112 WeakPolarHBondContact O-CB 3.41Å; L108-L112 PolarHBondContact O-N 2.94Å; L108-M136 HydrophobicContact CB-CE 3.97Å
109	A	97.9	Very high	96.7	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-39.7	173.3	0	0	0	0	0	111.5	V97 L103 N105 P106 V107 R111 L112 V113 A131 M136	V97-A109 HydrophobicContact CG1-CB 3.93Å; V97-A109 HydrophobicContact CG2-CB 4.26Å; L103-A109 HydrophobicContact CD1-CB 3.68Å; N105-A109 PolarHBondContact O-N 3.09Å; P106-A109 WeakPolarHBondContact O-CB 3.43Å; P106-A109 PolarHBondContact O-N 3.08Å; P106-A109 VanDerWaalsContact O-N 3.11Å; V107-A109 VanDerWaalsContact C-N 3.32Å; A109-R111 VanDerWaalsContact C-N 3.34Å; A109-L112 WeakPolarHBondContact O-CB 3.25Å; A109-L112 PolarHBondContact O-N 3.35Å; A109-V113 WeakPolarHBondContact O-CG2 3.47Å; A109-V113 PolarHBondContact O-N 3.44Å; A109-A131 HydrophobicContact CB-CB 4.34Å; A109-M136 HydrophobicContact CB-CE 4.08Å; A109-M136 HydrophobicContact CB-SD 3.72Å
110	A	98.2	Very high	96.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.4	-43.3	172	0	0	0	0	0	111.5	A84 V86 G95 V97 P106 V107 L112 V113 M114	A84-A110 HydrophobicContact CB-CB 4.22Å; V86-A110 HydrophobicContact CG1-CB 4.32Å; V86-A110 HydrophobicContact CG2-CB 4.44Å; G95-A110 CarbonylContact C-O 3.56Å; G95-A110 WeakPolarHBondContact CA-O 3.34Å; V97-A110 HydrophobicContact CG2-CB 4.42Å; P106-A110 PolarHBondContact O-N 3.45Å; V107-A110 WeakPolarHBondContact O-CB 3.47Å; V107-A110 PolarHBondContact O-N 2.98Å; A110-L112 PolarHBondContact O-N 3.22Å; A110-V113 PolarHBondContact O-N 3.47Å; A110-M114 PolarHBondContact O-N 3.34Å; A110-M114 VanDerWaalsContact O-N 3.08Å
111	R	98	Very high	96.8	Very high	30 Å²	30	43.7 Å²	43.7	11%	0.113	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-42.6	174.2	-175.6	60.4	-176.2	-91.4	-2.3	112.2	L50 D51 T54 V86 V107 L108 A109 V113 M114 E115	L50-R111 VanDerWaalsContact CG-NH1 3.28Å; L50-R111 PolarHBondContact O-NH1 2.84Å; D51-R111 IonicContact OD1-CZ 3.43Å; D51-R111 IonicContact OD1-NH1 3.44Å; D51-R111 PolarHBondContact OD1-NH1 3.19Å; D51-R111 IonicContact OD1-NH2 2.99Å; D51-R111 PolarHBondContact OD1-NH2 3.43Å; T54-R111 HydrophobicContact CG2-CB 4.38Å; T54-R111 HydrophobicContact CG2-CG 4.47Å; T54-R111 PolarHBondContact OG1-NH1 3.3Å; V86-R111 HydrophobicContact CG2-CB 4.28Å; V107-R111 PolarHBondContact O-N 2.89Å; L108-R111 PolarHBondContact O-N 2.78Å; A109-R111 VanDerWaalsContact C-N 3.34Å; R111-V113 PolarHBondContact O-N 3.41Å; R111-M114 VanDerWaalsContact CD-CE 3.46Å; R111-M114 WeakPolarHBondContact O-CB 3.49Å; R111-M114 PolarHBondContact O-N 3.49Å; R111-E115 IonicContact CZ-OE1 3.69Å; R111-E115 IonicContact NE-OE1 2.74Å; R111-E115 PolarHBondContact NE-OE1 2.77Å; R111-E115 IonicContact NH2-OE1 3.1Å; R111-E115 PolarHBondContact NH2-OE1 2.91Å; R111-E115 WeakPolarHBondContact O-CG 3.24Å; R111-E115 PolarHBondContact O-N 2.67Å
112	L	97.5	Very high	96.9	Very high	28 Å²	28	44.7 Å²	44.7	15%	0.147	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-42.4	175.3	-168.8	91.6	0	0	0	112.1	L108 A109 A110 M114 E115 Q116 F130 H134	L108-L112 WeakPolarHBondContact O-CB 3.41Å; L108-L112 PolarHBondContact O-N 2.94Å; A109-L112 WeakPolarHBondContact O-CB 3.25Å; A109-L112 PolarHBondContact O-N 3.35Å; A110-L112 PolarHBondContact O-N 3.22Å; L112-M114 VanDerWaalsContact C-N 3.3Å; L112-M114 PolarHBondContact O-N 3.24Å; L112-E115 PolarHBondContact O-N 3.17Å; L112-Q116 HydrophobicContact CD1-CG 4.08Å; L112-Q116 HydrophobicContact CG-CB 4.44Å; L112-Q116 HydrophobicContact CG-CG 4.33Å; L112-Q116 WeakPolarHBondContact O-CB 3.19Å; L112-Q116 PolarHBondContact O-N 3.41Å; L112-F130 HydrophobicContact CB-CE1 4.31Å; L112-F130 HydrophobicContact CD2-CD1 3.73Å; L112-F130 HydrophobicContact CD2-CE1 3.32Å; L112-F130 HydrophobicContact CD2-CZ 4.07Å; L112-F130 HydrophobicContact CG-CE1 3.79Å; L112-F130 HydrophobicContact CG-CZ 4.31Å; L112-H134 HydrophobicContact CD1-CB 3.68Å; L112-H134 HydrophobicContact CD2-CB 3.4Å; L112-H134 HydrophobicContact CG-CB 4.04Å
113	V	97.9	Very high	96.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.5	-42.5	175.6	168.1	0	0	0	0	110.7	V97 A109 A110 R111 E115 S117 H119 M122 F130	V97-V113 HydrophobicContact CG1-CG2 3.96Å; A109-V113 WeakPolarHBondContact O-CG2 3.47Å; A109-V113 PolarHBondContact O-N 3.44Å; A110-V113 PolarHBondContact O-N 3.47Å; R111-V113 PolarHBondContact O-N 3.41Å; V113-E115 PolarHBondContact O-N 3.25Å; V113-S117 VanDerWaalsContact O-CB 3.23Å; V113-S117 WeakPolarHBondContact O-CB 3.34Å; V113-S117 PolarHBondContact O-N 2.88Å; V113-S117 PolarHBondContact O-OG 3.49Å; V113-H119 WeakPolarHBondContact CG1-O 3.17Å; V113-M122 HydrophobicContact CG1-CG 4.38Å; V113-M122 HydrophobicContact CG2-CB 4.31Å; V113-M122 HydrophobicContact CG2-CG 4.18Å; V113-M122 HydrophobicContact CG2-SD 3.98Å; V113-F130 HydrophobicContact CB-CE1 4.39Å; V113-F130 HydrophobicContact CG2-CD1 3.89Å; V113-F130 HydrophobicContact CG2-CE1 3.75Å
114	M	97.8	Very high	96.8	Very high	17 Å²	17	49.1 Å²	49.1	8%	0.084	26%	0.256	C	S	.	.	H	α-helix	trans	-64	-38.5	177.7	-171.8	-178.4	75.2	0	0	113.1	L50 V86 K93 A110 R111 L112	L50-M114 HydrophobicContact CD1-CE 4.04Å; L50-M114 HydrophobicContact CD1-SD 4.47Å; L50-M114 HydrophobicContact CD2-CE 3.57Å; L50-M114 HydrophobicContact CG-CE 4.28Å; V86-M114 HydrophobicContact CG2-CB 4.43Å; V86-M114 HydrophobicContact CG2-CE 4.44Å; V86-M114 HydrophobicContact CG2-SD 3.98Å; K93-M114 HydrophobicContact CB-CG 3.82Å; K93-M114 HydrophobicContact CB-SD 4.07Å; A110-M114 PolarHBondContact O-N 3.34Å; A110-M114 VanDerWaalsContact O-N 3.08Å; R111-M114 VanDerWaalsContact CD-CE 3.46Å; R111-M114 WeakPolarHBondContact O-CB 3.49Å; R111-M114 PolarHBondContact O-N 3.49Å; L112-M114 VanDerWaalsContact C-N 3.3Å; L112-M114 PolarHBondContact O-N 3.24Å
115	E	96.8	Very high	96.8	Very high	98 Å²	98	51.5 Å²	51.5	46%	0.458	27%	0.27	S	S	.	.	H	α-helix	trans	-91.1	-37.3	-172.3	-70.1	-177.4	161.8	0	0	114	R111 L112 V113	R111-E115 IonicContact CZ-OE1 3.69Å; R111-E115 IonicContact NE-OE1 2.74Å; R111-E115 PolarHBondContact NE-OE1 2.77Å; R111-E115 IonicContact NH2-OE1 3.1Å; R111-E115 PolarHBondContact NH2-OE1 2.91Å; R111-E115 WeakPolarHBondContact O-CG 3.24Å; R111-E115 PolarHBondContact O-N 2.67Å; L112-E115 PolarHBondContact O-N 3.17Å; V113-E115 PolarHBondContact O-N 3.25Å
116	Q	96.8	Very high	96.7	Very high	115 Å²	115	52.8 Å²	52.8	54%	0.537	29%	0.287	S	S	.	.	H	α-helix	trans	-115.8	3.8	-167	-56.1	-63.6	-22.1	0	0	113.2	L112 F130	L112-Q116 HydrophobicContact CD1-CG 4.08Å; L112-Q116 HydrophobicContact CG-CB 4.44Å; L112-Q116 HydrophobicContact CG-CG 4.33Å; L112-Q116 WeakPolarHBondContact O-CB 3.19Å; L112-Q116 PolarHBondContact O-N 3.41Å; Q116-F130 HydrophobicContact CB-CZ 3.99Å
117	S	94.7	Very high	96.7	Very high	19 Å²	19	52.8 Å²	52.8	13%	0.133	29%	0.288	C	S	.	.			trans	-126.9	155	178.4	101.4	0	0	0	0	112	V113 H119	V113-S117 VanDerWaalsContact O-CB 3.23Å; V113-S117 WeakPolarHBondContact O-CB 3.34Å; V113-S117 PolarHBondContact O-N 2.88Å; V113-S117 PolarHBondContact O-OG 3.49Å; S117-H119 PolarHBondContact O-N 2.96Å; S117-H119 PolarHBondContact OG-N 3.34Å; S117-H119 PolarHBondContact OG-O 3.3Å
118	P	94	Very high	96.7	Very high	122 Å²	122	53.4 Å²	53.4	79%	0.792	29%	0.291	S	S	*	.	S	Bend	trans	-81.4	2.4	169.5	35.2	-35.6	0	0	0	112.7
119	H	95.1	Very high	96.6	Very high	104 Å²	104	54.2 Å²	54.2	48%	0.481	30%	0.295	S	S	.	.			trans	-105.5	150.6	-173.7	-56.2	-66.4	0	0	0	110.8	V113 S117	V113-H119 WeakPolarHBondContact CG1-O 3.17Å; S117-H119 PolarHBondContact O-N 2.96Å; S117-H119 PolarHBondContact OG-N 3.34Å; S117-H119 PolarHBondContact OG-O 3.3Å
120	V	96.2	Very high	96.6	Very high	83 Å²	83	55.5 Å²	55.5	50%	0.503	30%	0.301	S	S	.	.	S	Bend	trans	-87.3	-30.7	174.9	177.9	0	0	0	0	111.4	A94 G95 A96 V214	A94-V120 HydrophobicContact CB-CG1 4.08Å; G95-V120 CarbonylContact C-O 3.59Å; G95-V120 VanDerWaalsContact CA-O 3.28Å; G95-V120 WeakPolarHBondContact CA-O 3.45Å; A96-V120 PolarHBondContact N-O 3.16Å; V120-V214 HydrophobicContact CG1-CG2 4.24Å
121	M	97.4	Very high	96.6	Very high	68 Å²	68	55.5 Å²	55.5	34%	0.335	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	133.9	-175.1	-174	179.3	-175.7	0	0	110.6	A96 A98 I123 P212 L213	A96-M121 HydrophobicContact CB-CB 4.14Å; A96-M121 HydrophobicContact CB-CG 3.96Å; A96-M121 WeakPolarHBondContact O-CA 3.2Å; A98-M121 HydrophobicContact CB-CE 3.53Å; M121-I123 HydrophobicContact CE-CG2 3.81Å; M121-I123 HydrophobicContact CG-CG2 4.3Å; M121-P212 HydrophobicContact CE-CB 3.99Å; M121-P212 HydrophobicContact CE-CG 4.08Å; M121-L213 HydrophobicContact CE-CD2 4.41Å; M121-L213 HydrophobicContact SD-CD2 4.23Å
122	M	97.7	Very high	96.5	Very high	39 Å²	39	56.2 Å²	56.2	19%	0.192	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	149.3	170.2	-68.2	-174.5	135	0	0	109.7	A96 V97 A98 V113 A127 F130	A96-M122 PolarHBondContact O-N 3.36Å; V97-M122 VanDerWaalsContact CA-O 3.26Å; V97-M122 WeakPolarHBondContact CA-O 3.4Å; A98-M122 PolarHBondContact N-O 3.18Å; A98-M122 VanDerWaalsContact N-O 3.15Å; V113-M122 HydrophobicContact CG1-CG 4.38Å; V113-M122 HydrophobicContact CG2-CB 4.31Å; V113-M122 HydrophobicContact CG2-CG 4.18Å; V113-M122 HydrophobicContact CG2-SD 3.98Å; M122-A127 HydrophobicContact CB-CB 3.7Å; M122-F130 HydrophobicContact CE-CB 4.24Å; M122-F130 HydrophobicContact CE-CD2 4.12Å; M122-F130 HydrophobicContact CE-CG 4.18Å; M122-F130 HydrophobicContact SD-CB 3.7Å; M122-F130 HydrophobicContact SD-CD1 3.8Å; M122-F130 HydrophobicContact SD-CD2 4.03Å; M122-F130 HydrophobicContact SD-CE1 4.44Å; M122-F130 HydrophobicContact SD-CG 3.56Å; M122-F130 VanDerWaalsContact SD-CG 3.56Å
123	I	96.8	Very high	96.5	Very high	114 Å²	114	58.9 Å²	58.9	59%	0.585	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	151.2	-176.1	67.8	174.4	0	0	0	112.5	A98 M121 G126 A127	A98-I123 HydrophobicContact CB-CG2 3.97Å; A98-I123 CarbonylContact O-C 2.82Å; A98-I123 VanDerWaalsContact O-CA 3.25Å; A98-I123 WeakPolarHBondContact O-CA 3.39Å; M121-I123 HydrophobicContact CE-CG2 3.81Å; M121-I123 HydrophobicContact CG-CG2 4.3Å; I123-G126 PolarHBondContact O-N 2.74Å; I123-A127 PolarHBondContact O-N 3.41Å
124	G	95	Very high	96.5	Very high	23 Å²	23	62.8 Å²	62.8	24%	0.237	35%	0.349	C	S	.	.	H	α-helix	trans	52.9	-139.8	172.7	0	0	0	0	0	113.7	A98 G99 G126 A127 E128	A98-G124 PolarHBondContact O-N 3.19Å; G99-G124 WeakPolarHBondContact O-CA 3.4Å; G124-G126 PolarHBondContact O-N 2.9Å; G124-G126 VanDerWaalsContact O-N 3.14Å; G124-A127 WeakPolarHBondContact O-CB 3.4Å; G124-A127 PolarHBondContact O-N 3.47Å; G124-E128 PolarHBondContact O-N 2.95Å; G124-E128 VanDerWaalsContact O-N 3.16Å
125	E	95	Very high	96.3	Very high	142 Å²	142	65.3 Å²	65.3	66%	0.664	38%	0.379	S	S	*	.	H	α-helix	trans	-56.3	-32.1	-177.8	-161.7	-170	163	0	0	113.1	E128 N129	E125-E128 PolarHBondContact O-N 3.47Å; E125-N129 VanDerWaalsContact O-CB 3.29Å; E125-N129 WeakPolarHBondContact O-CB 3.22Å; E125-N129 PolarHBondContact O-N 3.44Å; E125-N129 PolarHBondContact O-ND2 2.74Å
126	G	95.5	Very high	96.3	Very high	43 Å²	43	62.5 Å²	62.5	44%	0.443	37%	0.367	S	S	.	.	H	α-helix	trans	-64.6	-41.6	176.9	0	0	0	0	0	112.8	I123 G124 F130	I123-G126 PolarHBondContact O-N 2.74Å; G124-G126 PolarHBondContact O-N 2.9Å; G124-G126 VanDerWaalsContact O-N 3.14Å; G126-F130 WeakPolarHBondContact O-CB 3.29Å; G126-F130 PolarHBondContact O-N 3.4Å; G126-F130 VanDerWaalsContact O-N 3.13Å
127	A	96.7	Very high	96.2	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.008	37%	0.374	C	S	.	.	H	α-helix	trans	-67	-42.1	175.2	0	0	0	0	0	111.6	V97 V100 M122 I123 G124 F130 A131	V97-A127 HydrophobicContact CB-CB 4.35Å; V97-A127 HydrophobicContact CG1-CB 4.06Å; V100-A127 HydrophobicContact CG1-CB 3.75Å; M122-A127 HydrophobicContact CB-CB 3.7Å; I123-A127 PolarHBondContact O-N 3.41Å; G124-A127 WeakPolarHBondContact O-CB 3.4Å; G124-A127 PolarHBondContact O-N 3.47Å; A127-F130 PolarHBondContact O-N 2.92Å; A127-A131 WeakPolarHBondContact O-CB 3.5Å; A127-A131 PolarHBondContact O-N 3.21Å
128	E	97.2	Very high	96.3	Very high	12 Å²	12	70.4 Å²	70.4	6%	0.056	40%	0.395	C	S	.	.	H	α-helix	trans	-64.2	-48.8	178.4	-64.6	-169	157.4	0	0	111.9	V100 S101 H102 L103 G124 E125 F130 A131 F132	V100-E128 HydrophobicContact CB-CG 4.1Å; V100-E128 HydrophobicContact CG1-CG 4.02Å; S101-E128 PolarHBondContact N-OE1 2.93Å; H102-E128 WeakPolarHBondContact CB-OE1 3.36Å; H102-E128 IonicContact CE1-OE2 2.81Å; H102-E128 IonicContact CG-OE1 2.83Å; H102-E128 IonicContact CG-OE2 3.35Å; H102-E128 PolarHBondContact N-OE1 2.65Å; H102-E128 VanDerWaalsContact ND1-CD 3.29Å; H102-E128 IonicContact ND1-OE1 2.7Å; H102-E128 PolarHBondContact ND1-OE1 2.89Å; H102-E128 IonicContact ND1-OE2 2.99Å; H102-E128 PolarHBondContact ND1-OE2 3.33Å; L103-E128 HydrophobicContact CD1-CG 4.35Å; L103-E128 HydrophobicContact CG-CG 4.31Å; G124-E128 PolarHBondContact O-N 2.95Å; G124-E128 VanDerWaalsContact O-N 3.16Å; E125-E128 PolarHBondContact O-N 3.47Å; E128-F130 VanDerWaalsContact C-N 3.26Å; E128-F130 PolarHBondContact O-N 2.87Å; E128-A131 PolarHBondContact O-N 3.26Å; E128-A131 VanDerWaalsContact O-N 3.14Å; E128-F132 HydrophobicContact CB-CD2 4.3Å; E128-F132 HydrophobicContact CB-CE2 3.64Å; E128-F132 HydrophobicContact CB-CZ 3.96Å; E128-F132 WeakPolarHBondContact O-CD2 3.28Å; E128-F132 WeakPolarHBondContact O-CG 3.19Å; E128-F132 PolarHBondContact O-N 3.23Å
129	N	97.3	Very high	96.3	Very high	79 Å²	79	65.3 Å²	65.3	42%	0.422	36%	0.361	S	S	.	.	H	α-helix	trans	-59.8	-39.2	177.8	-73.9	-23.5	0	0	0	111.8	E125 A133	E125-N129 VanDerWaalsContact O-CB 3.29Å; E125-N129 WeakPolarHBondContact O-CB 3.22Å; E125-N129 PolarHBondContact O-N 3.44Å; E125-N129 PolarHBondContact O-ND2 2.74Å; N129-A133 VanDerWaalsContact O-CB 3.28Å; N129-A133 WeakPolarHBondContact O-CB 3.4Å; N129-A133 PolarHBondContact O-N 3.05Å
130	F	97.7	Very high	96.3	Very high	28 Å²	28	62.6 Å²	62.6	12%	0.123	36%	0.355	C	S	.	.	H	α-helix	trans	-62.9	-48.5	173.8	174	-97.6	0	0	0	111.7	L112 V113 Q116 M122 G126 A127 E128 F132 A133 H134	L112-F130 HydrophobicContact CB-CE1 4.31Å; L112-F130 HydrophobicContact CD2-CD1 3.73Å; L112-F130 HydrophobicContact CD2-CE1 3.32Å; L112-F130 HydrophobicContact CD2-CZ 4.07Å; L112-F130 HydrophobicContact CG-CE1 3.79Å; L112-F130 HydrophobicContact CG-CZ 4.31Å; V113-F130 HydrophobicContact CB-CE1 4.39Å; V113-F130 HydrophobicContact CG2-CD1 3.89Å; V113-F130 HydrophobicContact CG2-CE1 3.75Å; Q116-F130 HydrophobicContact CB-CZ 3.99Å; M122-F130 HydrophobicContact CE-CB 4.24Å; M122-F130 HydrophobicContact CE-CD2 4.12Å; M122-F130 HydrophobicContact CE-CG 4.18Å; M122-F130 HydrophobicContact SD-CB 3.7Å; M122-F130 HydrophobicContact SD-CD1 3.8Å; M122-F130 HydrophobicContact SD-CD2 4.03Å; M122-F130 HydrophobicContact SD-CE1 4.44Å; M122-F130 HydrophobicContact SD-CG 3.56Å; M122-F130 VanDerWaalsContact SD-CG 3.56Å; G126-F130 WeakPolarHBondContact O-CB 3.29Å; G126-F130 PolarHBondContact O-N 3.4Å; G126-F130 VanDerWaalsContact O-N 3.13Å; A127-F130 PolarHBondContact O-N 2.92Å; E128-F130 VanDerWaalsContact C-N 3.26Å; E128-F130 PolarHBondContact O-N 2.87Å; F130-F132 PolarHBondContact O-N 3.17Å; F130-A133 PolarHBondContact O-N 2.77Å; F130-H134 AromaticContact CD2-CE1 3.58Å; F130-H134 AromaticContact CD2-ND1 3.85Å; F130-H134 AromaticContact CE2-CE1 3.17Å; F130-H134 WeakPolarHBondContact CE2-CE1 3.44Å; F130-H134 AromaticContact CE2-ND1 3.71Å; F130-H134 AromaticContact CE2-NE2 3.93Å; F130-H134 AromaticContact CZ-CE1 3.65Å; F130-H134 AromaticContact CZ-ND1 3.92Å; F130-H134 PolarHBondContact O-N 3.14Å; F130-H134 PolarHBondContact O-ND1 3.41Å
131	A	96.9	Very high	96.1	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.008	34%	0.341	C	S	.	.	H	α-helix	trans	-60.6	-44.9	178.5	0	0	0	0	0	112.4	L103 A109 A127 E128 A133 H134 G135 M136	L103-A131 HydrophobicContact CD1-CB 3.9Å; L103-A131 HydrophobicContact CD2-CB 3.61Å; L103-A131 HydrophobicContact CG-CB 4.44Å; A109-A131 HydrophobicContact CB-CB 4.34Å; A127-A131 WeakPolarHBondContact O-CB 3.5Å; A127-A131 PolarHBondContact O-N 3.21Å; E128-A131 PolarHBondContact O-N 3.26Å; E128-A131 VanDerWaalsContact O-N 3.14Å; A131-A133 PolarHBondContact O-N 3.3Å; A131-H134 CarbonylContact O-C 3.47Å; A131-H134 PolarHBondContact O-N 3.01Å; A131-H134 VanDerWaalsContact O-N 3.14Å; A131-G135 PolarHBondContact O-N 3.31Å; A131-M136 HydrophobicContact CB-CB 4.15Å; A131-M136 HydrophobicContact CB-CG 4.22Å; A131-M136 HydrophobicContact CB-SD 3.68Å; A131-M136 WeakPolarHBondContact O-CB 3.34Å; A131-M136 PolarHBondContact O-N 3.22Å; A131-M136 VanDerWaalsContact O-N 3.09Å
132	F	97.6	Very high	95.9	Very high	45 Å²	45	64.1 Å²	64.1	20%	0.197	36%	0.358	C	S	.	.	H	α-helix	trans	-64.8	-39.1	177.4	-58	-33.9	0	0	0	112.3	H102 L103 E128 F130 H134 G135 M136 R138	H102-F132 HydrophobicContact CB-CZ 3.92Å; L103-F132 HydrophobicContact CD2-CD1 4.1Å; L103-F132 HydrophobicContact CD2-CE1 3.47Å; L103-F132 VanDerWaalsContact CD2-CE1 3.47Å; L103-F132 HydrophobicContact CD2-CZ 4.04Å; E128-F132 HydrophobicContact CB-CD2 4.3Å; E128-F132 HydrophobicContact CB-CE2 3.64Å; E128-F132 HydrophobicContact CB-CZ 3.96Å; E128-F132 WeakPolarHBondContact O-CD2 3.28Å; E128-F132 WeakPolarHBondContact O-CG 3.19Å; E128-F132 PolarHBondContact O-N 3.23Å; F130-F132 PolarHBondContact O-N 3.17Å; F132-H134 PolarHBondContact O-N 3.49Å; F132-G135 PolarHBondContact O-N 3.18Å; F132-M136 WeakPolarHBondContact CD1-O 3.4Å; F132-R138 HydrophobicContact CD1-CB 4.09Å; F132-R138 VanDerWaalsContact CE1-CA 3.48Å; F132-R138 HydrophobicContact CE1-CB 3.55Å; F132-R138 HydrophobicContact CE1-CG 3.96Å; F132-R138 HydrophobicContact CE2-CB 4.37Å; F132-R138 HydrophobicContact CE2-CG 4.16Å; F132-R138 HydrophobicContact CZ-CB 3.72Å; F132-R138 HydrophobicContact CZ-CG 3.59Å
133	A	96.8	Very high	95.6	Very high	83 Å²	83	64.9 Å²	64.9	69%	0.686	36%	0.363	S	S	*	.	H	α-helix	trans	-63	-21.9	175.8	0	0	0	0	0	113	N129 F130 A131	N129-A133 VanDerWaalsContact O-CB 3.28Å; N129-A133 WeakPolarHBondContact O-CB 3.4Å; N129-A133 PolarHBondContact O-N 3.05Å; F130-A133 PolarHBondContact O-N 2.77Å; A131-A133 PolarHBondContact O-N 3.3Å
134	H	96.9	Very high	95.5	Very high	82 Å²	82	59.5 Å²	59.5	38%	0.38	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	18.9	175.8	-65.6	79.2	0	0	0	113.2	L112 F130 A131 F132	L112-H134 HydrophobicContact CD1-CB 3.68Å; L112-H134 HydrophobicContact CD2-CB 3.4Å; L112-H134 HydrophobicContact CG-CB 4.04Å; F130-H134 AromaticContact CD2-CE1 3.58Å; F130-H134 AromaticContact CD2-ND1 3.85Å; F130-H134 AromaticContact CE2-CE1 3.17Å; F130-H134 WeakPolarHBondContact CE2-CE1 3.44Å; F130-H134 AromaticContact CE2-ND1 3.71Å; F130-H134 AromaticContact CE2-NE2 3.93Å; F130-H134 AromaticContact CZ-CE1 3.65Å; F130-H134 AromaticContact CZ-ND1 3.92Å; F130-H134 PolarHBondContact O-N 3.14Å; F130-H134 PolarHBondContact O-ND1 3.41Å; A131-H134 CarbonylContact O-C 3.47Å; A131-H134 PolarHBondContact O-N 3.01Å; A131-H134 VanDerWaalsContact O-N 3.14Å; F132-H134 PolarHBondContact O-N 3.49Å
135	G	95.2	Very high	95.2	Very high	70 Å²	70	60.8 Å²	60.8	72%	0.722	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	10.2	168	0	0	0	0	0	115.9	A131 F132	A131-G135 PolarHBondContact O-N 3.31Å; F132-G135 PolarHBondContact O-N 3.18Å
136	M	95.9	Very high	94.8	Very high	39 Å²	39	55.1 Å²	55.1	19%	0.192	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-69.5	141.3	168.1	-65.7	-169.8	69.6	0	0	110.8	L103 L108 A109 A131 F132	L103-M136 HydrophobicContact CD2-CB 4.42Å; L103-M136 HydrophobicContact CD2-CE 4.43Å; L108-M136 HydrophobicContact CB-CE 3.97Å; A109-M136 HydrophobicContact CB-CE 4.08Å; A109-M136 HydrophobicContact CB-SD 3.72Å; A131-M136 HydrophobicContact CB-CB 4.15Å; A131-M136 HydrophobicContact CB-CG 4.22Å; A131-M136 HydrophobicContact CB-SD 3.68Å; A131-M136 WeakPolarHBondContact O-CB 3.34Å; A131-M136 PolarHBondContact O-N 3.22Å; A131-M136 VanDerWaalsContact O-N 3.09Å; F132-M136 WeakPolarHBondContact CD1-O 3.4Å
137	E	94.3	Very high	94.4	Very high	150 Å²	150	58.1 Å²	58.1	70%	0.701	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-73.8	135.4	177.9	-174.9	-179.1	179.9	0	0	111.3	V139	E137-V139 HydrophobicContact CG-CG1 4.42Å
138	R	96.4	Very high	93.7	Very high	151 Å²	151	62.4 Å²	62.4	57%	0.57	35%	0.349	S	S	*	.	B	Isolated β-bridge	trans	-80.9	119.7	169.2	-174.9	174.6	-173.5	149	6.8	110	H102 F132	H102-R138 HydrophobicContact CB-CG 4.07Å; F132-R138 HydrophobicContact CD1-CB 4.09Å; F132-R138 VanDerWaalsContact CE1-CA 3.48Å; F132-R138 HydrophobicContact CE1-CB 3.55Å; F132-R138 HydrophobicContact CE1-CG 3.96Å; F132-R138 HydrophobicContact CE2-CB 4.37Å; F132-R138 HydrophobicContact CE2-CG 4.16Å; F132-R138 HydrophobicContact CZ-CB 3.72Å; F132-R138 HydrophobicContact CZ-CG 3.59Å
139	V	95.9	Very high	93.1	Very high	14 Å²	14	62.1 Å²	62.1	9%	0.085	35%	0.348	C	S	.	.			trans	-108.8	156.3	178.3	-65	0	0	0	0	112.1	H102 R104 E137 I143 F144	H102-V139 WeakPolarHBondContact O-CG2 3.48Å; H102-V139 PolarHBondContact O-N 3.1Å; H102-V139 VanDerWaalsContact O-N 3.1Å; R104-V139 HydrophobicContact CB-CG1 4.09Å; R104-V139 HydrophobicContact CB-CG2 4.15Å; E137-V139 HydrophobicContact CG-CG1 4.42Å; V139-I143 HydrophobicContact CB-CD1 3.8Å; V139-I143 HydrophobicContact CB-CG1 4.43Å; V139-I143 HydrophobicContact CG1-CD1 4.15Å; V139-I143 HydrophobicContact CG2-CD1 3.58Å; V139-I143 HydrophobicContact CG2-CG1 4.21Å; V139-F144 HydrophobicContact CG2-CE2 4.38Å; V139-F144 HydrophobicContact CG2-CZ 3.93Å
140	S	94.8	Very high	92.7	Very high	48 Å²	48	63 Å²	63	34%	0.336	35%	0.346	S	S	.	.			trans	-67.9	138.1	170.1	179.5	0	0	0	0	110	E142 I143	S140-E142 PolarHBondContact O-N 2.86Å; S140-E142 WeakPolarHBondContact OG-CB 3.26Å; S140-E142 WeakPolarHBondContact OG-CG 3.32Å; S140-E142 PolarHBondContact OG-N 3.11Å; S140-E142 PolarHBondContact OG-OE2 2.98Å; S140-I143 WeakPolarHBondContact O-CG1 3.4Å; S140-I143 WeakPolarHBondContact O-CG2 3.41Å; S140-I143 PolarHBondContact O-N 2.94Å
141	P	91.9	Very high	92.1	Very high	35 Å²	35	67.7 Å²	67.7	23%	0.227	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-56.9	-22.7	173.7	-24	33.6	0	0	0	113.6	H80 I143 F144	H80-P141 PolarHBondContact CD2-O 3.1Å; H80-P141 VanDerWaalsContact CD2-O 3.25Å; P141-I143 PolarHBondContact O-N 3.11Å; P141-I143 VanDerWaalsContact O-N 3.13Å; P141-F144 VanDerWaalsContact O-CD2 3.27Å; P141-F144 WeakPolarHBondContact O-CD2 3.46Å; P141-F144 PolarHBondContact O-N 2.84Å; P141-F144 VanDerWaalsContact O-N 3.11Å
142	E	92.1	Very high	91.3	Very high	148 Å²	148	69.7 Å²	69.7	69%	0.692	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-59.4	-22.7	178.6	-63.4	155.8	163.3	0	0	113	S140 F144 S145	S140-E142 PolarHBondContact O-N 2.86Å; S140-E142 WeakPolarHBondContact OG-CB 3.26Å; S140-E142 WeakPolarHBondContact OG-CG 3.32Å; S140-E142 PolarHBondContact OG-N 3.11Å; S140-E142 PolarHBondContact OG-OE2 2.98Å; E142-F144 PolarHBondContact O-N 2.87Å; E142-S145 WeakPolarHBondContact O-CB 3.14Å; E142-S145 PolarHBondContact O-N 2.81Å; E142-S145 VanDerWaalsContact O-N 3.12Å
143	I	93.1	Very high	90.7	Very high	55 Å²	55	67.5 Å²	67.5	28%	0.282	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-66	-22.2	178.3	75.5	162	0	0	0	112.6	R104 V139 S140 P141	R104-I143 HydrophobicContact CB-CD1 4.23Å; R104-I143 HydrophobicContact CG-CD1 3.92Å; V139-I143 HydrophobicContact CB-CD1 3.8Å; V139-I143 HydrophobicContact CB-CG1 4.43Å; V139-I143 HydrophobicContact CG1-CD1 4.15Å; V139-I143 HydrophobicContact CG2-CD1 3.58Å; V139-I143 HydrophobicContact CG2-CG1 4.21Å; S140-I143 WeakPolarHBondContact O-CG1 3.4Å; S140-I143 WeakPolarHBondContact O-CG2 3.41Å; S140-I143 PolarHBondContact O-N 2.94Å; P141-I143 PolarHBondContact O-N 3.11Å; P141-I143 VanDerWaalsContact O-N 3.13Å
144	F	93.2	Very high	90.2	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-90.6	-8.8	179	-47	-57.7	0	0	0	112.2	G69 I70 A72 H80 L82 S101 L103 V139 P141 E142 T146	G69-F144 VanDerWaalsContact C-CD1 3.4Å; G69-F144 WeakPolarHBondContact O-CD1 3.49Å; I70-F144 CarbonylContact O-C 3.13Å; I70-F144 VanDerWaalsContact O-O 3.05Å; A72-F144 HydrophobicContact CB-CB 4.29Å; H80-F144 HydrophobicContact CB-CB 4.43Å; H80-F144 HydrophobicContact CB-CD2 4.26Å; L82-F144 HydrophobicContact CD1-CD1 4.14Å; L82-F144 HydrophobicContact CD1-CD2 4.23Å; L82-F144 HydrophobicContact CD1-CE1 3.76Å; L82-F144 HydrophobicContact CD1-CE2 3.91Å; L82-F144 HydrophobicContact CD1-CG 4.35Å; L82-F144 HydrophobicContact CD1-CZ 3.65Å; S101-F144 WeakPolarHBondContact O-CE2 3.27Å; L103-F144 VanDerWaalsContact O-CZ 3.28Å; L103-F144 WeakPolarHBondContact O-CZ 3.17Å; V139-F144 HydrophobicContact CG2-CE2 4.38Å; V139-F144 HydrophobicContact CG2-CZ 3.93Å; P141-F144 VanDerWaalsContact O-CD2 3.27Å; P141-F144 WeakPolarHBondContact O-CD2 3.46Å; P141-F144 PolarHBondContact O-N 2.84Å; P141-F144 VanDerWaalsContact O-N 3.11Å; E142-F144 PolarHBondContact O-N 2.87Å; F144-T146 PolarHBondContact O-N 2.73Å
145	S	89.6	Confident	89.3	Confident	51 Å²	51	65.2 Å²	65.2	36%	0.357	35%	0.353	S	S	.	.			trans	-83	111.9	-178.3	-63.7	0	0	0	0	110.5	F74 H80 E142	F74-S145 WeakPolarHBondContact CE1-OG 3.38Å; F74-S145 WeakPolarHBondContact CZ-OG 3.13Å; H80-S145 PolarHBondContact NE2-OG 3.03Å; E142-S145 WeakPolarHBondContact O-CB 3.14Å; E142-S145 PolarHBondContact O-N 2.81Å; E142-S145 VanDerWaalsContact O-N 3.12Å
146	T	86.8	Confident	88.3	Confident	23 Å²	23	63.1 Å²	63.1	14%	0.141	33%	0.328	C	S	.	.			trans	-109	148.8	169.8	71.6	0	0	0	0	111.4	P64 I70 F144 L148 R149 Y150	P64-T146 HydrophobicContact CB-CG2 4.41Å; I70-T146 WeakPolarHBondContact O-CG2 3.33Å; F144-T146 PolarHBondContact O-N 2.73Å; T146-L148 PolarHBondContact O-N 2.86Å; T146-R149 PolarHBondContact O-N 3.36Å; T146-R149 VanDerWaalsContact O-N 3.07Å; T146-R149 WeakPolarHBondContact OG1-CB 3.37Å; T146-R149 WeakPolarHBondContact OG1-CG 3.49Å; T146-R149 PolarHBondContact OG1-N 3.13Å; T146-Y150 PolarHBondContact O-N 2.86Å
147	P	86.5	Confident	87.6	Confident	106 Å²	106	65.6 Å²	65.6	69%	0.688	34%	0.335	S	S	*	.	H	α-helix	trans	-53.8	-41.1	178	-27.2	34.6	0	0	0	112.9	R149 Y150 E151	P147-R149 PolarHBondContact O-N 3.32Å; P147-Y150 PolarHBondContact O-N 3.3Å; P147-E151 PolarHBondContact O-N 3.12Å
148	L	82.3	Confident	86.6	Confident	90 Å²	90	66.8 Å²	66.8	47%	0.471	34%	0.341	S	S	.	.	H	α-helix	trans	-61.9	-40.9	178.6	-177.6	68.9	0	0	0	112.6	T146 Q152	T146-L148 PolarHBondContact O-N 2.86Å; L148-Q152 WeakPolarHBondContact O-CG 3.38Å; L148-Q152 PolarHBondContact O-N 3.47Å
149	R	84.6	Confident	84.9	Confident	6 Å²	6	63.9 Å²	63.9	2%	0.023	33%	0.334	C	S	.	.	H	α-helix	trans	-73.1	-32	179.2	-66.5	-61.5	-173	-163.9	-0.7	112	G71 A72 F74 T146 P147 Q152 L153	G71-R149 PolarHBondContact O-NE 3.31Å; G71-R149 PolarHBondContact O-NH2 2.82Å; A72-R149 WeakPolarHBondContact O-CG 3.36Å; F74-R149 HydrophobicContact CD2-CB 4.12Å; F74-R149 HydrophobicContact CE2-CB 3.9Å; T146-R149 PolarHBondContact O-N 3.36Å; T146-R149 VanDerWaalsContact O-N 3.07Å; T146-R149 WeakPolarHBondContact OG1-CB 3.37Å; T146-R149 WeakPolarHBondContact OG1-CG 3.49Å; T146-R149 PolarHBondContact OG1-N 3.13Å; P147-R149 PolarHBondContact O-N 3.32Å; R149-Q152 PolarHBondContact O-N 2.83Å; R149-L153 PolarHBondContact O-N 3.31Å; R149-L153 VanDerWaalsContact O-N 3.14Å
150	Y	88	Confident	82.9	Confident	98 Å²	98	66.4 Å²	66.4	38%	0.384	36%	0.363	S	S	.	.	H	α-helix	trans	-68.5	-42.9	175.3	-168.6	-107.9	0	0	0	111.3	F74 T146 P147 Q152 L153 L154	F74-Y150 HydrophobicContact CE1-CD2 4.45Å; F74-Y150 HydrophobicContact CE2-CD2 4.1Å; F74-Y150 HydrophobicContact CZ-CD2 4.02Å; T146-Y150 PolarHBondContact O-N 2.86Å; P147-Y150 PolarHBondContact O-N 3.3Å; Y150-Q152 VanDerWaalsContact C-N 3.3Å; Y150-Q152 PolarHBondContact O-N 3.42Å; Y150-L153 WeakPolarHBondContact O-CB 3.43Å; Y150-L153 PolarHBondContact O-N 2.64Å; Y150-L153 VanDerWaalsContact O-N 3.15Å; Y150-L154 HydrophobicContact CD1-CD1 4.01Å; Y150-L154 HydrophobicContact CD1-CG 4.43Å; Y150-L154 HydrophobicContact CE1-CD1 3.8Å; Y150-L154 HydrophobicContact CE1-CD2 4.41Å; Y150-L154 HydrophobicContact CE1-CG 4.21Å; Y150-L154 WeakPolarHBondContact O-CG 3.08Å; Y150-L154 PolarHBondContact O-N 2.8Å; Y150-L154 VanDerWaalsContact O-N 3.08Å
151	E	84.9	Confident	80.7	Confident	127 Å²	127	66 Å²	66	59%	0.593	36%	0.362	S	S	*	.	H	α-helix	trans	-58.5	-40.2	172.4	-75.2	178.5	176.7	0	0	112.4	P147 L153 L154 A155	P147-E151 PolarHBondContact O-N 3.12Å; E151-L153 VanDerWaalsContact C-N 3.35Å; E151-L153 PolarHBondContact O-N 2.9Å; E151-L154 PolarHBondContact O-N 3.15Å; E151-A155 PolarHBondContact O-N 3.38Å
152	Q	81.6	Confident	78.4	Confident	42 Å²	42	68.9 Å²	68.9	20%	0.196	38%	0.379	C	S	.	.	H	α-helix	trans	-62	-39.4	175.1	-73.9	170.4	0.8	0	0	112.8	L148 R149 Y150 A156 T201	L148-Q152 WeakPolarHBondContact O-CG 3.38Å; L148-Q152 PolarHBondContact O-N 3.47Å; R149-Q152 PolarHBondContact O-N 2.83Å; Y150-Q152 VanDerWaalsContact C-N 3.3Å; Y150-Q152 PolarHBondContact O-N 3.42Å; Q152-A156 WeakPolarHBondContact O-CB 3.36Å; Q152-A156 PolarHBondContact O-N 3.2Å; Q152-T201 HydrophobicContact CB-CG2 4.31Å
153	L	84.8	Confident	75.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-63.5	-45.7	175.3	173.9	69.2	0	0	0	111.4	F74 E78 R149 Y150 E151 A155 A156 R157 T201 N202	F74-L153 HydrophobicContact CB-CB 4.19Å; F74-L153 HydrophobicContact CB-CD1 4.18Å; F74-L153 HydrophobicContact CB-CD2 3.72Å; F74-L153 HydrophobicContact CB-CG 4.23Å; F74-L153 HydrophobicContact CD2-CB 4.43Å; F74-L153 HydrophobicContact CG-CD2 4.09Å; E78-L153 HydrophobicContact CG-CD2 3.97Å; R149-L153 PolarHBondContact O-N 3.31Å; R149-L153 VanDerWaalsContact O-N 3.14Å; Y150-L153 WeakPolarHBondContact O-CB 3.43Å; Y150-L153 PolarHBondContact O-N 2.64Å; Y150-L153 VanDerWaalsContact O-N 3.15Å; E151-L153 VanDerWaalsContact C-N 3.35Å; E151-L153 PolarHBondContact O-N 2.9Å; L153-A155 VanDerWaalsContact C-N 3.34Å; L153-A155 PolarHBondContact O-N 3.05Å; L153-A156 PolarHBondContact O-N 3.42Å; L153-R157 HydrophobicContact CD1-CG 4.4Å; L153-R157 WeakPolarHBondContact O-CG 3.46Å; L153-R157 PolarHBondContact O-N 2.85Å; L153-T201 HydrophobicContact CB-CG2 4.37Å; L153-N202 HydrophobicContact CD1-CB 4.06Å
154	L	86.4	Confident	73.1	Confident	74 Å²	74	69 Å²	69	39%	0.387	39%	0.387	S	S	.	.	H	α-helix	trans	-60.2	-46.5	179.3	-66.4	176.2	0	0	0	110.9	Y150 E151 A156 R157 E158	Y150-L154 HydrophobicContact CD1-CD1 4.01Å; Y150-L154 HydrophobicContact CD1-CG 4.43Å; Y150-L154 HydrophobicContact CE1-CD1 3.8Å; Y150-L154 HydrophobicContact CE1-CD2 4.41Å; Y150-L154 HydrophobicContact CE1-CG 4.21Å; Y150-L154 WeakPolarHBondContact O-CG 3.08Å; Y150-L154 PolarHBondContact O-N 2.8Å; Y150-L154 VanDerWaalsContact O-N 3.08Å; E151-L154 PolarHBondContact O-N 3.15Å; L154-A156 PolarHBondContact O-N 2.9Å; L154-R157 PolarHBondContact O-N 3.4Å; L154-E158 PolarHBondContact O-N 2.81Å; L154-E158 VanDerWaalsContact O-N 3.12Å
155	A	78	Confident	70.3	Confident	43 Å²	43	71.1 Å²	71.1	36%	0.355	40%	0.399	S	S	.	.	H	α-helix	trans	-59.9	-44.5	176.4	0	0	0	0	0	112.4	E151 L153 R157 E158 E159	E151-A155 PolarHBondContact O-N 3.38Å; L153-A155 VanDerWaalsContact C-N 3.34Å; L153-A155 PolarHBondContact O-N 3.05Å; A155-R157 VanDerWaalsContact C-N 3.3Å; A155-R157 PolarHBondContact O-N 3.19Å; A155-E158 PolarHBondContact O-N 2.79Å; A155-E159 PolarHBondContact O-N 3.22Å
156	A	74.1	Confident	67.7	Low	25 Å²	25	74.8 Å²	74.8	21%	0.207	41%	0.41	C	S	.	.	H	α-helix	trans	-65	-31	178.7	0	0	0	0	0	113.2	Q152 L153 L154 T201 N202	Q152-A156 WeakPolarHBondContact O-CB 3.36Å; Q152-A156 PolarHBondContact O-N 3.2Å; L153-A156 PolarHBondContact O-N 3.42Å; L154-A156 PolarHBondContact O-N 2.9Å; A156-T201 HydrophobicContact CB-CG2 4.16Å; A156-N202 HydrophobicContact CB-CB 4.04Å
157	R	80.2	Confident	64.9	Low	91 Å²	91	78.6 Å²	78.6	34%	0.343	44%	0.437	S	S	.	.	H	α-helix	trans	-74.3	-37.2	176.3	-76.7	176.8	167.5	-177.3	-2.8	112.7	R76 E78 L153 L154 A155 E159 G160	R76-R157 PolarHBondContact O-NH2 2.99Å; E78-R157 IonicContact OE1-CZ 3.95Å; E78-R157 VanDerWaalsContact OE1-CZ 3.27Å; E78-R157 IonicContact OE1-NH1 3.42Å; E78-R157 PolarHBondContact OE1-NH1 2.81Å; E78-R157 IonicContact OE1-NH2 3.73Å; E78-R157 PolarHBondContact OE1-NH2 3.18Å; L153-R157 HydrophobicContact CD1-CG 4.4Å; L153-R157 WeakPolarHBondContact O-CG 3.46Å; L153-R157 PolarHBondContact O-N 2.85Å; L154-R157 PolarHBondContact O-N 3.4Å; A155-R157 VanDerWaalsContact C-N 3.3Å; A155-R157 PolarHBondContact O-N 3.19Å; R157-E159 PolarHBondContact O-N 3.06Å; R157-G160 PolarHBondContact O-N 3.47Å
158	E	74.4	Confident	62.2	Low	176 Å²	176	78.2 Å²	78.2	82%	0.822	45%	0.452	S	S	*	.	H	α-helix	trans	-62.1	-30.2	177.4	-76.3	-175.5	166.2	0	0	112.6	L154 A155 G160	L154-E158 PolarHBondContact O-N 2.81Å; L154-E158 VanDerWaalsContact O-N 3.12Å; A155-E158 PolarHBondContact O-N 2.79Å; E158-G160 VanDerWaalsContact C-N 3.27Å; E158-G160 PolarHBondContact O-N 3.07Å
159	E	60.7	Low	59.6	Low	90 Å²	90	77.4 Å²	77.4	42%	0.421	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-1.6	179.3	-67.9	-178.7	155.9	0	0	114	A155 R157 A161 K174	A155-E159 PolarHBondContact O-N 3.22Å; R157-E159 PolarHBondContact O-N 3.06Å; E159-A161 PolarHBondContact O-N 3.42Å; E159-A161 VanDerWaalsContact O-N 3.13Å; E159-K174 VanDerWaalsContact OE1-CD 3.22Å; E159-K174 WeakPolarHBondContact OE1-CD 3.47Å; E159-K174 WeakPolarHBondContact OE1-CE 3.41Å; E159-K174 IonicContact OE1-NZ 3.24Å; E159-K174 PolarHBondContact OE1-NZ 3.2Å
160	G	53.9	Low	57.1	Low	67 Å²	67	83.2 Å²	83.2	69%	0.691	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	12.7	174.6	0	0	0	0	0	114.9	R157 E158	R157-G160 PolarHBondContact O-N 3.47Å; E158-G160 VanDerWaalsContact C-N 3.27Å; E158-G160 PolarHBondContact O-N 3.07Å
161	A	48.9	Very low	54.4	Low	38 Å²	38	83.1 Å²	83.1	31%	0.314	50%	0.503	S	S	.	.			trans	-101.3	110.8	-165.8	0	0	0	0	0	111.9	E159 V163	E159-A161 PolarHBondContact O-N 3.42Å; E159-A161 VanDerWaalsContact O-N 3.13Å; A161-V163 VanDerWaalsContact C-N 3.29Å; A161-V163 HydrophobicContact CB-CG2 3.33Å; A161-V163 PolarHBondContact O-N 2.81Å
162	T	42.8	Very low	52	Low	97 Å²	97	80.5 Å²	80.5	60%	0.595	49%	0.493	S	S	*	.			trans	-79.6	86.1	153.1	-9.9	0	0	0	0	105.5	L164	T162-L164 PolarHBondContact O-N 3.46Å; T162-L164 VanDerWaalsContact O-N 3.08Å
163	V	38.1	Very low	49.7	Very low	79 Å²	79	83 Å²	83	48%	0.479	51%	0.505	S	S	.	.			trans	-80	100.2	-171.9	-170.6	0	0	0	0	109.5	A161	A161-V163 VanDerWaalsContact C-N 3.29Å; A161-V163 HydrophobicContact CB-CG2 3.33Å; A161-V163 PolarHBondContact O-N 2.81Å
164	L	35.7	Very low	47.6	Very low	127 Å²	127	89.4 Å²	89.4	67%	0.665	53%	0.533	S	S	*	.			trans	-83.7	124.7	159.6	-76.8	162.8	0	0	0	108	T162 H166	T162-L164 PolarHBondContact O-N 3.46Å; T162-L164 VanDerWaalsContact O-N 3.08Å; L164-H166 VanDerWaalsContact C-N 3.27Å; L164-H166 PolarHBondContact O-N 3.46Å
165	D	34.8	Very low	45.6	Very low	44 Å²	44	88.8 Å²	88.8	24%	0.235	53%	0.528	C	S	.	.	S	Bend	trans	-74.4	65.8	-169.6	-164.6	17.4	0	0	0	112.8	T232	D165-T232 WeakPolarHBondContact OD2-CB 3.46Å; D165-T232 WeakPolarHBondContact OD2-CG2 3.44Å
166	H	33.7	Very low	44.1	Very low	127 Å²	127	90.2 Å²	90.2	59%	0.588	53%	0.526	S	S	*	.			trans	-137.7	3.9	-174.7	-68.4	-30.7	0	0	0	116.1	L164	L164-H166 VanDerWaalsContact C-N 3.27Å; L164-H166 PolarHBondContact O-N 3.46Å
167	S	28.6	Very low	43.1	Very low	103 Å²	103	90.7 Å²	90.7	72%	0.72	52%	0.524	S	S	*	.	S	Bend	trans	-104.5	112	176.1	58.8	0	0	0	0	111.1	A169	S167-A169 PolarHBondContact O-N 2.91Å
168	G	30.5	Very low	42.3	Very low	98 Å²	98	86.7 Å²	86.7	100%	1.01	51%	0.511	S	S	*	.			trans	-62.8	65.1	-177.7	0	0	0	0	0	116.1
169	A	27.6	Very low	42.9	Very low	74 Å²	74	78.6 Å²	78.6	61%	0.612	47%	0.474	S	S	*	.			trans	-112.6	148.9	167.8	0	0	0	0	0	109.4	S167 L171	S167-A169 PolarHBondContact O-N 2.91Å; A169-L171 PolarHBondContact O-N 2.77Å
170	P	31.6	Very low	44.5	Very low	127 Å²	127	74.3 Å²	74.3	83%	0.825	45%	0.454	S	S	*	.			trans	-66.7	129.6	-179.1	28.4	-32.2	0	0	0	110.6
171	L	31.8	Very low	46.6	Very low	96 Å²	96	71.1 Å²	71.1	50%	0.503	42%	0.421	S	S	.	.			trans	10.9	105.9	161.7	-68.8	156.2	0	0	0	115.9	A14 A169	A14-L171 HydrophobicContact CB-CD2 4.35Å; A169-L171 PolarHBondContact O-N 2.77Å
172	D	34.7	Very low	48.9	Very low	73 Å²	73	69.3 Å²	69.3	39%	0.39	41%	0.406	S	S	.	.			trans	-79.3	119.1	163.9	-172.9	-7.5	0	0	0	109.7	K174 Q175	D172-K174 PolarHBondContact O-N 3.09Å; D172-K174 PolarHBondContact OD1-N 3.29Å; D172-Q175 HydrophobicContact CB-CG 4.46Å; D172-Q175 PolarHBondContact O-N 2.87Å
173	E	32.3	Very low	51.6	Low	93 Å²	93	64.7 Å²	64.7	44%	0.435	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-7.1	-177.9	-67.2	-174.6	132.8	0	0	114.1	S16 Q19	S16-E173 WeakPolarHBondContact CB-OE1 3.49Å; S16-E173 PolarHBondContact OG-OE1 2.81Å; Q19-E173 PolarHBondContact NE2-OE2 2.93Å
174	K	39.8	Very low	54.4	Low	135 Å²	135	61 Å²	61	59%	0.587	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-5.2	-178.9	-63.6	-177.8	-177.8	-175.5	0	114.6	E159 D172 K176	E159-K174 VanDerWaalsContact OE1-CD 3.22Å; E159-K174 WeakPolarHBondContact OE1-CD 3.47Å; E159-K174 WeakPolarHBondContact OE1-CE 3.41Å; E159-K174 IonicContact OE1-NZ 3.24Å; E159-K174 PolarHBondContact OE1-NZ 3.2Å; D172-K174 PolarHBondContact O-N 3.09Å; D172-K174 PolarHBondContact OD1-N 3.29Å; K174-K176 PolarHBondContact O-N 2.92Å
175	Q	44.6	Very low	57.4	Low	61 Å²	61	55.1 Å²	55.1	29%	0.285	33%	0.325	S	S	.	.			trans	-98.8	88.3	-173.4	-63.6	179.8	7.8	0	0	112.4	D172 M177	D172-Q175 HydrophobicContact CB-CG 4.46Å; D172-Q175 PolarHBondContact O-N 2.87Å; Q175-M177 PolarHBondContact O-N 2.88Å; Q175-M177 VanDerWaalsContact O-N 3.1Å
176	K	48.2	Very low	60.4	Low	73 Å²	73	53.4 Å²	53.4	32%	0.317	32%	0.316	S	S	.	.			trans	-78.2	88.6	166.2	-85.5	-166.9	178.3	-172.3	0	110.2	Y28 K174	Y28-K176 PolarHBondContact OH-NZ 3.49Å; K174-K176 PolarHBondContact O-N 2.92Å
177	M	51.9	Low	63.2	Low	35 Å²	35	51.9 Å²	51.9	17%	0.172	31%	0.311	C	S	.	.			trans	-81.2	135.7	156.4	-57.7	-166.7	-142.7	0	0	108.1	Q175 M200 T232	Q175-M177 PolarHBondContact O-N 2.88Å; Q175-M177 VanDerWaalsContact O-N 3.1Å; M177-M200 HydrophobicContact SD-SD 4.26Å; M177-T232 HydrophobicContact CE-CG2 4.39Å; M177-T232 HydrophobicContact SD-CG2 4.44Å
178	G	64.4	Low	66.3	Low	7 Å²	7	53.5 Å²	53.5	7%	0.072	31%	0.312	C	S	.	.			trans	-161.2	114.2	179.4	0	0	0	0	0	111.1	N67 T197	N67-G178 WeakPolarHBondContact CB-O 3.3Å; N67-G178 PolarHBondContact ND2-O 3.49Å; G178-T197 PolarHBondContact O-OG1 3.09Å
179	T	85.5	Confident	69.3	Low	7 Å²	7	50.5 Å²	50.5	4%	0.043	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138.7	165.2	-61.3	0	0	0	0	106.2	H9 G10 G11 T195 S196 S211 T230	H9-T179 PolarHBondContact CE1-O 3.25Å; H9-T179 PolarHBondContact ND1-O 3.38Å; G10-T179 CarbonylContact C-O 3.59Å; G11-T179 WeakPolarHBondContact CA-O 3.34Å; G11-T179 PolarHBondContact N-O 3.09Å; T179-T195 HydrophobicContact CG2-CG2 4.35Å; T179-S196 WeakPolarHBondContact CG2-O 3.44Å; T179-S211 WeakPolarHBondContact CG2-OG 3.42Å; T179-S211 PolarHBondContact OG1-OG 3.12Å; T179-T230 PolarHBondContact N-OG1 3.24Å
180	V	94.8	Very high	72.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	151.2	169.9	-52.7	0	0	0	0	108.9	H9 V57 L60 F66 A68 T195 S196	H9-V180 VanDerWaalsContact O-CA 3.28Å; H9-V180 WeakPolarHBondContact O-CA 3.49Å; V57-V180 HydrophobicContact CG1-CG2 4.26Å; L60-V180 HydrophobicContact CB-CB 3.92Å; L60-V180 HydrophobicContact CB-CG1 4.22Å; L60-V180 HydrophobicContact CB-CG2 3.82Å; L60-V180 HydrophobicContact CD1-CB 3.9Å; L60-V180 HydrophobicContact CD1-CG2 4.31Å; L60-V180 HydrophobicContact CG-CB 4.34Å; F66-V180 HydrophobicContact CB-CG1 3.55Å; F66-V180 HydrophobicContact CG-CG1 4.25Å; A68-V180 HydrophobicContact CB-CB 4.31Å; A68-V180 HydrophobicContact CB-CG1 3.85Å; A68-V180 HydrophobicContact CB-CG2 3.47Å; A68-V180 VanDerWaalsContact CB-CG2 3.47Å; V180-T195 CarbonylContact O-C 3.48Å; V180-T195 WeakPolarHBondContact O-CA 3.44Å; V180-S196 WeakPolarHBondContact CG2-O 3.18Å; V180-S196 PolarHBondContact N-O 3.23Å; V180-S196 PolarHBondContact O-N 2.86Å
181	G	97.3	Very high	75.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	165.1	178	0	0	0	0	0	113.9	I8 H9 A194 S228	I8-G181 CarbonylContact C-O 3.56Å; I8-G181 WeakPolarHBondContact CA-O 3.44Å; H9-G181 PolarHBondContact CE1-N 3.43Å; H9-G181 PolarHBondContact N-O 3.16Å; H9-G181 PolarHBondContact O-N 3.37Å; G181-A194 CarbonylContact C-O 3.58Å; G181-A194 WeakPolarHBondContact CA-O 3.38Å; G181-S228 WeakPolarHBondContact CA-OG 3.1Å
182	A	98.5	Very high	79	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	146.1	-177	0	0	0	0	0	110.7	A7 I8 V53 A56 V57 A193 A194	A7-A182 CarbonylContact O-C 3.54Å; A7-A182 VanDerWaalsContact O-CA 3.3Å; A7-A182 WeakPolarHBondContact O-CA 3.28Å; I8-A182 HydrophobicContact CG2-CB 3.9Å; V53-A182 HydrophobicContact CB-CB 3.97Å; V53-A182 HydrophobicContact CG1-CB 4.09Å; A56-A182 HydrophobicContact CB-CB 3.84Å; V57-A182 HydrophobicContact CG2-CB 3.87Å; A182-A193 CarbonylContact O-C 3.41Å; A182-A193 WeakPolarHBondContact O-CA 3.46Å; A182-A194 PolarHBondContact N-O 2.93Å; A182-A194 PolarHBondContact O-N 3.47Å
183	V	98.6	Very high	82	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	144.1	170.1	-65.3	0	0	0	0	108.6	I6 A7 A192 A193 A226 I278 I280	I6-V183 WeakPolarHBondContact CA-O 3.27Å; A7-V183 HydrophobicContact CB-CG2 3.84Å; A7-V183 PolarHBondContact N-O 3.03Å; A7-V183 PolarHBondContact O-N 3.21Å; V183-A192 VanDerWaalsContact CA-O 3.31Å; V183-A192 WeakPolarHBondContact CA-O 3.46Å; V183-A193 HydrophobicContact CG1-CB 3.94Å; V183-A226 HydrophobicContact CB-CB 4Å; V183-A226 HydrophobicContact CG1-CB 4.04Å; V183-I278 HydrophobicContact CG1-CD1 4.37Å; V183-I278 HydrophobicContact CG1-CG1 4.06Å; V183-I278 HydrophobicContact CG2-CB 4.21Å; V183-I278 HydrophobicContact CG2-CD1 3.86Å; V183-I278 HydrophobicContact CG2-CG1 3.7Å; V183-I280 HydrophobicContact CB-CD1 4.35Å; V183-I280 HydrophobicContact CB-CG1 4.45Å; V183-I280 HydrophobicContact CG2-CB 4.35Å; V183-I280 HydrophobicContact CG2-CD1 3.67Å; V183-I280 HydrophobicContact CG2-CG1 3.64Å; V183-I280 WeakPolarHBondContact O-CD1 3.49Å
184	A	98.5	Very high	85.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	154.1	-180	0	0	0	0	0	112.6	V5 I6 A49 V52 V53 L191 A192	V5-A184 CarbonylContact O-C 3.59Å; V5-A184 VanDerWaalsContact O-CA 3.23Å; V5-A184 WeakPolarHBondContact O-CA 3.5Å; I6-A184 HydrophobicContact CB-CB 4.43Å; I6-A184 HydrophobicContact CG1-CB 4.42Å; A49-A184 HydrophobicContact CB-CB 4.12Å; V52-A184 HydrophobicContact CB-CB 4.39Å; V52-A184 HydrophobicContact CG1-CB 3.97Å; V53-A184 HydrophobicContact CG1-CB 3.64Å; A184-L191 WeakPolarHBondContact O-CA 3.49Å; A184-A192 PolarHBondContact N-O 3.04Å; A184-A192 PolarHBondContact O-N 3.24Å
185	L	98.1	Very high	87.9	Confident	5 Å²	5	23.5 Å²	23.5	3%	0.026	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.4	166.6	178	67	0	0	0	108	A4 V5 N190 L191 I280 G284	A4-L185 CarbonylContact C-O 3.57Å; A4-L185 VanDerWaalsContact CA-O 3.23Å; A4-L185 WeakPolarHBondContact CA-O 3.36Å; V5-L185 HydrophobicContact CG1-CB 3.8Å; V5-L185 HydrophobicContact CG1-CD2 4.45Å; V5-L185 PolarHBondContact N-O 3.29Å; V5-L185 PolarHBondContact O-N 2.87Å; L185-N190 WeakPolarHBondContact CA-O 3.46Å; L185-L191 HydrophobicContact CB-CD2 3.9Å; L185-L191 HydrophobicContact CD1-CD2 3.77Å; L185-L191 HydrophobicContact CD1-CG 3.98Å; L185-L191 HydrophobicContact CG-CD2 4.38Å; L185-I280 HydrophobicContact CB-CG2 3.94Å; L185-G284 VanDerWaalsContact CD2-CA 3.49Å
186	D	96.9	Very high	90.4	Very high	8 Å²	8	20.6 Å²	20.6	4%	0.043	12%	0.116	C	C	.	.			trans	-90	177.7	179.8	66.6	27.9	0	0	0	114.2	L43 A49 D188 G189 N190	L43-D186 HydrophobicContact CD2-CB 4.06Å; A49-D186 HydrophobicContact CB-CB 3.93Å; A49-D186 PolarHBondContact N-OD2 3.41Å; D186-D188 PolarHBondContact O-N 3.34Å; D186-D188 WeakPolarHBondContact OD1-CA 3.42Å; D186-D188 WeakPolarHBondContact OD1-CB 3.37Å; D186-D188 PolarHBondContact OD1-N 3.08Å; D186-G189 PolarHBondContact O-N 3.42Å; D186-G189 VanDerWaalsContact O-N 3.13Å; D186-G189 PolarHBondContact OD1-N 3.27Å; D186-N190 PolarHBondContact N-O 3.2Å; D186-N190 PolarHBondContact OD1-N 2.91Å; D186-N190 PolarHBondContact OD1-ND2 3.27Å; D186-N190 WeakPolarHBondContact OD2-CB 3.42Å; D186-N190 PolarHBondContact OD2-ND2 2.9Å
187	L	93.7	Very high	92.6	Very high	94 Å²	94	17.4 Å²	17.4	49%	0.492	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.8	-180	-69.4	174.8	0	0	0	113.4	A4 L43 G189	A4-L187 HydrophobicContact CB-CD2 3.77Å; A4-L187 HydrophobicContact CB-CG 4.13Å; L43-L187 VanDerWaalsContact O-CD1 3.3Å; L43-L187 WeakPolarHBondContact O-CD1 3.15Å; L187-G189 VanDerWaalsContact C-N 3.32Å
188	D	93	Very high	94.4	Very high	137 Å²	137	15.7 Å²	15.7	73%	0.733	9%	0.094	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.1	176.8	-69.7	-36.5	0	0	0	112.3	D186 N190	D186-D188 PolarHBondContact O-N 3.34Å; D186-D188 WeakPolarHBondContact OD1-CA 3.42Å; D186-D188 WeakPolarHBondContact OD1-CB 3.37Å; D186-D188 PolarHBondContact OD1-N 3.08Å; D188-N190 WeakPolarHBondContact CB-ND2 3.45Å
189	G	93.1	Very high	95.5	Very high	36 Å²	36	15.6 Å²	15.6	37%	0.371	9%	0.093	S	C	.	.	S	Bend	trans	83.7	19.5	178.6	0	0	0	0	0	114	D186 L187	D186-G189 PolarHBondContact O-N 3.42Å; D186-G189 VanDerWaalsContact O-N 3.13Å; D186-G189 PolarHBondContact OD1-N 3.27Å; L187-G189 VanDerWaalsContact C-N 3.32Å
190	N	97.5	Very high	95.4	Very high	30 Å²	30	17.1 Å²	17.1	16%	0.16	10%	0.1	C	C	.	.			trans	-91	140.8	176.5	-51.4	-67.5	0	0	0	111.6	A49 N90 L185 D186 D188 N222	A49-N190 WeakPolarHBondContact CB-O 3.32Å; N90-N190 HydrophobicContact CB-CB 4.29Å; N90-N190 WeakPolarHBondContact CB-OD1 3.29Å; N90-N190 VanDerWaalsContact CG-OD1 3.29Å; N90-N190 PolarHBondContact ND2-OD1 3.32Å; L185-N190 WeakPolarHBondContact CA-O 3.46Å; D186-N190 PolarHBondContact N-O 3.2Å; D186-N190 PolarHBondContact OD1-N 2.91Å; D186-N190 PolarHBondContact OD1-ND2 3.27Å; D186-N190 WeakPolarHBondContact OD2-CB 3.42Å; D186-N190 PolarHBondContact OD2-ND2 2.9Å; D188-N190 WeakPolarHBondContact CB-ND2 3.45Å; N190-N222 WeakPolarHBondContact CA-OD1 3.45Å; N190-N222 PolarHBondContact OD1-ND2 2.89Å
191	L	98.1	Very high	94.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	144.4	177.4	-74.7	172.1	0	0	0	110.5	G89 A184 L185 N221 N222 A226 I280 H282	G89-L191 WeakPolarHBondContact CA-O 3.31Å; G89-L191 PolarHBondContact N-O 3.47Å; A184-L191 WeakPolarHBondContact O-CA 3.49Å; L185-L191 HydrophobicContact CB-CD2 3.9Å; L185-L191 HydrophobicContact CD1-CD2 3.77Å; L185-L191 HydrophobicContact CD1-CG 3.98Å; L185-L191 HydrophobicContact CG-CD2 4.38Å; L191-N221 WeakPolarHBondContact CD1-O 3.11Å; L191-N222 PolarHBondContact N-OD1 3.42Å; L191-A226 HydrophobicContact CB-CB 4.08Å; L191-A226 HydrophobicContact CD2-CB 4.11Å; L191-I280 HydrophobicContact CD2-CB 4.35Å; L191-I280 HydrophobicContact CD2-CG2 3.92Å; L191-H282 HydrophobicContact CD1-CB 4.43Å
192	A	98.6	Very high	94.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	156	170.4	0	0	0	0	0	111.5	A49 L50 V53 M87 V183 A184 A226	A49-A192 HydrophobicContact CB-CB 3.85Å; L50-A192 HydrophobicContact CB-CB 4.12Å; L50-A192 HydrophobicContact CD1-CB 4.28Å; V53-A192 HydrophobicContact CG1-CB 4.31Å; V53-A192 HydrophobicContact CG2-CB 3.79Å; M87-A192 WeakPolarHBondContact O-CA 3.39Å; V183-A192 VanDerWaalsContact CA-O 3.31Å; V183-A192 WeakPolarHBondContact CA-O 3.46Å; A184-A192 PolarHBondContact N-O 3.04Å; A184-A192 PolarHBondContact O-N 3.24Å; A192-A226 WeakPolarHBondContact O-CB 3.43Å
193	A	98.6	Very high	93.8	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.2	176.7	0	0	0	0	0	111.1	V86 M87 A182 V183 Y219 A220 A226	V86-A193 CarbonylContact C-O 3.38Å; V86-A193 WeakPolarHBondContact CA-O 3.48Å; M87-A193 PolarHBondContact N-O 3.45Å; M87-A193 PolarHBondContact O-N 3.16Å; A182-A193 CarbonylContact O-C 3.41Å; A182-A193 WeakPolarHBondContact O-CA 3.46Å; V183-A193 HydrophobicContact CG1-CB 3.94Å; A193-Y219 WeakPolarHBondContact CB-O 3.49Å; A193-A220 HydrophobicContact CB-CB 4.07Å; A193-A226 HydrophobicContact CB-CB 4.33Å
194	A	98.5	Very high	93.2	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	144.8	173.5	0	0	0	0	0	111.6	V53 V57 C85 V86 V107 G181 A182	V53-A194 HydrophobicContact CB-CB 3.97Å; V53-A194 HydrophobicContact CG2-CB 3.9Å; V57-A194 HydrophobicContact CB-CB 4.39Å; V57-A194 HydrophobicContact CG2-CB 3.66Å; C85-A194 CarbonylContact O-C 3.37Å; C85-A194 VanDerWaalsContact O-CA 3.22Å; C85-A194 WeakPolarHBondContact O-CA 3.24Å; V86-A194 HydrophobicContact CB-CB 4.49Å; V86-A194 HydrophobicContact CG1-CB 3.91Å; V107-A194 HydrophobicContact CG2-CB 4.31Å; G181-A194 CarbonylContact C-O 3.58Å; G181-A194 WeakPolarHBondContact CA-O 3.38Å; A182-A194 PolarHBondContact N-O 2.93Å; A182-A194 PolarHBondContact O-N 3.47Å
195	T	97.8	Very high	92.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.2	177.4	46.8	0	0	0	0	110.8	A84 C85 T179 V180 S211 G217 C218 S228	A84-T195 CarbonylContact C-O 3.56Å; A84-T195 WeakPolarHBondContact CA-O 3.17Å; A84-T195 WeakPolarHBondContact CB-O 3.46Å; C85-T195 PolarHBondContact N-O 3.25Å; C85-T195 PolarHBondContact O-N 3.41Å; T179-T195 HydrophobicContact CG2-CG2 4.35Å; V180-T195 CarbonylContact O-C 3.48Å; V180-T195 WeakPolarHBondContact O-CA 3.44Å; T195-S211 PolarHBondContact OG1-O 2.88Å; T195-G217 VanDerWaalsContact CG2-O 3.31Å; T195-G217 WeakPolarHBondContact CG2-O 3.41Å; T195-C218 HydrophobicContact CG2-CB 3.92Å; T195-S228 WeakPolarHBondContact CG2-OG 3.18Å
196	S	96.7	Very high	92.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	148.9	170.3	-176.4	0	0	0	0	110.9	E61 D83 T179 V180	E61-S196 VanDerWaalsContact OE1-CB 3.28Å; E61-S196 WeakPolarHBondContact OE1-CB 3.12Å; E61-S196 PolarHBondContact OE1-OG 2.93Å; D83-S196 CarbonylContact O-C 3.59Å; D83-S196 VanDerWaalsContact O-CA 3.27Å; D83-S196 WeakPolarHBondContact O-CA 3.41Å; D83-S196 PolarHBondContact O-OG 2.91Å; T179-S196 WeakPolarHBondContact CG2-O 3.44Å; V180-S196 WeakPolarHBondContact CG2-O 3.18Å; V180-S196 PolarHBondContact N-O 3.23Å; V180-S196 PolarHBondContact O-N 2.86Å
197	T	94.1	Very high	92	Very high	6 Å²	6	30.5 Å²	30.5	4%	0.037	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	149	177.9	-172.2	0	0	0	0	112.5	N67 L82 D83 G178 G199 S211	N67-T197 WeakPolarHBondContact O-CA 3.25Å; L82-T197 WeakPolarHBondContact CA-O 3.48Å; D83-T197 HydrophobicContact CB-CG2 3.91Å; D83-T197 PolarHBondContact N-O 3.24Å; D83-T197 PolarHBondContact O-N 3.27Å; G178-T197 PolarHBondContact O-OG1 3.09Å; T197-G199 VanDerWaalsContact C-N 3.31Å; T197-G199 PolarHBondContact OG1-N 2.91Å; T197-S211 WeakPolarHBondContact CG2-OG 3.41Å
198	G	89.5	Confident	91.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.176	C	C	.	.			trans	-84.5	-1.2	164	0	0	0	0	0	114.3	N67 V73	N67-G198 PolarHBondContact O-N 3.1Å; V73-G198 WeakPolarHBondContact CG2-O 3.46Å
199	G	87.2	Confident	91.6	Very high	4 Å²	4	22 Å²	22	4%	0.041	14%	0.142	C	C	.	.			trans	84.1	-149.5	-177.8	0	0	0	0	0	113.6	N67 V73 T197	N67-G199 PolarHBondContact ND2-O 3.36Å; V73-G199 WeakPolarHBondContact CG2-O 3.47Å; T197-G199 VanDerWaalsContact C-N 3.31Å; T197-G199 PolarHBondContact OG1-N 2.91Å
200	M	84.8	Confident	91.6	Very high	39 Å²	39	20.5 Å²	20.5	19%	0.192	13%	0.125	C	C	.	.			trans	-111.3	139.3	-179.3	-59.5	-178.4	-59.5	0	0	110.6	V73 M177 N202 K203	V73-M200 VanDerWaalsContact CG2-C 3.5Å; M177-M200 HydrophobicContact SD-SD 4.26Å; M200-N202 PolarHBondContact O-N 2.98Å; M200-K203 HydrophobicContact CB-CB 4.23Å; M200-K203 HydrophobicContact CE-CB 4.47Å; M200-K203 WeakPolarHBondContact O-CB 3.48Å; M200-K203 VanDerWaalsContact O-CG 3.31Å; M200-K203 WeakPolarHBondContact O-CG 3.31Å; M200-K203 PolarHBondContact O-N 3.46Å; M200-K203 VanDerWaalsContact O-N 3.17Å
201	T	84.7	Confident	91.3	Very high	34 Å²	34	19.1 Å²	19.1	21%	0.209	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	134	173.8	-55.7	0	0	0	0	110.2	V73 Q152 L153 A156 K203	V73-T201 WeakPolarHBondContact CG1-OG1 3.37Å; Q152-T201 HydrophobicContact CB-CG2 4.31Å; L153-T201 HydrophobicContact CB-CG2 4.37Å; A156-T201 HydrophobicContact CB-CG2 4.16Å; T201-K203 PolarHBondContact O-N 3.43Å
202	N	86.3	Confident	91.2	Very high	20 Å²	20	19.2 Å²	19.2	11%	0.107	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	21.4	179.3	-160.4	36	0	0	0	114.3	F74 L153 A156 M200	F74-N202 PolarHBondContact O-N 3.13Å; L153-N202 HydrophobicContact CD1-CB 4.06Å; A156-N202 HydrophobicContact CB-CB 4.04Å; M200-N202 PolarHBondContact O-N 2.98Å
203	K	85.1	Confident	91.1	Very high	9 Å²	9	21.8 Å²	21.8	4%	0.039	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-62.5	152.7	173.2	70.4	171.8	175.4	158.7	0	111.8	T75 R76 E81 M200 T201 R207	T75-K203 HydrophobicContact CG2-CG 4.06Å; R76-K203 WeakPolarHBondContact CB-O 3.46Å; R76-K203 PolarHBondContact N-O 2.99Å; E81-K203 VanDerWaalsContact CB-NZ 3.3Å; E81-K203 VanDerWaalsContact OE2-CE 3.27Å; E81-K203 WeakPolarHBondContact OE2-CE 3.35Å; E81-K203 IonicContact OE2-NZ 3.28Å; E81-K203 PolarHBondContact OE2-NZ 3.3Å; M200-K203 HydrophobicContact CB-CB 4.23Å; M200-K203 HydrophobicContact CE-CB 4.47Å; M200-K203 WeakPolarHBondContact O-CB 3.48Å; M200-K203 VanDerWaalsContact O-CG 3.31Å; M200-K203 WeakPolarHBondContact O-CG 3.31Å; M200-K203 PolarHBondContact O-N 3.46Å; M200-K203 VanDerWaalsContact O-N 3.17Å; T201-K203 PolarHBondContact O-N 3.43Å; K203-R207 HydrophobicContact CD-CB 4.28Å; K203-R207 PolarHBondContact NZ-O 3.12Å
204	L	85.8	Confident	90.9	Very high	81 Å²	81	24.5 Å²	24.5	42%	0.424	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-61.2	133.2	164.9	-65.3	177	0	0	0	109.3	G206 R207	L204-G206 PolarHBondContact O-N 3.34Å; L204-R207 WeakPolarHBondContact O-CB 3.39Å; L204-R207 PolarHBondContact O-N 3.11Å; L204-R207 VanDerWaalsContact O-N 3.12Å
205	P	88.6	Confident	90.8	Very high	49 Å²	49	24.8 Å²	24.8	32%	0.318	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	138.1	169.9	-23.7	32.2	0	0	0	111.2	D77 E81	D77-P205 HydrophobicContact CB-CG 3.98Å; D77-P205 WeakPolarHBondContact OD2-CG 3.47Å; E81-P205 WeakPolarHBondContact OE1-CA 3.4Å; E81-P205 WeakPolarHBondContact OE1-CB 3.06Å
206	G	89.9	Confident	90.7	Very high	56 Å²	56	24.9 Å²	24.9	58%	0.577	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.1	-1.9	-176	0	0	0	0	0	114.7	E81 L204 V208	E81-G206 VanDerWaalsContact CD-N 3.29Å; E81-G206 PolarHBondContact OE1-N 3.39Å; E81-G206 PolarHBondContact OE2-N 3.41Å; E81-G206 VanDerWaalsContact OE2-N 3.1Å; L204-G206 PolarHBondContact O-N 3.34Å; G206-V208 PolarHBondContact O-N 3.46Å
207	R	90.3	Very high	90.5	Very high	45 Å²	45	24.9 Å²	24.9	17%	0.17	15%	0.152	C	C	.	.			trans	-73.7	115.7	171.8	-174	-77	-178.3	-175.2	2.7	109.2	K203 L204 E234	K203-R207 HydrophobicContact CD-CB 4.28Å; K203-R207 PolarHBondContact NZ-O 3.12Å; L204-R207 WeakPolarHBondContact O-CB 3.39Å; L204-R207 PolarHBondContact O-N 3.11Å; L204-R207 VanDerWaalsContact O-N 3.12Å; R207-E234 IonicContact CZ-OE1 2.94Å; R207-E234 VanDerWaalsContact CZ-OE1 3.27Å; R207-E234 IonicContact CZ-OE2 3.81Å; R207-E234 IonicContact NE-OE1 3.56Å; R207-E234 PolarHBondContact NE-OE1 2.97Å; R207-E234 IonicContact NH2-OE1 3.46Å; R207-E234 PolarHBondContact NH2-OE1 3.24Å; R207-E234 IonicContact NH2-OE2 2.89Å; R207-E234 PolarHBondContact NH2-OE2 3.46Å
208	V	90.1	Very high	90.7	Very high	51 Å²	51	24.6 Å²	24.6	31%	0.309	15%	0.15	S	C	.	.			trans	-102.7	139.2	175.1	-178.7	0	0	0	0	110.5	A98 G206 P212	A98-V208 HydrophobicContact CB-CG1 3.97Å; A98-V208 HydrophobicContact CB-CG2 4.1Å; G206-V208 PolarHBondContact O-N 3.46Å; V208-P212 HydrophobicContact CG1-CG 3.35Å
209	G	88.5	Confident	91.1	Very high	2 Å²	2	25.8 Å²	25.8	2%	0.021	16%	0.155	C	C	.	.			trans	-92	-165.4	178.8	0	0	0	0	0	114.7	S211 P212 L213	G209-S211 VanDerWaalsContact C-N 3.33Å; G209-P212 WeakPolarHBondContact O-CD 3.37Å; G209-L213 WeakPolarHBondContact O-CD1 3.22Å
210	D	92.1	Very high	91.7	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	15%	0.153	C	C	.	.	S	Bend	trans	-69.8	-28.9	173.3	60.3	-56.3	0	0	0	112.5	L213 A216 G217 G233 F236 I237	D210-L213 WeakPolarHBondContact O-CB 3.39Å; D210-L213 PolarHBondContact O-N 2.63Å; D210-A216 HydrophobicContact CB-CB 4.21Å; D210-G217 VanDerWaalsContact O-CA 3.3Å; D210-G217 WeakPolarHBondContact O-CA 3.41Å; D210-G217 PolarHBondContact O-N 2.82Å; D210-G217 VanDerWaalsContact O-N 3.1Å; D210-G233 VanDerWaalsContact OD1-CA 3.23Å; D210-G233 WeakPolarHBondContact OD1-CA 3.22Å; D210-F236 HydrophobicContact CB-CB 3.91Å; D210-I237 HydrophobicContact CB-CG1 3.88Å
211	S	92.2	Very high	92.3	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.007	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-46.3	-169.9	-50.2	0	0	0	0	115.2	C85 T179 T195 T197 G209 L213	C85-S211 WeakPolarHBondContact CB-O 3.16Å; T179-S211 WeakPolarHBondContact CG2-OG 3.42Å; T179-S211 PolarHBondContact OG1-OG 3.12Å; T195-S211 PolarHBondContact OG1-O 2.88Å; T197-S211 WeakPolarHBondContact CG2-OG 3.41Å; G209-S211 VanDerWaalsContact C-N 3.33Å; S211-L213 VanDerWaalsContact C-N 3.26Å; S211-L213 PolarHBondContact O-N 3.12Å
212	P	95.5	Very high	92.8	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.013	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-1	178.5	34	-35.6	0	0	0	113.9	D83 A96 A98 M121 V208 G209	D83-P212 HydrophobicContact CB-CB 4.13Å; D83-P212 HydrophobicContact CB-CG 3.86Å; A96-P212 HydrophobicContact CB-CB 4.3Å; A96-P212 VanDerWaalsContact CB-O 3.3Å; A96-P212 WeakPolarHBondContact CB-O 3.45Å; A98-P212 HydrophobicContact CB-CB 4.17Å; A98-P212 HydrophobicContact CB-CG 4.02Å; M121-P212 HydrophobicContact CE-CB 3.99Å; M121-P212 HydrophobicContact CE-CG 4.08Å; V208-P212 HydrophobicContact CG1-CG 3.35Å; G209-P212 WeakPolarHBondContact O-CD 3.37Å
213	L	96.1	Very high	93.1	Very high	55 Å²	55	27.5 Å²	27.5	29%	0.288	17%	0.172	S	C	.	.	S	Bend	trans	-98.2	111.5	-173.5	-62.3	176.3	0	0	0	110.8	M121 G209 D210 S211 G215 A216 G217 I237	M121-L213 HydrophobicContact CE-CD2 4.41Å; M121-L213 HydrophobicContact SD-CD2 4.23Å; G209-L213 WeakPolarHBondContact O-CD1 3.22Å; D210-L213 WeakPolarHBondContact O-CB 3.39Å; D210-L213 PolarHBondContact O-N 2.63Å; S211-L213 VanDerWaalsContact C-N 3.26Å; S211-L213 PolarHBondContact O-N 3.12Å; L213-G215 PolarHBondContact O-N 3.06Å; L213-A216 HydrophobicContact CB-CB 3.99Å; L213-A216 PolarHBondContact O-N 2.96Å; L213-G217 PolarHBondContact O-N 3.19Å; L213-G217 VanDerWaalsContact O-N 3.09Å; L213-I237 HydrophobicContact CD1-CD1 3.69Å; L213-I237 HydrophobicContact CD1-CG1 3.73Å; L213-I237 HydrophobicContact CD1-CG2 4.43Å
214	V	95.5	Very high	93.5	Very high	56 Å²	56	27.1 Å²	27.1	34%	0.339	17%	0.171	S	C	.	.	B	Isolated β-bridge	trans	-57.8	128.9	175	-179.9	0	0	0	0	110.1	M87 A94 V120 A216 C218 Y219	M87-V214 HydrophobicContact CE-CG1 4.27Å; M87-V214 HydrophobicContact SD-CG1 3.69Å; A94-V214 HydrophobicContact CB-CG2 3.63Å; V120-V214 HydrophobicContact CG1-CG2 4.24Å; V214-A216 VanDerWaalsContact C-N 3.29Å; V214-A216 PolarHBondContact O-N 2.8Å; V214-C218 CarbonylContact C-O 3.58Å; V214-C218 WeakPolarHBondContact CA-O 3.3Å; V214-Y219 HydrophobicContact CG1-CD2 4.42Å
215	G	95.4	Very high	94.1	Very high	6 Å²	6	23.3 Å²	23.3	6%	0.062	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-11.3	-177	0	0	0	0	0	114.9	L213 C218 L240 A242 Y243	L213-G215 PolarHBondContact O-N 3.06Å; G215-C218 PolarHBondContact N-O 2.93Å; G215-L240 CarbonylContact O-C 3.57Å; G215-L240 WeakPolarHBondContact O-CA 3.41Å; G215-L240 VanDerWaalsContact O-O 3.13Å; G215-A242 PolarHBondContact O-N 3.39Å; G215-Y243 PolarHBondContact O-N 2.95Å
216	A	95.7	Very high	94.5	Very high	2 Å²	2	21 Å²	21	2%	0.017	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-67.7	171.1	0	0	0	0	0	111.1	D210 L213 V214 I237 A242	D210-A216 HydrophobicContact CB-CB 4.21Å; L213-A216 HydrophobicContact CB-CB 3.99Å; L213-A216 PolarHBondContact O-N 2.96Å; V214-A216 VanDerWaalsContact C-N 3.29Å; V214-A216 PolarHBondContact O-N 2.8Å; A216-I237 HydrophobicContact CB-CG1 4.21Å; A216-A242 WeakPolarHBondContact O-CB 3.29Å; A216-A242 PolarHBondContact O-N 2.87Å
217	G	94.3	Very high	94.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-32.3	-178.4	0	0	0	0	0	114.2	T195 D210 L213 C229	T195-G217 VanDerWaalsContact CG2-O 3.31Å; T195-G217 WeakPolarHBondContact CG2-O 3.41Å; D210-G217 VanDerWaalsContact O-CA 3.3Å; D210-G217 WeakPolarHBondContact O-CA 3.41Å; D210-G217 PolarHBondContact O-N 2.82Å; D210-G217 VanDerWaalsContact O-N 3.1Å; L213-G217 PolarHBondContact O-N 3.19Å; L213-G217 VanDerWaalsContact O-N 3.09Å; G217-C229 PolarHBondContact O-N 2.88Å
218	C	97.7	Very high	95.3	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	133.8	-174.8	-178.8	0	0	0	0	110.4	C85 T195 V214 G215	C85-C218 HydrophobicContact CB-CB 4.03Å; T195-C218 HydrophobicContact CG2-CB 3.92Å; V214-C218 CarbonylContact C-O 3.58Å; V214-C218 WeakPolarHBondContact CA-O 3.3Å; G215-C218 PolarHBondContact N-O 2.93Å
219	Y	98.4	Very high	95.6	Very high	25 Å²	25	13.7 Å²	13.7	10%	0.098	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	141.6	175.8	-170.1	-100.7	0	0	0	111.3	M87 A193 V214 N221 A226 V227 Y243 A246	M87-Y219 HydrophobicContact CE-CD2 4.32Å; M87-Y219 HydrophobicContact CE-CE2 4.19Å; M87-Y219 HydrophobicContact SD-CD2 4.07Å; A193-Y219 WeakPolarHBondContact CB-O 3.49Å; V214-Y219 HydrophobicContact CG1-CD2 4.42Å; Y219-N221 HydrophobicContact CE1-CB 3.93Å; Y219-A226 CarbonylContact O-C 3.57Å; Y219-A226 WeakPolarHBondContact O-CA 3.25Å; Y219-V227 PolarHBondContact N-O 3.32Å; Y219-V227 PolarHBondContact O-N 2.94Å; Y219-Y243 HydrophobicContact CD2-CD2 4.28Å; Y219-Y243 HydrophobicContact CE1-CD2 4.17Å; Y219-Y243 AromaticContact CE2-CD2 3.62Å; Y219-Y243 HydrophobicContact CE2-CD2 3.62Å; Y219-Y243 HydrophobicContact CE2-CE2 4.34Å; Y219-Y243 AromaticContact CZ-CD2 3.55Å; Y219-A246 HydrophobicContact CD1-CB 4.05Å; Y219-A246 HydrophobicContact CE1-CB 3.53Å
220	A	98.2	Very high	95.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	137.8	171.6	0	0	0	0	0	111.4	M87 A193 V225 A226	M87-A220 HydrophobicContact CB-CB 4.3Å; M87-A220 VanDerWaalsContact CE-O 3.23Å; M87-A220 WeakPolarHBondContact CE-O 3.12Å; M87-A220 HydrophobicContact CG-CB 4.15Å; M87-A220 PolarHBondContact SD-N 3.16Å; A193-A220 HydrophobicContact CB-CB 4.07Å; A220-V225 WeakPolarHBondContact CA-O 3.44Å; A220-A226 HydrophobicContact CB-CB 4.12Å
221	N	97.5	Very high	95.6	Very high	30 Å²	30	14 Å²	14	16%	0.16	9%	0.088	C	C	.	.			trans	-152	123.3	173.2	-178.4	-9.4	0	0	0	109.6	L92 L191 Y219 A223 S224 V225	L92-N221 HydrophobicContact CD2-CB 4Å; L191-N221 WeakPolarHBondContact CD1-O 3.11Å; Y219-N221 HydrophobicContact CE1-CB 3.93Å; N221-A223 PolarHBondContact O-N 3.35Å; N221-A223 VanDerWaalsContact O-N 3.08Å; N221-A223 WeakPolarHBondContact OD1-CB 3.37Å; N221-A223 PolarHBondContact OD1-N 2.85Å; N221-S224 CarbonylContact O-C 3.55Å; N221-S224 PolarHBondContact O-N 3.18Å; N221-V225 PolarHBondContact N-O 2.86Å; N221-V225 PolarHBondContact O-N 2.93Å; N221-V225 VanDerWaalsContact O-N 3.09Å
222	N	95.6	Very high	95.2	Very high	37 Å²	37	14 Å²	14	20%	0.198	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-25.5	178.2	-81	12.9	0	0	0	113.5	G89 N90 N190 L191 S224 H282	G89-N222 PolarHBondContact O-N 2.81Å; G89-N222 PolarHBondContact O-OD1 3.45Å; N90-N222 WeakPolarHBondContact CA-ND2 3.5Å; N90-N222 WeakPolarHBondContact CB-ND2 3.41Å; N90-N222 PolarHBondContact N-OD1 3.04Å; N190-N222 WeakPolarHBondContact CA-OD1 3.45Å; N190-N222 PolarHBondContact OD1-ND2 2.89Å; L191-N222 PolarHBondContact N-OD1 3.42Å; N222-S224 VanDerWaalsContact C-N 3.3Å; N222-H282 WeakPolarHBondContact O-CB 3.48Å
223	A	92.1	Very high	94.7	Very high	67 Å²	67	13.9 Å²	13.9	55%	0.554	9%	0.088	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-22.2	178.4	0	0	0	0	0	113.4	N221	N221-A223 PolarHBondContact O-N 3.35Å; N221-A223 VanDerWaalsContact O-N 3.08Å; N221-A223 WeakPolarHBondContact OD1-CB 3.37Å; N221-A223 PolarHBondContact OD1-N 2.85Å
224	S	93.9	Very high	94.3	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.007	9%	0.085	C	C	.	.	S	Bend	trans	-137.4	-77.3	-171.8	48.2	0	0	0	0	113.1	N221 N222 D250 D281 H282	N221-S224 CarbonylContact O-C 3.55Å; N221-S224 PolarHBondContact O-N 3.18Å; N222-S224 VanDerWaalsContact C-N 3.3Å; S224-D250 WeakPolarHBondContact CB-OD1 3.18Å; S224-D281 WeakPolarHBondContact O-CA 3.37Å; S224-D281 WeakPolarHBondContact O-CB 3.38Å; S224-H282 PolarHBondContact O-N 3.02Å
225	V	97.8	Very high	94.1	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	149.1	-163.2	67.1	0	0	0	0	113.2	A220 N221 V227 I245 A246 M249 L256 A279 I280	A220-V225 WeakPolarHBondContact CA-O 3.44Å; N221-V225 PolarHBondContact N-O 2.86Å; N221-V225 PolarHBondContact O-N 2.93Å; N221-V225 VanDerWaalsContact O-N 3.09Å; V225-V227 HydrophobicContact CB-CG2 4.37Å; V225-V227 HydrophobicContact CG1-CG2 3.84Å; V225-V227 HydrophobicContact CG2-CG2 3.65Å; V225-I245 HydrophobicContact CG1-CG2 4.16Å; V225-I245 HydrophobicContact CG2-CG2 4.39Å; V225-A246 HydrophobicContact CG1-CB 3.73Å; V225-M249 HydrophobicContact CB-CE 4.39Å; V225-M249 HydrophobicContact CB-SD 3.87Å; V225-M249 HydrophobicContact CG1-SD 4.14Å; V225-M249 HydrophobicContact CG2-SD 4.29Å; V225-L256 HydrophobicContact CB-CD1 4.46Å; V225-L256 HydrophobicContact CG2-CD1 3.5Å; V225-L256 VanDerWaalsContact CG2-CD1 3.5Å; V225-A279 HydrophobicContact CG2-CB 3.99Å; V225-I280 CarbonylContact C-O 3.45Å; V225-I280 WeakPolarHBondContact CA-O 3.44Å; V225-I280 WeakPolarHBondContact CG2-O 3.38Å
226	A	98.5	Very high	94	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.6	159.6	0	0	0	0	0	110.3	V183 L191 A192 A193 Y219 A220 A279 I280	V183-A226 HydrophobicContact CB-CB 4Å; V183-A226 HydrophobicContact CG1-CB 4.04Å; L191-A226 HydrophobicContact CB-CB 4.08Å; L191-A226 HydrophobicContact CD2-CB 4.11Å; A192-A226 WeakPolarHBondContact O-CB 3.43Å; A193-A226 HydrophobicContact CB-CB 4.33Å; Y219-A226 CarbonylContact O-C 3.57Å; Y219-A226 WeakPolarHBondContact O-CA 3.25Å; A220-A226 HydrophobicContact CB-CB 4.12Å; A226-A279 CarbonylContact O-C 3.58Å; A226-A279 WeakPolarHBondContact O-CA 3.24Å; A226-I280 PolarHBondContact N-O 3.35Å; A226-I280 PolarHBondContact O-N 2.83Å
227	V	98.4	Very high	93.9	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	135.8	-174.6	-174.8	0	0	0	0	110.7	Y219 V225 A242 I245 L277 I278 A279	Y219-V227 PolarHBondContact N-O 3.32Å; Y219-V227 PolarHBondContact O-N 2.94Å; V225-V227 HydrophobicContact CB-CG2 4.37Å; V225-V227 HydrophobicContact CG1-CG2 3.84Å; V225-V227 HydrophobicContact CG2-CG2 3.65Å; V227-A242 HydrophobicContact CB-CB 4.08Å; V227-A242 HydrophobicContact CG1-CB 3.94Å; V227-I245 HydrophobicContact CG1-CD1 3.91Å; V227-I245 HydrophobicContact CG2-CB 4.36Å; V227-I245 HydrophobicContact CG2-CD1 4.1Å; V227-I245 HydrophobicContact CG2-CG2 4.33Å; V227-L277 HydrophobicContact CG1-CB 4.29Å; V227-L277 HydrophobicContact CG1-CD1 4.24Å; V227-L277 HydrophobicContact CG1-CD2 4.49Å; V227-I278 WeakPolarHBondContact CA-O 3.4Å; V227-A279 HydrophobicContact CG2-CB 4.05Å
228	S	98.1	Very high	93.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	130.1	167.8	173.9	0	0	0	0	110	H9 G181 T195 L277 I278	H9-S228 PolarHBondContact NE2-O 3.42Å; H9-S228 PolarHBondContact NE2-OG 2.83Å; G181-S228 WeakPolarHBondContact CA-OG 3.1Å; T195-S228 WeakPolarHBondContact CG2-OG 3.18Å; S228-L277 CarbonylContact O-C 3.43Å; S228-L277 WeakPolarHBondContact O-CA 3.44Å; S228-L277 VanDerWaalsContact O-CB 3.27Å; S228-L277 WeakPolarHBondContact O-CB 3.27Å; S228-I278 PolarHBondContact N-O 3.33Å; S228-I278 PolarHBondContact O-N 3.33Å
229	C	96	Very high	93.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	157.2	-173.2	-62.9	0	0	0	0	113.5	H9 G217 F236 L277	H9-C229 PolarHBondContact CE1-O 3.16Å; G217-C229 PolarHBondContact O-N 2.88Å; C229-F236 HydrophobicContact CB-CD1 3.55Å; C229-F236 HydrophobicContact CB-CE1 3.61Å; C229-L277 HydrophobicContact CB-CB 4.43Å
230	T	92.7	Very high	93.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	135.4	171.3	175.1	0	0	0	0	110.9	G11 A12 T179 F236 G275 G276 M295	G11-T230 WeakPolarHBondContact CA-OG1 3.39Å; A12-T230 HydrophobicContact CB-CG2 3.61Å; A12-T230 PolarHBondContact N-OG1 3.47Å; T179-T230 PolarHBondContact N-OG1 3.24Å; T230-F236 WeakPolarHBondContact O-CZ 3.47Å; T230-G275 CarbonylContact O-C 3.54Å; T230-G275 WeakPolarHBondContact O-CA 3.37Å; T230-G276 PolarHBondContact N-O 3.23Å; T230-G276 PolarHBondContact O-N 2.96Å; T230-M295 HydrophobicContact CG2-CG 4.41Å; T230-M295 HydrophobicContact CG2-SD 3.94Å
231	G	88.1	Confident	93.4	Very high	11 Å²	11	24.9 Å²	24.9	11%	0.113	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.9	-145.2	175.7	0	0	0	0	0	113.4	G233 S274	G231-G233 PolarHBondContact O-N 3.36Å; G231-S274 CarbonylContact C-O 3.55Å; G231-S274 VanDerWaalsContact CA-O 3.31Å; G231-S274 WeakPolarHBondContact CA-O 3.46Å
232	T	83.7	Confident	93.4	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.006	13%	0.126	C	C	.	.			trans	-72.1	85.4	-179.2	57	0	0	0	0	111	D165 M177 E234 V235 F236 G273 S274	D165-T232 WeakPolarHBondContact OD2-CB 3.46Å; D165-T232 WeakPolarHBondContact OD2-CG2 3.44Å; M177-T232 HydrophobicContact CE-CG2 4.39Å; M177-T232 HydrophobicContact SD-CG2 4.44Å; T232-E234 VanDerWaalsContact C-N 3.27Å; T232-E234 PolarHBondContact O-N 3.14Å; T232-V235 PolarHBondContact O-N 3.36Å; T232-F236 WeakPolarHBondContact O-CD2 3.38Å; T232-F236 PolarHBondContact O-N 3.44Å; T232-G273 VanDerWaalsContact OG1-CA 3.23Å; T232-G273 WeakPolarHBondContact OG1-CA 3.27Å; T232-S274 WeakPolarHBondContact CG2-O 3.41Å; T232-S274 WeakPolarHBondContact CG2-OG 3.38Å; T232-S274 PolarHBondContact N-O 3Å; T232-S274 PolarHBondContact OG1-N 3.48Å; T232-S274 PolarHBondContact OG1-O 3.18Å
233	G	85.3	Confident	93.5	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-50.4	-38.3	-166.7	0	0	0	0	0	115.4	D210 G231 V235 F236 I237	D210-G233 VanDerWaalsContact OD1-CA 3.23Å; D210-G233 WeakPolarHBondContact OD1-CA 3.22Å; G231-G233 PolarHBondContact O-N 3.36Å; G233-V235 VanDerWaalsContact C-N 3.28Å; G233-V235 PolarHBondContact O-N 3.19Å; G233-F236 PolarHBondContact O-N 3.16Å; G233-I237 WeakPolarHBondContact O-CG1 3.36Å; G233-I237 PolarHBondContact O-N 3.08Å
234	E	88.6	Confident	93.7	Very high	46 Å²	46	23.9 Å²	23.9	22%	0.215	11%	0.113	C	C	.	.	H	α-helix	trans	-58.3	-39.4	177.3	-73.2	72.1	-164.2	0	0	112.3	R207 T232 R238	R207-E234 IonicContact CZ-OE1 2.94Å; R207-E234 VanDerWaalsContact CZ-OE1 3.27Å; R207-E234 IonicContact CZ-OE2 3.81Å; R207-E234 IonicContact NE-OE1 3.56Å; R207-E234 PolarHBondContact NE-OE1 2.97Å; R207-E234 IonicContact NH2-OE1 3.46Å; R207-E234 PolarHBondContact NH2-OE1 3.24Å; R207-E234 IonicContact NH2-OE2 2.89Å; R207-E234 PolarHBondContact NH2-OE2 3.46Å; T232-E234 VanDerWaalsContact C-N 3.27Å; T232-E234 PolarHBondContact O-N 3.14Å; E234-R238 WeakPolarHBondContact O-CB 3.37Å; E234-R238 WeakPolarHBondContact O-CG 3.39Å; E234-R238 PolarHBondContact O-N 3.41Å; E234-R238 VanDerWaalsContact O-N 3.12Å
235	V	90.2	Very high	93.9	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.012	11%	0.113	C	C	.	.	H	α-helix	trans	-76.2	-39.8	179.7	-175.5	0	0	0	0	110.8	T232 G233 I237 R238 A239 L268 L271	T232-V235 PolarHBondContact O-N 3.36Å; G233-V235 VanDerWaalsContact C-N 3.28Å; G233-V235 PolarHBondContact O-N 3.19Å; V235-I237 VanDerWaalsContact C-N 3.32Å; V235-I237 PolarHBondContact O-N 3.33Å; V235-R238 PolarHBondContact O-N 2.89Å; V235-A239 VanDerWaalsContact O-CB 3.26Å; V235-A239 WeakPolarHBondContact O-CB 3.43Å; V235-A239 PolarHBondContact O-N 2.88Å; V235-L268 HydrophobicContact CG1-CD2 3.86Å; V235-L271 HydrophobicContact CG1-CB 3.57Å; V235-L271 HydrophobicContact CG1-CD1 4.15Å
236	F	93.1	Very high	93.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63	-38.8	176.3	-80.7	-110	0	0	0	111.9	D210 C229 T230 T232 G233 L240 A241 L268	D210-F236 HydrophobicContact CB-CB 3.91Å; C229-F236 HydrophobicContact CB-CD1 3.55Å; C229-F236 HydrophobicContact CB-CE1 3.61Å; T230-F236 WeakPolarHBondContact O-CZ 3.47Å; T232-F236 WeakPolarHBondContact O-CD2 3.38Å; T232-F236 PolarHBondContact O-N 3.44Å; G233-F236 PolarHBondContact O-N 3.16Å; F236-L240 WeakPolarHBondContact O-CA 3.18Å; F236-L240 PolarHBondContact O-N 3.46Å; F236-A241 HydrophobicContact CB-CB 4.3Å; F236-A241 HydrophobicContact CD1-CB 3.54Å; F236-A241 HydrophobicContact CE1-CB 4.19Å; F236-A241 HydrophobicContact CG-CB 4.15Å; F236-A241 PolarHBondContact O-N 3.17Å; F236-A241 VanDerWaalsContact O-N 3.12Å; F236-L268 HydrophobicContact CD1-CD1 4.38Å; F236-L268 HydrophobicContact CD2-CD1 4.3Å; F236-L268 HydrophobicContact CD2-CD2 4.14Å; F236-L268 HydrophobicContact CE1-CD1 3.73Å; F236-L268 HydrophobicContact CE2-CD1 3.66Å; F236-L268 HydrophobicContact CE2-CD2 4.24Å; F236-L268 HydrophobicContact CG-CD2 4.4Å; F236-L268 HydrophobicContact CZ-CD1 3.34Å
237	I	94.2	Very high	93.7	Very high	57 Å²	57	24.7 Å²	24.7	29%	0.292	12%	0.12	S	C	.	.	H	α-helix	trans	-62.1	-52.1	172.1	-67.4	166.1	0	0	0	110.7	D210 L213 A216 G233 V235 A239 L240	D210-I237 HydrophobicContact CB-CG1 3.88Å; L213-I237 HydrophobicContact CD1-CD1 3.69Å; L213-I237 HydrophobicContact CD1-CG1 3.73Å; L213-I237 HydrophobicContact CD1-CG2 4.43Å; A216-I237 HydrophobicContact CB-CG1 4.21Å; G233-I237 WeakPolarHBondContact O-CG1 3.36Å; G233-I237 PolarHBondContact O-N 3.08Å; V235-I237 VanDerWaalsContact C-N 3.32Å; V235-I237 PolarHBondContact O-N 3.33Å; I237-A239 PolarHBondContact O-N 2.91Å; I237-L240 PolarHBondContact O-N 2.78Å; I237-L240 VanDerWaalsContact O-N 3.14Å
238	R	93.6	Very high	93.6	Very high	161 Å²	161	25.7 Å²	25.7	61%	0.608	13%	0.125	S	C	*	.	H	α-helix	trans	-62.8	-30.6	-177.9	-74.9	172.7	62.3	-152.7	-4.9	112.9	E234 V235	E234-R238 WeakPolarHBondContact O-CB 3.37Å; E234-R238 WeakPolarHBondContact O-CG 3.39Å; E234-R238 PolarHBondContact O-N 3.41Å; E234-R238 VanDerWaalsContact O-N 3.12Å; V235-R238 PolarHBondContact O-N 2.89Å
239	A	93.3	Very high	93.6	Very high	19 Å²	19	27 Å²	27	16%	0.157	13%	0.131	C	C	.	.	H	α-helix	trans	-87.3	-13.7	178.6	0	0	0	0	0	113.6	V235 I237 A241 L268 L271	V235-A239 VanDerWaalsContact O-CB 3.26Å; V235-A239 WeakPolarHBondContact O-CB 3.43Å; V235-A239 PolarHBondContact O-N 2.88Å; I237-A239 PolarHBondContact O-N 2.91Å; A239-A241 PolarHBondContact O-N 2.76Å; A239-L268 HydrophobicContact CB-CD2 4.02Å; A239-L271 HydrophobicContact CB-CD1 4.08Å
240	L	96.2	Very high	93.4	Very high	89 Å²	89	30.4 Å²	30.4	47%	0.466	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	48.6	-166.2	-63.4	171.7	0	0	0	111	G215 F236 I237 A242 Y243 D244	G215-L240 CarbonylContact O-C 3.57Å; G215-L240 WeakPolarHBondContact O-CA 3.41Å; G215-L240 VanDerWaalsContact O-O 3.13Å; F236-L240 WeakPolarHBondContact O-CA 3.18Å; F236-L240 PolarHBondContact O-N 3.46Å; I237-L240 PolarHBondContact O-N 2.78Å; I237-L240 VanDerWaalsContact O-N 3.14Å; L240-A242 VanDerWaalsContact C-N 3.31Å; L240-A242 PolarHBondContact O-N 3.01Å; L240-A242 VanDerWaalsContact O-N 3.16Å; L240-Y243 PolarHBondContact O-N 2.88Å; L240-Y243 VanDerWaalsContact O-N 3.08Å; L240-D244 WeakPolarHBondContact O-CB 3.35Å; L240-D244 PolarHBondContact O-N 2.87Å
241	A	95.3	Very high	93.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-53.8	-43	-162.4	0	0	0	0	0	113.8	F236 A239 I245 V263 L268	F236-A241 HydrophobicContact CB-CB 4.3Å; F236-A241 HydrophobicContact CD1-CB 3.54Å; F236-A241 HydrophobicContact CE1-CB 4.19Å; F236-A241 HydrophobicContact CG-CB 4.15Å; F236-A241 PolarHBondContact O-N 3.17Å; F236-A241 VanDerWaalsContact O-N 3.12Å; A239-A241 PolarHBondContact O-N 2.76Å; A241-I245 PolarHBondContact O-N 3.11Å; A241-V263 HydrophobicContact CB-CG1 4.12Å; A241-L268 HydrophobicContact CB-CD2 4.44Å
242	A	96.7	Very high	93.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.9	-44.9	179	0	0	0	0	0	112.8	G215 A216 V227 L240	G215-A242 PolarHBondContact O-N 3.39Å; A216-A242 WeakPolarHBondContact O-CB 3.29Å; A216-A242 PolarHBondContact O-N 2.87Å; V227-A242 HydrophobicContact CB-CB 4.08Å; V227-A242 HydrophobicContact CG1-CB 3.94Å; L240-A242 VanDerWaalsContact C-N 3.31Å; L240-A242 PolarHBondContact O-N 3.01Å; L240-A242 VanDerWaalsContact O-N 3.16Å
243	Y	97.5	Very high	93.7	Very high	84 Å²	84	43.8 Å²	43.8	33%	0.329	23%	0.234	S	C	.	.	H	α-helix	trans	-71.4	-33.6	178.3	178.3	-109.9	0	0	0	112.8	G215 Y219 L240 I245 A246 A247	G215-Y243 PolarHBondContact O-N 2.95Å; Y219-Y243 HydrophobicContact CD2-CD2 4.28Å; Y219-Y243 HydrophobicContact CE1-CD2 4.17Å; Y219-Y243 AromaticContact CE2-CD2 3.62Å; Y219-Y243 HydrophobicContact CE2-CD2 3.62Å; Y219-Y243 HydrophobicContact CE2-CE2 4.34Å; Y219-Y243 AromaticContact CZ-CD2 3.55Å; L240-Y243 PolarHBondContact O-N 2.88Å; L240-Y243 VanDerWaalsContact O-N 3.08Å; Y243-I245 PolarHBondContact O-N 2.85Å; Y243-A246 WeakPolarHBondContact O-CB 3.17Å; Y243-A246 PolarHBondContact O-N 2.63Å; Y243-A246 VanDerWaalsContact O-N 3.09Å; Y243-A247 HydrophobicContact CE1-CB 4.28Å; Y243-A247 PolarHBondContact O-N 3.22Å
244	D	97.3	Very high	94	Very high	30 Å²	30	45.3 Å²	45.3	16%	0.16	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-30.7	-179.4	-170.1	43.4	0	0	0	111.9	L240 A247 L248 V263 K267	L240-D244 WeakPolarHBondContact O-CB 3.35Å; L240-D244 PolarHBondContact O-N 2.87Å; D244-A247 PolarHBondContact O-N 3.44Å; D244-L248 WeakPolarHBondContact O-CB 3.35Å; D244-L248 WeakPolarHBondContact O-CG 3.45Å; D244-L248 PolarHBondContact O-N 3.46Å; D244-V263 HydrophobicContact CB-CG2 4.36Å; D244-V263 WeakPolarHBondContact OD2-CG2 3.38Å; D244-K267 IonicContact OD1-NZ 3.96Å; D244-K267 PolarHBondContact OD1-NZ 3.27Å; D244-K267 WeakPolarHBondContact OD2-CD 3.32Å; D244-K267 WeakPolarHBondContact OD2-CE 3.48Å; D244-K267 IonicContact OD2-NZ 2.83Å; D244-K267 PolarHBondContact OD2-NZ 3.22Å
245	I	97.4	Very high	94.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62	-51.5	170.2	-66.6	166.9	0	0	0	110.5	V225 V227 A241 Y243 A247 L248 M249 L256 A259 C260 V263 L277	V225-I245 HydrophobicContact CG1-CG2 4.16Å; V225-I245 HydrophobicContact CG2-CG2 4.39Å; V227-I245 HydrophobicContact CG1-CD1 3.91Å; V227-I245 HydrophobicContact CG2-CB 4.36Å; V227-I245 HydrophobicContact CG2-CD1 4.1Å; V227-I245 HydrophobicContact CG2-CG2 4.33Å; A241-I245 PolarHBondContact O-N 3.11Å; Y243-I245 PolarHBondContact O-N 2.85Å; I245-A247 VanDerWaalsContact C-N 3.3Å; I245-A247 PolarHBondContact O-N 3.22Å; I245-L248 PolarHBondContact O-N 3.08Å; I245-M249 HydrophobicContact CG2-SD 4.07Å; I245-M249 WeakPolarHBondContact O-CG 3.3Å; I245-M249 PolarHBondContact O-N 3.45Å; I245-L256 HydrophobicContact CG2-CD1 4.32Å; I245-A259 HydrophobicContact CG2-CB 4.04Å; I245-C260 HydrophobicContact CD1-CB 4.48Å; I245-V263 HydrophobicContact CG1-CB 4.28Å; I245-V263 HydrophobicContact CG1-CG2 3.9Å; I245-L277 HydrophobicContact CD1-CD1 3.76Å; I245-L277 HydrophobicContact CD1-CD2 3.41Å; I245-L277 VanDerWaalsContact CD1-CD2 3.41Å; I245-L277 HydrophobicContact CD1-CG 4.24Å
246	A	96.5	Very high	94.5	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-44.5	177.7	0	0	0	0	0	111.2	Y219 V225 Y243 L248 M249 D250	Y219-A246 HydrophobicContact CD1-CB 4.05Å; Y219-A246 HydrophobicContact CE1-CB 3.53Å; V225-A246 HydrophobicContact CG1-CB 3.73Å; Y243-A246 WeakPolarHBondContact O-CB 3.17Å; Y243-A246 PolarHBondContact O-N 2.63Å; Y243-A246 VanDerWaalsContact O-N 3.09Å; A246-L248 PolarHBondContact O-N 3.12Å; A246-M249 PolarHBondContact O-N 2.93Å; A246-D250 WeakPolarHBondContact O-CB 3.47Å; A246-D250 VanDerWaalsContact O-CG 3.27Å; A246-D250 PolarHBondContact O-N 2.96Å
247	A	96.3	Very high	94.5	Very high	18 Å²	18	48.6 Å²	48.6	15%	0.149	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-37.7	178.3	0	0	0	0	0	113.1	Y243 D244 I245 Y251	Y243-A247 HydrophobicContact CE1-CB 4.28Å; Y243-A247 PolarHBondContact O-N 3.22Å; D244-A247 PolarHBondContact O-N 3.44Å; I245-A247 VanDerWaalsContact C-N 3.3Å; I245-A247 PolarHBondContact O-N 3.22Å; A247-Y251 HydrophobicContact CB-CD2 3.98Å; A247-Y251 HydrophobicContact CB-CE2 4.26Å; A247-Y251 WeakPolarHBondContact O-CB 3.3Å; A247-Y251 WeakPolarHBondContact O-CD2 3.29Å; A247-Y251 PolarHBondContact O-N 3.36Å
248	L	96.8	Very high	94.5	Very high	21 Å²	21	50 Å²	50	11%	0.11	28%	0.278	C	S	.	.	H	α-helix	trans	-67.7	-36.2	175.3	-75.9	169.9	0	0	0	112.1	D244 I245 A246 G252 G253 L254 A259 R262 V263	D244-L248 WeakPolarHBondContact O-CB 3.35Å; D244-L248 WeakPolarHBondContact O-CG 3.45Å; D244-L248 PolarHBondContact O-N 3.46Å; I245-L248 PolarHBondContact O-N 3.08Å; A246-L248 PolarHBondContact O-N 3.12Å; L248-G252 CarbonylContact O-C 3.57Å; L248-G252 WeakPolarHBondContact O-CA 3.19Å; L248-G252 PolarHBondContact O-N 3.16Å; L248-G253 PolarHBondContact O-N 3.03Å; L248-L254 HydrophobicContact CB-CD2 4.42Å; L248-L254 HydrophobicContact CD2-CD2 4.41Å; L248-L254 PolarHBondContact O-N 3.39Å; L248-A259 HydrophobicContact CB-CB 3.88Å; L248-A259 HydrophobicContact CD1-CB 4.46Å; L248-R262 HydrophobicContact CD1-CB 4.42Å; L248-R262 HydrophobicContact CD1-CG 4.47Å; L248-V263 HydrophobicContact CD1-CG2 3.78Å
249	M	96.2	Very high	94.6	Very high	27 Å²	27	42.3 Å²	42.3	13%	0.133	25%	0.249	C	C	.	.	H	α-helix	trans	-68.9	-53.7	173.4	-66.7	173.1	67.3	0	0	110.7	V225 I245 A246 G253 L256 A259 D281	V225-M249 HydrophobicContact CB-CE 4.39Å; V225-M249 HydrophobicContact CB-SD 3.87Å; V225-M249 HydrophobicContact CG1-SD 4.14Å; V225-M249 HydrophobicContact CG2-SD 4.29Å; I245-M249 HydrophobicContact CG2-SD 4.07Å; I245-M249 WeakPolarHBondContact O-CG 3.3Å; I245-M249 PolarHBondContact O-N 3.45Å; A246-M249 PolarHBondContact O-N 2.93Å; M249-G253 WeakPolarHBondContact O-CA 3.35Å; M249-G253 PolarHBondContact O-N 2.89Å; M249-G253 VanDerWaalsContact O-N 3.14Å; M249-L256 HydrophobicContact CE-CB 4.28Å; M249-L256 HydrophobicContact CE-CD1 4.37Å; M249-L256 HydrophobicContact SD-CB 4.43Å; M249-L256 HydrophobicContact SD-CD1 3.82Å; M249-A259 HydrophobicContact CG-CB 3.86Å; M249-D281 HydrophobicContact CE-CB 3.88Å
250	D	92.6	Very high	94.7	Very high	71 Å²	71	41.4 Å²	41.4	38%	0.38	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-43.9	-173.3	-71.4	-22.9	0	0	0	113.2	S224 A246	S224-D250 WeakPolarHBondContact CB-OD1 3.18Å; A246-D250 WeakPolarHBondContact O-CB 3.47Å; A246-D250 VanDerWaalsContact O-CG 3.27Å; A246-D250 PolarHBondContact O-N 2.96Å
251	Y	93.5	Very high	94.5	Very high	179 Å²	179	41.6 Å²	41.6	70%	0.702	24%	0.24	S	C	*	.	H	α-helix	trans	-106.6	-26.2	-173.5	-52.2	-57.3	0	0	0	113.3	A247	A247-Y251 HydrophobicContact CB-CD2 3.98Å; A247-Y251 HydrophobicContact CB-CE2 4.26Å; A247-Y251 WeakPolarHBondContact O-CB 3.3Å; A247-Y251 WeakPolarHBondContact O-CD2 3.29Å; A247-Y251 PolarHBondContact O-N 3.36Å
252	G	87.3	Confident	94.4	Very high	46 Å²	46	46.9 Å²	46.9	47%	0.474	26%	0.26	S	S	.	.	H	α-helix	trans	-89.4	-20.7	178.2	0	0	0	0	0	113.6	L248 L254	L248-G252 CarbonylContact O-C 3.57Å; L248-G252 WeakPolarHBondContact O-CA 3.19Å; L248-G252 PolarHBondContact O-N 3.16Å; G252-L254 WeakPolarHBondContact O-CD1 3.36Å; G252-L254 PolarHBondContact O-N 3.23Å
253	G	89.2	Confident	94.4	Very high	69 Å²	69	46.9 Å²	46.9	71%	0.711	26%	0.26	S	S	*	.			trans	67.8	22.2	-174	0	0	0	0	0	113.3	L248 M249	L248-G253 PolarHBondContact O-N 3.03Å; M249-G253 WeakPolarHBondContact O-CA 3.35Å; M249-G253 PolarHBondContact O-N 2.89Å; M249-G253 VanDerWaalsContact O-N 3.14Å
254	L	92.5	Very high	94.1	Very high	33 Å²	33	42.9 Å²	42.9	17%	0.173	24%	0.244	C	C	.	.			trans	-76.7	146.7	176.4	-79.1	73.6	0	0	0	109.9	L248 G252 E258 A259	L248-L254 HydrophobicContact CB-CD2 4.42Å; L248-L254 HydrophobicContact CD2-CD2 4.41Å; L248-L254 PolarHBondContact O-N 3.39Å; G252-L254 WeakPolarHBondContact O-CD1 3.36Å; G252-L254 PolarHBondContact O-N 3.23Å; L254-E258 HydrophobicContact CB-CB 4.06Å; L254-E258 HydrophobicContact CD2-CB 3.99Å; L254-E258 HydrophobicContact CG-CB 4.16Å; L254-A259 HydrophobicContact CB-CB 4.22Å
255	S	93.2	Very high	93.8	Very high	58 Å²	58	43.9 Å²	43.9	41%	0.406	25%	0.248	S	C	.	.			trans	-64.9	161.6	164.3	63.8	0	0	0	0	111.3	A257 E258 A259	S255-A257 VanDerWaalsContact C-N 3.26Å; S255-A257 PolarHBondContact O-N 2.88Å; S255-E258 WeakPolarHBondContact CB-OE2 3.21Å; S255-E258 PolarHBondContact N-OE2 3.16Å; S255-E258 PolarHBondContact O-N 3.33Å; S255-E258 VanDerWaalsContact OG-CD 3.26Å; S255-E258 VanDerWaalsContact OG-CG 3.25Å; S255-E258 WeakPolarHBondContact OG-CG 3.48Å; S255-E258 PolarHBondContact OG-N 2.97Å; S255-E258 PolarHBondContact OG-OE2 2.58Å; S255-A259 WeakPolarHBondContact O-CB 3.48Å; S255-A259 PolarHBondContact O-N 3.49Å
256	L	95.4	Very high	93.5	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-51.4	-46.4	175.6	179.5	63.6	0	0	0	111.8	V225 I245 M249 A259 C260 A279 D281 N285 V287	V225-L256 HydrophobicContact CB-CD1 4.46Å; V225-L256 HydrophobicContact CG2-CD1 3.5Å; V225-L256 VanDerWaalsContact CG2-CD1 3.5Å; I245-L256 HydrophobicContact CG2-CD1 4.32Å; M249-L256 HydrophobicContact CE-CB 4.28Å; M249-L256 HydrophobicContact CE-CD1 4.37Å; M249-L256 HydrophobicContact SD-CB 4.43Å; M249-L256 HydrophobicContact SD-CD1 3.82Å; L256-A259 PolarHBondContact O-N 2.78Å; L256-C260 WeakPolarHBondContact O-CB 3.28Å; L256-C260 PolarHBondContact O-N 3.38Å; L256-C260 PolarHBondContact O-SG 3.03Å; L256-A279 HydrophobicContact CD1-CB 3.84Å; L256-D281 HydrophobicContact CB-CB 4.4Å; L256-D281 HydrophobicContact CD2-CB 4.01Å; L256-N285 HydrophobicContact CD2-CB 4.13Å; L256-N285 VanDerWaalsContact CD2-O 3.29Å; L256-N285 WeakPolarHBondContact CD2-O 3.46Å; L256-V287 HydrophobicContact CB-CG2 4.39Å; L256-V287 HydrophobicContact CD2-CB 4.25Å; L256-V287 HydrophobicContact CD2-CG2 3.71Å; L256-V287 HydrophobicContact CG-CB 4.21Å; L256-V287 HydrophobicContact CG-CG2 3.72Å
257	A	93.3	Very high	93.3	Very high	53 Å²	53	52.5 Å²	52.5	44%	0.438	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-46.5	-179.5	0	0	0	0	0	112.5	S255 E261 V287	S255-A257 VanDerWaalsContact C-N 3.26Å; S255-A257 PolarHBondContact O-N 2.88Å; A257-E261 VanDerWaalsContact O-CB 3.24Å; A257-E261 WeakPolarHBondContact O-CB 3.47Å; A257-E261 PolarHBondContact O-N 2.86Å; A257-V287 HydrophobicContact CB-CG2 4.21Å
258	E	93.9	Very high	92.9	Very high	87 Å²	87	51.6 Å²	51.6	41%	0.407	28%	0.28	S	S	.	.	H	α-helix	trans	-65.5	-40.9	178.6	-68.7	165.3	134.4	0	0	111.9	L254 S255 R262	L254-E258 HydrophobicContact CB-CB 4.06Å; L254-E258 HydrophobicContact CD2-CB 3.99Å; L254-E258 HydrophobicContact CG-CB 4.16Å; S255-E258 WeakPolarHBondContact CB-OE2 3.21Å; S255-E258 PolarHBondContact N-OE2 3.16Å; S255-E258 PolarHBondContact O-N 3.33Å; S255-E258 VanDerWaalsContact OG-CD 3.26Å; S255-E258 VanDerWaalsContact OG-CG 3.25Å; S255-E258 WeakPolarHBondContact OG-CG 3.48Å; S255-E258 PolarHBondContact OG-N 2.97Å; S255-E258 PolarHBondContact OG-OE2 2.58Å; E258-R262 VanDerWaalsContact O-CB 3.24Å; E258-R262 WeakPolarHBondContact O-CB 3.25Å; E258-R262 PolarHBondContact O-N 3.3Å
259	A	95.9	Very high	92.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-49.1	178.2	0	0	0	0	0	110.9	I245 L248 M249 L254 S255 L256 R262 V263	I245-A259 HydrophobicContact CG2-CB 4.04Å; L248-A259 HydrophobicContact CB-CB 3.88Å; L248-A259 HydrophobicContact CD1-CB 4.46Å; M249-A259 HydrophobicContact CG-CB 3.86Å; L254-A259 HydrophobicContact CB-CB 4.22Å; S255-A259 WeakPolarHBondContact O-CB 3.48Å; S255-A259 PolarHBondContact O-N 3.49Å; L256-A259 PolarHBondContact O-N 2.78Å; A259-R262 PolarHBondContact O-N 3.39Å; A259-V263 WeakPolarHBondContact O-CG2 3.22Å; A259-V263 PolarHBondContact O-N 3.03Å; A259-V263 VanDerWaalsContact O-N 3.13Å
260	C	96.1	Very high	92	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.5	-41.6	179.1	-61.7	0	0	0	0	112.5	I245 L256 R262 V263 V264 L277 V287 P289	I245-C260 HydrophobicContact CD1-CB 4.48Å; L256-C260 WeakPolarHBondContact O-CB 3.28Å; L256-C260 PolarHBondContact O-N 3.38Å; L256-C260 PolarHBondContact O-SG 3.03Å; C260-R262 VanDerWaalsContact C-N 3.34Å; C260-R262 PolarHBondContact O-N 3.07Å; C260-V263 PolarHBondContact O-N 3.37Å; C260-V264 WeakPolarHBondContact O-CB 3.26Å; C260-V264 WeakPolarHBondContact O-CG2 3.34Å; C260-V264 PolarHBondContact O-N 3.45Å; C260-L277 HydrophobicContact CB-CD1 4.27Å; C260-V287 HydrophobicContact CB-CG1 3.98Å; C260-P289 HydrophobicContact CB-CG 3.61Å
261	E	91.9	Very high	91.8	Very high	93 Å²	93	56.4 Å²	56.4	44%	0.435	32%	0.321	S	S	.	.	H	α-helix	trans	-60.5	-44.2	177	-171.6	73.4	175.3	0	0	110.9	A257 V263 V264 M265	A257-E261 VanDerWaalsContact O-CB 3.24Å; A257-E261 WeakPolarHBondContact O-CB 3.47Å; A257-E261 PolarHBondContact O-N 2.86Å; E261-V263 VanDerWaalsContact C-N 3.33Å; E261-V263 PolarHBondContact O-N 3.2Å; E261-V264 PolarHBondContact O-N 2.8Å; E261-M265 HydrophobicContact CG-CB 4.37Å; E261-M265 HydrophobicContact CG-CG 4.09Å; E261-M265 WeakPolarHBondContact O-CA 3.31Å; E261-M265 VanDerWaalsContact O-CB 3.32Å; E261-M265 WeakPolarHBondContact O-CB 3.44Å; E261-M265 PolarHBondContact O-N 2.61Å; E261-M265 VanDerWaalsContact OE1-CG 3.29Å; E261-M265 WeakPolarHBondContact OE1-CG 3.36Å; E261-M265 VanDerWaalsContact OE2-CG 3.29Å; E261-M265 WeakPolarHBondContact OE2-CG 3.44Å
262	R	93.4	Very high	91.3	Very high	111 Å²	111	50.5 Å²	50.5	42%	0.419	32%	0.315	S	S	.	.	I	π-helix	trans	-64	-36.9	178.7	-172.8	162.9	-172.7	173.1	-2.6	112.9	L248 E258 A259 C260 E266 K267	L248-R262 HydrophobicContact CD1-CB 4.42Å; L248-R262 HydrophobicContact CD1-CG 4.47Å; E258-R262 VanDerWaalsContact O-CB 3.24Å; E258-R262 WeakPolarHBondContact O-CB 3.25Å; E258-R262 PolarHBondContact O-N 3.3Å; A259-R262 PolarHBondContact O-N 3.39Å; C260-R262 VanDerWaalsContact C-N 3.34Å; C260-R262 PolarHBondContact O-N 3.07Å; R262-E266 WeakPolarHBondContact O-CB 3.47Å; R262-K267 PolarHBondContact O-N 2.93Å
263	V	95.3	Very high	91.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	30%	0.295	C	S	.	.	I	π-helix	trans	-71.9	-51.9	175.5	175.6	0	0	0	0	110.3	A241 D244 I245 L248 A259 C260 E261 K267 L268	A241-V263 HydrophobicContact CB-CG1 4.12Å; D244-V263 HydrophobicContact CB-CG2 4.36Å; D244-V263 WeakPolarHBondContact OD2-CG2 3.38Å; I245-V263 HydrophobicContact CG1-CB 4.28Å; I245-V263 HydrophobicContact CG1-CG2 3.9Å; L248-V263 HydrophobicContact CD1-CG2 3.78Å; A259-V263 WeakPolarHBondContact O-CG2 3.22Å; A259-V263 PolarHBondContact O-N 3.03Å; A259-V263 VanDerWaalsContact O-N 3.13Å; C260-V263 PolarHBondContact O-N 3.37Å; E261-V263 VanDerWaalsContact C-N 3.33Å; E261-V263 PolarHBondContact O-N 3.2Å; V263-K267 PolarHBondContact O-N 3.47Å; V263-L268 HydrophobicContact CG1-CD1 4.4Å; V263-L268 HydrophobicContact CG1-CG 4.28Å; V263-L268 WeakPolarHBondContact O-CB 3.33Å; V263-L268 WeakPolarHBondContact O-CG 3.22Å; V263-L268 PolarHBondContact O-N 3.41Å
264	V	93	Very high	90.9	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-81.6	-37.6	-168.1	177.3	0	0	0	0	114.2	C260 E261 L268 P269 L277 P289 N291	C260-V264 WeakPolarHBondContact O-CB 3.26Å; C260-V264 WeakPolarHBondContact O-CG2 3.34Å; C260-V264 PolarHBondContact O-N 3.45Å; E261-V264 PolarHBondContact O-N 2.8Å; V264-L268 HydrophobicContact CG2-CD1 4.4Å; V264-P269 WeakPolarHBondContact O-CD 3.4Å; V264-L277 HydrophobicContact CG2-CD2 3.33Å; V264-L277 HydrophobicContact CG2-CG 3.8Å; V264-P289 HydrophobicContact CB-CB 4.18Å; V264-P289 HydrophobicContact CB-CG 4.3Å; V264-P289 HydrophobicContact CG1-CB 4.16Å; V264-P289 HydrophobicContact CG2-CB 4.39Å; V264-P289 HydrophobicContact CG2-CG 4.01Å; V264-N291 HydrophobicContact CG1-CB 4.33Å; V264-N291 PolarHBondContact O-ND2 2.78Å
265	M	89.8	Confident	90.8	Very high	50 Å²	50	45.4 Å²	45.4	25%	0.246	27%	0.265	C	S	.	.	I	π-helix	trans	-97.1	-18.6	-176.7	-53.5	-54.4	-179.2	0	0	113.4	E261 P269 P289 F290 N291 R312	E261-M265 HydrophobicContact CG-CB 4.37Å; E261-M265 HydrophobicContact CG-CG 4.09Å; E261-M265 WeakPolarHBondContact O-CA 3.31Å; E261-M265 VanDerWaalsContact O-CB 3.32Å; E261-M265 WeakPolarHBondContact O-CB 3.44Å; E261-M265 PolarHBondContact O-N 2.61Å; E261-M265 VanDerWaalsContact OE1-CG 3.29Å; E261-M265 WeakPolarHBondContact OE1-CG 3.36Å; E261-M265 VanDerWaalsContact OE2-CG 3.29Å; E261-M265 WeakPolarHBondContact OE2-CG 3.44Å; M265-P269 WeakPolarHBondContact O-CG 3.42Å; M265-P289 HydrophobicContact CE-CB 3.95Å; M265-F290 WeakPolarHBondContact CE-O 3.19Å; M265-N291 HydrophobicContact SD-CB 4.01Å; M265-R312 PolarHBondContact SD-NH2 3.12Å
266	E	91	Very high	90.7	Very high	115 Å²	115	42.6 Å²	42.6	54%	0.537	25%	0.245	S	C	.	.	I	π-helix	trans	-114.2	-65.5	180	-50.7	178.6	-176.5	0	0	112.7	R262 A270	R262-E266 WeakPolarHBondContact O-CB 3.47Å; E266-A270 VanDerWaalsContact O-CB 3.24Å; E266-A270 WeakPolarHBondContact O-CB 3.22Å; E266-A270 PolarHBondContact O-N 3.34Å
267	K	91.7	Very high	90.7	Very high	66 Å²	66	42.4 Å²	42.4	29%	0.287	24%	0.244	S	C	.	.	I	π-helix	trans	-65.5	-47.7	-171.1	-72.7	-176.1	-179.4	-179.9	0	112.6	D244 R262 V263 A270 L271	D244-K267 IonicContact OD1-NZ 3.96Å; D244-K267 PolarHBondContact OD1-NZ 3.27Å; D244-K267 WeakPolarHBondContact OD2-CD 3.32Å; D244-K267 WeakPolarHBondContact OD2-CE 3.48Å; D244-K267 IonicContact OD2-NZ 2.83Å; D244-K267 PolarHBondContact OD2-NZ 3.22Å; R262-K267 PolarHBondContact O-N 2.93Å; V263-K267 PolarHBondContact O-N 3.47Å; K267-A270 PolarHBondContact O-N 3.09Å; K267-L271 WeakPolarHBondContact O-CG 3.42Å; K267-L271 PolarHBondContact O-N 2.95Å
268	L	89.7	Confident	90.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-51.4	-179.6	-70.7	179.4	0	0	0	111.6	V235 F236 A239 A241 V263 V264 A270 L271 G272 G273	V235-L268 HydrophobicContact CG1-CD2 3.86Å; F236-L268 HydrophobicContact CD1-CD1 4.38Å; F236-L268 HydrophobicContact CD2-CD1 4.3Å; F236-L268 HydrophobicContact CD2-CD2 4.14Å; F236-L268 HydrophobicContact CE1-CD1 3.73Å; F236-L268 HydrophobicContact CE2-CD1 3.66Å; F236-L268 HydrophobicContact CE2-CD2 4.24Å; F236-L268 HydrophobicContact CG-CD2 4.4Å; F236-L268 HydrophobicContact CZ-CD1 3.34Å; A239-L268 HydrophobicContact CB-CD2 4.02Å; A241-L268 HydrophobicContact CB-CD2 4.44Å; V263-L268 HydrophobicContact CG1-CD1 4.4Å; V263-L268 HydrophobicContact CG1-CG 4.28Å; V263-L268 WeakPolarHBondContact O-CB 3.33Å; V263-L268 WeakPolarHBondContact O-CG 3.22Å; V263-L268 PolarHBondContact O-N 3.41Å; V264-L268 HydrophobicContact CG2-CD1 4.4Å; L268-A270 VanDerWaalsContact C-N 3.31Å; L268-A270 PolarHBondContact O-N 3.12Å; L268-L271 CarbonylContact O-C 3.51Å; L268-L271 PolarHBondContact O-N 3.01Å; L268-G272 PolarHBondContact O-N 3.3Å; L268-G273 CarbonylContact C-O 3.58Å; L268-G273 WeakPolarHBondContact O-CA 3.26Å; L268-G273 PolarHBondContact O-N 3.22Å
269	P	87.1	Confident	91.2	Very high	58 Å²	58	35.7 Å²	35.7	38%	0.377	20%	0.204	S	C	.	.	H	α-helix	trans	-59.1	-37.9	175.3	-29.2	37.7	0	0	0	113.9	V264 M265 L271 G272 N291	V264-P269 WeakPolarHBondContact O-CD 3.4Å; M265-P269 WeakPolarHBondContact O-CG 3.42Å; P269-L271 PolarHBondContact O-N 2.96Å; P269-G272 PolarHBondContact O-N 2.76Å; P269-N291 WeakPolarHBondContact CG-ND2 3.48Å
270	A	87.3	Confident	91.3	Very high	88 Å²	88	35.7 Å²	35.7	73%	0.727	20%	0.204	S	C	*	.	H	α-helix	trans	-63	-24.7	176.8	0	0	0	0	0	113.1	E266 K267 L268	E266-A270 VanDerWaalsContact O-CB 3.24Å; E266-A270 WeakPolarHBondContact O-CB 3.22Å; E266-A270 PolarHBondContact O-N 3.34Å; K267-A270 PolarHBondContact O-N 3.09Å; L268-A270 VanDerWaalsContact C-N 3.31Å; L268-A270 PolarHBondContact O-N 3.12Å
271	L	87.3	Confident	91.3	Very high	73 Å²	73	36.1 Å²	36.1	38%	0.382	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	2.9	173.9	-65.3	173.6	0	0	0	113.2	V235 A239 K267 L268 P269 G273	V235-L271 HydrophobicContact CG1-CB 3.57Å; V235-L271 HydrophobicContact CG1-CD1 4.15Å; A239-L271 HydrophobicContact CB-CD1 4.08Å; K267-L271 WeakPolarHBondContact O-CG 3.42Å; K267-L271 PolarHBondContact O-N 2.95Å; L268-L271 CarbonylContact O-C 3.51Å; L268-L271 PolarHBondContact O-N 3.01Å; P269-L271 PolarHBondContact O-N 2.96Å; L271-G273 VanDerWaalsContact C-N 3.34Å
272	G	82.7	Confident	91.3	Very high	56 Å²	56	36.4 Å²	36.4	58%	0.577	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.6	13.4	-175.3	0	0	0	0	0	114.3	L268 P269	L268-G272 PolarHBondContact O-N 3.3Å; P269-G272 PolarHBondContact O-N 2.76Å
273	G	83.1	Confident	91.2	Very high	4 Å²	4	37 Å²	37	4%	0.041	22%	0.215	C	C	.	.			trans	-87.8	148.1	-179.8	0	0	0	0	0	113.5	T232 L268 L271 N291	T232-G273 VanDerWaalsContact OG1-CA 3.23Å; T232-G273 WeakPolarHBondContact OG1-CA 3.27Å; L268-G273 CarbonylContact C-O 3.58Å; L268-G273 WeakPolarHBondContact O-CA 3.26Å; L268-G273 PolarHBondContact O-N 3.22Å; L271-G273 VanDerWaalsContact C-N 3.34Å; G273-N291 PolarHBondContact O-ND2 3.48Å
274	S	86.3	Confident	91	Very high	36 Å²	36	37 Å²	37	25%	0.252	22%	0.215	S	C	.	.			trans	-129.7	150.6	172.4	68.7	0	0	0	0	111.4	G231 T232 N291	G231-S274 CarbonylContact C-O 3.55Å; G231-S274 VanDerWaalsContact CA-O 3.31Å; G231-S274 WeakPolarHBondContact CA-O 3.46Å; T232-S274 WeakPolarHBondContact CG2-O 3.41Å; T232-S274 WeakPolarHBondContact CG2-OG 3.38Å; T232-S274 PolarHBondContact N-O 3Å; T232-S274 PolarHBondContact OG1-N 3.48Å; T232-S274 PolarHBondContact OG1-O 3.18Å; S274-N291 WeakPolarHBondContact CA-OD1 3.23Å
275	G	88.5	Confident	91.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.8	-156.9	-177.7	0	0	0	0	0	113	T230 F290 N291	T230-G275 CarbonylContact O-C 3.54Å; T230-G275 WeakPolarHBondContact O-CA 3.37Å; G275-F290 CarbonylContact O-C 3.53Å; G275-F290 WeakPolarHBondContact O-CA 3.47Å; G275-F290 WeakPolarHBondContact O-CB 3.3Å; G275-N291 PolarHBondContact N-OD1 3.25Å; G275-N291 PolarHBondContact O-N 2.73Å; G275-N291 PolarHBondContact O-OD1 3.48Å; G275-N291 VanDerWaalsContact O-OD1 3.11Å
276	G	92.5	Very high	91.3	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	-174.7	176.7	0	0	0	0	0	112	T230 P289	T230-G276 PolarHBondContact N-O 3.23Å; T230-G276 PolarHBondContact O-N 2.96Å; G276-P289 CarbonylContact C-O 3.59Å; G276-P289 WeakPolarHBondContact CA-O 3.18Å
277	L	95.9	Very high	91.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	165.9	178.4	58.6	91.6	0	0	0	110.8	V227 S228 C229 I245 C260 V264 A279 L288 P289	V227-L277 HydrophobicContact CG1-CB 4.29Å; V227-L277 HydrophobicContact CG1-CD1 4.24Å; V227-L277 HydrophobicContact CG1-CD2 4.49Å; S228-L277 CarbonylContact O-C 3.43Å; S228-L277 WeakPolarHBondContact O-CA 3.44Å; S228-L277 VanDerWaalsContact O-CB 3.27Å; S228-L277 WeakPolarHBondContact O-CB 3.27Å; C229-L277 HydrophobicContact CB-CB 4.43Å; I245-L277 HydrophobicContact CD1-CD1 3.76Å; I245-L277 HydrophobicContact CD1-CD2 3.41Å; I245-L277 VanDerWaalsContact CD1-CD2 3.41Å; I245-L277 HydrophobicContact CD1-CG 4.24Å; C260-L277 HydrophobicContact CB-CD1 4.27Å; V264-L277 HydrophobicContact CG2-CD2 3.33Å; V264-L277 HydrophobicContact CG2-CG 3.8Å; L277-A279 HydrophobicContact CD1-CB 3.97Å; L277-L288 CarbonylContact O-C 3.58Å; L277-L288 VanDerWaalsContact O-CA 3.31Å; L277-L288 WeakPolarHBondContact O-CA 3.37Å; L277-P289 HydrophobicContact CD1-CG 4.06Å; L277-P289 HydrophobicContact CG-CG 4.27Å; L277-P289 PolarHBondContact N-O 3.48Å; L277-P289 WeakPolarHBondContact O-CD 3.49Å
278	I	97.7	Very high	91.7	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.8	165.8	63	-174.5	0	0	0	108.2	A7 H9 V183 V227 S228 L288 M295	A7-I278 HydrophobicContact CB-CB 4.29Å; A7-I278 HydrophobicContact CB-CD1 4.42Å; A7-I278 WeakPolarHBondContact O-CD1 3.33Å; H9-I278 HydrophobicContact CB-CG2 4.01Å; V183-I278 HydrophobicContact CG1-CD1 4.37Å; V183-I278 HydrophobicContact CG1-CG1 4.06Å; V183-I278 HydrophobicContact CG2-CB 4.21Å; V183-I278 HydrophobicContact CG2-CD1 3.86Å; V183-I278 HydrophobicContact CG2-CG1 3.7Å; V227-I278 WeakPolarHBondContact CA-O 3.4Å; S228-I278 PolarHBondContact N-O 3.33Å; S228-I278 PolarHBondContact O-N 3.33Å; I278-L288 HydrophobicContact CG2-CB 4.29Å; I278-L288 HydrophobicContact CG2-CD2 3.74Å; I278-L288 HydrophobicContact CG2-CG 4.07Å; I278-M295 HydrophobicContact CG2-CE 4.28Å
279	A	98.2	Very high	91.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	143.1	179.5	0	0	0	0	0	112.4	V225 A226 V227 L256 L277 V286 V287	V225-A279 HydrophobicContact CG2-CB 3.99Å; A226-A279 CarbonylContact O-C 3.58Å; A226-A279 WeakPolarHBondContact O-CA 3.24Å; V227-A279 HydrophobicContact CG2-CB 4.05Å; L256-A279 HydrophobicContact CD1-CB 3.84Å; L277-A279 HydrophobicContact CD1-CB 3.97Å; A279-V286 WeakPolarHBondContact O-CA 3.45Å; A279-V287 PolarHBondContact N-O 3.21Å; A279-V287 PolarHBondContact O-N 3.25Å
280	I	98.1	Very high	92.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	128.8	174.5	-61.9	177.8	0	0	0	109	V5 A7 V183 L185 L191 V225 A226 N285 V286	V5-I280 HydrophobicContact CG1-CD1 3.91Å; V5-I280 HydrophobicContact CG1-CG2 3.73Å; V5-I280 HydrophobicContact CG2-CD1 4.25Å; A7-I280 HydrophobicContact CB-CD1 4.08Å; A7-I280 HydrophobicContact CB-CG1 4.45Å; V183-I280 HydrophobicContact CB-CD1 4.35Å; V183-I280 HydrophobicContact CB-CG1 4.45Å; V183-I280 HydrophobicContact CG2-CB 4.35Å; V183-I280 HydrophobicContact CG2-CD1 3.67Å; V183-I280 HydrophobicContact CG2-CG1 3.64Å; V183-I280 WeakPolarHBondContact O-CD1 3.49Å; L185-I280 HydrophobicContact CB-CG2 3.94Å; L191-I280 HydrophobicContact CD2-CB 4.35Å; L191-I280 HydrophobicContact CD2-CG2 3.92Å; V225-I280 CarbonylContact C-O 3.45Å; V225-I280 WeakPolarHBondContact CA-O 3.44Å; V225-I280 WeakPolarHBondContact CG2-O 3.38Å; A226-I280 PolarHBondContact N-O 3.35Å; A226-I280 PolarHBondContact O-N 2.83Å; I280-N285 VanDerWaalsContact CA-O 3.29Å; I280-N285 WeakPolarHBondContact CA-O 3.43Å; I280-V286 HydrophobicContact CD1-CG2 4.49Å; I280-V286 HydrophobicContact CG1-CG1 4.24Å; I280-V286 HydrophobicContact CG1-CG2 4.18Å
281	D	96.2	Very high	92.1	Very high	8 Å²	8	28.7 Å²	28.7	4%	0.043	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	173.1	174.4	68.9	17.4	0	0	0	112.8	S224 M249 L256 E283 G284 N285	S224-D281 WeakPolarHBondContact O-CA 3.37Å; S224-D281 WeakPolarHBondContact O-CB 3.38Å; M249-D281 HydrophobicContact CE-CB 3.88Å; L256-D281 HydrophobicContact CB-CB 4.4Å; L256-D281 HydrophobicContact CD2-CB 4.01Å; D281-E283 PolarHBondContact O-N 3.05Å; D281-E283 VanDerWaalsContact O-N 3.13Å; D281-E283 WeakPolarHBondContact OD1-CA 3.49Å; D281-E283 WeakPolarHBondContact OD1-CB 3.29Å; D281-E283 PolarHBondContact OD1-N 2.88Å; D281-G284 PolarHBondContact O-N 3Å; D281-G284 PolarHBondContact OD1-N 3.39Å; D281-G284 VanDerWaalsContact OD1-N 3.08Å; D281-N285 PolarHBondContact N-O 2.78Å; D281-N285 WeakPolarHBondContact OD1-CB 3.39Å; D281-N285 PolarHBondContact OD1-N 2.9Å; D281-N285 PolarHBondContact OD1-ND2 3.42Å; D281-N285 WeakPolarHBondContact OD2-CB 3.37Å; D281-N285 PolarHBondContact OD2-ND2 3.05Å
282	H	92.2	Very high	91.9	Very high	99 Å²	99	25.7 Å²	25.7	46%	0.458	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.8	-180	73.6	-77.1	0	0	0	114.4	L191 N222 S224	L191-H282 HydrophobicContact CD1-CB 4.43Å; N222-H282 WeakPolarHBondContact O-CB 3.48Å; S224-H282 PolarHBondContact O-N 3.02Å
283	E	91.1	Very high	91.7	Very high	124 Å²	124	26.8 Å²	26.8	58%	0.579	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-8.3	175.1	-58.6	-173.5	163.4	0	0	112.2	D281 N285	D281-E283 PolarHBondContact O-N 3.05Å; D281-E283 VanDerWaalsContact O-N 3.13Å; D281-E283 WeakPolarHBondContact OD1-CA 3.49Å; D281-E283 WeakPolarHBondContact OD1-CB 3.29Å; D281-E283 PolarHBondContact OD1-N 2.88Å; E283-N285 PolarHBondContact OE2-ND2 2.81Å
284	G	91.6	Very high	91.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.			trans	82.2	21.2	-176.7	0	0	0	0	0	113.5	L185 D281 Y301	L185-G284 VanDerWaalsContact CD2-CA 3.49Å; D281-G284 PolarHBondContact O-N 3Å; D281-G284 PolarHBondContact OD1-N 3.39Å; D281-G284 VanDerWaalsContact OD1-N 3.08Å; G284-Y301 WeakPolarHBondContact O-CE1 3.48Å; G284-Y301 PolarHBondContact O-OH 3.39Å
285	N	94.4	Very high	91.8	Very high	65 Å²	65	24.9 Å²	24.9	35%	0.348	13%	0.125	S	C	.	.			trans	-74.5	141.7	168.9	-55.7	-54.8	0	0	0	109.2	L256 I280 D281 E283	L256-N285 HydrophobicContact CD2-CB 4.13Å; L256-N285 VanDerWaalsContact CD2-O 3.29Å; L256-N285 WeakPolarHBondContact CD2-O 3.46Å; I280-N285 VanDerWaalsContact CA-O 3.29Å; I280-N285 WeakPolarHBondContact CA-O 3.43Å; D281-N285 PolarHBondContact N-O 2.78Å; D281-N285 WeakPolarHBondContact OD1-CB 3.39Å; D281-N285 PolarHBondContact OD1-N 2.9Å; D281-N285 PolarHBondContact OD1-ND2 3.42Å; D281-N285 WeakPolarHBondContact OD2-CB 3.37Å; D281-N285 PolarHBondContact OD2-ND2 3.05Å; E283-N285 PolarHBondContact OE2-ND2 2.81Å
286	V	95	Very high	92	Very high	27 Å²	27	25.6 Å²	25.6	16%	0.164	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.1	-177.4	-169.5	0	0	0	0	109.7	V5 A7 A279 I280 L288 W299	V5-V286 HydrophobicContact CG1-CG2 4.46Å; V5-V286 HydrophobicContact CG2-CG2 3.51Å; A7-V286 HydrophobicContact CB-CG1 3.93Å; A279-V286 WeakPolarHBondContact O-CA 3.45Å; I280-V286 HydrophobicContact CD1-CG2 4.49Å; I280-V286 HydrophobicContact CG1-CG1 4.24Å; I280-V286 HydrophobicContact CG1-CG2 4.18Å; V286-L288 HydrophobicContact CG1-CD1 3.74Å; V286-L288 HydrophobicContact CG1-CG 4.29Å; V286-W299 HydrophobicContact CB-CD2 4.44Å; V286-W299 HydrophobicContact CB-CE3 4.23Å; V286-W299 HydrophobicContact CG1-CB 4.17Å; V286-W299 HydrophobicContact CG1-CD2 4.23Å; V286-W299 HydrophobicContact CG1-CE3 4.36Å; V286-W299 HydrophobicContact CG1-CG 4.16Å; V286-W299 HydrophobicContact CG2-CE3 3.84Å; V286-W299 HydrophobicContact CG2-CZ3 4.15Å
287	V	95.4	Very high	92.1	Very high	29 Å²	29	25.8 Å²	25.8	18%	0.176	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.8	177.1	-177.1	0	0	0	0	109.5	L256 A257 C260 A279 P289	L256-V287 HydrophobicContact CB-CG2 4.39Å; L256-V287 HydrophobicContact CD2-CB 4.25Å; L256-V287 HydrophobicContact CD2-CG2 3.71Å; L256-V287 HydrophobicContact CG-CB 4.21Å; L256-V287 HydrophobicContact CG-CG2 3.72Å; A257-V287 HydrophobicContact CB-CG2 4.21Å; C260-V287 HydrophobicContact CB-CG1 3.98Å; A279-V287 PolarHBondContact N-O 3.21Å; A279-V287 PolarHBondContact O-N 3.25Å; V287-P289 HydrophobicContact CG1-CG 3.99Å
288	L	95.5	Very high	92.1	Very high	26 Å²	26	25.9 Å²	25.9	14%	0.136	13%	0.129	C	C	.	.			trans	-128.6	57.6	-175.5	-48.5	92.7	0	0	0	113.1	A7 L277 I278 V286 M295 R297 W299	A7-L288 HydrophobicContact CB-CD2 4.47Å; L277-L288 CarbonylContact O-C 3.58Å; L277-L288 VanDerWaalsContact O-CA 3.31Å; L277-L288 WeakPolarHBondContact O-CA 3.37Å; I278-L288 HydrophobicContact CG2-CB 4.29Å; I278-L288 HydrophobicContact CG2-CD2 3.74Å; I278-L288 HydrophobicContact CG2-CG 4.07Å; V286-L288 HydrophobicContact CG1-CD1 3.74Å; V286-L288 HydrophobicContact CG1-CG 4.29Å; L288-M295 HydrophobicContact CB-CE 4.02Å; L288-R297 HydrophobicContact CD2-CB 3.85Å; L288-R297 HydrophobicContact CD2-CG 4.16Å; L288-W299 HydrophobicContact CD1-CG 4.25Å; L288-W299 HydrophobicContact CD2-CB 4.4Å
289	P	93.7	Very high	92	Very high	11 Å²	11	28.7 Å²	28.7	7%	0.071	14%	0.14	C	C	.	.			trans	-78.4	148.7	-174	28.1	-22.9	0	0	0	112.1	C260 V264 M265 G276 L277 V287	C260-P289 HydrophobicContact CB-CG 3.61Å; V264-P289 HydrophobicContact CB-CB 4.18Å; V264-P289 HydrophobicContact CB-CG 4.3Å; V264-P289 HydrophobicContact CG1-CB 4.16Å; V264-P289 HydrophobicContact CG2-CB 4.39Å; V264-P289 HydrophobicContact CG2-CG 4.01Å; M265-P289 HydrophobicContact CE-CB 3.95Å; G276-P289 CarbonylContact C-O 3.59Å; G276-P289 WeakPolarHBondContact CA-O 3.18Å; L277-P289 HydrophobicContact CD1-CG 4.06Å; L277-P289 HydrophobicContact CG-CG 4.27Å; L277-P289 PolarHBondContact N-O 3.48Å; L277-P289 WeakPolarHBondContact O-CD 3.49Å; V287-P289 HydrophobicContact CG1-CG 3.99Å
290	F	91.4	Very high	91.8	Very high	7 Å²	7	28.8 Å²	28.8	3%	0.031	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-154.9	145.5	175.7	60.6	-80	0	0	0	110.2	M265 G275 T292 M295 R297 R312	M265-F290 WeakPolarHBondContact CE-O 3.19Å; G275-F290 CarbonylContact O-C 3.53Å; G275-F290 WeakPolarHBondContact O-CA 3.47Å; G275-F290 WeakPolarHBondContact O-CB 3.3Å; F290-T292 WeakPolarHBondContact CD2-O 3.19Å; F290-M295 HydrophobicContact CB-CB 3.92Å; F290-M295 HydrophobicContact CB-CE 4.37Å; F290-M295 HydrophobicContact CB-SD 3.94Å; F290-M295 HydrophobicContact CD1-CB 3.93Å; F290-M295 HydrophobicContact CD1-CE 4.03Å; F290-M295 HydrophobicContact CD2-CB 4Å; F290-M295 HydrophobicContact CE1-CB 4.45Å; F290-M295 HydrophobicContact CE2-CB 4.47Å; F290-M295 HydrophobicContact CG-CB 3.68Å; F290-M295 HydrophobicContact CG-SD 4.48Å; F290-R297 VanDerWaalsContact CE1-NH1 3.29Å; F290-R312 HydrophobicContact CD2-CG 4.46Å; F290-R312 HydrophobicContact CE1-CG 3.95Å; F290-R312 HydrophobicContact CE2-CG 3.44Å; F290-R312 VanDerWaalsContact CE2-CG 3.44Å; F290-R312 HydrophobicContact CZ-CB 4.07Å; F290-R312 HydrophobicContact CZ-CG 3.14Å; F290-R312 PolarHBondContact O-NE 2.92Å; F290-R312 PolarHBondContact O-NH2 3.03Å
291	N	88.3	Confident	91.6	Very high	38 Å²	38	30.5 Å²	30.5	20%	0.203	15%	0.148	C	C	.	.	S	Bend	trans	-107.8	9.6	-178.7	68	17.8	0	0	0	113.5	V264 M265 P269 G273 S274 G275	V264-N291 HydrophobicContact CG1-CB 4.33Å; V264-N291 PolarHBondContact O-ND2 2.78Å; M265-N291 HydrophobicContact SD-CB 4.01Å; P269-N291 WeakPolarHBondContact CG-ND2 3.48Å; G273-N291 PolarHBondContact O-ND2 3.48Å; S274-N291 WeakPolarHBondContact CA-OD1 3.23Å; G275-N291 PolarHBondContact N-OD1 3.25Å; G275-N291 PolarHBondContact O-N 2.73Å; G275-N291 PolarHBondContact O-OD1 3.48Å; G275-N291 VanDerWaalsContact O-OD1 3.11Å
292	T	82.4	Confident	91.3	Very high	9 Å²	9	31.6 Å²	31.6	6%	0.055	16%	0.158	C	C	.	.	S	Bend	trans	-91.5	174.2	174.2	54	0	0	0	0	112	A12 F290 G294	A12-T292 HydrophobicContact CB-CG2 4.42Å; F290-T292 WeakPolarHBondContact CD2-O 3.19Å; T292-G294 VanDerWaalsContact C-N 3.28Å; T292-G294 PolarHBondContact O-N 3.09Å; T292-G294 PolarHBondContact OG1-O 3.26Å
293	E	78.5	Confident	90.8	Very high	79 Å²	79	29.8 Å²	29.8	37%	0.369	17%	0.166	S	C	.	.	S	Bend	trans	-61.7	-37.5	175.4	-170.1	-177.9	164.2	0	0	112.1	I15 S16 R17	I15-E293 WeakPolarHBondContact O-CG 3.13Å; S16-E293 WeakPolarHBondContact CA-OE1 3.42Å; R17-E293 PolarHBondContact N-OE1 2.98Å
294	G	82.2	Confident	90.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	161.8	174.2	0	0	0	0	0	113.3	G13 T292 I310	G13-G294 PolarHBondContact N-O 2.74Å; T292-G294 VanDerWaalsContact C-N 3.28Å; T292-G294 PolarHBondContact O-N 3.09Å; T292-G294 PolarHBondContact OG1-O 3.26Å; G294-I310 CarbonylContact C-O 3.57Å; G294-I310 WeakPolarHBondContact CA-O 3.49Å
295	M	90.2	Very high	90.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	118.8	169.1	-180	173.6	82.5	0	0	108.6	H9 G11 A12 T230 I278 L288 F290 R297 I310	H9-M295 HydrophobicContact CB-CG 4.47Å; H9-M295 HydrophobicContact CB-SD 4.49Å; G11-M295 WeakPolarHBondContact O-CA 3.24Å; A12-M295 HydrophobicContact CB-CB 3.94Å; A12-M295 HydrophobicContact CB-CG 3.88Å; A12-M295 HydrophobicContact CB-SD 4.18Å; T230-M295 HydrophobicContact CG2-CG 4.41Å; T230-M295 HydrophobicContact CG2-SD 3.94Å; I278-M295 HydrophobicContact CG2-CE 4.28Å; L288-M295 HydrophobicContact CB-CE 4.02Å; F290-M295 HydrophobicContact CB-CB 3.92Å; F290-M295 HydrophobicContact CB-CE 4.37Å; F290-M295 HydrophobicContact CB-SD 3.94Å; F290-M295 HydrophobicContact CD1-CB 3.93Å; F290-M295 HydrophobicContact CD1-CE 4.03Å; F290-M295 HydrophobicContact CD2-CB 4Å; F290-M295 HydrophobicContact CE1-CB 4.45Å; F290-M295 HydrophobicContact CE2-CB 4.47Å; F290-M295 HydrophobicContact CG-CB 3.68Å; F290-M295 HydrophobicContact CG-SD 4.48Å; M295-R297 HydrophobicContact CE-CB 3.98Å; M295-R297 HydrophobicContact CE-CG 4.44Å; M295-R297 PolarHBondContact O-N 2.88Å; M295-R297 PolarHBondContact O-NH1 2.9Å; M295-I310 CarbonylContact C-O 3.58Å; M295-I310 PolarHBondContact N-O 3Å; M295-I310 CarbonylContact O-C 3.59Å; M295-I310 WeakPolarHBondContact O-CA 3.45Å
296	Y	91.9	Very high	89.9	Confident	15 Å²	15	32 Å²	32	6%	0.059	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	116.5	171.2	-60.1	-75.4	0	0	0	108.4	H9 G10 G11 I15 M20 Y28 F66 I310	H9-Y296 CarbonylContact C-O 3.53Å; H9-Y296 WeakPolarHBondContact CA-O 3.49Å; H9-Y296 WeakPolarHBondContact CB-O 3.22Å; G10-Y296 PolarHBondContact N-O 3.19Å; G11-Y296 WeakPolarHBondContact O-CD2 3Å; G11-Y296 PolarHBondContact O-N 2.82Å; G11-Y296 VanDerWaalsContact O-N 3.08Å; I15-Y296 HydrophobicContact CD1-CD2 3.63Å; I15-Y296 HydrophobicContact CD1-CE1 4.34Å; I15-Y296 HydrophobicContact CD1-CE2 3.33Å; I15-Y296 HydrophobicContact CD1-CG 4.24Å; I15-Y296 HydrophobicContact CG1-CE2 3.99Å; M20-Y296 HydrophobicContact CE-CE1 3.92Å; M20-Y296 WeakPolarHBondContact CE-OH 3.47Å; Y28-Y296 AromaticContact CD1-CD1 3.62Å; Y28-Y296 HydrophobicContact CD1-CD1 3.62Å; Y28-Y296 AromaticContact CD1-CE1 3.36Å; Y28-Y296 HydrophobicContact CD1-CE1 3.36Å; Y28-Y296 HydrophobicContact CD1-CG 4.33Å; Y28-Y296 AromaticContact CD1-CZ 3.87Å; Y28-Y296 AromaticContact CD2-CE1 3.79Å; Y28-Y296 HydrophobicContact CD2-CE1 3.79Å; Y28-Y296 HydrophobicContact CE1-CD1 4.23Å; Y28-Y296 AromaticContact CE1-CE1 3.68Å; Y28-Y296 HydrophobicContact CE1-CE1 3.68Å; Y28-Y296 HydrophobicContact CE1-CE2 4.19Å; Y28-Y296 AromaticContact CE1-CZ 3.67Å; Y28-Y296 HydrophobicContact CE2-CE1 4.14Å; Y28-Y296 AromaticContact CG-CD1 3.85Å; Y28-Y296 HydrophobicContact CG-CD1 3.85Å; Y28-Y296 AromaticContact CG-CE1 3.42Å; Y28-Y296 HydrophobicContact CG-CE1 3.42Å; Y28-Y296 VanDerWaalsContact CG-CE1 3.42Å; Y28-Y296 AromaticContact CZ-CZ 3.88Å; F66-Y296 HydrophobicContact CE1-CG 4.31Å; Y296-I310 HydrophobicContact CD1-CB 4.45Å; Y296-I310 HydrophobicContact CD1-CD1 3.82Å; Y296-I310 HydrophobicContact CD1-CG1 3.74Å; Y296-I310 HydrophobicContact CD1-CG2 3.98Å; Y296-I310 HydrophobicContact CE1-CD1 3.86Å; Y296-I310 HydrophobicContact CE1-CG1 4.2Å; Y296-I310 HydrophobicContact CE1-CG2 3.95Å
297	R	94.6	Very high	89.6	Confident	5 Å²	5	33.8 Å²	33.8	2%	0.019	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	149.2	-175.2	66.9	-171.8	178.6	-75.3	0.7	111.7	I8 L288 F290 M295 G309 I310 Y311 D316	I8-R297 WeakPolarHBondContact O-CA 3.41Å; L288-R297 HydrophobicContact CD2-CB 3.85Å; L288-R297 HydrophobicContact CD2-CG 4.16Å; F290-R297 VanDerWaalsContact CE1-NH1 3.29Å; M295-R297 HydrophobicContact CE-CB 3.98Å; M295-R297 HydrophobicContact CE-CG 4.44Å; M295-R297 PolarHBondContact O-N 2.88Å; M295-R297 PolarHBondContact O-NH1 2.9Å; R297-G309 WeakPolarHBondContact CG-O 3.47Å; R297-G309 PolarHBondContact N-O 3.3Å; R297-G309 PolarHBondContact O-N 2.86Å; R297-G309 VanDerWaalsContact O-O 3.05Å; R297-I310 PolarHBondContact NH1-O 3.14Å; R297-Y311 PolarHBondContact NH1-O 2.83Å; R297-Y311 PolarHBondContact NH2-O 2.93Å; R297-D316 IonicContact CZ-OD2 3.99Å; R297-D316 IonicContact NE-OD2 2.68Å; R297-D316 PolarHBondContact NE-OD2 3.13Å; R297-D316 IonicContact NH2-OD2 3.87Å; R297-D316 PolarHBondContact NH2-OD2 3.05Å
298	A	94.7	Very high	89.2	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	154.8	170.2	0	0	0	0	0	110.9	A7 I8 L32 V36 T307 T308	A7-A298 CarbonylContact C-O 3.57Å; A7-A298 WeakPolarHBondContact CA-O 3.08Å; I8-A298 HydrophobicContact CD1-CB 4.31Å; I8-A298 HydrophobicContact CG1-CB 3.96Å; I8-A298 PolarHBondContact N-O 3.29Å; I8-A298 PolarHBondContact O-N 3.06Å; L32-A298 HydrophobicContact CB-CB 3.84Å; V36-A298 HydrophobicContact CG2-CB 3.56Å; A298-T307 CarbonylContact C-O 3.57Å; A298-T307 WeakPolarHBondContact CA-O 3.43Å; A298-T307 WeakPolarHBondContact CB-O 3.47Å; A298-T308 HydrophobicContact CB-CG2 3.72Å
299	W	97.3	Very high	88.7	Confident	59 Å²	59	33.4 Å²	33.4	22%	0.223	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	162.1	177.8	72.2	-83	0	0	0	111	V5 I6 A7 V286 L288 Y301 T307	V5-W299 HydrophobicContact CG2-CE3 4.21Å; I6-W299 CarbonylContact O-C 3.59Å; I6-W299 WeakPolarHBondContact O-CA 3.33Å; I6-W299 WeakPolarHBondContact O-CB 3.33Å; A7-W299 HydrophobicContact CB-CB 3.68Å; V286-W299 HydrophobicContact CB-CD2 4.44Å; V286-W299 HydrophobicContact CB-CE3 4.23Å; V286-W299 HydrophobicContact CG1-CB 4.17Å; V286-W299 HydrophobicContact CG1-CD2 4.23Å; V286-W299 HydrophobicContact CG1-CE3 4.36Å; V286-W299 HydrophobicContact CG1-CG 4.16Å; V286-W299 HydrophobicContact CG2-CE3 3.84Å; V286-W299 HydrophobicContact CG2-CZ3 4.15Å; L288-W299 HydrophobicContact CD1-CG 4.25Å; L288-W299 HydrophobicContact CD2-CB 4.4Å; W299-Y301 HydrophobicContact CH2-CD2 4.22Å; W299-Y301 AromaticContact CH2-CE2 3.79Å; W299-Y301 HydrophobicContact CH2-CE2 3.79Å; W299-Y301 AromaticContact CZ3-CD2 3.62Å; W299-Y301 HydrophobicContact CZ3-CD2 3.62Å; W299-Y301 AromaticContact CZ3-CE2 3.37Å; W299-Y301 HydrophobicContact CZ3-CE2 3.37Å; W299-Y301 HydrophobicContact CZ3-CG 4.42Å; W299-Y301 AromaticContact CZ3-CZ 3.94Å; W299-T307 PolarHBondContact N-O 3.33Å; W299-T307 PolarHBondContact O-N 2.97Å
300	G	92.6	Very high	88.2	Confident	2 Å²	2	33 Å²	33	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.7	142.8	176	0	0	0	0	0	113.2	I6	I6-G300 PolarHBondContact N-O 3.21Å; I6-G300 VanDerWaalsContact N-O 3.1Å; I6-G300 PolarHBondContact O-N 3.09Å
301	Y	94.3	Very high	87.7	Confident	36 Å²	36	33.4 Å²	33.4	14%	0.141	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	149.1	168.7	-68.2	-69.7	0	0	0	110.4	K3 A4 V5 Q40 G284 W299 G303 D304	K3-Y301 HydrophobicContact CB-CD1 3.78Å; K3-Y301 HydrophobicContact CB-CE1 3.69Å; K3-Y301 HydrophobicContact CD-CD1 4.2Å; K3-Y301 HydrophobicContact CD-CE1 3.69Å; K3-Y301 HydrophobicContact CG-CD1 4.37Å; K3-Y301 HydrophobicContact CG-CE1 4.25Å; A4-Y301 CarbonylContact O-C 3.47Å; A4-Y301 WeakPolarHBondContact O-CA 3.4Å; V5-Y301 HydrophobicContact CB-CD1 3.53Å; V5-Y301 HydrophobicContact CB-CE1 3.69Å; V5-Y301 HydrophobicContact CB-CG 4.46Å; V5-Y301 HydrophobicContact CG1-CD1 4.41Å; V5-Y301 HydrophobicContact CG1-CE1 4.15Å; V5-Y301 HydrophobicContact CG2-CD1 3.76Å; V5-Y301 HydrophobicContact CG2-CE1 3.76Å; V5-Y301 HydrophobicContact CG2-CG 4.35Å; Q40-Y301 PolarHBondContact NE2-O 3.28Å; G284-Y301 WeakPolarHBondContact O-CE1 3.48Å; G284-Y301 PolarHBondContact O-OH 3.39Å; W299-Y301 HydrophobicContact CH2-CD2 4.22Å; W299-Y301 AromaticContact CH2-CE2 3.79Å; W299-Y301 HydrophobicContact CH2-CE2 3.79Å; W299-Y301 AromaticContact CZ3-CD2 3.62Å; W299-Y301 HydrophobicContact CZ3-CD2 3.62Å; W299-Y301 AromaticContact CZ3-CE2 3.37Å; W299-Y301 HydrophobicContact CZ3-CE2 3.37Å; W299-Y301 HydrophobicContact CZ3-CG 4.42Å; W299-Y301 AromaticContact CZ3-CZ 3.94Å; Y301-G303 PolarHBondContact O-N 3.04Å; Y301-D304 PolarHBondContact O-N 3.47Å
302	A	89.9	Confident	86.6	Confident	32 Å²	32	38 Å²	38	26%	0.264	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	127.2	170.4	0	0	0	0	0	110.5	A4 L43 E44	A4-A302 HydrophobicContact CB-CB 3.99Å; A4-A302 PolarHBondContact O-N 2.81Å; L43-A302 HydrophobicContact CB-CB 4.33Å; E44-A302 HydrophobicContact CG-CB 3.87Å
303	G	81.4	Confident	84.9	Confident	60 Å²	60	43.8 Å²	43.8	62%	0.619	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.1	-11.3	-176.3	0	0	0	0	0	116.8	E44 Y301	E44-G303 VanDerWaalsContact OE1-CA 3.29Å; E44-G303 WeakPolarHBondContact OE1-CA 3.32Å; E44-G303 PolarHBondContact OE1-N 3.25Å; Y301-G303 PolarHBondContact O-N 3.04Å
304	D	87.8	Confident	82.8	Confident	95 Å²	95	45 Å²	45	51%	0.508	24%	0.243	S	C	.	.	S	Bend	trans	-95.5	162.7	-178.7	-74.8	-13	0	0	0	112.6	Q40 Y301	Q40-D304 PolarHBondContact NE2-O 3.49Å; Y301-D304 PolarHBondContact O-N 3.47Å
305	T	83.8	Confident	80.4	Confident	125 Å²	125	46.6 Å²	46.6	77%	0.767	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-72.9	132.2	171.7	-53.8	0	0	0	0	109.9	T307	T305-T307 PolarHBondContact O-N 3.36Å
306	P	86.9	Confident	77.5	Confident	17 Å²	17	51.3 Å²	51.3	11%	0.11	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-55.6	138.1	174.9	-19.9	25	0	0	0	112.3	V36 E37	V36-P306 HydrophobicContact CB-CB 4.15Å; V36-P306 HydrophobicContact CB-CG 4.4Å; V36-P306 HydrophobicContact CG1-CB 3.77Å; V36-P306 HydrophobicContact CG1-CG 4.03Å; E37-P306 HydrophobicContact CG-CG 3.5Å; E37-P306 VanDerWaalsContact CG-CG 3.5Å
307	T	89	Confident	74.6	Confident	63 Å²	63	55.1 Å²	55.1	39%	0.387	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	129.6	166.3	-58.9	0	0	0	0	108.4	A298 W299 T305	A298-T307 CarbonylContact C-O 3.57Å; A298-T307 WeakPolarHBondContact CA-O 3.43Å; A298-T307 WeakPolarHBondContact CB-O 3.47Å; W299-T307 PolarHBondContact N-O 3.33Å; W299-T307 PolarHBondContact O-N 2.97Å; T305-T307 PolarHBondContact O-N 3.36Å
308	T	87.3	Confident	71.4	Confident	40 Å²	40	62.2 Å²	62.2	25%	0.245	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	146.1	-178.7	52.9	0	0	0	0	109.9	I29 L32 A298	I29-T308 HydrophobicContact CG2-CG2 4.48Å; I29-T308 WeakPolarHBondContact CG2-OG1 3.27Å; L32-T308 HydrophobicContact CB-CG2 4.2Å; A298-T308 HydrophobicContact CB-CG2 3.72Å
309	G	84.8	Confident	68.6	Low	7 Å²	7	68.2 Å²	68.2	7%	0.072	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	152.6	179.4	0	0	0	0	0	112.2	R297	R297-G309 WeakPolarHBondContact CG-O 3.47Å; R297-G309 PolarHBondContact N-O 3.3Å; R297-G309 PolarHBondContact O-N 2.86Å; R297-G309 VanDerWaalsContact O-O 3.05Å
310	I	83.5	Confident	65.9	Low	4 Å²	4	73 Å²	73	2%	0.021	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	-60.4	175.7	-60.3	176.2	0	0	0	108.8	I15 M20 E25 I29 G294 M295 Y296 R297	I15-I310 HydrophobicContact CD1-CG2 4.19Å; I15-I310 HydrophobicContact CG2-CG2 3.94Å; M20-I310 HydrophobicContact SD-CD1 4.37Å; E25-I310 HydrophobicContact CG-CD1 3.9Å; I29-I310 HydrophobicContact CG1-CD1 4.19Å; G294-I310 CarbonylContact C-O 3.57Å; G294-I310 WeakPolarHBondContact CA-O 3.49Å; M295-I310 CarbonylContact C-O 3.58Å; M295-I310 PolarHBondContact N-O 3Å; M295-I310 CarbonylContact O-C 3.59Å; M295-I310 WeakPolarHBondContact O-CA 3.45Å; Y296-I310 HydrophobicContact CD1-CB 4.45Å; Y296-I310 HydrophobicContact CD1-CD1 3.82Å; Y296-I310 HydrophobicContact CD1-CG1 3.74Å; Y296-I310 HydrophobicContact CD1-CG2 3.98Å; Y296-I310 HydrophobicContact CE1-CD1 3.86Å; Y296-I310 HydrophobicContact CE1-CG1 4.2Å; Y296-I310 HydrophobicContact CE1-CG2 3.95Å; R297-I310 PolarHBondContact NH1-O 3.14Å
311	Y	80.2	Confident	64.1	Low	14 Å²	14	80.9 Å²	80.9	6%	0.055	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	168.1	178.2	-53.9	-75.4	0	0	0	110.3	I15 R17 M20 R297 E313	I15-Y311 HydrophobicContact CB-CE1 4.26Å; I15-Y311 HydrophobicContact CG2-CE1 3.83Å; I15-Y311 WeakPolarHBondContact CG2-OH 3.18Å; I15-Y311 VanDerWaalsContact O-CE1 3.25Å; I15-Y311 WeakPolarHBondContact O-CE1 3.49Å; R17-Y311 WeakPolarHBondContact CA-OH 3.33Å; R17-Y311 HydrophobicContact CB-CD1 4.09Å; R17-Y311 HydrophobicContact CB-CE1 3.67Å; R17-Y311 HydrophobicContact CB-CE2 4.23Å; R17-Y311 HydrophobicContact CG-CD2 4.17Å; R17-Y311 HydrophobicContact CG-CE1 4.22Å; R17-Y311 HydrophobicContact CG-CE2 3.87Å; M20-Y311 PolarHBondContact SD-OH 3.45Å; M20-Y311 VanDerWaalsContact SD-OH 3.42Å; R297-Y311 PolarHBondContact NH1-O 2.83Å; R297-Y311 PolarHBondContact NH2-O 2.93Å; Y311-E313 PolarHBondContact O-N 3.41Å
312	R	64.9	Low	62.9	Low	135 Å²	135	85.9 Å²	85.9	51%	0.509	46%	0.461	S	S	.	.			trans	-64.6	99.3	159.2	-70.8	-170.5	-174.7	-177	1.5	105.8	M265 F290	M265-R312 PolarHBondContact SD-NH2 3.12Å; F290-R312 HydrophobicContact CD2-CG 4.46Å; F290-R312 HydrophobicContact CE1-CG 3.95Å; F290-R312 HydrophobicContact CE2-CG 3.44Å; F290-R312 VanDerWaalsContact CE2-CG 3.44Å; F290-R312 HydrophobicContact CZ-CB 4.07Å; F290-R312 HydrophobicContact CZ-CG 3.14Å; F290-R312 PolarHBondContact O-NE 2.92Å; F290-R312 PolarHBondContact O-NH2 3.03Å
313	E	47.8	Very low	62.5	Low	131 Å²	131	86.8 Å²	86.8	61%	0.612	47%	0.469	S	S	*	.			trans	-59.6	144.1	161.7	-64.2	-157.1	157.9	0	0	106.6	Y311 G315	Y311-E313 PolarHBondContact O-N 3.41Å; E313-G315 PolarHBondContact O-N 3.39Å
314	K	34.2	Very low	62.7	Low	105 Å²	105	86 Å²	86	46%	0.457	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	27.2	177.3	-91.5	-177.4	169.9	-177.5	0	113	G363	K314-G363 WeakPolarHBondContact CE-O 3.41Å; K314-G363 PolarHBondContact NZ-O 3.5Å
315	G	30.9	Very low	62.9	Low	32 Å²	32	83.7 Å²	83.7	33%	0.33	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-160	16.9	-165.1	0	0	0	0	0	117.9	E313 T317	E313-G315 PolarHBondContact O-N 3.39Å; G315-T317 VanDerWaalsContact C-C 3.48Å; G315-T317 CarbonylContact C-O 3.54Å; G315-T317 WeakPolarHBondContact CA-O 3.49Å; G315-T317 CarbonylContact O-C 3.48Å; G315-T317 VanDerWaalsContact O-C 3.25Å
316	D	30.9	Very low	63.3	Low	99 Å²	99	83 Å²	83	53%	0.529	43%	0.429	S	S	.	.	S	Bend	trans	-86.5	-6.9	176.1	-113.9	-10.9	0	0	0	114.8	R297	R297-D316 IonicContact CZ-OD2 3.99Å; R297-D316 IonicContact NE-OD2 2.68Å; R297-D316 PolarHBondContact NE-OD2 3.13Å; R297-D316 IonicContact NH2-OD2 3.87Å; R297-D316 PolarHBondContact NH2-OD2 3.05Å
317	T	29.7	Very low	63.3	Low	96 Å²	96	90.2 Å²	90.2	59%	0.589	47%	0.467	S	S	*	.	S	Bend		-93.1	138.2	129.5	49.6	0	0	0	0	103.8	G315 Q319	G315-T317 VanDerWaalsContact C-C 3.48Å; G315-T317 CarbonylContact C-O 3.54Å; G315-T317 WeakPolarHBondContact CA-O 3.49Å; G315-T317 CarbonylContact O-C 3.48Å; G315-T317 VanDerWaalsContact O-C 3.25Å; T317-Q319 PolarHBondContact O-N 3.09Å
318	D	27.1	Very low	63.5	Low	154 Å²	154	88.8 Å²	88.8	82%	0.824	46%	0.456	S	S	*	.			trans	-56.7	68.7	174.4	-159.8	10.8	0	0	0	112.3	Q320	D318-Q320 VanDerWaalsContact C-N 3.29Å; D318-Q320 PolarHBondContact O-N 3.18Å
319	Q	37.2	Very low	63.8	Low	127 Å²	127	92 Å²	92	59%	0.593	48%	0.48	S	S	*	.			trans	-95.8	74.6	168.3	-79.4	-172.5	13.8	0	0	103	T317 K321	T317-Q319 PolarHBondContact O-N 3.09Å; Q319-K321 PolarHBondContact O-N 3.23Å; Q319-K321 VanDerWaalsContact O-N 3.09Å
320	Q	39	Very low	64.4	Low	158 Å²	158	94.8 Å²	94.8	74%	0.738	49%	0.491	S	S	*	.			trans	-24	121.7	146.6	-99	177.8	-8.9	0	0	108.6	D318 I322	D318-Q320 VanDerWaalsContact C-N 3.29Å; D318-Q320 PolarHBondContact O-N 3.18Å; Q320-I322 VanDerWaalsContact C-N 3.31Å; Q320-I322 WeakPolarHBondContact O-CG1 3.32Å; Q320-I322 PolarHBondContact O-N 3.32Å
321	K	56.3	Low	64.9	Low	169 Å²	169	98 Å²	98	74%	0.735	51%	0.514	S	S	*	.			trans	-51.3	102.5	172.1	-75.3	179.3	-176.7	170.9	0	107.3	Q319 A323	Q319-K321 PolarHBondContact O-N 3.23Å; Q319-K321 VanDerWaalsContact O-N 3.09Å; K321-A323 PolarHBondContact O-N 3.04Å
322	I	68.2	Low	65.7	Low	140 Å²	140	99.7 Å²	99.7	72%	0.718	52%	0.523	S	S	*	.			trans	-79.7	111.2	-174.9	-52.8	-172.7	0	0	0	106.2	Q320 A324	Q320-I322 VanDerWaalsContact C-N 3.31Å; Q320-I322 WeakPolarHBondContact O-CG1 3.32Å; Q320-I322 PolarHBondContact O-N 3.32Å; I322-A324 PolarHBondContact O-N 2.74Å
323	A	82.8	Confident	67.1	Low	52 Å²	52	99.8 Å²	99.8	43%	0.43	53%	0.53	S	S	.	.			trans	-68.3	87.9	170.4	0	0	0	0	0	108.9	K321 V325 R326	K321-A323 PolarHBondContact O-N 3.04Å; A323-V325 VanDerWaalsContact C-N 3.33Å; A323-R326 HydrophobicContact CB-CG 4.03Å
324	A	85.5	Confident	69.2	Low	43 Å²	43	101.3 Å²	101.3	36%	0.355	53%	0.53	S	S	.	.			trans	-69	-30.8	-177.8	0	0	0	0	0	112.9	I322 V350 G538	I322-A324 PolarHBondContact O-N 2.74Å; A324-V350 HydrophobicContact CB-CG1 4.17Å; A324-V350 HydrophobicContact CB-CG2 4.47Å; A324-G538 WeakPolarHBondContact O-CA 3.31Å
325	V	91.1	Very high	72	Confident	46 Å²	46	98 Å²	98	28%	0.279	53%	0.525	S	S	.	.	S	Bend	trans	-139	139.7	174.6	-180	0	0	0	0	108.5	A323 L328 V350 M535 G538	A323-V325 VanDerWaalsContact C-N 3.33Å; V325-L328 HydrophobicContact CG1-CB 3.6Å; V325-L328 HydrophobicContact CG1-CD2 3.95Å; V325-L328 HydrophobicContact CG1-CG 4.43Å; V325-V350 HydrophobicContact CG2-CB 4.24Å; V325-V350 HydrophobicContact CG2-CG1 4.04Å; V325-M535 HydrophobicContact CG1-CE 4.22Å; V325-M535 HydrophobicContact CG2-CE 4.21Å; V325-G538 CarbonylContact C-O 3.6Å; V325-G538 VanDerWaalsContact CA-O 3.3Å; V325-G538 WeakPolarHBondContact CA-O 3.23Å
326	R	91.2	Very high	75.1	Confident	112 Å²	112	97.8 Å²	97.8	42%	0.423	52%	0.515	S	S	.	.			trans	-130.2	126	-177.2	-58	174.6	-165.9	145.3	3.7	110.2	A323 L328 G538 E539	A323-R326 HydrophobicContact CB-CG 4.03Å; R326-L328 PolarHBondContact O-N 3.26Å; R326-G538 PolarHBondContact N-O 3.03Å; R326-E539 HydrophobicContact CB-CG 3.89Å; R326-E539 WeakPolarHBondContact CD-OE1 3.31Å; R326-E539 IonicContact NH1-OE1 3.38Å; R326-E539 PolarHBondContact NH1-OE1 2.9Å
327	N	88.6	Confident	78.3	Confident	168 Å²	168	93.1 Å²	93.1	90%	0.898	49%	0.491	S	S	*	.	S	Bend	trans	46.3	37	171.2	-60.4	-24.5	0	0	0	115.3	S329	N327-S329 PolarHBondContact O-N 3.02Å
328	L	93.4	Very high	81.5	Confident	32 Å²	32	88.5 Å²	88.5	17%	0.168	46%	0.463	C	S	.	.			trans	-76.2	124	-179	179.4	63.6	0	0	0	110.7	V325 R326 F330 T351 L533 M535 A540	V325-L328 HydrophobicContact CG1-CB 3.6Å; V325-L328 HydrophobicContact CG1-CD2 3.95Å; V325-L328 HydrophobicContact CG1-CG 4.43Å; R326-L328 PolarHBondContact O-N 3.26Å; L328-F330 HydrophobicContact CD1-CD1 4.21Å; L328-F330 HydrophobicContact CD2-CD1 4.27Å; L328-F330 HydrophobicContact CD2-CE1 3.92Å; L328-F330 HydrophobicContact CG-CD1 3.98Å; L328-F330 HydrophobicContact CG-CE1 4.09Å; L328-T351 HydrophobicContact CD2-CG2 3.47Å; L328-T351 VanDerWaalsContact CD2-CG2 3.47Å; L328-T351 VanDerWaalsContact CD2-OG1 3.31Å; L328-T351 WeakPolarHBondContact CD2-OG1 3.46Å; L328-L533 HydrophobicContact CD1-CD1 4.01Å; L328-L533 HydrophobicContact CD1-CD2 4.09Å; L328-M535 HydrophobicContact CD2-CE 3.89Å; L328-M535 HydrophobicContact CD2-SD 4.23Å; L328-A540 HydrophobicContact CD1-CB 3.65Å
329	S	93.6	Very high	84.8	Confident	108 Å²	108	81.2 Å²	81.2	76%	0.755	42%	0.423	S	S	*	.			trans	-131.6	131.5	176.1	-67.4	0	0	0	0	110.6	N327	N327-S329 PolarHBondContact O-N 3.02Å
330	F	95.6	Very high	87.7	Confident	66 Å²	66	75.2 Å²	75.2	29%	0.289	40%	0.395	S	S	.	.			trans	-158.1	165.7	171.3	61.7	-90	0	0	0	111	L328 L338 I340 T351 L355 I516 L533	L328-F330 HydrophobicContact CD1-CD1 4.21Å; L328-F330 HydrophobicContact CD2-CD1 4.27Å; L328-F330 HydrophobicContact CD2-CE1 3.92Å; L328-F330 HydrophobicContact CG-CD1 3.98Å; L328-F330 HydrophobicContact CG-CE1 4.09Å; F330-L338 HydrophobicContact CB-CD2 4.33Å; F330-L338 HydrophobicContact CD2-CD2 3.35Å; F330-L338 HydrophobicContact CE2-CD2 3.78Å; F330-L338 HydrophobicContact CG-CD2 3.98Å; F330-I340 HydrophobicContact CE1-CD1 4.38Å; F330-I340 HydrophobicContact CZ-CD1 4.16Å; F330-T351 HydrophobicContact CE1-CG2 3.86Å; F330-T351 HydrophobicContact CZ-CG2 4.12Å; F330-L355 HydrophobicContact CZ-CD1 4.02Å; F330-I516 HydrophobicContact CE2-CD1 3.92Å; F330-I516 HydrophobicContact CZ-CD1 4.28Å; F330-L533 HydrophobicContact CB-CD1 3.78Å; F330-L533 HydrophobicContact CD1-CD1 3.99Å; F330-L533 HydrophobicContact CG-CD1 4.1Å
331	S	95.7	Very high	90.2	Very high	72 Å²	72	67.7 Å²	67.7	50%	0.503	36%	0.36	S	S	.	.			trans	-119.7	159.6	172	58.8	0	0	0	0	110.3	R531	S331-R531 PolarHBondContact O-NH2 2.94Å
332	L	96.5	Very high	91.7	Very high	48 Å²	48	59.7 Å²	59.7	25%	0.251	33%	0.326	S	S	.	.			trans	-131.5	122.9	172.3	177.8	69.1	0	0	0	108.5	E336 L338 V482 I516	L332-E336 HydrophobicContact CD1-CB 4.29Å; L332-E336 HydrophobicContact CD1-CG 4.39Å; L332-L338 HydrophobicContact CD1-CB 3.72Å; L332-V482 HydrophobicContact CD2-CG1 3.88Å; L332-V482 HydrophobicContact CD2-CG2 4.37Å; L332-I516 HydrophobicContact CD2-CD1 4.34Å; L332-I516 HydrophobicContact CD2-CG1 3.72Å
333	Q	94.3	Very high	92.2	Very high	138 Å²	138	55.8 Å²	55.8	65%	0.645	31%	0.305	S	S	*	.			trans	-83	156.3	174.8	-59.9	-148.5	-7.1	0	0	111.6	G335 E336	Q333-G335 PolarHBondContact O-N 3.32Å; Q333-E336 HydrophobicContact CB-CB 3.94Å; Q333-E336 WeakPolarHBondContact CB-OE2 3.07Å; Q333-E336 PolarHBondContact N-OE2 3.02Å; Q333-E336 WeakPolarHBondContact O-CB 3.42Å; Q333-E336 PolarHBondContact O-N 2.92Å; Q333-E336 VanDerWaalsContact O-N 3.17Å
334	R	92.2	Very high	92	Very high	163 Å²	163	57.2 Å²	57.2	62%	0.615	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	124.6	175.5	-171.4	176.8	-176.9	178.9	-1.8	109.5	E336 S512	R334-E336 VanDerWaalsContact C-N 3.27Å; R334-S512 WeakPolarHBondContact CG-O 3.46Å; R334-S512 PolarHBondContact NE-O 3.14Å
335	G	92.9	Very high	91.5	Very high	35 Å²	35	59 Å²	59	36%	0.361	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	1	-177.2	0	0	0	0	0	114.7	Q333 Q508 M513	Q333-G335 PolarHBondContact O-N 3.32Å; G335-Q508 PolarHBondContact O-NE2 2.86Å; G335-M513 VanDerWaalsContact CA-O 3.3Å; G335-M513 WeakPolarHBondContact CA-O 3.27Å; G335-M513 PolarHBondContact N-O 3.25Å
336	E	95.7	Very high	91.2	Very high	27 Å²	27	57 Å²	57	13%	0.126	32%	0.323	C	S	.	.			trans	-85.7	143.2	171.9	-179.8	-175.9	-154.5	0	0	110	L332 Q333 R334 Q508 V515 D530 R531	L332-E336 HydrophobicContact CD1-CB 4.29Å; L332-E336 HydrophobicContact CD1-CG 4.39Å; Q333-E336 HydrophobicContact CB-CB 3.94Å; Q333-E336 WeakPolarHBondContact CB-OE2 3.07Å; Q333-E336 PolarHBondContact N-OE2 3.02Å; Q333-E336 WeakPolarHBondContact O-CB 3.42Å; Q333-E336 PolarHBondContact O-N 2.92Å; Q333-E336 VanDerWaalsContact O-N 3.17Å; R334-E336 VanDerWaalsContact C-N 3.27Å; E336-Q508 VanDerWaalsContact C-NE2 3.35Å; E336-Q508 PolarHBondContact O-NE2 3.29Å; E336-V515 PolarHBondContact O-N 2.92Å; E336-D530 HydrophobicContact CG-CB 4.23Å; E336-R531 WeakPolarHBondContact OE1-CB 3.27Å; E336-R531 IonicContact OE1-CZ 3.64Å; E336-R531 IonicContact OE1-NE 2.96Å; E336-R531 IonicContact OE1-NH1 3.74Å; E336-R531 PolarHBondContact OE1-NH1 3.43Å; E336-R531 IonicContact OE2-NH1 3.08Å; E336-R531 PolarHBondContact OE2-NH1 3.48Å
337	T	97	Very high	91	Very high	1 Å²	1	52 Å²	52	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	110.2	163.3	-54.8	0	0	0	0	109.8	Q508 V515 F517 I528 D530 R531	T337-Q508 PolarHBondContact OG1-NE2 2.79Å; T337-Q508 PolarHBondContact OG1-OE1 2.85Å; T337-V515 CarbonylContact C-O 3.58Å; T337-V515 WeakPolarHBondContact CA-O 3.45Å; T337-V515 HydrophobicContact CG2-CB 4.28Å; T337-V515 HydrophobicContact CG2-CG1 4.27Å; T337-F517 HydrophobicContact CG2-CB 4.03Å; T337-I528 WeakPolarHBondContact CB-O 3.39Å; T337-I528 HydrophobicContact CG2-CG1 4.43Å; T337-I528 WeakPolarHBondContact CG2-O 3.43Å; T337-I528 PolarHBondContact OG1-O 2.81Å; T337-D530 PolarHBondContact N-OD2 3.33Å; T337-D530 PolarHBondContact O-N 3.3Å; T337-R531 PolarHBondContact O-N 3.37Å
338	L	97.7	Very high	91.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	112.5	168.4	177.9	64.3	0	0	0	109.3	F330 L332 I340 V515 I516 F517 R531 L533	F330-L338 HydrophobicContact CB-CD2 4.33Å; F330-L338 HydrophobicContact CD2-CD2 3.35Å; F330-L338 HydrophobicContact CE2-CD2 3.78Å; F330-L338 HydrophobicContact CG-CD2 3.98Å; L332-L338 HydrophobicContact CD1-CB 3.72Å; L338-I340 HydrophobicContact CG-CG1 4.45Å; L338-V515 PolarHBondContact N-O 3.46Å; L338-I516 CarbonylContact O-C 3.58Å; L338-I516 WeakPolarHBondContact O-CA 3.44Å; L338-F517 PolarHBondContact O-N 3.28Å; L338-R531 CarbonylContact C-O 3.39Å; L338-R531 WeakPolarHBondContact CA-O 3.41Å; L338-R531 HydrophobicContact CD1-CB 4.09Å; L338-R531 HydrophobicContact CD1-CG 4.42Å; L338-L533 HydrophobicContact CD1-CB 4.19Å
339	A	97	Very high	90.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.7	170.1	0	0	0	0	0	111	V341 F517 V525 A529 R531 V532 L533	A339-V341 HydrophobicContact CB-CG1 4.17Å; A339-F517 CarbonylContact C-O 3.57Å; A339-F517 WeakPolarHBondContact CA-O 3.43Å; A339-V525 HydrophobicContact CB-CG1 3.86Å; A339-V525 HydrophobicContact CB-CG2 4.21Å; A339-A529 HydrophobicContact CB-CB 3.56Å; A339-R531 PolarHBondContact N-O 3.48Å; A339-V532 HydrophobicContact CB-CG2 4.44Å; A339-V532 CarbonylContact O-C 3.51Å; A339-V532 WeakPolarHBondContact O-CA 3.45Å; A339-L533 PolarHBondContact O-N 2.92Å
340	I	96.6	Very high	90.8	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	116	170.4	-61.3	178.9	0	0	0	107.5	F330 L338 K348 T351 I516 F517 I518 T519 L533 M535	F330-I340 HydrophobicContact CE1-CD1 4.38Å; F330-I340 HydrophobicContact CZ-CD1 4.16Å; L338-I340 HydrophobicContact CG-CG1 4.45Å; I340-K348 HydrophobicContact CG2-CB 4.04Å; I340-K348 HydrophobicContact CG2-CD 4.49Å; I340-K348 HydrophobicContact CG2-CG 4.04Å; I340-T351 HydrophobicContact CD1-CG2 4.38Å; I340-I516 HydrophobicContact CD1-CG2 3.63Å; I340-I516 HydrophobicContact CG1-CG2 4.09Å; I340-F517 PolarHBondContact N-O 2.96Å; I340-I518 HydrophobicContact CB-CG1 4.06Å; I340-I518 WeakPolarHBondContact O-CA 3.34Å; I340-T519 PolarHBondContact O-N 3.41Å; I340-L533 WeakPolarHBondContact CA-O 3.37Å; I340-L533 HydrophobicContact CG2-CD2 4.37Å; I340-M535 HydrophobicContact CG2-CG 3.88Å; I340-M535 HydrophobicContact CG2-SD 3.45Å; I340-M535 WeakPolarHBondContact CG2-SD 3.16Å
341	V	93.2	Very high	90.6	Very high	0 Å²	0	39 Å²	39	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	154.5	-169.1	-56.1	0	0	0	0	112	A339 T519 M522 V525 V532 L533 V534 M535	A339-V341 HydrophobicContact CB-CG1 4.17Å; V341-T519 WeakPolarHBondContact CA-O 3.29Å; V341-T519 HydrophobicContact CG1-CG2 4.3Å; V341-M522 HydrophobicContact CB-CE 3.93Å; V341-M522 HydrophobicContact CB-SD 4.43Å; V341-M522 HydrophobicContact CG1-SD 4.45Å; V341-M522 HydrophobicContact CG2-CE 3.5Å; V341-M522 VanDerWaalsContact CG2-CE 3.5Å; V341-M522 HydrophobicContact CG2-SD 4.26Å; V341-V525 HydrophobicContact CG1-CB 4.46Å; V341-V525 HydrophobicContact CG1-CG1 4.31Å; V341-V525 HydrophobicContact CG1-CG2 3.37Å; V341-V532 HydrophobicContact CG1-CG1 4.11Å; V341-V532 HydrophobicContact CG2-CG1 3.55Å; V341-L533 PolarHBondContact N-O 3.04Å; V341-V534 HydrophobicContact CG2-CB 4.13Å; V341-V534 HydrophobicContact CG2-CG1 4.31Å; V341-V534 HydrophobicContact CG2-CG2 3.74Å; V341-V534 CarbonylContact O-C 3.59Å; V341-M535 PolarHBondContact O-N 2.86Å
342	G	87.3	Confident	90.5	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.021	21%	0.212	C	C	.	.			trans	151.7	168.2	-178.4	0	0	0	0	0	110.9	K348	G342-K348 WeakPolarHBondContact O-CE 3.39Å; G342-K348 PolarHBondContact O-NZ 3.33Å
343	E	79.4	Confident	90.2	Very high	57 Å²	57	35.8 Å²	35.8	27%	0.266	21%	0.212	S	C	.	.	S	Bend	trans	-65.9	164.6	177.7	-74.6	167.4	159.9	0	0	112.1	G345 S346 K348 Y557 L561 S774	E343-G345 PolarHBondContact O-N 3.46Å; E343-S346 WeakPolarHBondContact O-CB 3.36Å; E343-S346 PolarHBondContact O-N 2.78Å; E343-S346 PolarHBondContact O-OG 3.18Å; E343-S346 VanDerWaalsContact O-OG 3.05Å; E343-K348 PolarHBondContact O-NZ 3.39Å; E343-Y557 WeakPolarHBondContact CB-OH 3.2Å; E343-Y557 HydrophobicContact CG-CE2 4.47Å; E343-Y557 WeakPolarHBondContact CG-OH 3.43Å; E343-Y557 PolarHBondContact N-OH 3.45Å; E343-Y557 PolarHBondContact OE2-OH 2.94Å; E343-L561 HydrophobicContact CG-CD2 4.18Å; E343-S774 WeakPolarHBondContact OE1-CB 3.4Å; E343-S774 PolarHBondContact OE1-OG 3.45Å
344	S	76.6	Confident	90.1	Very high	82 Å²	82	30.4 Å²	30.4	57%	0.573	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	136.1	173.2	-72	0	0	0	0	110.7	D772	S344-D772 WeakPolarHBondContact CB-OD2 3.36Å; S344-D772 PolarHBondContact N-OD2 2.68Å; S344-D772 PolarHBondContact OG-OD1 2.96Å; S344-D772 PolarHBondContact OG-OD2 3.18Å
345	G	76.1	Confident	90.1	Very high	80 Å²	80	24.3 Å²	24.3	83%	0.825	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.9	0.4	-176.9	0	0	0	0	0	115.9	E343 G347	E343-G345 PolarHBondContact O-N 3.46Å; G345-G347 PolarHBondContact O-N 3.13Å
346	S	85.3	Confident	90.1	Very high	6 Å²	6	23.1 Å²	23.1	4%	0.042	16%	0.156	C	C	.	.	S	Bend	trans	-72.2	-3.8	177.3	71.5	0	0	0	0	115.2	E343 K348 M535 G538	E343-S346 WeakPolarHBondContact O-CB 3.36Å; E343-S346 PolarHBondContact O-N 2.78Å; E343-S346 PolarHBondContact O-OG 3.18Å; E343-S346 VanDerWaalsContact O-OG 3.05Å; S346-K348 VanDerWaalsContact OG-CG 3.3Å; S346-K348 WeakPolarHBondContact OG-CG 3.41Å; S346-M535 WeakPolarHBondContact CB-O 3.38Å; S346-M535 WeakPolarHBondContact O-CE 3.4Å; S346-G538 VanDerWaalsContact O-CA 3.29Å; S346-G538 WeakPolarHBondContact O-CA 3.41Å; S346-G538 PolarHBondContact O-N 3.4Å
347	G	87	Confident	89.8	Confident	5 Å²	5	24 Å²	24	5%	0.052	16%	0.158	C	C	.	.	S	Bend	trans	102.2	5.7	178.2	0	0	0	0	0	115.9	G345 V350 T351	G345-G347 PolarHBondContact O-N 3.13Å; G347-V350 PolarHBondContact O-N 3.39Å; G347-T351 WeakPolarHBondContact O-CB 3.3Å; G347-T351 PolarHBondContact O-N 3.2Å; G347-T351 PolarHBondContact O-OG1 3.27Å
348	K	91.3	Very high	89.5	Confident	9 Å²	9	25.8 Å²	25.8	4%	0.039	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-57.8	-176.6	-42.8	-176.5	-63.6	-76.1	0	113.5	I340 G342 E343 S346 V350 T351 A352 I518 M535	I340-K348 HydrophobicContact CG2-CB 4.04Å; I340-K348 HydrophobicContact CG2-CD 4.49Å; I340-K348 HydrophobicContact CG2-CG 4.04Å; G342-K348 WeakPolarHBondContact O-CE 3.39Å; G342-K348 PolarHBondContact O-NZ 3.33Å; E343-K348 PolarHBondContact O-NZ 3.39Å; S346-K348 VanDerWaalsContact OG-CG 3.3Å; S346-K348 WeakPolarHBondContact OG-CG 3.41Å; K348-V350 VanDerWaalsContact C-N 3.33Å; K348-V350 PolarHBondContact O-N 3.46Å; K348-T351 VanDerWaalsContact O-CB 3.27Å; K348-T351 WeakPolarHBondContact O-CB 3.35Å; K348-T351 PolarHBondContact O-N 3.34Å; K348-T351 VanDerWaalsContact O-N 3.16Å; K348-A352 PolarHBondContact O-N 3.12Å; K348-I518 HydrophobicContact CB-CG1 4.4Å; K348-I518 HydrophobicContact CB-CG2 3.46Å; K348-I518 VanDerWaalsContact CB-CG2 3.46Å; K348-I518 HydrophobicContact CD-CG2 4.01Å; K348-I518 HydrophobicContact CG-CG2 4.35Å; K348-I518 WeakPolarHBondContact O-CD1 3.29Å; K348-M535 HydrophobicContact CG-SD 4.36Å
349	S	88.1	Confident	88.9	Confident	35 Å²	35	27.3 Å²	27.3	25%	0.245	18%	0.175	C	C	.	.	H	α-helix	trans	-67.7	-33.8	179.3	-49.7	0	0	0	0	112	T351 A352 L353 D486	S349-T351 VanDerWaalsContact C-N 3.29Å; S349-T351 PolarHBondContact O-N 2.98Å; S349-A352 WeakPolarHBondContact O-CB 3.47Å; S349-A352 PolarHBondContact O-N 3.46Å; S349-L353 WeakPolarHBondContact O-CG 3.23Å; S349-L353 PolarHBondContact O-N 3.01Å; S349-D486 WeakPolarHBondContact CB-OD2 3.49Å; S349-D486 PolarHBondContact OG-OD1 3.22Å; S349-D486 PolarHBondContact OG-OD2 3.15Å
350	V	90.4	Very high	88.1	Confident	50 Å²	50	31 Å²	31	30%	0.303	19%	0.192	S	C	.	.	H	α-helix	trans	-59.4	-42.6	172.1	179	0	0	0	0	110.2	A324 V325 G347 K348 A352 L353 A354 L359	A324-V350 HydrophobicContact CB-CG1 4.17Å; A324-V350 HydrophobicContact CB-CG2 4.47Å; V325-V350 HydrophobicContact CG2-CB 4.24Å; V325-V350 HydrophobicContact CG2-CG1 4.04Å; G347-V350 PolarHBondContact O-N 3.39Å; K348-V350 VanDerWaalsContact C-N 3.33Å; K348-V350 PolarHBondContact O-N 3.46Å; V350-A352 PolarHBondContact O-N 3.31Å; V350-L353 PolarHBondContact O-N 2.82Å; V350-A354 WeakPolarHBondContact O-CB 3.46Å; V350-A354 PolarHBondContact O-N 3Å; V350-L359 HydrophobicContact CG1-CD1 3.56Å; V350-L359 HydrophobicContact CG1-CD2 4.42Å; V350-L359 WeakPolarHBondContact O-CD1 3.48Å
351	T	92.4	Very high	87	Confident	9 Å²	9	37 Å²	37	6%	0.055	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-45.2	174.8	-58.6	0	0	0	0	111.6	L328 F330 I340 G347 K348 S349 A354 L355	L328-T351 HydrophobicContact CD2-CG2 3.47Å; L328-T351 VanDerWaalsContact CD2-CG2 3.47Å; L328-T351 VanDerWaalsContact CD2-OG1 3.31Å; L328-T351 WeakPolarHBondContact CD2-OG1 3.46Å; F330-T351 HydrophobicContact CE1-CG2 3.86Å; F330-T351 HydrophobicContact CZ-CG2 4.12Å; I340-T351 HydrophobicContact CD1-CG2 4.38Å; G347-T351 WeakPolarHBondContact O-CB 3.3Å; G347-T351 PolarHBondContact O-N 3.2Å; G347-T351 PolarHBondContact O-OG1 3.27Å; K348-T351 VanDerWaalsContact O-CB 3.27Å; K348-T351 WeakPolarHBondContact O-CB 3.35Å; K348-T351 PolarHBondContact O-N 3.34Å; K348-T351 VanDerWaalsContact O-N 3.16Å; S349-T351 VanDerWaalsContact C-N 3.29Å; S349-T351 PolarHBondContact O-N 2.98Å; T351-A354 WeakPolarHBondContact O-CB 3.3Å; T351-A354 PolarHBondContact O-N 3.18Å; T351-L355 WeakPolarHBondContact O-CG 3.46Å; T351-L355 PolarHBondContact O-N 3.07Å; T351-L355 VanDerWaalsContact O-N 3.08Å
352	A	92.5	Very high	85.9	Confident	2 Å²	2	41.1 Å²	41.1	2%	0.017	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-47.4	175.7	0	0	0	0	0	112.9	K348 S349 V350 A354 L355 M356 M401 I484 I518	K348-A352 PolarHBondContact O-N 3.12Å; S349-A352 WeakPolarHBondContact O-CB 3.47Å; S349-A352 PolarHBondContact O-N 3.46Å; V350-A352 PolarHBondContact O-N 3.31Å; A352-A354 VanDerWaalsContact C-N 3.29Å; A352-A354 PolarHBondContact O-N 3.03Å; A352-L355 PolarHBondContact O-N 3.49Å; A352-M356 WeakPolarHBondContact O-CG 3.11Å; A352-M356 PolarHBondContact O-N 3.03Å; A352-M356 VanDerWaalsContact O-N 3.12Å; A352-M401 HydrophobicContact CB-CE 3.82Å; A352-M401 HydrophobicContact CB-SD 4.46Å; A352-I484 HydrophobicContact CB-CG2 3.6Å; A352-I518 HydrophobicContact CB-CD1 3.57Å
353	L	91.6	Very high	85.1	Confident	50 Å²	50	43 Å²	43	26%	0.262	27%	0.274	S	S	.	.	H	α-helix	trans	-65.9	-32.3	179	-66.4	174.4	0	0	0	112.2	S349 V350 R357 L358 L359 M401 F403	S349-L353 WeakPolarHBondContact O-CG 3.23Å; S349-L353 PolarHBondContact O-N 3.01Å; V350-L353 PolarHBondContact O-N 2.82Å; L353-R357 PolarHBondContact O-N 3.48Å; L353-R357 VanDerWaalsContact O-N 3.16Å; L353-L358 HydrophobicContact CB-CB 4.42Å; L353-L358 HydrophobicContact CD2-CB 4.03Å; L353-L358 HydrophobicContact CD2-CD1 3.9Å; L353-L358 PolarHBondContact O-N 2.89Å; L353-L359 HydrophobicContact CB-CD1 4.48Å; L353-L359 HydrophobicContact CB-CD2 3.68Å; L353-L359 HydrophobicContact CB-CG 3.64Å; L353-L359 HydrophobicContact CD1-CD2 3.91Å; L353-L359 HydrophobicContact CG-CD2 4.48Å; L353-L359 PolarHBondContact O-N 2.85Å; L353-M401 HydrophobicContact CD2-CE 4.27Å; L353-M401 HydrophobicContact CD2-SD 4.41Å; L353-F403 HydrophobicContact CD2-CE1 4.38Å
354	A	91.7	Very high	85.1	Confident	24 Å²	24	41.7 Å²	41.7	20%	0.198	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-48.5	174.1	0	0	0	0	0	111.2	V350 T351 A352 M356 R357 L359 V366	V350-A354 WeakPolarHBondContact O-CB 3.46Å; V350-A354 PolarHBondContact O-N 3Å; T351-A354 WeakPolarHBondContact O-CB 3.3Å; T351-A354 PolarHBondContact O-N 3.18Å; A352-A354 VanDerWaalsContact C-N 3.29Å; A352-A354 PolarHBondContact O-N 3.03Å; A354-M356 PolarHBondContact O-N 3.29Å; A354-R357 PolarHBondContact O-N 2.91Å; A354-L359 HydrophobicContact CB-CD1 3.77Å; A354-V366 HydrophobicContact CB-CG1 4.23Å; A354-V366 HydrophobicContact CB-CG2 3.96Å
355	L	92.5	Very high	85.4	Confident	36 Å²	36	43.9 Å²	43.9	19%	0.188	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-36.2	177	-68.8	174.6	0	0	0	112.5	F330 T351 A352 R357 T371 M399 I484 I516	F330-L355 HydrophobicContact CZ-CD1 4.02Å; T351-L355 WeakPolarHBondContact O-CG 3.46Å; T351-L355 PolarHBondContact O-N 3.07Å; T351-L355 VanDerWaalsContact O-N 3.08Å; A352-L355 PolarHBondContact O-N 3.49Å; L355-R357 VanDerWaalsContact C-N 3.26Å; L355-R357 PolarHBondContact O-N 2.87Å; L355-T371 HydrophobicContact CD2-CG2 3.98Å; L355-M399 HydrophobicContact CB-CE 4.32Å; L355-I484 HydrophobicContact CB-CD1 4.24Å; L355-I484 HydrophobicContact CD1-CD1 4.22Å; L355-I516 HydrophobicContact CD1-CD1 3.66Å
356	M	91.8	Very high	85.9	Confident	9 Å²	9	42.5 Å²	42.5	4%	0.044	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-2.5	177	-67.3	-64.9	-78.2	0	0	113.6	A352 A354 L358 R395 M399 M401 I484	A352-M356 WeakPolarHBondContact O-CG 3.11Å; A352-M356 PolarHBondContact O-N 3.03Å; A352-M356 VanDerWaalsContact O-N 3.12Å; A354-M356 PolarHBondContact O-N 3.29Å; M356-L358 HydrophobicContact CB-CD1 3.87Å; M356-L358 HydrophobicContact CB-CG 3.92Å; M356-L358 PolarHBondContact O-N 2.85Å; M356-R395 HydrophobicContact CE-CB 4.17Å; M356-R395 HydrophobicContact CE-CG 3.71Å; M356-R395 WeakPolarHBondContact O-CD 3.44Å; M356-M399 HydrophobicContact SD-CB 3.87Å; M356-M399 HydrophobicContact SD-CE 3.92Å; M356-M401 HydrophobicContact CE-CB 4.2Å; M356-M401 HydrophobicContact CG-SD 4.24Å; M356-I484 HydrophobicContact CG-CD1 3.9Å; M356-I484 HydrophobicContact SD-CD1 4.12Å
357	R	91	Very high	86	Confident	46 Å²	46	51.5 Å²	51.5	17%	0.174	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	41	-173.1	-59.4	-170.2	58.6	-166	-3.7	113.7	L353 A354 L355 E360 L383 S384 Q386 M391	L353-R357 PolarHBondContact O-N 3.48Å; L353-R357 VanDerWaalsContact O-N 3.16Å; A354-R357 PolarHBondContact O-N 2.91Å; L355-R357 VanDerWaalsContact C-N 3.26Å; L355-R357 PolarHBondContact O-N 2.87Å; R357-E360 IonicContact CZ-OE2 2.71Å; R357-E360 VanDerWaalsContact CZ-OE2 3.27Å; R357-E360 IonicContact NE-OE1 2.73Å; R357-E360 IonicContact NE-OE2 3.3Å; R357-E360 PolarHBondContact NE-OE2 3.49Å; R357-E360 IonicContact NH2-OE1 3.62Å; R357-E360 IonicContact NH2-OE2 3.82Å; R357-E360 PolarHBondContact NH2-OE2 2.86Å; R357-L383 WeakPolarHBondContact CD-O 3.23Å; R357-L383 PolarHBondContact NH1-O 2.93Å; R357-S384 PolarHBondContact NH1-O 2.99Å; R357-Q386 PolarHBondContact NH1-O 3.37Å; R357-M391 HydrophobicContact CB-CE 3.98Å; R357-M391 HydrophobicContact CG-CE 3.94Å
358	L	89.5	Confident	86	Confident	39 Å²	39	54.4 Å²	54.4	20%	0.204	32%	0.316	C	S	.	.			trans	-95.2	-26.3	175.3	-67.4	173.6	0	0	0	112.1	L353 M356 E360 Q361 F403	L353-L358 HydrophobicContact CB-CB 4.42Å; L353-L358 HydrophobicContact CD2-CB 4.03Å; L353-L358 HydrophobicContact CD2-CD1 3.9Å; L353-L358 PolarHBondContact O-N 2.89Å; M356-L358 HydrophobicContact CB-CD1 3.87Å; M356-L358 HydrophobicContact CB-CG 3.92Å; M356-L358 PolarHBondContact O-N 2.85Å; L358-E360 PolarHBondContact O-N 2.78Å; L358-Q361 WeakPolarHBondContact O-CB 3.39Å; L358-Q361 PolarHBondContact O-N 2.74Å; L358-F403 HydrophobicContact CD1-CE1 4.11Å; L358-F403 HydrophobicContact CD1-CZ 4.1Å
359	L	85.2	Confident	85.8	Confident	32 Å²	32	61.8 Å²	61.8	17%	0.168	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-41.1	176.3	-70.8	-178.8	0	0	0	112.9	V350 L353 A354 Q361 A362 G363 G364 V366	V350-L359 HydrophobicContact CG1-CD1 3.56Å; V350-L359 HydrophobicContact CG1-CD2 4.42Å; V350-L359 WeakPolarHBondContact O-CD1 3.48Å; L353-L359 HydrophobicContact CB-CD1 4.48Å; L353-L359 HydrophobicContact CB-CD2 3.68Å; L353-L359 HydrophobicContact CB-CG 3.64Å; L353-L359 HydrophobicContact CD1-CD2 3.91Å; L353-L359 HydrophobicContact CG-CD2 4.48Å; L353-L359 PolarHBondContact O-N 2.85Å; A354-L359 HydrophobicContact CB-CD1 3.77Å; L359-Q361 PolarHBondContact O-N 3.03Å; L359-A362 CarbonylContact O-C 3.51Å; L359-A362 PolarHBondContact O-N 3.07Å; L359-G363 PolarHBondContact O-N 2.74Å; L359-G364 WeakPolarHBondContact O-CA 3.43Å; L359-G364 PolarHBondContact O-N 2.74Å; L359-V366 HydrophobicContact CB-CG2 4.14Å; L359-V366 HydrophobicContact CD1-CG2 4.08Å
360	E	80.6	Confident	86	Confident	77 Å²	77	66.1 Å²	66.1	36%	0.36	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-58.6	-33.8	179.9	-63.7	173.9	166.7	0	0	111.3	R357 L358 A362 G363 V366	R357-E360 IonicContact CZ-OE2 2.71Å; R357-E360 VanDerWaalsContact CZ-OE2 3.27Å; R357-E360 IonicContact NE-OE1 2.73Å; R357-E360 IonicContact NE-OE2 3.3Å; R357-E360 PolarHBondContact NE-OE2 3.49Å; R357-E360 IonicContact NH2-OE1 3.62Å; R357-E360 IonicContact NH2-OE2 3.82Å; R357-E360 PolarHBondContact NH2-OE2 2.86Å; L358-E360 PolarHBondContact O-N 2.78Å; E360-A362 VanDerWaalsContact C-N 3.32Å; E360-A362 PolarHBondContact O-N 2.98Å; E360-G363 PolarHBondContact O-N 2.8Å; E360-V366 HydrophobicContact CG-CG2 4.35Å
361	Q	73.9	Confident	86.1	Confident	126 Å²	126	65.2 Å²	65.2	59%	0.589	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-71.3	-26.6	177.9	-56.3	-173	-20	0	0	112.8	L358 L359 G363	L358-Q361 WeakPolarHBondContact O-CB 3.39Å; L358-Q361 PolarHBondContact O-N 2.74Å; L359-Q361 PolarHBondContact O-N 3.03Å; Q361-G363 VanDerWaalsContact C-N 3.31Å
362	A	70.1	Confident	86.2	Confident	88 Å²	88	69.6 Å²	69.6	73%	0.727	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-92.2	12.2	175.3	0	0	0	0	0	112.7	L359 E360 G364	L359-A362 CarbonylContact O-C 3.51Å; L359-A362 PolarHBondContact O-N 3.07Å; E360-A362 VanDerWaalsContact C-N 3.32Å; E360-A362 PolarHBondContact O-N 2.98Å; A362-G364 VanDerWaalsContact C-N 3.32Å; A362-G364 PolarHBondContact O-N 3.2Å
363	G	71.2	Confident	86.4	Confident	42 Å²	42	70 Å²	70	43%	0.433	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	6.8	-177.5	0	0	0	0	0	114.5	K314 L359 E360 Q361	K314-G363 WeakPolarHBondContact CE-O 3.41Å; K314-G363 PolarHBondContact NZ-O 3.5Å; L359-G363 PolarHBondContact O-N 2.74Å; E360-G363 PolarHBondContact O-N 2.8Å; Q361-G363 VanDerWaalsContact C-N 3.31Å
364	G	77.9	Confident	86.5	Confident	29 Å²	29	76 Å²	76	30%	0.299	41%	0.411	S	S	.	.			trans	-65.2	151.6	170.1	0	0	0	0	0	111.9	L359 A362	L359-G364 WeakPolarHBondContact O-CA 3.43Å; L359-G364 PolarHBondContact O-N 2.74Å; A362-G364 VanDerWaalsContact C-N 3.32Å; A362-G364 PolarHBondContact O-N 3.2Å
365	L	84	Confident	86.4	Confident	127 Å²	127	78.3 Å²	78.3	67%	0.665	41%	0.414	S	S	*	.			trans	-107.6	127.5	172.2	-70.8	164.4	0	0	0	108.6
366	V	86.5	Confident	86.1	Confident	51 Å²	51	82.7 Å²	82.7	31%	0.309	43%	0.428	S	S	.	.			trans	-113.5	121	173.2	-177.5	0	0	0	0	107.4	A354 L359 E360	A354-V366 HydrophobicContact CB-CG1 4.23Å; A354-V366 HydrophobicContact CB-CG2 3.96Å; L359-V366 HydrophobicContact CB-CG2 4.14Å; L359-V366 HydrophobicContact CD1-CG2 4.08Å; E360-V366 HydrophobicContact CG-CG2 4.35Å
367	Q	86.7	Confident	85.8	Confident	196 Å²	196	86.1 Å²	86.1	92%	0.916	45%	0.453	S	S	*	.			trans	-115.7	115.8	171.9	-69.1	-179.2	-33.2	0	0	107.1
368	C	86.9	Confident	85.6	Confident	66 Å²	66	93.6 Å²	93.6	45%	0.446	48%	0.481	S	S	.	.			trans	-146.7	133.4	179.9	-173.5	0	0	0	0	108	Q370 T371	C368-Q370 PolarHBondContact SG-O 2.93Å; C368-T371 PolarHBondContact SG-OG1 2.95Å; C368-T371 VanDerWaalsContact SG-OG1 3.4Å
369	D	87.5	Confident	85.7	Confident	164 Å²	164	96.3 Å²	96.3	88%	0.877	49%	0.493	S	S	*	.	S	Bend	trans	-62.1	-45.3	-178.6	-66	-24.8	0	0	0	111.2
370	Q	91.4	Very high	86.2	Confident	125 Å²	125	98.4 Å²	98.4	58%	0.584	51%	0.507	S	S	*	.			trans	-151.4	139	178	-64.1	-169.8	-48.7	0	0	111.1	C368 L372	C368-Q370 PolarHBondContact SG-O 2.93Å; Q370-L372 HydrophobicContact CB-CG 4.43Å
371	T	93.1	Very high	86.8	Confident	31 Å²	31	95.5 Å²	95.5	19%	0.19	49%	0.494	C	S	.	.			trans	-129.8	94.2	170.2	-54.1	0	0	0	0	109.7	L355 C368 L383	L355-T371 HydrophobicContact CD2-CG2 3.98Å; C368-T371 PolarHBondContact SG-OG1 2.95Å; C368-T371 VanDerWaalsContact SG-OG1 3.4Å; T371-L383 HydrophobicContact CG2-CB 4.09Å; T371-L383 HydrophobicContact CG2-CD1 3.74Å; T371-L383 HydrophobicContact CG2-CG 4.27Å; T371-L383 PolarHBondContact O-N 3.36Å
372	L	95.5	Very high	87.8	Confident	102 Å²	102	91.2 Å²	91.2	53%	0.534	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.6	-172.9	-56.7	177.9	0	0	0	111.8	Q370 V380 I381 E382	Q370-L372 HydrophobicContact CB-CG 4.43Å; L372-V380 HydrophobicContact CB-CG1 4.21Å; L372-I381 WeakPolarHBondContact CA-O 3.13Å; L372-E382 HydrophobicContact CD2-CB 3.93Å; L372-E382 HydrophobicContact CD2-CG 4.26Å
373	L	95	Very high	88.9	Confident	10 Å²	10	87.3 Å²	87.3	5%	0.052	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.9	173.3	176	69.7	0	0	0	110.4	V380 I381 L383 V394 D398 M399 V482	L373-V380 WeakPolarHBondContact O-CA 3.45Å; L373-I381 HydrophobicContact CB-CG1 3.99Å; L373-I381 HydrophobicContact CD2-CD1 4.18Å; L373-I381 HydrophobicContact CD2-CG1 4.37Å; L373-I381 PolarHBondContact N-O 3.11Å; L373-I381 PolarHBondContact O-N 3.41Å; L373-L383 HydrophobicContact CB-CD1 4.26Å; L373-L383 HydrophobicContact CB-CD2 4.09Å; L373-L383 HydrophobicContact CB-CG 4.13Å; L373-L383 HydrophobicContact CD2-CD2 4.18Å; L373-V394 HydrophobicContact CD2-CG1 3.72Å; L373-D398 HydrophobicContact CD2-CB 3.98Å; L373-M399 HydrophobicContact CD1-CG 3.94Å; L373-M399 HydrophobicContact CD1-SD 4.07Å; L373-M399 HydrophobicContact CD2-CG 3.66Å; L373-M399 HydrophobicContact CD2-SD 3.73Å; L373-M399 HydrophobicContact CG-CG 4.46Å; L373-M399 HydrophobicContact CG-SD 4.39Å; L373-V482 HydrophobicContact CD1-CG2 3.77Å
374	R	93.8	Very high	89.6	Confident	177 Å²	177	87.9 Å²	87.9	67%	0.668	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	110.2	166.8	-171	177.6	-59.5	-136	-0.8	110.2	E379 V380	R374-E379 CarbonylContact C-O 3.6Å; R374-E379 WeakPolarHBondContact CA-O 3.25Å; R374-V380 HydrophobicContact CB-CG2 4.22Å; R374-V380 HydrophobicContact CG-CG2 4.12Å
375	R	91	Very high	90.2	Very high	72 Å²	72	93.5 Å²	93.5	27%	0.272	46%	0.456	S	S	.	.			trans	-69.3	168	179.9	-58.6	-179.3	74.3	-174.9	11.5	111.8	S377 R378 E379 I381 D398	R375-S377 PolarHBondContact O-N 3.06Å; R375-R378 WeakPolarHBondContact O-CA 3.3Å; R375-R378 PolarHBondContact O-N 3.28Å; R375-E379 WeakPolarHBondContact CD-OE2 3.12Å; R375-E379 IonicContact CZ-OE2 2.7Å; R375-E379 PolarHBondContact N-O 3.35Å; R375-E379 IonicContact NE-OE2 3.31Å; R375-E379 IonicContact NH1-OE2 3.61Å; R375-E379 PolarHBondContact NH1-OE2 3.04Å; R375-I381 HydrophobicContact CG-CD1 4.33Å; R375-I381 HydrophobicContact CG-CG1 4.33Å; R375-D398 WeakPolarHBondContact CB-OD1 3.34Å; R375-D398 IonicContact CZ-OD2 2.86Å; R375-D398 VanDerWaalsContact CZ-OD2 3.22Å; R375-D398 VanDerWaalsContact NE-CG 3.35Å; R375-D398 IonicContact NE-OD1 3.83Å; R375-D398 PolarHBondContact NE-OD1 3.23Å; R375-D398 IonicContact NE-OD2 3.79Å; R375-D398 PolarHBondContact NE-OD2 3.31Å; R375-D398 IonicContact NH2-OD2 3.2Å; R375-D398 PolarHBondContact NH2-OD2 3.48Å
376	R	85.2	Confident	90.5	Very high	128 Å²	128	89.1 Å²	89.1	48%	0.483	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.3	173.3	-78.4	-177.6	53.7	-152	-7.6	113.1	R378 R479 A481	R376-R378 PolarHBondContact O-N 3.48Å; R376-R378 VanDerWaalsContact O-N 3.16Å; R376-R479 WeakPolarHBondContact CD-O 3.17Å; R376-R479 VanDerWaalsContact NH1-CB 3.26Å; R376-R479 PolarHBondContact NH1-O 3.14Å; R376-A481 HydrophobicContact CG-CB 4.04Å
377	S	85.6	Confident	90.7	Very high	81 Å²	81	89.3 Å²	89.3	57%	0.566	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-7.4	172.8	59.5	0	0	0	0	113.6	R375 E379	R375-S377 PolarHBondContact O-N 3.06Å; S377-E379 PolarHBondContact O-N 3.16Å; S377-E379 WeakPolarHBondContact OG-CB 3.42Å; S377-E379 PolarHBondContact OG-N 3.47Å
378	R	87	Confident	90.7	Very high	202 Å²	202	83 Å²	83	76%	0.762	42%	0.418	S	S	*	.	S	Bend	trans	72.5	-0.8	-170.4	-52.5	-178.9	173.3	177.1	-2.1	115.1	R375 R376	R375-R378 WeakPolarHBondContact O-CA 3.3Å; R375-R378 PolarHBondContact O-N 3.28Å; R376-R378 PolarHBondContact O-N 3.48Å; R376-R378 VanDerWaalsContact O-N 3.16Å
379	E	92.4	Very high	90.8	Very high	97 Å²	97	82.6 Å²	82.6	45%	0.453	42%	0.419	S	S	.	.			trans	-61.4	138.2	167.7	-176.2	-177.1	-155	0	0	110	R374 R375 S377 I381	R374-E379 CarbonylContact C-O 3.6Å; R374-E379 WeakPolarHBondContact CA-O 3.25Å; R375-E379 WeakPolarHBondContact CD-OE2 3.12Å; R375-E379 IonicContact CZ-OE2 2.7Å; R375-E379 PolarHBondContact N-O 3.35Å; R375-E379 IonicContact NE-OE2 3.31Å; R375-E379 IonicContact NH1-OE2 3.61Å; R375-E379 PolarHBondContact NH1-OE2 3.04Å; S377-E379 PolarHBondContact O-N 3.16Å; S377-E379 WeakPolarHBondContact OG-CB 3.42Å; S377-E379 PolarHBondContact OG-N 3.47Å; E379-I381 HydrophobicContact CG-CG2 4.01Å
380	V	94.1	Very high	90.9	Very high	75 Å²	75	79.2 Å²	79.2	46%	0.455	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.2	172.6	-179.6	0	0	0	0	107.6	L372 L373 R374	L372-V380 HydrophobicContact CB-CG1 4.21Å; L373-V380 WeakPolarHBondContact O-CA 3.45Å; R374-V380 HydrophobicContact CB-CG2 4.22Å; R374-V380 HydrophobicContact CG-CG2 4.12Å
381	I	94.4	Very high	91	Very high	17 Å²	17	73.4 Å²	73.4	9%	0.087	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	147.9	177	64.5	170.9	0	0	0	109.9	L372 L373 R375 E379 L383 V394	L372-I381 WeakPolarHBondContact CA-O 3.13Å; L373-I381 HydrophobicContact CB-CG1 3.99Å; L373-I381 HydrophobicContact CD2-CD1 4.18Å; L373-I381 HydrophobicContact CD2-CG1 4.37Å; L373-I381 PolarHBondContact N-O 3.11Å; L373-I381 PolarHBondContact O-N 3.41Å; R375-I381 HydrophobicContact CG-CD1 4.33Å; R375-I381 HydrophobicContact CG-CG1 4.33Å; E379-I381 HydrophobicContact CG-CG2 4.01Å; I381-L383 HydrophobicContact CD1-CD2 3.97Å; I381-L383 HydrophobicContact CG1-CD2 4.28Å; I381-V394 HydrophobicContact CD1-CG1 4.37Å; I381-V394 HydrophobicContact CD1-CG2 3.6Å
382	E	94.9	Very high	90.8	Very high	36 Å²	36	80.2 Å²	80.2	17%	0.168	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.1	170.1	-179.8	154.7	-154.5	0	0	109.8	L372 S384 E385 Q386	L372-E382 HydrophobicContact CD2-CB 3.93Å; L372-E382 HydrophobicContact CD2-CG 4.26Å; E382-S384 WeakPolarHBondContact CG-OG 3.43Å; E382-S384 PolarHBondContact OE1-OG 3.15Å; E382-E385 HydrophobicContact CB-CB 4.46Å; E382-E385 HydrophobicContact CB-CG 4.26Å; E382-E385 HydrophobicContact CG-CB 4.44Å; E382-E385 HydrophobicContact CG-CG 3.94Å; E382-E385 PolarHBondContact O-N 2.85Å; E382-Q386 WeakPolarHBondContact O-CG 3.49Å; E382-Q386 PolarHBondContact O-NE2 2.89Å
383	L	92.6	Very high	90.4	Very high	5 Å²	5	81.2 Å²	81.2	3%	0.026	39%	0.394	C	S	.	.	S	Bend	trans	-70	-34.4	-172	-66.8	-179.2	0	0	0	112.8	R357 T371 L373 I381 E385 Q386 M391 V394 M399	R357-L383 WeakPolarHBondContact CD-O 3.23Å; R357-L383 PolarHBondContact NH1-O 2.93Å; T371-L383 HydrophobicContact CG2-CB 4.09Å; T371-L383 HydrophobicContact CG2-CD1 3.74Å; T371-L383 HydrophobicContact CG2-CG 4.27Å; T371-L383 PolarHBondContact O-N 3.36Å; L373-L383 HydrophobicContact CB-CD1 4.26Å; L373-L383 HydrophobicContact CB-CD2 4.09Å; L373-L383 HydrophobicContact CB-CG 4.13Å; L373-L383 HydrophobicContact CD2-CD2 4.18Å; I381-L383 HydrophobicContact CD1-CD2 3.97Å; I381-L383 HydrophobicContact CG1-CD2 4.28Å; L383-E385 VanDerWaalsContact C-N 3.28Å; L383-E385 PolarHBondContact O-N 3.37Å; L383-Q386 PolarHBondContact O-N 3.16Å; L383-M391 HydrophobicContact CD2-CE 4.46Å; L383-M391 HydrophobicContact CD2-SD 4.04Å; L383-V394 HydrophobicContact CD2-CG1 3.91Å; L383-M399 HydrophobicContact CD1-CE 4.42Å; L383-M399 HydrophobicContact CD1-SD 3.77Å; L383-M399 HydrophobicContact CD2-SD 4.46Å
384	S	87.2	Confident	90.2	Very high	54 Å²	54	81 Å²	81	38%	0.378	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-34.2	176.2	34	0	0	0	0	112.3	R357 E382	R357-S384 PolarHBondContact NH1-O 2.99Å; E382-S384 WeakPolarHBondContact CG-OG 3.43Å; E382-S384 PolarHBondContact OE1-OG 3.15Å
385	E	90.2	Very high	90.1	Very high	148 Å²	148	74.4 Å²	74.4	69%	0.692	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-11.6	-179.2	-64.5	-171.7	153.9	0	0	114.2	E382 L383	E382-E385 HydrophobicContact CB-CB 4.46Å; E382-E385 HydrophobicContact CB-CG 4.26Å; E382-E385 HydrophobicContact CG-CB 4.44Å; E382-E385 HydrophobicContact CG-CG 3.94Å; E382-E385 PolarHBondContact O-N 2.85Å; L383-E385 VanDerWaalsContact C-N 3.28Å; L383-E385 PolarHBondContact O-N 3.37Å
386	Q	90.4	Very high	89.8	Confident	34 Å²	34	72 Å²	72	16%	0.159	37%	0.366	C	S	.	.			trans	-71.9	140.7	-178.2	-57.5	-50.8	-63.9	0	0	111.5	R357 E382 L383 Q390 M391	R357-Q386 PolarHBondContact NH1-O 3.37Å; E382-Q386 WeakPolarHBondContact O-CG 3.49Å; E382-Q386 PolarHBondContact O-NE2 2.89Å; L383-Q386 PolarHBondContact O-N 3.16Å; Q386-Q390 HydrophobicContact CB-CB 4.03Å; Q386-M391 HydrophobicContact CB-CG 3.8Å; Q386-M391 HydrophobicContact CB-SD 3.88Å; Q386-M391 HydrophobicContact CG-SD 4.17Å
387	S	89.8	Confident	89.9	Confident	56 Å²	56	67 Å²	67	39%	0.392	35%	0.352	S	S	.	.			trans	-68.1	162.1	166.7	64.6	0	0	0	0	111.4	A389 Q390 M391	S387-A389 PolarHBondContact O-N 3.34Å; S387-Q390 PolarHBondContact O-N 3.31Å; S387-Q390 VanDerWaalsContact O-N 3.1Å; S387-Q390 WeakPolarHBondContact OG-CG 3.33Å; S387-Q390 PolarHBondContact OG-N 3.09Å; S387-Q390 PolarHBondContact OG-OE1 3.44Å; S387-M391 PolarHBondContact O-N 3.19Å
388	A	86.2	Confident	90.2	Very high	64 Å²	64	63.6 Å²	63.6	53%	0.529	33%	0.328	S	S	.	.	H	α-helix	trans	-55.8	-34.4	174.4	0	0	0	0	0	112.7	R392	A388-R392 WeakPolarHBondContact O-CG 3.01Å; A388-R392 PolarHBondContact O-N 2.7Å
389	A	88.9	Confident	90.6	Very high	56 Å²	56	54.3 Å²	54.3	46%	0.463	29%	0.293	S	S	.	.	H	α-helix	trans	-71.9	-39.5	176.7	0	0	0	0	0	112.8	S387 R392 H393	S387-A389 PolarHBondContact O-N 3.34Å; A389-R392 WeakPolarHBondContact O-CB 3.5Å; A389-R392 PolarHBondContact O-N 3.16Å; A389-H393 PolarHBondContact O-ND1 2.92Å
390	Q	91.1	Very high	90.6	Very high	94 Å²	94	49.9 Å²	49.9	44%	0.439	27%	0.273	S	S	.	.	H	α-helix	trans	-66.4	-42.4	172.9	-75.5	160.9	-49.2	0	0	111.1	Q386 S387 R392 H393 V394	Q386-Q390 HydrophobicContact CB-CB 4.03Å; S387-Q390 PolarHBondContact O-N 3.31Å; S387-Q390 VanDerWaalsContact O-N 3.1Å; S387-Q390 WeakPolarHBondContact OG-CG 3.33Å; S387-Q390 PolarHBondContact OG-N 3.09Å; S387-Q390 PolarHBondContact OG-OE1 3.44Å; Q390-R392 PolarHBondContact O-N 2.78Å; Q390-R392 VanDerWaalsContact O-N 3.17Å; Q390-H393 WeakPolarHBondContact O-CB 3.21Å; Q390-H393 PolarHBondContact O-N 3.17Å; Q390-V394 PolarHBondContact O-N 2.95Å
391	M	91.7	Very high	90.6	Very high	2 Å²	2	47 Å²	47	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-26.6	175	-79.4	-55.8	-66.4	0	0	113.2	R357 L383 Q386 S387 H393 V394 R395	R357-M391 HydrophobicContact CB-CE 3.98Å; R357-M391 HydrophobicContact CG-CE 3.94Å; L383-M391 HydrophobicContact CD2-CE 4.46Å; L383-M391 HydrophobicContact CD2-SD 4.04Å; Q386-M391 HydrophobicContact CB-CG 3.8Å; Q386-M391 HydrophobicContact CB-SD 3.88Å; Q386-M391 HydrophobicContact CG-SD 4.17Å; S387-M391 PolarHBondContact O-N 3.19Å; M391-H393 VanDerWaalsContact C-N 3.27Å; M391-H393 PolarHBondContact O-N 2.65Å; M391-V394 PolarHBondContact O-N 3.17Å; M391-V394 HydrophobicContact SD-CB 4.36Å; M391-V394 HydrophobicContact SD-CG2 4.45Å; M391-R395 HydrophobicContact CE-CG 4.28Å; M391-R395 WeakPolarHBondContact O-CB 3.33Å; M391-R395 VanDerWaalsContact O-CG 3.24Å; M391-R395 WeakPolarHBondContact O-CG 3.45Å; M391-R395 PolarHBondContact O-N 3.27Å; M391-R395 PolarHBondContact O-NE 2.89Å; M391-R395 VanDerWaalsContact O-NE 3.11Å
392	R	88.8	Confident	90.4	Very high	174 Å²	174	46.2 Å²	46.2	66%	0.657	25%	0.251	S	S	*	.	H	α-helix	trans	-65.1	-30.1	171.6	-72.4	175.6	-174.3	165.8	1.8	112.5	A388 A389 Q390 H427	A388-R392 WeakPolarHBondContact O-CG 3.01Å; A388-R392 PolarHBondContact O-N 2.7Å; A389-R392 WeakPolarHBondContact O-CB 3.5Å; A389-R392 PolarHBondContact O-N 3.16Å; Q390-R392 PolarHBondContact O-N 2.78Å; Q390-R392 VanDerWaalsContact O-N 3.17Å; R392-H427 PolarHBondContact O-CE1 3.32Å; R392-H427 VanDerWaalsContact O-CE1 3.26Å
393	H	87.8	Confident	89.9	Confident	124 Å²	124	48.3 Å²	48.3	57%	0.574	26%	0.259	S	S	*	.	H	α-helix	trans	-83.5	-27	177.4	-65.8	78.9	0	0	0	112.4	A389 Q390 M391 A397	A389-H393 PolarHBondContact O-ND1 2.92Å; Q390-H393 WeakPolarHBondContact O-CB 3.21Å; Q390-H393 PolarHBondContact O-N 3.17Å; M391-H393 VanDerWaalsContact C-N 3.27Å; M391-H393 PolarHBondContact O-N 2.65Å; H393-A397 VanDerWaalsContact O-CB 3.3Å; H393-A397 WeakPolarHBondContact O-CB 3.05Å
394	V	91.6	Very high	88.9	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-73.1	-46.9	174.4	178.8	0	0	0	0	110.7	L373 I381 L383 Q390 M391 D398 M399	L373-V394 HydrophobicContact CD2-CG1 3.72Å; I381-V394 HydrophobicContact CD1-CG1 4.37Å; I381-V394 HydrophobicContact CD1-CG2 3.6Å; L383-V394 HydrophobicContact CD2-CG1 3.91Å; Q390-V394 PolarHBondContact O-N 2.95Å; M391-V394 PolarHBondContact O-N 3.17Å; M391-V394 HydrophobicContact SD-CB 4.36Å; M391-V394 HydrophobicContact SD-CG2 4.45Å; V394-D398 HydrophobicContact CG1-CB 4.31Å; V394-D398 PolarHBondContact O-N 2.93Å; V394-M399 HydrophobicContact CG1-CG 4.25Å; V394-M399 HydrophobicContact CG1-SD 4.18Å; V394-M399 PolarHBondContact O-N 3.05Å
395	R	91.5	Very high	88.1	Confident	38 Å²	38	54.9 Å²	54.9	14%	0.143	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-68.2	130.5	175.7	-67.4	-179.8	-77.9	-168.4	-2.7	109.6	M356 M391 A397 M399 H427	M356-R395 HydrophobicContact CE-CB 4.17Å; M356-R395 HydrophobicContact CE-CG 3.71Å; M356-R395 WeakPolarHBondContact O-CD 3.44Å; M391-R395 HydrophobicContact CE-CG 4.28Å; M391-R395 WeakPolarHBondContact O-CB 3.33Å; M391-R395 VanDerWaalsContact O-CG 3.24Å; M391-R395 WeakPolarHBondContact O-CG 3.45Å; M391-R395 PolarHBondContact O-N 3.27Å; M391-R395 PolarHBondContact O-NE 2.89Å; M391-R395 VanDerWaalsContact O-NE 3.11Å; R395-A397 VanDerWaalsContact C-N 3.33Å; R395-A397 PolarHBondContact O-N 3.12Å; R395-M399 CarbonylContact C-O 3.47Å; R395-H427 PolarHBondContact O-CE1 3.08Å; R395-H427 PolarHBondContact O-NE2 3.14Å
396	G	83.5	Confident	87.1	Confident	21 Å²	21	48.6 Å²	48.6	22%	0.216	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	-52.1	-173.7	0	0	0	0	0	112.7	M399 C478	G396-M399 PolarHBondContact N-O 2.81Å; G396-C478 WeakPolarHBondContact O-CB 3.03Å
397	A	87.4	Confident	85.8	Confident	24 Å²	24	52.9 Å²	52.9	20%	0.198	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-45.9	-173.1	0	0	0	0	0	114.9	H393 R395 H427 P480	H393-A397 VanDerWaalsContact O-CB 3.3Å; H393-A397 WeakPolarHBondContact O-CB 3.05Å; R395-A397 VanDerWaalsContact C-N 3.33Å; R395-A397 PolarHBondContact O-N 3.12Å; A397-H427 HydrophobicContact CB-CB 4.17Å; A397-P480 WeakPolarHBondContact O-CA 3.28Å
398	D	92.6	Very high	84.9	Confident	10 Å²	10	55.3 Å²	55.3	5%	0.053	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-32.2	-178.4	-70.2	-70.8	0	0	0	112	L373 R375 V394 A481 V482	L373-D398 HydrophobicContact CD2-CB 3.98Å; R375-D398 WeakPolarHBondContact CB-OD1 3.34Å; R375-D398 IonicContact CZ-OD2 2.86Å; R375-D398 VanDerWaalsContact CZ-OD2 3.22Å; R375-D398 VanDerWaalsContact NE-CG 3.35Å; R375-D398 IonicContact NE-OD1 3.83Å; R375-D398 PolarHBondContact NE-OD1 3.23Å; R375-D398 IonicContact NE-OD2 3.79Å; R375-D398 PolarHBondContact NE-OD2 3.31Å; R375-D398 IonicContact NH2-OD2 3.2Å; R375-D398 PolarHBondContact NH2-OD2 3.48Å; V394-D398 HydrophobicContact CG1-CB 4.31Å; V394-D398 PolarHBondContact O-N 2.93Å; D398-A481 WeakPolarHBondContact O-CA 3.43Å; D398-A481 WeakPolarHBondContact O-CB 3.45Å; D398-A481 PolarHBondContact O-N 3.41Å; D398-V482 PolarHBondContact O-N 3.33Å; D398-V482 VanDerWaalsContact O-N 3.13Å
399	M	94.6	Very high	84.5	Confident	6 Å²	6	54 Å²	54	3%	0.03	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.7	175.3	-61.9	179.2	67.3	0	0	110.3	L355 M356 L373 L383 V394 R395 G396 V482 I484	L355-M399 HydrophobicContact CB-CE 4.32Å; M356-M399 HydrophobicContact SD-CB 3.87Å; M356-M399 HydrophobicContact SD-CE 3.92Å; L373-M399 HydrophobicContact CD1-CG 3.94Å; L373-M399 HydrophobicContact CD1-SD 4.07Å; L373-M399 HydrophobicContact CD2-CG 3.66Å; L373-M399 HydrophobicContact CD2-SD 3.73Å; L373-M399 HydrophobicContact CG-CG 4.46Å; L373-M399 HydrophobicContact CG-SD 4.39Å; L383-M399 HydrophobicContact CD1-CE 4.42Å; L383-M399 HydrophobicContact CD1-SD 3.77Å; L383-M399 HydrophobicContact CD2-SD 4.46Å; V394-M399 HydrophobicContact CG1-CG 4.25Å; V394-M399 HydrophobicContact CG1-SD 4.18Å; V394-M399 PolarHBondContact O-N 3.05Å; R395-M399 CarbonylContact C-O 3.47Å; G396-M399 PolarHBondContact N-O 2.81Å; M399-V482 WeakPolarHBondContact CA-O 3.35Å; M399-V482 HydrophobicContact CG-CB 4.26Å; M399-I484 HydrophobicContact CE-CD1 4.04Å
400	A	94	Very high	84.4	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.033	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	155	173.6	0	0	0	0	0	111.1	A475 P480 V482 L483 I484	A400-A475 HydrophobicContact CB-CB 4.02Å; A400-A475 WeakPolarHBondContact CB-O 3.17Å; A400-P480 HydrophobicContact CB-CB 4.02Å; A400-P480 HydrophobicContact CB-CG 3.74Å; A400-V482 PolarHBondContact N-O 2.77Å; A400-L483 HydrophobicContact CB-CD1 4.23Å; A400-I484 PolarHBondContact O-N 2.83Å
401	M	92.5	Very high	84.3	Confident	15 Å²	15	50.2 Å²	50.2	7%	0.074	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133	178.3	-172.1	168.4	177.8	0	0	110.3	A352 L353 M356 F403 I484 D486	A352-M401 HydrophobicContact CB-CE 3.82Å; A352-M401 HydrophobicContact CB-SD 4.46Å; L353-M401 HydrophobicContact CD2-CE 4.27Å; L353-M401 HydrophobicContact CD2-SD 4.41Å; M356-M401 HydrophobicContact CE-CB 4.2Å; M356-M401 HydrophobicContact CG-SD 4.24Å; M401-F403 HydrophobicContact CB-CE2 4.32Å; M401-F403 HydrophobicContact CB-CZ 4.29Å; M401-F403 HydrophobicContact CE-CD1 3.88Å; M401-F403 HydrophobicContact CE-CE1 4.1Å; M401-F403 HydrophobicContact CG-CD1 4.22Å; M401-F403 HydrophobicContact CG-CE1 4.19Å; M401-F403 HydrophobicContact CG-CG 4.4Å; M401-F403 HydrophobicContact CG-CZ 4.34Å; M401-F403 HydrophobicContact SD-CD1 3.9Å; M401-F403 HydrophobicContact SD-CE1 3.57Å; M401-F403 VanDerWaalsContact SD-CE1 3.57Å; M401-F403 HydrophobicContact SD-CZ 4.08Å; M401-I484 CarbonylContact C-O 3.45Å; M401-I484 VanDerWaalsContact CA-O 3.25Å; M401-I484 WeakPolarHBondContact CA-O 3.44Å; M401-I484 HydrophobicContact CB-CB 4.48Å; M401-I484 HydrophobicContact CG-CB 4.27Å; M401-I484 HydrophobicContact CG-CG2 4.3Å; M401-D486 HydrophobicContact CE-CB 3.83Å
402	I	91.1	Very high	84	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	107.5	162.8	-63.8	161.2	0	0	0	105	Q468 M471 I472 A475 L483 I484 A485 D486 P488	I402-Q468 VanDerWaalsContact CG2-NE2 3.33Å; I402-M471 HydrophobicContact CB-SD 4.13Å; I402-M471 HydrophobicContact CG2-CG 4.36Å; I402-M471 HydrophobicContact CG2-SD 3.51Å; I402-M471 VanDerWaalsContact CG2-SD 3.51Å; I402-I472 HydrophobicContact CD1-CB 4.47Å; I402-I472 HydrophobicContact CD1-CG1 3.69Å; I402-I472 HydrophobicContact CG1-CG1 4.4Å; I402-A475 HydrophobicContact CG1-CB 3.91Å; I402-L483 HydrophobicContact CD1-CD1 3.96Å; I402-L483 HydrophobicContact CD1-CD2 4.01Å; I402-L483 HydrophobicContact CD1-CG 4.33Å; I402-L483 HydrophobicContact CG1-CD1 4.1Å; I402-I484 PolarHBondContact N-O 2.87Å; I402-A485 HydrophobicContact CB-CB 4.46Å; I402-A485 HydrophobicContact CD1-CB 4.21Å; I402-D486 PolarHBondContact O-N 3.19Å; I402-P488 HydrophobicContact CG2-CB 4.1Å
403	F	84.3	Confident	84.1	Confident	80 Å²	80	50.3 Å²	50.3	35%	0.351	27%	0.273	S	S	.	.			trans	-74.7	157.6	-179.9	-67.1	-83.6	0	0	0	111.3	L353 L358 M401 S409 M471	L353-F403 HydrophobicContact CD2-CE1 4.38Å; L358-F403 HydrophobicContact CD1-CE1 4.11Å; L358-F403 HydrophobicContact CD1-CZ 4.1Å; M401-F403 HydrophobicContact CB-CE2 4.32Å; M401-F403 HydrophobicContact CB-CZ 4.29Å; M401-F403 HydrophobicContact CE-CD1 3.88Å; M401-F403 HydrophobicContact CE-CE1 4.1Å; M401-F403 HydrophobicContact CG-CD1 4.22Å; M401-F403 HydrophobicContact CG-CE1 4.19Å; M401-F403 HydrophobicContact CG-CG 4.4Å; M401-F403 HydrophobicContact CG-CZ 4.34Å; M401-F403 HydrophobicContact SD-CD1 3.9Å; M401-F403 HydrophobicContact SD-CE1 3.57Å; M401-F403 VanDerWaalsContact SD-CE1 3.57Å; M401-F403 HydrophobicContact SD-CZ 4.08Å; F403-S409 VanDerWaalsContact CB-OG 3.25Å; F403-S409 WeakPolarHBondContact CB-OG 3.3Å; F403-M471 PolarHBondContact N-SD 2.86Å; F403-M471 VanDerWaalsContact N-SD 3.41Å
404	Q	72.4	Confident	84.3	Confident	90 Å²	90	49 Å²	49	42%	0.421	27%	0.266	S	S	.	.	S	Bend	trans	-61.1	137.2	170.9	-169.1	177.1	-0.9	0	0	109.7	E487	Q404-E487 HydrophobicContact CG-CB 4.36Å
405	E	70.2	Confident	84.4	Confident	108 Å²	108	50.4 Å²	50.4	51%	0.505	28%	0.275	S	S	.	.			trans	59.5	104.3	179.3	-68	174.9	-158.1	0	0	116.6	M407 T408 S409	E405-M407 PolarHBondContact O-N 2.64Å; E405-T408 PolarHBondContact O-N 3.45Å; E405-T408 PolarHBondContact O-OG1 2.85Å; E405-S409 PolarHBondContact O-N 3.07Å; E405-S409 PolarHBondContact O-OG 3.06Å
406	P	68.9	Low	84.5	Confident	16 Å²	16	48.6 Å²	48.6	10%	0.104	27%	0.268	C	S	.	.	H	α-helix	trans	-58.9	-23.5	177.5	-27	34.3	0	0	0	117.7	L410 R467 Q468 M471	P406-L410 WeakPolarHBondContact O-CB 3.24Å; P406-L410 WeakPolarHBondContact O-CG 3.31Å; P406-L410 PolarHBondContact O-N 3.18Å; P406-L410 VanDerWaalsContact O-N 3.16Å; P406-R467 HydrophobicContact CB-CB 3.53Å; P406-R467 HydrophobicContact CG-CB 4.33Å; P406-Q468 HydrophobicContact CG-CB 4.23Å; P406-M471 HydrophobicContact CB-CE 3.75Å; P406-M471 HydrophobicContact CG-CE 3.88Å
407	M	64.1	Low	85.1	Confident	124 Å²	124	47.6 Å²	47.6	61%	0.611	26%	0.258	S	S	*	.	H	α-helix	trans	-73.1	-36	-176.2	-62.6	-150.4	-70.5	0	0	112.9	E405 R467	E405-M407 PolarHBondContact O-N 2.64Å; M407-R467 PolarHBondContact SD-NH1 3.17Å
408	T	70.6	Confident	85.4	Confident	106 Å²	106	48.2 Å²	48.2	65%	0.65	26%	0.256	S	S	*	.	H	α-helix	trans	-83.2	-25.9	179.5	54	0	0	0	0	111.5	E405	E405-T408 PolarHBondContact O-N 3.45Å; E405-T408 PolarHBondContact O-OG1 2.85Å
409	S	77.8	Confident	85.5	Confident	38 Å²	38	48.2 Å²	48.2	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-84.7	-31.4	-176.9	-61.1	0	0	0	0	114	F403 E405 M471	F403-S409 VanDerWaalsContact CB-OG 3.25Å; F403-S409 WeakPolarHBondContact CB-OG 3.3Å; E405-S409 PolarHBondContact O-N 3.07Å; E405-S409 PolarHBondContact O-OG 3.06Å; S409-M471 VanDerWaalsContact CB-CE 3.44Å
410	L	86.2	Confident	85.5	Confident	3 Å²	3	48 Å²	48	2%	0.016	26%	0.255	C	S	.	.	S	Bend	trans	-88.6	134.3	175.5	-65.8	172.8	0	0	0	110.1	P406 P412 P459 R467 V470 M474	P406-L410 WeakPolarHBondContact O-CB 3.24Å; P406-L410 WeakPolarHBondContact O-CG 3.31Å; P406-L410 PolarHBondContact O-N 3.18Å; P406-L410 VanDerWaalsContact O-N 3.16Å; L410-P412 WeakPolarHBondContact O-CD 3.41Å; L410-P459 HydrophobicContact CB-CB 3.89Å; L410-P459 HydrophobicContact CB-CG 3.76Å; L410-P459 HydrophobicContact CD1-CB 4.03Å; L410-P459 HydrophobicContact CD1-CG 4.29Å; L410-R467 HydrophobicContact CD1-CB 4.15Å; L410-R467 HydrophobicContact CD1-CG 4.48Å; L410-V470 HydrophobicContact CD1-CB 4.44Å; L410-V470 HydrophobicContact CD1-CG1 4.01Å; L410-V470 HydrophobicContact CD2-CG1 4Å; L410-M474 HydrophobicContact CD2-CE 4.11Å; L410-M474 HydrophobicContact CD2-SD 4.37Å
411	N	88.6	Confident	85.6	Confident	67 Å²	67	47.8 Å²	47.8	36%	0.358	25%	0.253	S	S	.	.			trans	-74	118.5	178.3	-172.7	-33.7	0	0	0	110.3	V413 F414 Q419	N411-V413 PolarHBondContact O-N 3.18Å; N411-V413 WeakPolarHBondContact OD1-CG2 3.35Å; N411-V413 PolarHBondContact OD1-N 3.15Å; N411-F414 HydrophobicContact CB-CD2 3.91Å; N411-F414 VanDerWaalsContact CG-CD2 3.47Å; N411-F414 WeakPolarHBondContact ND2-CD2 2.76Å; N411-F414 WeakPolarHBondContact ND2-CE2 3.33Å; N411-F414 PolarHBondContact O-N 3.22Å; N411-Q419 PolarHBondContact O-NE2 3.02Å
412	P	85	Confident	85.6	Confident	75 Å²	75	51.4 Å²	51.4	49%	0.487	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.3	-173.5	28.9	-35.9	0	0	0	114.2	L410	L410-P412 WeakPolarHBondContact O-CD 3.41Å
413	V	91.4	Very high	85.6	Confident	102 Å²	102	52.8 Å²	52.8	62%	0.618	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-9.3	-179.2	-56.2	0	0	0	0	114	N411 Y458	N411-V413 PolarHBondContact O-N 3.18Å; N411-V413 WeakPolarHBondContact OD1-CG2 3.35Å; N411-V413 PolarHBondContact OD1-N 3.15Å; V413-Y458 WeakPolarHBondContact O-CE1 3.41Å
414	F	92.4	Very high	86	Confident	98 Å²	98	49 Å²	49	43%	0.43	26%	0.263	S	S	.	.	S	Bend	trans	-108.3	148.2	175.8	-64.9	-67.1	0	0	0	111.4	N411 Q419 P459	N411-F414 HydrophobicContact CB-CD2 3.91Å; N411-F414 VanDerWaalsContact CG-CD2 3.47Å; N411-F414 WeakPolarHBondContact ND2-CD2 2.76Å; N411-F414 WeakPolarHBondContact ND2-CE2 3.33Å; N411-F414 PolarHBondContact O-N 3.22Å; F414-Q419 HydrophobicContact CB-CG 3.77Å; F414-Q419 PolarHBondContact O-NE2 3.34Å; F414-P459 VanDerWaalsContact O-CD 3.31Å; F414-P459 WeakPolarHBondContact O-CD 3.49Å
415	T	94.2	Very high	87	Confident	34 Å²	34	47.8 Å²	47.8	21%	0.209	26%	0.255	C	S	.	.			trans	-68.4	156.1	173.8	64.8	0	0	0	0	110.9	G417 E418 Q419 L455 R457 Y458	T415-G417 VanDerWaalsContact C-N 3.28Å; T415-G417 PolarHBondContact O-N 2.8Å; T415-E418 PolarHBondContact O-N 3.14Å; T415-E418 WeakPolarHBondContact OG1-CB 3.1Å; T415-E418 PolarHBondContact OG1-N 3.12Å; T415-Q419 PolarHBondContact O-N 3.01Å; T415-L455 WeakPolarHBondContact CB-O 3.22Å; T415-L455 PolarHBondContact OG1-O 3.46Å; T415-R457 WeakPolarHBondContact CA-O 3.4Å; T415-Y458 HydrophobicContact CG2-CD1 4.47Å; T415-Y458 HydrophobicContact CG2-CE1 4.04Å; T415-Y458 HydrophobicContact CG2-CE2 4.39Å
416	V	93.5	Very high	88	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-55.8	-44.6	177.8	167.5	0	0	0	0	111.4	Q419 I420 L443 I454 R457 L462 V470	V416-Q419 PolarHBondContact O-N 2.94Å; V416-I420 HydrophobicContact CG1-CD1 4.06Å; V416-I420 WeakPolarHBondContact O-CG1 3.34Å; V416-I420 PolarHBondContact O-N 2.75Å; V416-L443 HydrophobicContact CG1-CD1 4.21Å; V416-L443 HydrophobicContact CG1-CD2 4.12Å; V416-I454 HydrophobicContact CB-CG2 4.49Å; V416-I454 HydrophobicContact CG1-CG2 4.11Å; V416-I454 HydrophobicContact CG2-CG2 4.48Å; V416-R457 WeakPolarHBondContact CG2-O 3.45Å; V416-R457 PolarHBondContact N-O 3.45Å; V416-L462 HydrophobicContact CG2-CD1 3.68Å; V416-V470 HydrophobicContact CG1-CB 4.32Å; V416-V470 HydrophobicContact CG1-CG1 3.7Å; V416-V470 HydrophobicContact CG1-CG2 3.58Å; V416-V470 HydrophobicContact CG2-CG1 4.43Å; V416-V470 HydrophobicContact CG2-CG2 4.31Å
417	G	94.9	Very high	88.9	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-39.9	-179.4	0	0	0	0	0	112.8	T415 A421 L455	T415-G417 VanDerWaalsContact C-N 3.28Å; T415-G417 PolarHBondContact O-N 2.8Å; G417-A421 WeakPolarHBondContact O-CB 3.3Å; G417-A421 PolarHBondContact O-N 2.94Å; G417-L455 VanDerWaalsContact CA-CD2 3.48Å; G417-L455 PolarHBondContact N-O 3.48Å
418	E	95.3	Very high	90.1	Very high	36 Å²	36	47.8 Å²	47.8	17%	0.168	26%	0.255	C	S	.	.	H	α-helix	trans	-66.5	-39.4	-179.7	-165.9	60.5	-124.4	0	0	111.9	T415 A421 E422 R425 R432	T415-E418 PolarHBondContact O-N 3.14Å; T415-E418 WeakPolarHBondContact OG1-CB 3.1Å; T415-E418 PolarHBondContact OG1-N 3.12Å; E418-A421 PolarHBondContact O-N 2.85Å; E418-E422 WeakPolarHBondContact O-CB 3.27Å; E418-E422 PolarHBondContact O-N 3.44Å; E418-R425 IonicContact OE1-CZ 3.22Å; E418-R425 IonicContact OE1-NH1 2.78Å; E418-R425 PolarHBondContact OE1-NH1 3.49Å; E418-R425 IonicContact OE1-NH2 2.78Å; E418-R425 PolarHBondContact OE1-NH2 2.85Å; E418-R432 IonicContact OE2-CZ 2.65Å; E418-R432 IonicContact OE2-NE 3.6Å; E418-R432 IonicContact OE2-NH2 3.38Å; E418-R432 PolarHBondContact OE2-NH2 3.35Å
419	Q	94	Very high	90.8	Very high	11 Å²	11	50.3 Å²	50.3	5%	0.051	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-43.6	178.2	-68	-179.2	69.5	0	0	112.4	N411 F414 T415 V416 M474	N411-Q419 PolarHBondContact O-NE2 3.02Å; F414-Q419 HydrophobicContact CB-CG 3.77Å; F414-Q419 PolarHBondContact O-NE2 3.34Å; T415-Q419 PolarHBondContact O-N 3.01Å; V416-Q419 PolarHBondContact O-N 2.94Å; Q419-M474 HydrophobicContact CB-SD 4.35Å
420	I	94.3	Very high	91.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-67.7	-43.6	176	-60.6	168.9	0	0	0	110.4	V416 E422 S423 I424 A439 L443 V470 A473 M474	V416-I420 HydrophobicContact CG1-CD1 4.06Å; V416-I420 WeakPolarHBondContact O-CG1 3.34Å; V416-I420 PolarHBondContact O-N 2.75Å; I420-E422 VanDerWaalsContact C-N 3.31Å; I420-E422 PolarHBondContact O-N 2.82Å; I420-S423 PolarHBondContact O-N 2.91Å; I420-I424 HydrophobicContact CG2-CD1 4.1Å; I420-I424 PolarHBondContact O-N 3.47Å; I420-A439 HydrophobicContact CB-CB 3.86Å; I420-A439 HydrophobicContact CG2-CB 3.62Å; I420-L443 HydrophobicContact CD1-CD2 3.5Å; I420-L443 HydrophobicContact CD1-CG 3.96Å; I420-V470 HydrophobicContact CD1-CG1 4.34Å; I420-A473 HydrophobicContact CD1-CB 4.1Å; I420-M474 HydrophobicContact CG1-CB 4.13Å
421	A	95.4	Very high	91.8	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-34.2	-179.6	0	0	0	0	0	112.3	G417 E418 S423 I424 R425 A435 M436 A439	G417-A421 WeakPolarHBondContact O-CB 3.3Å; G417-A421 PolarHBondContact O-N 2.94Å; E418-A421 PolarHBondContact O-N 2.85Å; A421-S423 PolarHBondContact O-N 3.09Å; A421-I424 PolarHBondContact O-N 3.04Å; A421-R425 WeakPolarHBondContact O-CG 3.46Å; A421-R425 PolarHBondContact O-N 3.37Å; A421-A435 HydrophobicContact CB-CB 3.88Å; A421-M436 HydrophobicContact CB-CE 4.03Å; A421-A439 HydrophobicContact CB-CB 4.44Å
422	E	93.7	Very high	92.1	Very high	91 Å²	91	56.3 Å²	56.3	43%	0.425	29%	0.289	S	S	.	.	H	α-helix	trans	-56.8	-50.2	177.1	-179	179.7	-166.2	0	0	112.1	E418 I420 I424 R425 L426	E418-E422 WeakPolarHBondContact O-CB 3.27Å; E418-E422 PolarHBondContact O-N 3.44Å; I420-E422 VanDerWaalsContact C-N 3.31Å; I420-E422 PolarHBondContact O-N 2.82Å; E422-I424 VanDerWaalsContact C-N 3.28Å; E422-I424 PolarHBondContact O-N 3.02Å; E422-R425 PolarHBondContact O-N 2.67Å; E422-L426 HydrophobicContact CG-CD1 3.84Å; E422-L426 HydrophobicContact CG-CG 4.37Å; E422-L426 WeakPolarHBondContact O-CG 3.27Å; E422-L426 PolarHBondContact O-N 3.25Å
423	S	90.6	Very high	92.5	Very high	29 Å²	29	60.4 Å²	60.4	20%	0.203	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-42.7	177.5	-62.2	0	0	0	0	111.6	I420 A421 L426 H427	I420-S423 PolarHBondContact O-N 2.91Å; A421-S423 PolarHBondContact O-N 3.09Å; S423-L426 PolarHBondContact O-N 2.84Å; S423-H427 PolarHBondContact O-CD2 3.4Å; S423-H427 PolarHBondContact O-N 2.73Å; S423-H427 VanDerWaalsContact O-N 3.15Å
424	I	92.8	Very high	92.7	Very high	2 Å²	2	61.2 Å²	61.2	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-45.5	179.3	-62.4	161.4	0	0	0	110.8	I420 A421 E422 L426 H427 Q428 A430 A435 E438 A439	I420-I424 HydrophobicContact CG2-CD1 4.1Å; I420-I424 PolarHBondContact O-N 3.47Å; A421-I424 PolarHBondContact O-N 3.04Å; E422-I424 VanDerWaalsContact C-N 3.28Å; E422-I424 PolarHBondContact O-N 3.02Å; I424-L426 PolarHBondContact O-N 3.26Å; I424-H427 PolarHBondContact O-N 3.04Å; I424-Q428 HydrophobicContact CG2-CB 4.35Å; I424-Q428 WeakPolarHBondContact O-CA 3.46Å; I424-Q428 VanDerWaalsContact O-CB 3.26Å; I424-Q428 WeakPolarHBondContact O-CB 3.37Å; I424-Q428 PolarHBondContact O-N 3.24Å; I424-A430 HydrophobicContact CG2-CB 3.97Å; I424-A435 HydrophobicContact CB-CB 4.17Å; I424-A435 HydrophobicContact CG2-CB 4.04Å; I424-E438 HydrophobicContact CD1-CB 3.88Å; I424-E438 HydrophobicContact CD1-CG 3.68Å; I424-E438 HydrophobicContact CG1-CG 4.42Å; I424-A439 HydrophobicContact CD1-CB 4.47Å
425	R	93.8	Very high	92.8	Very high	64 Å²	64	56.6 Å²	56.6	24%	0.242	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-44.7	178.7	-68.5	-172.3	-56.5	-109.8	3.9	112.1	E418 A421 E422 H427 N429 A430 A435	E418-R425 IonicContact OE1-CZ 3.22Å; E418-R425 IonicContact OE1-NH1 2.78Å; E418-R425 PolarHBondContact OE1-NH1 3.49Å; E418-R425 IonicContact OE1-NH2 2.78Å; E418-R425 PolarHBondContact OE1-NH2 2.85Å; A421-R425 WeakPolarHBondContact O-CG 3.46Å; A421-R425 PolarHBondContact O-N 3.37Å; E422-R425 PolarHBondContact O-N 2.67Å; R425-H427 VanDerWaalsContact C-N 3.31Å; R425-H427 PolarHBondContact O-N 2.95Å; R425-N429 PolarHBondContact O-N 2.83Å; R425-A430 WeakPolarHBondContact CG-O 3.49Å; R425-A435 HydrophobicContact CG-CB 3.49Å; R425-A435 VanDerWaalsContact CG-CB 3.49Å
426	L	90.1	Very high	92.9	Very high	113 Å²	113	57 Å²	57	59%	0.592	28%	0.278	S	S	*	.	H	α-helix	trans	-66.1	-31.4	-177.7	-71.3	174.6	0	0	0	113.1	E422 S423 I424	E422-L426 HydrophobicContact CG-CD1 3.84Å; E422-L426 HydrophobicContact CG-CG 4.37Å; E422-L426 WeakPolarHBondContact O-CG 3.27Å; E422-L426 PolarHBondContact O-N 3.25Å; S423-L426 PolarHBondContact O-N 2.84Å; I424-L426 PolarHBondContact O-N 3.26Å
427	H	89.1	Confident	93	Very high	55 Å²	55	61.9 Å²	61.9	26%	0.255	31%	0.308	S	S	.	.	H	α-helix	trans	-110.5	-17	-173.1	-62.4	-63.9	0	0	0	115.1	R392 R395 A397 S423 I424 R425	R392-H427 PolarHBondContact O-CE1 3.32Å; R392-H427 VanDerWaalsContact O-CE1 3.26Å; R395-H427 PolarHBondContact O-CE1 3.08Å; R395-H427 PolarHBondContact O-NE2 3.14Å; A397-H427 HydrophobicContact CB-CB 4.17Å; S423-H427 PolarHBondContact O-CD2 3.4Å; S423-H427 PolarHBondContact O-N 2.73Å; S423-H427 VanDerWaalsContact O-N 3.15Å; I424-H427 PolarHBondContact O-N 3.04Å; R425-H427 VanDerWaalsContact C-N 3.31Å; R425-H427 PolarHBondContact O-N 2.95Å
428	Q	88.1	Confident	92.9	Very high	80 Å²	80	63.4 Å²	63.4	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-121.8	5.4	-174.5	-54.9	-179.3	47.4	0	0	113.7	I424 A430 S477 C478	I424-Q428 HydrophobicContact CG2-CB 4.35Å; I424-Q428 WeakPolarHBondContact O-CA 3.46Å; I424-Q428 VanDerWaalsContact O-CB 3.26Å; I424-Q428 WeakPolarHBondContact O-CB 3.37Å; I424-Q428 PolarHBondContact O-N 3.24Å; Q428-A430 PolarHBondContact O-N 2.82Å; Q428-A430 VanDerWaalsContact O-N 3.09Å; Q428-S477 PolarHBondContact NE2-O 3.47Å; Q428-C478 PolarHBondContact NE2-SG 3.15Å
429	N	86.4	Confident	92.8	Very high	158 Å²	158	61.7 Å²	61.7	85%	0.845	31%	0.307	S	S	*	.			trans	52.4	28.1	-177.5	-65.5	-41.3	0	0	0	113.9	R425	R425-N429 PolarHBondContact O-N 2.83Å
430	A	91.1	Very high	92.8	Very high	22 Å²	22	64.4 Å²	64.4	18%	0.182	32%	0.319	C	S	.	.			trans	-75.5	145.9	178.6	0	0	0	0	0	110.9	I424 R425 Q428 E434 A435	I424-A430 HydrophobicContact CG2-CB 3.97Å; R425-A430 WeakPolarHBondContact CG-O 3.49Å; Q428-A430 PolarHBondContact O-N 2.82Å; Q428-A430 VanDerWaalsContact O-N 3.09Å; A430-E434 HydrophobicContact CB-CB 4.11Å; A430-A435 HydrophobicContact CB-CB 4.25Å
431	S	94.1	Very high	92.7	Very high	54 Å²	54	68.7 Å²	68.7	38%	0.378	34%	0.335	S	S	.	.			trans	-64.7	164.5	167	67	0	0	0	0	111	E433 E434 A435	S431-E433 PolarHBondContact O-N 3.3Å; S431-E434 VanDerWaalsContact CB-OE2 3.3Å; S431-E434 WeakPolarHBondContact CB-OE2 3.5Å; S431-E434 PolarHBondContact N-OE2 3.19Å; S431-E434 PolarHBondContact O-N 2.69Å; S431-E434 WeakPolarHBondContact OG-CB 3.22Å; S431-E434 VanDerWaalsContact OG-CG 3.24Å; S431-E434 WeakPolarHBondContact OG-CG 3.34Å; S431-E434 PolarHBondContact OG-N 3.31Å; S431-E434 PolarHBondContact OG-OE2 3.37Å; S431-A435 VanDerWaalsContact O-CB 3.28Å; S431-A435 WeakPolarHBondContact O-CB 3.18Å; S431-A435 PolarHBondContact O-N 3.01Å
432	R	93.7	Very high	92.5	Very high	158 Å²	158	68.9 Å²	68.9	60%	0.596	34%	0.336	S	S	*	.	H	α-helix	trans	-58.3	-37.4	177.9	-174.5	172.3	-175.1	-90.4	-6.3	112.8	E418 M436	E418-R432 IonicContact OE2-CZ 2.65Å; E418-R432 IonicContact OE2-NE 3.6Å; E418-R432 IonicContact OE2-NH2 3.38Å; E418-R432 PolarHBondContact OE2-NH2 3.35Å; R432-M436 WeakPolarHBondContact O-CB 3.42Å; R432-M436 PolarHBondContact O-N 3.28Å; R432-M436 VanDerWaalsContact O-N 3.12Å
433	E	94	Very high	92.4	Very high	162 Å²	162	64.5 Å²	64.5	76%	0.757	32%	0.315	S	S	*	.	H	α-helix	trans	-70	-48.6	179.2	-66.9	179.2	-179.3	0	0	111.2	S431 A435 M436 V437	S431-E433 PolarHBondContact O-N 3.3Å; E433-A435 VanDerWaalsContact C-N 3.33Å; E433-A435 PolarHBondContact O-N 3.06Å; E433-M436 PolarHBondContact O-N 2.84Å; E433-V437 WeakPolarHBondContact O-CG2 3.36Å; E433-V437 PolarHBondContact O-N 2.88Å
434	E	95.4	Very high	92.2	Very high	119 Å²	119	66.6 Å²	66.6	56%	0.556	32%	0.324	S	S	*	.	H	α-helix	trans	-59.8	-43.4	176.6	-70.1	163.7	146.5	0	0	111.6	A430 S431 M436 V437 E438	A430-E434 HydrophobicContact CB-CB 4.11Å; S431-E434 VanDerWaalsContact CB-OE2 3.3Å; S431-E434 WeakPolarHBondContact CB-OE2 3.5Å; S431-E434 PolarHBondContact N-OE2 3.19Å; S431-E434 PolarHBondContact O-N 2.69Å; S431-E434 WeakPolarHBondContact OG-CB 3.22Å; S431-E434 VanDerWaalsContact OG-CG 3.24Å; S431-E434 WeakPolarHBondContact OG-CG 3.34Å; S431-E434 PolarHBondContact OG-N 3.31Å; S431-E434 PolarHBondContact OG-OE2 3.37Å; E434-M436 VanDerWaalsContact C-N 3.31Å; E434-M436 PolarHBondContact O-N 3.49Å; E434-V437 PolarHBondContact O-N 3.1Å; E434-E438 PolarHBondContact O-N 3.41Å
435	A	95.4	Very high	91.9	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-34.7	178.2	0	0	0	0	0	112.6	A421 I424 R425 A430 S431 E433 A439	A421-A435 HydrophobicContact CB-CB 3.88Å; I424-A435 HydrophobicContact CB-CB 4.17Å; I424-A435 HydrophobicContact CG2-CB 4.04Å; R425-A435 HydrophobicContact CG-CB 3.49Å; R425-A435 VanDerWaalsContact CG-CB 3.49Å; A430-A435 HydrophobicContact CB-CB 4.25Å; S431-A435 VanDerWaalsContact O-CB 3.28Å; S431-A435 WeakPolarHBondContact O-CB 3.18Å; S431-A435 PolarHBondContact O-N 3.01Å; E433-A435 VanDerWaalsContact C-N 3.33Å; E433-A435 PolarHBondContact O-N 3.06Å; A435-A439 VanDerWaalsContact O-CB 3.27Å; A435-A439 WeakPolarHBondContact O-CB 3.49Å; A435-A439 PolarHBondContact O-N 2.81Å
436	M	95.3	Very high	91.5	Very high	43 Å²	43	65.8 Å²	65.8	21%	0.212	32%	0.323	C	S	.	.	H	α-helix	trans	-72.9	-37	176.7	-168.4	59	58.5	0	0	112.2	A421 R432 E433 E434 E438 A439 K440 L455	A421-M436 HydrophobicContact CB-CE 4.03Å; R432-M436 WeakPolarHBondContact O-CB 3.42Å; R432-M436 PolarHBondContact O-N 3.28Å; R432-M436 VanDerWaalsContact O-N 3.12Å; E433-M436 PolarHBondContact O-N 2.84Å; E434-M436 VanDerWaalsContact C-N 3.31Å; E434-M436 PolarHBondContact O-N 3.49Å; M436-E438 VanDerWaalsContact C-N 3.35Å; M436-A439 PolarHBondContact O-N 3.18Å; M436-K440 PolarHBondContact O-N 3.46Å; M436-L455 HydrophobicContact CG-CD1 4.39Å; M436-L455 HydrophobicContact SD-CB 4.39Å; M436-L455 HydrophobicContact SD-CD1 4.02Å; M436-L455 HydrophobicContact SD-CD2 3.87Å; M436-L455 HydrophobicContact SD-CG 4.33Å
437	V	95	Very high	91.1	Very high	103 Å²	103	65 Å²	65	62%	0.624	31%	0.313	S	S	*	.	H	α-helix	trans	-63.2	-44.3	173	172	0	0	0	0	110.4	E433 E434 K440 R441	E433-V437 WeakPolarHBondContact O-CG2 3.36Å; E433-V437 PolarHBondContact O-N 2.88Å; E434-V437 PolarHBondContact O-N 3.1Å; V437-K440 WeakPolarHBondContact O-CB 3.1Å; V437-K440 PolarHBondContact O-N 3.07Å; V437-R441 PolarHBondContact O-N 2.96Å
438	E	92.9	Very high	90.7	Very high	32 Å²	32	62.7 Å²	62.7	15%	0.15	30%	0.302	C	S	.	.	H	α-helix	trans	-68.8	-37.4	177	-176.8	67.7	176.7	0	0	111.7	I424 E434 M436 K440 R441 M442 R479	I424-E438 HydrophobicContact CD1-CB 3.88Å; I424-E438 HydrophobicContact CD1-CG 3.68Å; I424-E438 HydrophobicContact CG1-CG 4.42Å; E434-E438 PolarHBondContact O-N 3.41Å; M436-E438 VanDerWaalsContact C-N 3.35Å; E438-K440 VanDerWaalsContact C-N 3.33Å; E438-K440 PolarHBondContact O-N 3.44Å; E438-R441 WeakPolarHBondContact O-CB 3.34Å; E438-R441 PolarHBondContact O-N 2.76Å; E438-R441 VanDerWaalsContact O-N 3.11Å; E438-R441 IonicContact OE1-CZ 2.83Å; E438-R441 IonicContact OE1-NE 3.95Å; E438-R441 PolarHBondContact OE1-NE 2.93Å; E438-R441 IonicContact OE1-NH2 3.77Å; E438-R441 PolarHBondContact OE1-NH2 2.84Å; E438-R441 IonicContact OE2-CZ 3.47Å; E438-R441 IonicContact OE2-NE 3.74Å; E438-R441 PolarHBondContact OE2-NE 3.49Å; E438-R441 IonicContact OE2-NH2 2.87Å; E438-M442 WeakPolarHBondContact O-CG 3.44Å; E438-M442 PolarHBondContact O-N 3.42Å; E438-R479 IonicContact OE1-NH1 2.91Å
439	A	94.5	Very high	90	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.3	-44.3	172.1	0	0	0	0	0	111.7	I420 A421 I424 A435 M436 R441 M442 L443 L455	I420-A439 HydrophobicContact CB-CB 3.86Å; I420-A439 HydrophobicContact CG2-CB 3.62Å; A421-A439 HydrophobicContact CB-CB 4.44Å; I424-A439 HydrophobicContact CD1-CB 4.47Å; A435-A439 VanDerWaalsContact O-CB 3.27Å; A435-A439 WeakPolarHBondContact O-CB 3.49Å; A435-A439 PolarHBondContact O-N 2.81Å; M436-A439 PolarHBondContact O-N 3.18Å; A439-R441 VanDerWaalsContact C-N 3.33Å; A439-R441 PolarHBondContact O-N 2.83Å; A439-M442 PolarHBondContact O-N 3.39Å; A439-L443 WeakPolarHBondContact O-CG 3.33Å; A439-L443 PolarHBondContact O-N 3.35Å; A439-L455 HydrophobicContact CB-CD2 4.06Å
440	K	94.2	Very high	89.6	Confident	67 Å²	67	59.8 Å²	59.8	29%	0.291	29%	0.287	S	S	.	.	H	α-helix	trans	-57.5	-47.4	172.5	-167.4	-168.3	170.9	-74.2	0	111.3	M436 V437 E438 M442 L443 D444 A451 Q452 L455	M436-K440 PolarHBondContact O-N 3.46Å; V437-K440 WeakPolarHBondContact O-CB 3.1Å; V437-K440 PolarHBondContact O-N 3.07Å; E438-K440 VanDerWaalsContact C-N 3.33Å; E438-K440 PolarHBondContact O-N 3.44Å; K440-M442 VanDerWaalsContact C-N 3.27Å; K440-M442 PolarHBondContact O-N 3.22Å; K440-L443 WeakPolarHBondContact O-CB 3.14Å; K440-L443 PolarHBondContact O-N 3.24Å; K440-L443 VanDerWaalsContact O-N 3.12Å; K440-D444 IonicContact NZ-OD1 3.58Å; K440-D444 IonicContact NZ-OD2 3.58Å; K440-D444 PolarHBondContact NZ-OD2 2.9Å; K440-D444 PolarHBondContact O-N 2.81Å; K440-A451 HydrophobicContact CG-CB 4.49Å; K440-Q452 VanDerWaalsContact CD-OE1 3.26Å; K440-L455 HydrophobicContact CB-CD1 3.91Å; K440-L455 HydrophobicContact CG-CD1 4.16Å
441	R	91.9	Very high	89.3	Confident	91 Å²	91	58.9 Å²	58.9	34%	0.343	28%	0.28	S	S	.	.	H	α-helix	trans	-60.5	-38.6	179.9	-164.8	-177.8	74	77.6	3.6	111.4	V437 E438 A439 D444 Q445	V437-R441 PolarHBondContact O-N 2.96Å; E438-R441 WeakPolarHBondContact O-CB 3.34Å; E438-R441 PolarHBondContact O-N 2.76Å; E438-R441 VanDerWaalsContact O-N 3.11Å; E438-R441 IonicContact OE1-CZ 2.83Å; E438-R441 IonicContact OE1-NE 3.95Å; E438-R441 PolarHBondContact OE1-NE 2.93Å; E438-R441 IonicContact OE1-NH2 3.77Å; E438-R441 PolarHBondContact OE1-NH2 2.84Å; E438-R441 IonicContact OE2-CZ 3.47Å; E438-R441 IonicContact OE2-NE 3.74Å; E438-R441 PolarHBondContact OE2-NE 3.49Å; E438-R441 IonicContact OE2-NH2 2.87Å; A439-R441 VanDerWaalsContact C-N 3.33Å; A439-R441 PolarHBondContact O-N 2.83Å; R441-D444 PolarHBondContact O-N 2.76Å; R441-Q445 WeakPolarHBondContact O-CB 3.49Å; R441-Q445 PolarHBondContact O-N 2.93Å
442	M	90.8	Very high	89	Confident	3 Å²	3	62 Å²	62	2%	0.015	29%	0.289	C	S	.	.	H	α-helix	trans	-64.3	-44.7	173.7	-67.6	-59.9	93.9	0	0	111.8	E438 A439 K440 D444 Q445 V446 A473	E438-M442 WeakPolarHBondContact O-CG 3.44Å; E438-M442 PolarHBondContact O-N 3.42Å; A439-M442 PolarHBondContact O-N 3.39Å; K440-M442 VanDerWaalsContact C-N 3.27Å; K440-M442 PolarHBondContact O-N 3.22Å; M442-D444 VanDerWaalsContact C-N 3.33Å; M442-D444 PolarHBondContact O-N 3.19Å; M442-Q445 PolarHBondContact O-N 3.42Å; M442-V446 WeakPolarHBondContact O-CG2 3.42Å; M442-V446 PolarHBondContact O-N 2.96Å; M442-A473 HydrophobicContact CB-CB 3.91Å
443	L	91.2	Very high	88.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.6	-41.9	174.6	-68	-174.3	0	0	0	112.4	V416 I420 A439 K440 V446 R447 I448 A451 I454 L455 V470 A473	V416-L443 HydrophobicContact CG1-CD1 4.21Å; V416-L443 HydrophobicContact CG1-CD2 4.12Å; I420-L443 HydrophobicContact CD1-CD2 3.5Å; I420-L443 HydrophobicContact CD1-CG 3.96Å; A439-L443 WeakPolarHBondContact O-CG 3.33Å; A439-L443 PolarHBondContact O-N 3.35Å; K440-L443 WeakPolarHBondContact O-CB 3.14Å; K440-L443 PolarHBondContact O-N 3.24Å; K440-L443 VanDerWaalsContact O-N 3.12Å; L443-V446 VanDerWaalsContact O-CG2 3.27Å; L443-V446 WeakPolarHBondContact O-CG2 3.47Å; L443-V446 PolarHBondContact O-N 3.24Å; L443-R447 PolarHBondContact O-N 2.64Å; L443-I448 HydrophobicContact CB-CB 4.44Å; L443-I448 HydrophobicContact CD2-CD1 3.58Å; L443-I448 PolarHBondContact O-N 3.26Å; L443-A451 HydrophobicContact CB-CB 3.74Å; L443-A451 HydrophobicContact CD1-CB 4.49Å; L443-I454 HydrophobicContact CD1-CB 4.4Å; L443-I454 HydrophobicContact CD1-CG2 4.25Å; L443-L455 HydrophobicContact CD1-CD2 3.52Å; L443-L455 HydrophobicContact CD1-CG 3.89Å; L443-L455 HydrophobicContact CG-CD2 4.42Å; L443-V470 HydrophobicContact CD2-CG2 4.03Å; L443-A473 HydrophobicContact CD2-CB 4.3Å
444	D	87.5	Confident	88.3	Confident	73 Å²	73	49.7 Å²	49.7	39%	0.39	24%	0.242	S	C	.	.	H	α-helix	trans	-62.9	-43.3	174.6	-70.4	-38.9	0	0	0	110.8	K440 R441 M442 V446 R447 A451	K440-D444 IonicContact NZ-OD1 3.58Å; K440-D444 IonicContact NZ-OD2 3.58Å; K440-D444 PolarHBondContact NZ-OD2 2.9Å; K440-D444 PolarHBondContact O-N 2.81Å; R441-D444 PolarHBondContact O-N 2.76Å; M442-D444 VanDerWaalsContact C-N 3.33Å; M442-D444 PolarHBondContact O-N 3.19Å; D444-V446 VanDerWaalsContact C-N 3.35Å; D444-V446 PolarHBondContact O-N 2.9Å; D444-R447 WeakPolarHBondContact O-CA 3.34Å; D444-R447 PolarHBondContact O-N 3.08Å; D444-A451 WeakPolarHBondContact OD1-CB 3.33Å
445	Q	85.3	Confident	88.1	Confident	46 Å²	46	44.5 Å²	44.5	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-66	-35.7	-179.6	-160.1	177.2	-15.1	0	0	112.3	R441 M442 R447 L507 E510	R441-Q445 WeakPolarHBondContact O-CB 3.49Å; R441-Q445 PolarHBondContact O-N 2.93Å; M442-Q445 PolarHBondContact O-N 3.42Å; Q445-R447 PolarHBondContact O-N 3.43Å; Q445-L507 HydrophobicContact CG-CD2 3.76Å; Q445-E510 PolarHBondContact NE2-OE2 3.43Å
446	V	85.7	Confident	88	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.018	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	9.5	171.4	-55.9	0	0	0	0	113.6	M442 L443 D444 I448 R469 I472 A473 L503 L507	M442-V446 WeakPolarHBondContact O-CG2 3.42Å; M442-V446 PolarHBondContact O-N 2.96Å; L443-V446 VanDerWaalsContact O-CG2 3.27Å; L443-V446 WeakPolarHBondContact O-CG2 3.47Å; L443-V446 PolarHBondContact O-N 3.24Å; D444-V446 VanDerWaalsContact C-N 3.35Å; D444-V446 PolarHBondContact O-N 2.9Å; V446-I448 HydrophobicContact CG2-CD1 3.82Å; V446-I448 HydrophobicContact CG2-CG1 3.98Å; V446-I448 PolarHBondContact O-N 3.24Å; V446-R469 HydrophobicContact CB-CB 4.19Å; V446-R469 HydrophobicContact CG2-CB 3.95Å; V446-R469 WeakPolarHBondContact CG2-O 3.16Å; V446-R469 WeakPolarHBondContact O-CD 3.38Å; V446-R469 PolarHBondContact O-NH1 2.98Å; V446-I472 HydrophobicContact CG1-CB 4.39Å; V446-I472 HydrophobicContact CG1-CG2 3.96Å; V446-A473 HydrophobicContact CG1-CB 3.82Å; V446-A473 HydrophobicContact CG2-CB 3.9Å; V446-L503 HydrophobicContact CB-CD2 3.79Å; V446-L503 HydrophobicContact CG1-CD2 4.01Å; V446-L507 HydrophobicContact CG1-CD1 4.44Å
447	R	82.4	Confident	87.7	Confident	96 Å²	96	50 Å²	50	36%	0.362	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	44.8	176.3	-50.5	-177.9	178.3	-165.3	-2.6	113.5	L443 D444 Q445 L858	L443-R447 PolarHBondContact O-N 2.64Å; D444-R447 WeakPolarHBondContact O-CA 3.34Å; D444-R447 PolarHBondContact O-N 3.08Å; Q445-R447 PolarHBondContact O-N 3.43Å; R447-L858 PolarHBondContact NH1-O 3.49Å
448	I	79.7	Confident	87.4	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.031	24%	0.236	C	C	.	.			trans	-79.3	123.2	168.7	-80.6	170.7	0	0	0	108.9	L443 V446 I454 M466 R469 V470	L443-I448 HydrophobicContact CB-CB 4.44Å; L443-I448 HydrophobicContact CD2-CD1 3.58Å; L443-I448 PolarHBondContact O-N 3.26Å; V446-I448 HydrophobicContact CG2-CD1 3.82Å; V446-I448 HydrophobicContact CG2-CG1 3.98Å; V446-I448 PolarHBondContact O-N 3.24Å; I448-I454 HydrophobicContact CG2-CB 3.94Å; I448-I454 HydrophobicContact CG2-CG1 3.6Å; I448-I454 HydrophobicContact CG2-CG2 3.96Å; I448-M466 HydrophobicContact CG2-CE 4.32Å; I448-R469 HydrophobicContact CD1-CB 3.65Å; I448-R469 HydrophobicContact CG1-CB 3.75Å; I448-V470 HydrophobicContact CD1-CB 4.48Å; I448-V470 HydrophobicContact CD1-CG2 3.53Å
449	P	73.2	Confident	87.1	Confident	48 Å²	48	48.1 Å²	48.1	31%	0.312	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	148.4	176.8	28.6	-34.3	0	0	0	110.2	A451 I454 L863	P449-A451 PolarHBondContact O-N 3.15Å; P449-I454 WeakPolarHBondContact O-CG1 3.1Å; P449-L863 HydrophobicContact CG-CD1 4.3Å
450	E	78.3	Confident	86.3	Confident	129 Å²	129	53.4 Å²	53.4	60%	0.603	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	42.4	-178.2	-54.7	-175.3	161.9	0	0	113	Q452 T453 I454 R457	E450-Q452 PolarHBondContact O-N 3.19Å; E450-T453 WeakPolarHBondContact O-CA 3.39Å; E450-T453 WeakPolarHBondContact O-CB 3.4Å; E450-T453 PolarHBondContact O-N 3.08Å; E450-I454 PolarHBondContact O-N 3.01Å; E450-I454 VanDerWaalsContact O-N 3.09Å; E450-R457 IonicContact OE2-NH2 3.1Å
451	A	85	Confident	85.6	Confident	4 Å²	4	55.1 Å²	55.1	3%	0.033	26%	0.263	C	S	.	.	H	α-helix	trans	-45.3	-38.9	-174.7	0	0	0	0	0	113.5	K440 L443 D444 P449 T453 I454 L455	K440-A451 HydrophobicContact CG-CB 4.49Å; L443-A451 HydrophobicContact CB-CB 3.74Å; L443-A451 HydrophobicContact CD1-CB 4.49Å; D444-A451 WeakPolarHBondContact OD1-CB 3.33Å; P449-A451 PolarHBondContact O-N 3.15Å; A451-T453 PolarHBondContact O-N 3.42Å; A451-I454 PolarHBondContact O-N 3.34Å; A451-L455 WeakPolarHBondContact O-CG 3.42Å; A451-L455 PolarHBondContact O-N 3.47Å; A451-L455 VanDerWaalsContact O-N 3.08Å
452	Q	88	Confident	84.9	Confident	119 Å²	119	51.1 Å²	51.1	56%	0.556	25%	0.249	S	C	*	.	H	α-helix	trans	-57.7	-45.6	175.5	-173	59.9	46.2	0	0	113.2	K440 E450	K440-Q452 VanDerWaalsContact CD-OE1 3.26Å; E450-Q452 PolarHBondContact O-N 3.19Å
453	T	84.7	Confident	84	Confident	60 Å²	60	53.8 Å²	53.8	37%	0.368	27%	0.268	S	S	.	.	H	α-helix	trans	-67.3	-41.8	177.2	-52.6	0	0	0	0	110.1	E450 A451 L455 S456	E450-T453 WeakPolarHBondContact O-CA 3.39Å; E450-T453 WeakPolarHBondContact O-CB 3.4Å; E450-T453 PolarHBondContact O-N 3.08Å; A451-T453 PolarHBondContact O-N 3.42Å; T453-L455 VanDerWaalsContact C-N 3.31Å; T453-L455 PolarHBondContact O-N 3.12Å; T453-S456 PolarHBondContact O-N 3.2Å; T453-S456 PolarHBondContact O-OG 3.42Å
454	I	87.4	Confident	83	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-32.6	-177.2	-61	-53.5	0	0	0	112.9	V416 L443 I448 P449 E450 A451 S456 R457 L462 M466	V416-I454 HydrophobicContact CB-CG2 4.49Å; V416-I454 HydrophobicContact CG1-CG2 4.11Å; V416-I454 HydrophobicContact CG2-CG2 4.48Å; L443-I454 HydrophobicContact CD1-CB 4.4Å; L443-I454 HydrophobicContact CD1-CG2 4.25Å; I448-I454 HydrophobicContact CG2-CB 3.94Å; I448-I454 HydrophobicContact CG2-CG1 3.6Å; I448-I454 HydrophobicContact CG2-CG2 3.96Å; P449-I454 WeakPolarHBondContact O-CG1 3.1Å; E450-I454 PolarHBondContact O-N 3.01Å; E450-I454 VanDerWaalsContact O-N 3.09Å; A451-I454 PolarHBondContact O-N 3.34Å; I454-S456 PolarHBondContact O-N 3.19Å; I454-S456 VanDerWaalsContact O-N 3.09Å; I454-R457 HydrophobicContact CD1-CG 4.4Å; I454-R457 WeakPolarHBondContact O-CB 3.35Å; I454-R457 PolarHBondContact O-N 3.06Å; I454-L462 HydrophobicContact CD1-CD2 3.88Å; I454-L462 HydrophobicContact CG2-CD1 4.28Å; I454-L462 HydrophobicContact CG2-CD2 4.11Å; I454-M466 HydrophobicContact CD1-CE 3.49Å; I454-M466 VanDerWaalsContact CD1-CE 3.49Å; I454-M466 HydrophobicContact CG1-CE 3.94Å
455	L	91.9	Very high	82.4	Confident	9 Å²	9	52.8 Å²	52.8	5%	0.047	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-36.8	175.2	-72.4	172.4	0	0	0	112.9	T415 G417 M436 A439 K440 L443 A451 T453	T415-L455 WeakPolarHBondContact CB-O 3.22Å; T415-L455 PolarHBondContact OG1-O 3.46Å; G417-L455 VanDerWaalsContact CA-CD2 3.48Å; G417-L455 PolarHBondContact N-O 3.48Å; M436-L455 HydrophobicContact CG-CD1 4.39Å; M436-L455 HydrophobicContact SD-CB 4.39Å; M436-L455 HydrophobicContact SD-CD1 4.02Å; M436-L455 HydrophobicContact SD-CD2 3.87Å; M436-L455 HydrophobicContact SD-CG 4.33Å; A439-L455 HydrophobicContact CB-CD2 4.06Å; K440-L455 HydrophobicContact CB-CD1 3.91Å; K440-L455 HydrophobicContact CG-CD1 4.16Å; L443-L455 HydrophobicContact CD1-CD2 3.52Å; L443-L455 HydrophobicContact CD1-CG 3.89Å; L443-L455 HydrophobicContact CG-CD2 4.42Å; A451-L455 WeakPolarHBondContact O-CG 3.42Å; A451-L455 PolarHBondContact O-N 3.47Å; A451-L455 VanDerWaalsContact O-N 3.08Å; T453-L455 VanDerWaalsContact C-N 3.31Å; T453-L455 PolarHBondContact O-N 3.12Å
456	S	92.1	Very high	82.2	Confident	79 Å²	79	51.9 Å²	51.9	55%	0.552	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.6	-179.1	68	0	0	0	0	114.4	T453 I454	T453-S456 PolarHBondContact O-N 3.2Å; T453-S456 PolarHBondContact O-OG 3.42Å; I454-S456 PolarHBondContact O-N 3.19Å; I454-S456 VanDerWaalsContact O-N 3.09Å
457	R	89.2	Confident	82.2	Confident	81 Å²	81	53.5 Å²	53.5	31%	0.306	28%	0.277	S	S	.	.	S	Bend	trans	-83.4	156.3	179.7	-65.2	-163.8	-170.2	176	7.8	111.4	T415 V416 E450 I454 L462	T415-R457 WeakPolarHBondContact CA-O 3.4Å; V416-R457 WeakPolarHBondContact CG2-O 3.45Å; V416-R457 PolarHBondContact N-O 3.45Å; E450-R457 IonicContact OE2-NH2 3.1Å; I454-R457 HydrophobicContact CD1-CG 4.4Å; I454-R457 WeakPolarHBondContact O-CB 3.35Å; I454-R457 PolarHBondContact O-N 3.06Å; R457-L462 HydrophobicContact CB-CD2 4.28Å
458	Y	89.4	Confident	82.3	Confident	92 Å²	92	49.1 Å²	49.1	36%	0.361	26%	0.26	S	S	.	.			trans	-92.1	153.5	173	-65.3	-88.6	0	0	0	110.9	V413 T415 H460 Q461	V413-Y458 WeakPolarHBondContact O-CE1 3.41Å; T415-Y458 HydrophobicContact CG2-CD1 4.47Å; T415-Y458 HydrophobicContact CG2-CE1 4.04Å; T415-Y458 HydrophobicContact CG2-CE2 4.39Å; Y458-H460 VanDerWaalsContact C-N 3.26Å; Y458-H460 WeakPolarHBondContact CB-CE1 3.3Å; Y458-H460 WeakPolarHBondContact CB-ND1 3.47Å; Y458-H460 AromaticContact CG-CE1 3.8Å; Y458-H460 PolarHBondContact O-N 3.34Å; Y458-H460 VanDerWaalsContact O-N 3.16Å; Y458-Q461 WeakPolarHBondContact O-CB 3.41Å; Y458-Q461 PolarHBondContact O-N 3.31Å
459	P	86.1	Confident	82.7	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.019	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-52.3	-40.5	-178.8	-29.7	35.4	0	0	0	114.1	L410 F414 Q461 L462 R467	L410-P459 HydrophobicContact CB-CB 3.89Å; L410-P459 HydrophobicContact CB-CG 3.76Å; L410-P459 HydrophobicContact CD1-CB 4.03Å; L410-P459 HydrophobicContact CD1-CG 4.29Å; F414-P459 VanDerWaalsContact O-CD 3.31Å; F414-P459 WeakPolarHBondContact O-CD 3.49Å; P459-Q461 PolarHBondContact O-N 3.04Å; P459-Q461 VanDerWaalsContact O-N 3.12Å; P459-L462 WeakPolarHBondContact O-CB 3.32Å; P459-L462 PolarHBondContact O-N 2.96Å; P459-L462 VanDerWaalsContact O-N 3.08Å; P459-R467 PolarHBondContact O-NE 2.95Å; P459-R467 PolarHBondContact O-NH2 2.7Å
460	H	79.1	Confident	83.6	Confident	111 Å²	111	47.6 Å²	47.6	51%	0.514	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-65.2	-15	-179.4	64.1	-93.4	0	0	0	114.2	Y458 R467	Y458-H460 VanDerWaalsContact C-N 3.26Å; Y458-H460 WeakPolarHBondContact CB-CE1 3.3Å; Y458-H460 WeakPolarHBondContact CB-ND1 3.47Å; Y458-H460 AromaticContact CG-CE1 3.8Å; Y458-H460 PolarHBondContact O-N 3.34Å; Y458-H460 VanDerWaalsContact O-N 3.16Å; H460-R467 PolarHBondContact O-NH2 3.09Å
461	Q	79.1	Confident	84.2	Confident	102 Å²	102	41.6 Å²	41.6	48%	0.477	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-90.3	-0.6	177.6	-56.5	176.9	-41.9	0	0	113.1	Y458 P459	Y458-Q461 WeakPolarHBondContact O-CB 3.41Å; Y458-Q461 PolarHBondContact O-N 3.31Å; P459-Q461 PolarHBondContact O-N 3.04Å; P459-Q461 VanDerWaalsContact O-N 3.12Å
462	L	76	Confident	84.4	Confident	7 Å²	7	41.4 Å²	41.4	4%	0.037	22%	0.218	C	C	.	.	S	Bend	trans	-105.4	151.6	-178.2	-56.5	-172.4	0	0	0	111.8	V416 I454 R457 P459 M466 R467 V470	V416-L462 HydrophobicContact CG2-CD1 3.68Å; I454-L462 HydrophobicContact CD1-CD2 3.88Å; I454-L462 HydrophobicContact CG2-CD1 4.28Å; I454-L462 HydrophobicContact CG2-CD2 4.11Å; R457-L462 HydrophobicContact CB-CD2 4.28Å; P459-L462 WeakPolarHBondContact O-CB 3.32Å; P459-L462 PolarHBondContact O-N 2.96Å; P459-L462 VanDerWaalsContact O-N 3.08Å; L462-M466 HydrophobicContact CB-CB 3.95Å; L462-M466 HydrophobicContact CD1-CB 4.4Å; L462-M466 HydrophobicContact CD2-CE 3.91Å; L462-M466 HydrophobicContact CD2-SD 4.48Å; L462-R467 HydrophobicContact CB-CG 3.73Å; L462-R467 HydrophobicContact CD1-CG 4.48Å; L462-R467 PolarHBondContact O-NE 2.86Å; L462-R467 PolarHBondContact O-NH2 3.19Å; L462-V470 HydrophobicContact CD1-CG2 3.75Å
463	S	72	Confident	84.6	Confident	59 Å²	59	35.7 Å²	35.7	41%	0.413	19%	0.192	S	C	.	.			trans	-68.5	160.5	169.3	71.8	0	0	0	0	111.3	G465 M466 R467	S463-G465 VanDerWaalsContact C-N 3.32Å; S463-G465 PolarHBondContact O-N 2.82Å; S463-M466 PolarHBondContact O-N 2.9Å; S463-M466 VanDerWaalsContact O-N 3.08Å; S463-M466 WeakPolarHBondContact OG-CG 3.43Å; S463-M466 PolarHBondContact OG-N 3.12Å; S463-R467 WeakPolarHBondContact O-CG 3.25Å; S463-R467 PolarHBondContact O-N 3.04Å
464	G	70.3	Confident	85	Confident	44 Å²	44	34.8 Å²	34.8	45%	0.454	18%	0.184	S	C	.	.	H	α-helix	trans	-53	-47.4	178.7	0	0	0	0	0	112.9	M466 R467 Q468	G464-M466 PolarHBondContact O-N 3.08Å; G464-R467 PolarHBondContact O-N 3.36Å; G464-Q468 PolarHBondContact O-N 3.24Å
465	G	74.8	Confident	85.2	Confident	8 Å²	8	35.2 Å²	35.2	8%	0.082	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-37.3	176	0	0	0	0	0	114.1	S463 Q468 R469	S463-G465 VanDerWaalsContact C-N 3.32Å; S463-G465 PolarHBondContact O-N 2.82Å; G465-Q468 PolarHBondContact O-N 2.84Å; G465-R469 WeakPolarHBondContact O-CG 3.47Å; G465-R469 PolarHBondContact O-N 3.44Å
466	M	82.3	Confident	85.1	Confident	28 Å²	28	34.9 Å²	34.9	14%	0.138	19%	0.186	C	C	.	.	H	α-helix	trans	-68	-40.8	174.4	-71.9	175.2	84.1	0	0	111.6	I448 I454 L462 S463 G464 Q468 R469 V470	I448-M466 HydrophobicContact CG2-CE 4.32Å; I454-M466 HydrophobicContact CD1-CE 3.49Å; I454-M466 VanDerWaalsContact CD1-CE 3.49Å; I454-M466 HydrophobicContact CG1-CE 3.94Å; L462-M466 HydrophobicContact CB-CB 3.95Å; L462-M466 HydrophobicContact CD1-CB 4.4Å; L462-M466 HydrophobicContact CD2-CE 3.91Å; L462-M466 HydrophobicContact CD2-SD 4.48Å; S463-M466 PolarHBondContact O-N 2.9Å; S463-M466 VanDerWaalsContact O-N 3.08Å; S463-M466 WeakPolarHBondContact OG-CG 3.43Å; S463-M466 PolarHBondContact OG-N 3.12Å; G464-M466 PolarHBondContact O-N 3.08Å; M466-Q468 VanDerWaalsContact C-N 3.32Å; M466-Q468 PolarHBondContact O-N 2.92Å; M466-R469 PolarHBondContact O-N 3.4Å; M466-V470 WeakPolarHBondContact O-CG2 3.5Å; M466-V470 PolarHBondContact O-N 3.17Å
467	R	85.8	Confident	85.1	Confident	37 Å²	37	31.2 Å²	31.2	14%	0.14	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-40.3	175.1	-63.5	179.8	-154.8	-156.8	5.7	111.4	P406 M407 L410 P459 H460 L462 S463 G464 V470 M471	P406-R467 HydrophobicContact CB-CB 3.53Å; P406-R467 HydrophobicContact CG-CB 4.33Å; M407-R467 PolarHBondContact SD-NH1 3.17Å; L410-R467 HydrophobicContact CD1-CB 4.15Å; L410-R467 HydrophobicContact CD1-CG 4.48Å; P459-R467 PolarHBondContact O-NE 2.95Å; P459-R467 PolarHBondContact O-NH2 2.7Å; H460-R467 PolarHBondContact O-NH2 3.09Å; L462-R467 HydrophobicContact CB-CG 3.73Å; L462-R467 HydrophobicContact CD1-CG 4.48Å; L462-R467 PolarHBondContact O-NE 2.86Å; L462-R467 PolarHBondContact O-NH2 3.19Å; S463-R467 WeakPolarHBondContact O-CG 3.25Å; S463-R467 PolarHBondContact O-N 3.04Å; G464-R467 PolarHBondContact O-N 3.36Å; R467-V470 WeakPolarHBondContact O-CB 3.34Å; R467-V470 PolarHBondContact O-N 2.89Å; R467-M471 PolarHBondContact O-N 3.17Å
468	Q	84.4	Confident	85	Confident	4 Å²	4	27.8 Å²	27.8	2%	0.019	15%	0.149	C	C	.	.	H	α-helix	trans	-59.8	-47.8	174.4	-166.7	69.4	27.6	0	0	111.2	I402 P406 G464 G465 M466 V470 M471 I472 P488 L492 I500	I402-Q468 VanDerWaalsContact CG2-NE2 3.33Å; P406-Q468 HydrophobicContact CG-CB 4.23Å; G464-Q468 PolarHBondContact O-N 3.24Å; G465-Q468 PolarHBondContact O-N 2.84Å; M466-Q468 VanDerWaalsContact C-N 3.32Å; M466-Q468 PolarHBondContact O-N 2.92Å; Q468-V470 VanDerWaalsContact C-N 3.33Å; Q468-V470 PolarHBondContact O-N 3.18Å; Q468-M471 PolarHBondContact O-N 2.73Å; Q468-M471 VanDerWaalsContact O-N 3.16Å; Q468-I472 HydrophobicContact CG-CD1 4.13Å; Q468-I472 WeakPolarHBondContact O-CG1 3.36Å; Q468-I472 PolarHBondContact O-N 3.29Å; Q468-P488 WeakPolarHBondContact CG-O 3.14Å; Q468-P488 PolarHBondContact NE2-O 2.85Å; Q468-L492 HydrophobicContact CB-CD1 4.15Å; Q468-L492 HydrophobicContact CG-CD1 3.92Å; Q468-I500 HydrophobicContact CB-CD1 4.35Å; Q468-I500 HydrophobicContact CG-CD1 4.11Å; Q468-I500 HydrophobicContact CG-CG1 4.28Å; Q468-I500 HydrophobicContact CG-CG2 4.43Å
469	R	88.5	Confident	85	Confident	22 Å²	22	27.8 Å²	27.8	8%	0.083	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-41.3	176.3	-71.3	171.8	-174.4	-91.9	3.4	111.9	V446 I448 G465 M466 I472 A473 I500 L503	V446-R469 HydrophobicContact CB-CB 4.19Å; V446-R469 HydrophobicContact CG2-CB 3.95Å; V446-R469 WeakPolarHBondContact CG2-O 3.16Å; V446-R469 WeakPolarHBondContact O-CD 3.38Å; V446-R469 PolarHBondContact O-NH1 2.98Å; I448-R469 HydrophobicContact CD1-CB 3.65Å; I448-R469 HydrophobicContact CG1-CB 3.75Å; G465-R469 WeakPolarHBondContact O-CG 3.47Å; G465-R469 PolarHBondContact O-N 3.44Å; M466-R469 PolarHBondContact O-N 3.4Å; R469-I472 PolarHBondContact O-N 3.13Å; R469-A473 WeakPolarHBondContact O-CB 3.47Å; R469-A473 PolarHBondContact O-N 3.47Å; R469-I500 HydrophobicContact CG-CD1 3.65Å; R469-L503 HydrophobicContact CG-CD2 4.5Å
470	V	91	Very high	85.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.9	-44.8	174.1	166.7	0	0	0	0	111.2	L410 V416 I420 L443 I448 L462 M466 R467 Q468 A473 M474	L410-V470 HydrophobicContact CD1-CB 4.44Å; L410-V470 HydrophobicContact CD1-CG1 4.01Å; L410-V470 HydrophobicContact CD2-CG1 4Å; V416-V470 HydrophobicContact CG1-CB 4.32Å; V416-V470 HydrophobicContact CG1-CG1 3.7Å; V416-V470 HydrophobicContact CG1-CG2 3.58Å; V416-V470 HydrophobicContact CG2-CG1 4.43Å; V416-V470 HydrophobicContact CG2-CG2 4.31Å; I420-V470 HydrophobicContact CD1-CG1 4.34Å; L443-V470 HydrophobicContact CD2-CG2 4.03Å; I448-V470 HydrophobicContact CD1-CB 4.48Å; I448-V470 HydrophobicContact CD1-CG2 3.53Å; L462-V470 HydrophobicContact CD1-CG2 3.75Å; M466-V470 WeakPolarHBondContact O-CG2 3.5Å; M466-V470 PolarHBondContact O-N 3.17Å; R467-V470 WeakPolarHBondContact O-CB 3.34Å; R467-V470 PolarHBondContact O-N 2.89Å; Q468-V470 VanDerWaalsContact C-N 3.33Å; Q468-V470 PolarHBondContact O-N 3.18Å; V470-A473 WeakPolarHBondContact O-CB 3.49Å; V470-A473 PolarHBondContact O-N 3.12Å; V470-M474 PolarHBondContact O-N 3.49Å
471	M	91	Very high	86	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-64.3	-42.2	177.5	-169	-170.9	-54.5	0	0	112	I402 F403 P406 S409 R467 Q468 A473 M474 A475	I402-M471 HydrophobicContact CB-SD 4.13Å; I402-M471 HydrophobicContact CG2-CG 4.36Å; I402-M471 HydrophobicContact CG2-SD 3.51Å; I402-M471 VanDerWaalsContact CG2-SD 3.51Å; F403-M471 PolarHBondContact N-SD 2.86Å; F403-M471 VanDerWaalsContact N-SD 3.41Å; P406-M471 HydrophobicContact CB-CE 3.75Å; P406-M471 HydrophobicContact CG-CE 3.88Å; S409-M471 VanDerWaalsContact CB-CE 3.44Å; R467-M471 PolarHBondContact O-N 3.17Å; Q468-M471 PolarHBondContact O-N 2.73Å; Q468-M471 VanDerWaalsContact O-N 3.16Å; M471-A473 VanDerWaalsContact C-N 3.31Å; M471-A473 PolarHBondContact O-N 2.94Å; M471-M474 HydrophobicContact CG-CE 4.36Å; M471-M474 WeakPolarHBondContact O-CB 3.43Å; M471-M474 PolarHBondContact O-N 2.83Å; M471-A475 WeakPolarHBondContact O-CB 3.41Å; M471-A475 PolarHBondContact O-N 2.87Å
472	I	90.3	Very high	86.8	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.3	-44.6	174.5	-67.6	163.6	0	0	0	110.3	I402 V446 Q468 R469 M474 A475 L476 I500 L503 L507	I402-I472 HydrophobicContact CD1-CB 4.47Å; I402-I472 HydrophobicContact CD1-CG1 3.69Å; I402-I472 HydrophobicContact CG1-CG1 4.4Å; V446-I472 HydrophobicContact CG1-CB 4.39Å; V446-I472 HydrophobicContact CG1-CG2 3.96Å; Q468-I472 HydrophobicContact CG-CD1 4.13Å; Q468-I472 WeakPolarHBondContact O-CG1 3.36Å; Q468-I472 PolarHBondContact O-N 3.29Å; R469-I472 PolarHBondContact O-N 3.13Å; I472-M474 VanDerWaalsContact C-N 3.34Å; I472-M474 PolarHBondContact O-N 3.4Å; I472-A475 PolarHBondContact O-N 3.49Å; I472-L476 HydrophobicContact CG2-CD1 3.64Å; I472-L476 HydrophobicContact CG2-CG 4.44Å; I472-L476 WeakPolarHBondContact O-CB 3.5Å; I472-L476 VanDerWaalsContact O-CG 3.3Å; I472-L476 WeakPolarHBondContact O-CG 3.4Å; I472-L476 PolarHBondContact O-N 3.03Å; I472-I500 HydrophobicContact CD1-CD1 3.82Å; I472-I500 HydrophobicContact CD1-CG2 3.8Å; I472-L503 HydrophobicContact CD1-CD2 4.16Å; I472-L503 HydrophobicContact CG2-CD2 4.19Å; I472-L507 HydrophobicContact CG2-CD1 3.96Å
473	A	91.8	Very high	87.7	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.5	-42.9	176.1	0	0	0	0	0	111.9	I420 M442 L443 V446 R469 V470 M471 L476 S477	I420-A473 HydrophobicContact CD1-CB 4.1Å; M442-A473 HydrophobicContact CB-CB 3.91Å; L443-A473 HydrophobicContact CD2-CB 4.3Å; V446-A473 HydrophobicContact CG1-CB 3.82Å; V446-A473 HydrophobicContact CG2-CB 3.9Å; R469-A473 WeakPolarHBondContact O-CB 3.47Å; R469-A473 PolarHBondContact O-N 3.47Å; V470-A473 WeakPolarHBondContact O-CB 3.49Å; V470-A473 PolarHBondContact O-N 3.12Å; M471-A473 VanDerWaalsContact C-N 3.31Å; M471-A473 PolarHBondContact O-N 2.94Å; A473-L476 PolarHBondContact O-N 3.23Å; A473-S477 WeakPolarHBondContact O-CB 3.33Å; A473-S477 PolarHBondContact O-N 3.05Å
474	M	92.2	Very high	88.9	Confident	41 Å²	41	16.1 Å²	16.1	20%	0.202	9%	0.091	C	C	.	.	H	α-helix	trans	-63.1	-49.5	176.6	-172.4	173.4	68.3	0	0	111.4	L410 Q419 I420 V470 M471 I472 L476 S477	L410-M474 HydrophobicContact CD2-CE 4.11Å; L410-M474 HydrophobicContact CD2-SD 4.37Å; Q419-M474 HydrophobicContact CB-SD 4.35Å; I420-M474 HydrophobicContact CG1-CB 4.13Å; V470-M474 PolarHBondContact O-N 3.49Å; M471-M474 HydrophobicContact CG-CE 4.36Å; M471-M474 WeakPolarHBondContact O-CB 3.43Å; M471-M474 PolarHBondContact O-N 2.83Å; I472-M474 VanDerWaalsContact C-N 3.34Å; I472-M474 PolarHBondContact O-N 3.4Å; M474-L476 VanDerWaalsContact C-N 3.27Å; M474-L476 PolarHBondContact O-N 3.4Å; M474-S477 WeakPolarHBondContact O-CB 3.4Å; M474-S477 PolarHBondContact O-N 2.99Å; M474-S477 PolarHBondContact O-OG 2.99Å
475	A	91.4	Very high	90	Very high	11 Å²	11	14 Å²	14	9%	0.091	7%	0.07	C	C	.	.	H	α-helix	trans	-61.7	-34.1	179.2	0	0	0	0	0	112.7	A400 I402 M471 I472 L483	A400-A475 HydrophobicContact CB-CB 4.02Å; A400-A475 WeakPolarHBondContact CB-O 3.17Å; I402-A475 HydrophobicContact CG1-CB 3.91Å; M471-A475 WeakPolarHBondContact O-CB 3.41Å; M471-A475 PolarHBondContact O-N 2.87Å; I472-A475 PolarHBondContact O-N 3.49Å; A475-L483 HydrophobicContact CB-CD1 4.11Å
476	L	90.5	Very high	90.8	Very high	2 Å²	2	14 Å²	14	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-95.3	-5.1	-177.1	-63.2	176.5	0	0	0	114.2	I472 A473 M474 C478 R479 P480 L483 L507 M511 M513	I472-L476 HydrophobicContact CG2-CD1 3.64Å; I472-L476 HydrophobicContact CG2-CG 4.44Å; I472-L476 WeakPolarHBondContact O-CB 3.5Å; I472-L476 VanDerWaalsContact O-CG 3.3Å; I472-L476 WeakPolarHBondContact O-CG 3.4Å; I472-L476 PolarHBondContact O-N 3.03Å; A473-L476 PolarHBondContact O-N 3.23Å; M474-L476 VanDerWaalsContact C-N 3.27Å; M474-L476 PolarHBondContact O-N 3.4Å; L476-C478 PolarHBondContact O-N 3.46Å; L476-C478 VanDerWaalsContact O-N 3.14Å; L476-R479 PolarHBondContact O-N 3.19Å; L476-P480 HydrophobicContact CD2-CG 4.03Å; L476-L483 HydrophobicContact CD2-CD1 4.12Å; L476-L483 HydrophobicContact CD2-CD2 4.21Å; L476-L507 HydrophobicContact CD1-CB 3.99Å; L476-L507 HydrophobicContact CD1-CD1 3.22Å; L476-L507 HydrophobicContact CD1-CG 4.15Å; L476-M511 HydrophobicContact CB-CE 4.21Å; L476-M511 HydrophobicContact CB-SD 4.41Å; L476-M511 HydrophobicContact CD2-SD 4.24Å; L476-M513 HydrophobicContact CD1-CE 4.41Å; L476-M513 HydrophobicContact CD2-CE 3.92Å; L476-M513 HydrophobicContact CD2-SD 3.61Å
477	S	90.9	Very high	91	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.014	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-33.4	-177.8	65.2	0	0	0	0	113.5	Q428 A473 M474	Q428-S477 PolarHBondContact NE2-O 3.47Å; A473-S477 WeakPolarHBondContact O-CB 3.33Å; A473-S477 PolarHBondContact O-N 3.05Å; M474-S477 WeakPolarHBondContact O-CB 3.4Å; M474-S477 PolarHBondContact O-N 2.99Å; M474-S477 PolarHBondContact O-OG 2.99Å
478	C	87.9	Confident	91.1	Very high	9 Å²	9	11.6 Å²	11.6	6%	0.061	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	6.8	178	-64	0	0	0	0	114.4	G396 Q428 L476	G396-C478 WeakPolarHBondContact O-CB 3.03Å; Q428-C478 PolarHBondContact NE2-SG 3.15Å; L476-C478 PolarHBondContact O-N 3.46Å; L476-C478 VanDerWaalsContact O-N 3.14Å
479	R	89.7	Confident	91	Very high	91 Å²	91	11.6 Å²	11.6	34%	0.343	6%	0.058	S	C	.	.			trans	50.7	67.6	178.1	-62.4	176.5	174.6	98.1	-11.1	111.8	R376 E438 L476 M511	R376-R479 WeakPolarHBondContact CD-O 3.17Å; R376-R479 VanDerWaalsContact NH1-CB 3.26Å; R376-R479 PolarHBondContact NH1-O 3.14Å; E438-R479 IonicContact OE1-NH1 2.91Å; L476-R479 PolarHBondContact O-N 3.19Å; R479-M511 HydrophobicContact CB-SD 4.41Å; R479-M511 HydrophobicContact CG-CE 4.43Å; R479-M511 HydrophobicContact CG-SD 4.23Å
480	P	92.7	Very high	90.4	Very high	2 Å²	2	12.1 Å²	12.1	1%	0.013	6%	0.064	C	C	.	.			trans	-66.8	157.7	-176.4	31.2	-38.4	0	0	0	112.7	A397 A400 L476	A397-P480 WeakPolarHBondContact O-CA 3.28Å; A400-P480 HydrophobicContact CB-CB 4.02Å; A400-P480 HydrophobicContact CB-CG 3.74Å; L476-P480 HydrophobicContact CD2-CG 4.03Å
481	A	93.4	Very high	89.2	Confident	17 Å²	17	15.6 Å²	15.6	14%	0.14	9%	0.092	C	C	.	.	S	Bend	trans	-74.3	-34.3	170	0	0	0	0	0	111.7	R376 D398 M513 G514	R376-A481 HydrophobicContact CG-CB 4.04Å; D398-A481 WeakPolarHBondContact O-CA 3.43Å; D398-A481 WeakPolarHBondContact O-CB 3.45Å; D398-A481 PolarHBondContact O-N 3.41Å; A481-M513 WeakPolarHBondContact O-CA 3.5Å; A481-G514 PolarHBondContact O-N 3.01Å
482	V	95.5	Very high	88.4	Confident	19 Å²	19	16 Å²	16	12%	0.115	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.6	-179.5	-179.8	0	0	0	0	109.9	L332 L373 D398 M399 A400 I484 G514	L332-V482 HydrophobicContact CD2-CG1 3.88Å; L332-V482 HydrophobicContact CD2-CG2 4.37Å; L373-V482 HydrophobicContact CD1-CG2 3.77Å; D398-V482 PolarHBondContact O-N 3.33Å; D398-V482 VanDerWaalsContact O-N 3.13Å; M399-V482 WeakPolarHBondContact CA-O 3.35Å; M399-V482 HydrophobicContact CG-CB 4.26Å; A400-V482 PolarHBondContact N-O 2.77Å; V482-I484 HydrophobicContact CG1-CG1 4.36Å; V482-G514 WeakPolarHBondContact CA-O 3.27Å
483	L	95.7	Very high	87.6	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	123.3	169.6	179	70.7	0	0	0	109.3	A400 I402 A475 L476 M513 G514 V515 I516	A400-L483 HydrophobicContact CB-CD1 4.23Å; I402-L483 HydrophobicContact CD1-CD1 3.96Å; I402-L483 HydrophobicContact CD1-CD2 4.01Å; I402-L483 HydrophobicContact CD1-CG 4.33Å; I402-L483 HydrophobicContact CG1-CD1 4.1Å; A475-L483 HydrophobicContact CB-CD1 4.11Å; L476-L483 HydrophobicContact CD2-CD1 4.12Å; L476-L483 HydrophobicContact CD2-CD2 4.21Å; L483-M513 HydrophobicContact CB-CE 4.42Å; L483-M513 HydrophobicContact CB-SD 3.65Å; L483-M513 HydrophobicContact CD2-CE 3.8Å; L483-M513 HydrophobicContact CD2-SD 4.09Å; L483-M513 HydrophobicContact CG-SD 4.46Å; L483-G514 PolarHBondContact N-O 3.19Å; L483-V515 HydrophobicContact CB-CG2 4.45Å; L483-V515 CarbonylContact O-C 3.57Å; L483-V515 WeakPolarHBondContact O-CA 3.48Å; L483-I516 PolarHBondContact O-N 3.11Å
484	I	95.8	Very high	86.8	Confident	0 Å²	0	17 Å²	17	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	119.3	169	-57.9	173.7	0	0	0	107.4	A352 L355 M356 M399 A400 M401 I402 V482 I516 I518	A352-I484 HydrophobicContact CB-CG2 3.6Å; L355-I484 HydrophobicContact CB-CD1 4.24Å; L355-I484 HydrophobicContact CD1-CD1 4.22Å; M356-I484 HydrophobicContact CG-CD1 3.9Å; M356-I484 HydrophobicContact SD-CD1 4.12Å; M399-I484 HydrophobicContact CE-CD1 4.04Å; A400-I484 PolarHBondContact O-N 2.83Å; M401-I484 CarbonylContact C-O 3.45Å; M401-I484 VanDerWaalsContact CA-O 3.25Å; M401-I484 WeakPolarHBondContact CA-O 3.44Å; M401-I484 HydrophobicContact CB-CB 4.48Å; M401-I484 HydrophobicContact CG-CB 4.27Å; M401-I484 HydrophobicContact CG-CG2 4.3Å; I402-I484 PolarHBondContact N-O 2.87Å; V482-I484 HydrophobicContact CG1-CG1 4.36Å; I484-I516 HydrophobicContact CG1-CB 4.32Å; I484-I516 HydrophobicContact CG1-CD1 4.29Å; I484-I518 HydrophobicContact CG2-CD1 4.33Å
485	A	94	Very high	86	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	104.5	178.1	0	0	0	0	0	109.3	I402 P488 I516 F517 I518	I402-A485 HydrophobicContact CB-CB 4.46Å; I402-A485 HydrophobicContact CD1-CB 4.21Å; A485-P488 HydrophobicContact CB-CB 4.12Å; A485-P488 HydrophobicContact CB-CG 3.83Å; A485-I516 PolarHBondContact N-O 3.42Å; A485-F517 HydrophobicContact CB-CD2 4.24Å; A485-I518 PolarHBondContact O-N 2.96Å
486	D	91.2	Very high	85.3	Confident	7 Å²	7	15.7 Å²	15.7	4%	0.037	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	103.5	-177.2	-162.2	9.5	0	0	0	110.7	S349 M401 I402 I518	S349-D486 WeakPolarHBondContact CB-OD2 3.49Å; S349-D486 PolarHBondContact OG-OD1 3.22Å; S349-D486 PolarHBondContact OG-OD2 3.15Å; M401-D486 HydrophobicContact CE-CB 3.83Å; I402-D486 PolarHBondContact O-N 3.19Å; D486-I518 HydrophobicContact CB-CD1 4.43Å; D486-I518 WeakPolarHBondContact OD1-CG2 3.35Å
487	E	87.4	Confident	84.9	Confident	13 Å²	13	16.5 Å²	16.5	6%	0.061	10%	0.096	C	C	.	.	S	Bend	trans	52.1	46.8	-179.1	-65.6	-77.9	-177.7	0	0	113.3	Q404 T489 T490 I518 H520	Q404-E487 HydrophobicContact CG-CB 4.36Å; E487-T489 PolarHBondContact O-N 3.08Å; E487-T490 WeakPolarHBondContact O-CB 3.47Å; E487-T490 PolarHBondContact O-N 3.5Å; E487-T490 VanDerWaalsContact O-N 3.12Å; E487-T490 PolarHBondContact OE2-OG1 3.09Å; E487-T490 VanDerWaalsContact OE2-OG1 3.09Å; E487-I518 WeakPolarHBondContact CA-O 3.21Å; E487-I518 PolarHBondContact N-O 3.45Å; E487-H520 VanDerWaalsContact CD-ND1 3.27Å; E487-H520 IonicContact OE1-CE1 3.54Å; E487-H520 IonicContact OE1-CG 3.94Å; E487-H520 PolarHBondContact OE1-N 3.5Å; E487-H520 IonicContact OE1-ND1 2.67Å; E487-H520 PolarHBondContact OE1-ND1 3.41Å; E487-H520 IonicContact OE2-CE1 2.89Å; E487-H520 PolarHBondContact OE2-CE1 2.83Å; E487-H520 IonicContact OE2-ND1 3.16Å; E487-H520 PolarHBondContact OE2-ND1 2.52Å
488	P	87.2	Confident	84.5	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.006	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-7.9	-165.9	33.5	-40.5	0	0	0	114.5	I402 Q468 A485 I504 F517	I402-P488 HydrophobicContact CG2-CB 4.1Å; Q468-P488 WeakPolarHBondContact CG-O 3.14Å; Q468-P488 PolarHBondContact NE2-O 2.85Å; A485-P488 HydrophobicContact CB-CB 4.12Å; A485-P488 HydrophobicContact CB-CG 3.83Å; P488-I504 HydrophobicContact CB-CD1 4.49Å; P488-I504 HydrophobicContact CG-CD1 4.39Å; P488-F517 HydrophobicContact CG-CD2 4.3Å; P488-F517 HydrophobicContact CG-CE1 4.11Å; P488-F517 HydrophobicContact CG-CE2 3.44Å; P488-F517 VanDerWaalsContact CG-CE2 3.44Å; P488-F517 HydrophobicContact CG-CZ 3.32Å
489	T	84.1	Confident	84.2	Confident	5 Å²	5	17.7 Å²	17.7	3%	0.031	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	0.7	179.8	54.6	0	0	0	0	112.8	E487 L492 Q497 I500 L501	E487-T489 PolarHBondContact O-N 3.08Å; T489-L492 WeakPolarHBondContact O-CB 3.24Å; T489-L492 PolarHBondContact O-N 3.37Å; T489-Q497 HydrophobicContact CG2-CB 4.38Å; T489-Q497 HydrophobicContact CG2-CG 3.85Å; T489-I500 HydrophobicContact CG2-CB 4.39Å; T489-I500 HydrophobicContact CG2-CG2 4.1Å; T489-L501 HydrophobicContact CG2-CD2 3.82Å; T489-L501 HydrophobicContact CG2-CG 4Å
490	T	74.4	Confident	84	Confident	33 Å²	33	13.3 Å²	13.3	20%	0.202	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	138.1	-179.4	-72	0	0	0	0	111	E487 L492	E487-T490 WeakPolarHBondContact O-CB 3.47Å; E487-T490 PolarHBondContact O-N 3.5Å; E487-T490 VanDerWaalsContact O-N 3.12Å; E487-T490 PolarHBondContact OE2-OG1 3.09Å; E487-T490 VanDerWaalsContact OE2-OG1 3.09Å; T490-L492 PolarHBondContact O-N 2.66Å
491	A	66.2	Low	83.8	Confident	73 Å²	73	13.4 Å²	13.4	60%	0.603	9%	0.085	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	19.1	-177	0	0	0	0	0	115.6
492	L	73.6	Confident	83.5	Confident	11 Å²	11	14.4 Å²	14.4	6%	0.058	9%	0.087	C	C	.	.			trans	-98.6	149	168.9	-56.1	-179.5	0	0	0	110.2	Q468 T489 T490 I496 I500 H799	Q468-L492 HydrophobicContact CB-CD1 4.15Å; Q468-L492 HydrophobicContact CG-CD1 3.92Å; T489-L492 WeakPolarHBondContact O-CB 3.24Å; T489-L492 PolarHBondContact O-N 3.37Å; T490-L492 PolarHBondContact O-N 2.66Å; L492-I496 HydrophobicContact CB-CB 4.38Å; L492-I496 HydrophobicContact CB-CG2 4.09Å; L492-I496 HydrophobicContact CD1-CG2 3.93Å; L492-I496 HydrophobicContact CD2-CG2 4.23Å; L492-I496 HydrophobicContact CG-CG2 4.31Å; L492-I500 HydrophobicContact CD1-CG1 3.91Å; L492-H799 PolarHBondContact O-NE2 3.23Å
493	D	73.2	Confident	83	Confident	9 Å²	9	14 Å²	14	5%	0.048	8%	0.084	C	C	.	.			trans	-67.8	158.4	172	62.3	83.2	0	0	0	111.6	T495 I496 Q497 S636 H799	D493-T495 PolarHBondContact O-N 2.79Å; D493-T495 PolarHBondContact OD1-N 2.81Å; D493-T495 VanDerWaalsContact OD1-N 3.12Å; D493-T495 PolarHBondContact OD1-OG1 3.2Å; D493-I496 PolarHBondContact O-N 3.45Å; D493-I496 VanDerWaalsContact O-N 3.12Å; D493-I496 WeakPolarHBondContact OD1-CG1 3.23Å; D493-I496 PolarHBondContact OD1-N 2.81Å; D493-I496 WeakPolarHBondContact OD2-CG1 3.41Å; D493-Q497 WeakPolarHBondContact O-CB 3.48Å; D493-Q497 PolarHBondContact O-N 3.43Å; D493-S636 PolarHBondContact OD2-OG 3.3Å; D493-H799 HydrophobicContact CB-CB 4.28Å
494	V	75	Confident	82.7	Confident	11 Å²	11	14 Å²	14	7%	0.067	8%	0.084	C	C	.	.	H	α-helix	trans	-56	-30.6	-175	-65.4	0	0	0	0	113.5	A498 L840 A843	V494-A498 WeakPolarHBondContact O-CB 3.47Å; V494-A498 PolarHBondContact O-N 2.99Å; V494-A498 VanDerWaalsContact O-N 3.12Å; V494-L840 HydrophobicContact CG2-CD2 4.5Å; V494-A843 HydrophobicContact CB-CB 4.45Å; V494-A843 HydrophobicContact CG2-CB 4.26Å
495	T	75.8	Confident	82.4	Confident	1 Å²	1	17.3 Å²	17.3	1%	0.006	10%	0.099	C	C	.	.	H	α-helix	trans	-77.7	-44.4	-179.8	73.7	0	0	0	0	111.4	D493 A498 Q499 E635 L840 A843	D493-T495 PolarHBondContact O-N 2.79Å; D493-T495 PolarHBondContact OD1-N 2.81Å; D493-T495 VanDerWaalsContact OD1-N 3.12Å; D493-T495 PolarHBondContact OD1-OG1 3.2Å; T495-A498 PolarHBondContact O-N 2.92Å; T495-Q499 VanDerWaalsContact O-CG 3.25Å; T495-Q499 WeakPolarHBondContact O-CG 3.34Å; T495-Q499 PolarHBondContact O-N 2.96Å; T495-E635 HydrophobicContact CG2-CG 3.99Å; T495-E635 WeakPolarHBondContact CG2-OE1 3.17Å; T495-E635 PolarHBondContact OG1-OE1 3.33Å; T495-L840 HydrophobicContact CG2-CD2 3.84Å; T495-A843 HydrophobicContact CG2-CB 3.88Å
496	I	77.5	Confident	82.1	Confident	23 Å²	23	19.5 Å²	19.5	12%	0.118	11%	0.111	C	C	.	.	H	α-helix	trans	-65.4	-42.3	175	-64.5	-58.5	0	0	0	109.9	L492 D493 A498 Q499 I500	L492-I496 HydrophobicContact CB-CB 4.38Å; L492-I496 HydrophobicContact CB-CG2 4.09Å; L492-I496 HydrophobicContact CD1-CG2 3.93Å; L492-I496 HydrophobicContact CD2-CG2 4.23Å; L492-I496 HydrophobicContact CG-CG2 4.31Å; D493-I496 PolarHBondContact O-N 3.45Å; D493-I496 VanDerWaalsContact O-N 3.12Å; D493-I496 WeakPolarHBondContact OD1-CG1 3.23Å; D493-I496 PolarHBondContact OD1-N 2.81Å; D493-I496 WeakPolarHBondContact OD2-CG1 3.41Å; I496-A498 PolarHBondContact O-N 2.91Å; I496-Q499 WeakPolarHBondContact O-CB 3.28Å; I496-Q499 PolarHBondContact O-N 3.25Å; I496-Q499 VanDerWaalsContact O-N 3.14Å; I496-I500 HydrophobicContact CG2-CG1 4.14Å; I496-I500 VanDerWaalsContact O-CG1 3.3Å; I496-I500 WeakPolarHBondContact O-CG1 3.35Å; I496-I500 PolarHBondContact O-N 2.92Å
497	Q	82.1	Confident	81.9	Confident	19 Å²	19	19.3 Å²	19.3	9%	0.089	11%	0.11	C	C	.	.	H	α-helix	trans	-53	-54	173.3	167.3	169.4	-39.5	0	0	111.2	T489 D493 Q499 I500 L501 P845	T489-Q497 HydrophobicContact CG2-CB 4.38Å; T489-Q497 HydrophobicContact CG2-CG 3.85Å; D493-Q497 WeakPolarHBondContact O-CB 3.48Å; D493-Q497 PolarHBondContact O-N 3.43Å; Q497-Q499 VanDerWaalsContact C-N 3.27Å; Q497-Q499 PolarHBondContact O-N 3.11Å; Q497-I500 PolarHBondContact O-N 2.94Å; Q497-I500 VanDerWaalsContact O-N 3.11Å; Q497-L501 HydrophobicContact CG-CD1 4.04Å; Q497-L501 HydrophobicContact CG-CG 4.49Å; Q497-L501 WeakPolarHBondContact O-CG 3.31Å; Q497-L501 PolarHBondContact O-N 2.76Å; Q497-P845 VanDerWaalsContact NE2-CG 3.27Å
498	A	82.6	Confident	82	Confident	5 Å²	5	19.5 Å²	19.5	4%	0.041	11%	0.111	C	C	.	.	H	α-helix	trans	-57.8	-40.3	177.8	0	0	0	0	0	112.2	V494 T495 I496 Q502 A843 L858	V494-A498 WeakPolarHBondContact O-CB 3.47Å; V494-A498 PolarHBondContact O-N 2.99Å; V494-A498 VanDerWaalsContact O-N 3.12Å; T495-A498 PolarHBondContact O-N 2.92Å; I496-A498 PolarHBondContact O-N 2.91Å; A498-Q502 WeakPolarHBondContact O-CB 3.45Å; A498-Q502 PolarHBondContact O-N 3.18Å; A498-A843 HydrophobicContact CB-CB 4.49Å; A498-L858 HydrophobicContact CB-CD1 4Å
499	Q	82.2	Confident	82.1	Confident	31 Å²	31	27 Å²	27	15%	0.145	14%	0.144	C	C	.	.	H	α-helix	trans	-64.8	-40.5	175.8	-68.1	169.3	8.9	0	0	112.8	T495 I496 Q497 L503 L858	T495-Q499 VanDerWaalsContact O-CG 3.25Å; T495-Q499 WeakPolarHBondContact O-CG 3.34Å; T495-Q499 PolarHBondContact O-N 2.96Å; I496-Q499 WeakPolarHBondContact O-CB 3.28Å; I496-Q499 PolarHBondContact O-N 3.25Å; I496-Q499 VanDerWaalsContact O-N 3.14Å; Q497-Q499 VanDerWaalsContact C-N 3.27Å; Q497-Q499 PolarHBondContact O-N 3.11Å; Q499-L503 VanDerWaalsContact O-CB 3.28Å; Q499-L503 WeakPolarHBondContact O-CB 3.2Å; Q499-L503 PolarHBondContact O-N 3.11Å; Q499-L858 HydrophobicContact CG-CB 3.86Å; Q499-L858 HydrophobicContact CG-CD1 3.72Å; Q499-L858 HydrophobicContact CG-CG 4.4Å
500	I	85.3	Confident	82.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.3	-43.9	178.1	-67.9	-58.5	0	0	0	110.9	Q468 R469 I472 T489 L492 I496 Q497 Q502 L503 I504	Q468-I500 HydrophobicContact CB-CD1 4.35Å; Q468-I500 HydrophobicContact CG-CD1 4.11Å; Q468-I500 HydrophobicContact CG-CG1 4.28Å; Q468-I500 HydrophobicContact CG-CG2 4.43Å; R469-I500 HydrophobicContact CG-CD1 3.65Å; I472-I500 HydrophobicContact CD1-CD1 3.82Å; I472-I500 HydrophobicContact CD1-CG2 3.8Å; T489-I500 HydrophobicContact CG2-CB 4.39Å; T489-I500 HydrophobicContact CG2-CG2 4.1Å; L492-I500 HydrophobicContact CD1-CG1 3.91Å; I496-I500 HydrophobicContact CG2-CG1 4.14Å; I496-I500 VanDerWaalsContact O-CG1 3.3Å; I496-I500 WeakPolarHBondContact O-CG1 3.35Å; I496-I500 PolarHBondContact O-N 2.92Å; Q497-I500 PolarHBondContact O-N 2.94Å; Q497-I500 VanDerWaalsContact O-N 3.11Å; I500-Q502 PolarHBondContact O-N 3Å; I500-L503 WeakPolarHBondContact O-CB 3.34Å; I500-L503 PolarHBondContact O-N 3.46Å; I500-I504 HydrophobicContact CG2-CD1 4.06Å; I500-I504 WeakPolarHBondContact O-CG1 3.18Å; I500-I504 PolarHBondContact O-N 2.96Å
501	L	88.7	Confident	82.9	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-61.1	-45.6	175.9	-65.1	173.8	0	0	0	111.4	T489 Q497 L503 I504 K505 F517 V524 I528	T489-L501 HydrophobicContact CG2-CD2 3.82Å; T489-L501 HydrophobicContact CG2-CG 4Å; Q497-L501 HydrophobicContact CG-CD1 4.04Å; Q497-L501 HydrophobicContact CG-CG 4.49Å; Q497-L501 WeakPolarHBondContact O-CG 3.31Å; Q497-L501 PolarHBondContact O-N 2.76Å; L501-L503 VanDerWaalsContact C-N 3.32Å; L501-L503 PolarHBondContact O-N 2.97Å; L501-I504 PolarHBondContact O-N 3.39Å; L501-K505 WeakPolarHBondContact O-CB 3.31Å; L501-K505 PolarHBondContact O-N 3.02Å; L501-F517 HydrophobicContact CD2-CE1 4.4Å; L501-F517 HydrophobicContact CD2-CE2 3.82Å; L501-F517 HydrophobicContact CD2-CZ 3.45Å; L501-F517 VanDerWaalsContact CD2-CZ 3.45Å; L501-V524 HydrophobicContact CD1-CB 4.36Å; L501-V524 HydrophobicContact CD1-CG1 3.76Å; L501-V524 HydrophobicContact CD1-CG2 4.05Å; L501-V524 HydrophobicContact CD2-CG1 3.52Å; L501-V524 HydrophobicContact CG-CG1 4.29Å; L501-I528 HydrophobicContact CB-CD1 4.4Å; L501-I528 HydrophobicContact CD2-CD1 3.85Å
502	Q	85.5	Confident	84	Confident	38 Å²	38	31.3 Å²	31.3	18%	0.178	16%	0.156	C	C	.	.	H	α-helix	trans	-61.9	-41.2	175.4	-172.8	177	19.1	0	0	111.5	A498 I500 K505 V506 R856	A498-Q502 WeakPolarHBondContact O-CB 3.45Å; A498-Q502 PolarHBondContact O-N 3.18Å; I500-Q502 PolarHBondContact O-N 3Å; Q502-K505 PolarHBondContact O-N 3.33Å; Q502-V506 WeakPolarHBondContact O-CG2 3.47Å; Q502-V506 PolarHBondContact O-N 2.97Å; Q502-R856 PolarHBondContact NE2-O 2.89Å
503	L	86.7	Confident	84.9	Confident	11 Å²	11	30.8 Å²	30.8	6%	0.058	15%	0.153	C	C	.	.	H	α-helix	trans	-59.5	-51.3	176.7	176.3	64.2	0	0	0	110.9	V446 R469 I472 Q499 I500 L501 K505 V506 L507	V446-L503 HydrophobicContact CB-CD2 3.79Å; V446-L503 HydrophobicContact CG1-CD2 4.01Å; R469-L503 HydrophobicContact CG-CD2 4.5Å; I472-L503 HydrophobicContact CD1-CD2 4.16Å; I472-L503 HydrophobicContact CG2-CD2 4.19Å; Q499-L503 VanDerWaalsContact O-CB 3.28Å; Q499-L503 WeakPolarHBondContact O-CB 3.2Å; Q499-L503 PolarHBondContact O-N 3.11Å; I500-L503 WeakPolarHBondContact O-CB 3.34Å; I500-L503 PolarHBondContact O-N 3.46Å; L501-L503 VanDerWaalsContact C-N 3.32Å; L501-L503 PolarHBondContact O-N 2.97Å; L503-K505 VanDerWaalsContact C-N 3.29Å; L503-K505 PolarHBondContact O-N 3.38Å; L503-V506 PolarHBondContact O-N 3.07Å; L503-L507 HydrophobicContact CD1-CD1 3.72Å; L503-L507 HydrophobicContact CD1-CD2 4.49Å; L503-L507 HydrophobicContact CD1-CG 3.99Å; L503-L507 HydrophobicContact CD2-CD1 4.49Å; L503-L507 HydrophobicContact CG-CD1 3.77Å; L503-L507 HydrophobicContact CG-CG 4.37Å; L503-L507 VanDerWaalsContact O-CG 3.25Å; L503-L507 WeakPolarHBondContact O-CG 3.39Å; L503-L507 PolarHBondContact O-N 2.87Å
504	I	88.7	Confident	86	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-57.8	-44	178.5	-68.2	169.5	0	0	0	110.5	P488 I500 L501 V506 L507 Q508 V515 F517 I528	P488-I504 HydrophobicContact CB-CD1 4.49Å; P488-I504 HydrophobicContact CG-CD1 4.39Å; I500-I504 HydrophobicContact CG2-CD1 4.06Å; I500-I504 WeakPolarHBondContact O-CG1 3.18Å; I500-I504 PolarHBondContact O-N 2.96Å; L501-I504 PolarHBondContact O-N 3.39Å; I504-V506 PolarHBondContact O-N 3.22Å; I504-L507 PolarHBondContact O-N 3.07Å; I504-Q508 VanDerWaalsContact O-CB 3.26Å; I504-Q508 WeakPolarHBondContact O-CB 3.47Å; I504-Q508 PolarHBondContact O-N 2.69Å; I504-V515 HydrophobicContact CG2-CG1 4.44Å; I504-F517 HydrophobicContact CD1-CE2 4.05Å; I504-I528 HydrophobicContact CB-CD1 4.38Å; I504-I528 HydrophobicContact CG2-CD1 4.18Å
505	K	88.2	Confident	87	Confident	69 Å²	69	30 Å²	30	30%	0.3	15%	0.148	S	C	.	.	H	α-helix	trans	-62.8	-40.7	178.5	-166.3	168.6	-169.2	164.6	0	112.9	L501 Q502 L503 K509 E527	L501-K505 WeakPolarHBondContact O-CB 3.31Å; L501-K505 PolarHBondContact O-N 3.02Å; Q502-K505 PolarHBondContact O-N 3.33Å; L503-K505 VanDerWaalsContact C-N 3.29Å; L503-K505 PolarHBondContact O-N 3.38Å; K505-K509 PolarHBondContact O-N 2.85Å; K505-E527 PolarHBondContact NZ-O 3.23Å
506	V	87.8	Confident	88.1	Confident	45 Å²	45	30.1 Å²	30.1	27%	0.273	15%	0.149	S	C	.	.	H	α-helix	trans	-64.8	-49	175.1	169.7	0	0	0	0	110.4	Q502 L503 I504 Q508 K509 E510	Q502-V506 WeakPolarHBondContact O-CG2 3.47Å; Q502-V506 PolarHBondContact O-N 2.97Å; L503-V506 PolarHBondContact O-N 3.07Å; I504-V506 PolarHBondContact O-N 3.22Å; V506-Q508 VanDerWaalsContact C-N 3.32Å; V506-Q508 PolarHBondContact O-N 2.87Å; V506-K509 PolarHBondContact O-N 3.4Å; V506-E510 HydrophobicContact CG1-CG 4.46Å; V506-E510 WeakPolarHBondContact O-CG 3.22Å; V506-E510 PolarHBondContact O-N 2.94Å
507	L	87.3	Confident	88.9	Confident	3 Å²	3	29 Å²	29	2%	0.016	14%	0.144	C	C	.	.	H	α-helix	trans	-64.9	-37.1	-179.3	-63.4	176.1	0	0	0	112	Q445 V446 I472 L476 L503 I504 K509 E510 M511 M513	Q445-L507 HydrophobicContact CG-CD2 3.76Å; V446-L507 HydrophobicContact CG1-CD1 4.44Å; I472-L507 HydrophobicContact CG2-CD1 3.96Å; L476-L507 HydrophobicContact CD1-CB 3.99Å; L476-L507 HydrophobicContact CD1-CD1 3.22Å; L476-L507 HydrophobicContact CD1-CG 4.15Å; L503-L507 HydrophobicContact CD1-CD1 3.72Å; L503-L507 HydrophobicContact CD1-CD2 4.49Å; L503-L507 HydrophobicContact CD1-CG 3.99Å; L503-L507 HydrophobicContact CD2-CD1 4.49Å; L503-L507 HydrophobicContact CG-CD1 3.77Å; L503-L507 HydrophobicContact CG-CG 4.37Å; L503-L507 VanDerWaalsContact O-CG 3.25Å; L503-L507 WeakPolarHBondContact O-CG 3.39Å; L503-L507 PolarHBondContact O-N 2.87Å; I504-L507 PolarHBondContact O-N 3.07Å; L507-K509 VanDerWaalsContact C-N 3.33Å; L507-K509 PolarHBondContact O-N 3.38Å; L507-E510 PolarHBondContact O-N 3.38Å; L507-M511 HydrophobicContact CD2-CE 4.33Å; L507-M511 WeakPolarHBondContact O-CB 3.48Å; L507-M511 WeakPolarHBondContact O-CG 3.23Å; L507-M511 PolarHBondContact O-N 3.15Å; L507-M513 HydrophobicContact CB-CE 4.12Å
508	Q	91	Very high	89.5	Confident	17 Å²	17	28.1 Å²	28.1	8%	0.079	14%	0.139	C	C	.	.	H	α-helix	trans	-58.4	-47.7	174.4	-178.9	-170.4	31.3	0	0	110.9	G335 E336 T337 I504 V506 S512 M513 V515	G335-Q508 PolarHBondContact O-NE2 2.86Å; E336-Q508 VanDerWaalsContact C-NE2 3.35Å; E336-Q508 PolarHBondContact O-NE2 3.29Å; T337-Q508 PolarHBondContact OG1-NE2 2.79Å; T337-Q508 PolarHBondContact OG1-OE1 2.85Å; I504-Q508 VanDerWaalsContact O-CB 3.26Å; I504-Q508 WeakPolarHBondContact O-CB 3.47Å; I504-Q508 PolarHBondContact O-N 2.69Å; V506-Q508 VanDerWaalsContact C-N 3.32Å; V506-Q508 PolarHBondContact O-N 2.87Å; Q508-S512 VanDerWaalsContact O-CA 3.24Å; Q508-S512 WeakPolarHBondContact O-CA 3.38Å; Q508-S512 PolarHBondContact O-N 3.4Å; Q508-M513 HydrophobicContact CB-CE 3.99Å; Q508-M513 HydrophobicContact CB-CG 4.34Å; Q508-M513 HydrophobicContact CG-CG 4.28Å; Q508-M513 WeakPolarHBondContact CG-O 3.42Å; Q508-M513 PolarHBondContact O-N 3.42Å; Q508-V515 HydrophobicContact CB-CG2 4.21Å; Q508-V515 HydrophobicContact CG-CG2 3.87Å
509	K	88.3	Confident	89.8	Confident	158 Å²	158	28 Å²	28	69%	0.687	14%	0.138	S	C	*	.	H	α-helix	trans	-63.9	-44.8	178.2	-171.6	178.6	-179.6	-179.8	0	111.6	K505 V506 L507	K505-K509 PolarHBondContact O-N 2.85Å; V506-K509 PolarHBondContact O-N 3.4Å; L507-K509 VanDerWaalsContact C-N 3.33Å; L507-K509 PolarHBondContact O-N 3.38Å
510	E	87.8	Confident	89.8	Confident	119 Å²	119	27.7 Å²	27.7	56%	0.556	14%	0.136	S	C	*	.	H	α-helix	trans	-65.4	-39.3	179.9	-73.5	-179.8	173.9	0	0	112.8	Q445 V506 L507	Q445-E510 PolarHBondContact NE2-OE2 3.43Å; V506-E510 HydrophobicContact CG1-CG 4.46Å; V506-E510 WeakPolarHBondContact O-CG 3.22Å; V506-E510 PolarHBondContact O-N 2.94Å; L507-E510 PolarHBondContact O-N 3.38Å
511	M	87.8	Confident	89.7	Confident	29 Å²	29	29 Å²	29	14%	0.143	14%	0.143	C	C	.	.	H	α-helix	trans	-95.1	-11.5	-175.6	-59.2	-171.5	-174.2	0	0	113.4	L476 R479 L507 M513	L476-M511 HydrophobicContact CB-CE 4.21Å; L476-M511 HydrophobicContact CB-SD 4.41Å; L476-M511 HydrophobicContact CD2-SD 4.24Å; R479-M511 HydrophobicContact CB-SD 4.41Å; R479-M511 HydrophobicContact CG-CE 4.43Å; R479-M511 HydrophobicContact CG-SD 4.23Å; L507-M511 HydrophobicContact CD2-CE 4.33Å; L507-M511 WeakPolarHBondContact O-CB 3.48Å; L507-M511 WeakPolarHBondContact O-CG 3.23Å; L507-M511 PolarHBondContact O-N 3.15Å; M511-M513 VanDerWaalsContact C-N 3.25Å; M511-M513 HydrophobicContact CB-CG 4.44Å; M511-M513 PolarHBondContact O-N 3.43Å
512	S	89.8	Confident	89.6	Confident	55 Å²	55	29 Å²	29	39%	0.385	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	46.9	-171.7	-54.7	0	0	0	0	111.5	R334 Q508	R334-S512 WeakPolarHBondContact CG-O 3.46Å; R334-S512 PolarHBondContact NE-O 3.14Å; Q508-S512 VanDerWaalsContact O-CA 3.24Å; Q508-S512 WeakPolarHBondContact O-CA 3.38Å; Q508-S512 PolarHBondContact O-N 3.4Å
513	M	92.1	Very high	89.6	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.136	C	C	.	.			trans	-91.6	148.4	178.2	59.3	174.5	175.2	0	0	111	G335 L476 A481 L483 L507 Q508 M511 V515	G335-M513 VanDerWaalsContact CA-O 3.3Å; G335-M513 WeakPolarHBondContact CA-O 3.27Å; G335-M513 PolarHBondContact N-O 3.25Å; L476-M513 HydrophobicContact CD1-CE 4.41Å; L476-M513 HydrophobicContact CD2-CE 3.92Å; L476-M513 HydrophobicContact CD2-SD 3.61Å; A481-M513 WeakPolarHBondContact O-CA 3.5Å; L483-M513 HydrophobicContact CB-CE 4.42Å; L483-M513 HydrophobicContact CB-SD 3.65Å; L483-M513 HydrophobicContact CD2-CE 3.8Å; L483-M513 HydrophobicContact CD2-SD 4.09Å; L483-M513 HydrophobicContact CG-SD 4.46Å; L507-M513 HydrophobicContact CB-CE 4.12Å; Q508-M513 HydrophobicContact CB-CE 3.99Å; Q508-M513 HydrophobicContact CB-CG 4.34Å; Q508-M513 HydrophobicContact CG-CG 4.28Å; Q508-M513 WeakPolarHBondContact CG-O 3.42Å; Q508-M513 PolarHBondContact O-N 3.42Å; M511-M513 VanDerWaalsContact C-N 3.25Å; M511-M513 HydrophobicContact CB-CG 4.44Å; M511-M513 PolarHBondContact O-N 3.43Å; M513-V515 HydrophobicContact CE-CG2 4.16Å; M513-V515 HydrophobicContact CG-CG2 4.21Å; M513-V515 HydrophobicContact SD-CG2 4.43Å
514	G	95.9	Very high	89.6	Confident	2 Å²	2	26.8 Å²	26.8	2%	0.021	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	141.4	163.7	0	0	0	0	0	109.8	A481 V482 L483	A481-G514 PolarHBondContact O-N 3.01Å; V482-G514 WeakPolarHBondContact CA-O 3.27Å; L483-G514 PolarHBondContact N-O 3.19Å
515	V	96.6	Very high	89.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124	179.5	-179.1	0	0	0	0	109.6	E336 T337 L338 L483 I504 Q508 M513 F517	E336-V515 PolarHBondContact O-N 2.92Å; T337-V515 CarbonylContact C-O 3.58Å; T337-V515 WeakPolarHBondContact CA-O 3.45Å; T337-V515 HydrophobicContact CG2-CB 4.28Å; T337-V515 HydrophobicContact CG2-CG1 4.27Å; L338-V515 PolarHBondContact N-O 3.46Å; L483-V515 HydrophobicContact CB-CG2 4.45Å; L483-V515 CarbonylContact O-C 3.57Å; L483-V515 WeakPolarHBondContact O-CA 3.48Å; I504-V515 HydrophobicContact CG2-CG1 4.44Å; Q508-V515 HydrophobicContact CB-CG2 4.21Å; Q508-V515 HydrophobicContact CG-CG2 3.87Å; M513-V515 HydrophobicContact CE-CG2 4.16Å; M513-V515 HydrophobicContact CG-CG2 4.21Å; M513-V515 HydrophobicContact SD-CG2 4.43Å; V515-F517 HydrophobicContact CG1-CB 4.36Å; V515-F517 HydrophobicContact CG1-CD2 4.46Å
516	I	97.3	Very high	89.8	Confident	5 Å²	5	23.9 Å²	23.9	3%	0.026	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	114	163	-57.1	-177.4	0	0	0	106.5	F330 L332 L338 I340 L355 L483 I484 A485 I518	F330-I516 HydrophobicContact CE2-CD1 3.92Å; F330-I516 HydrophobicContact CZ-CD1 4.28Å; L332-I516 HydrophobicContact CD2-CD1 4.34Å; L332-I516 HydrophobicContact CD2-CG1 3.72Å; L338-I516 CarbonylContact O-C 3.58Å; L338-I516 WeakPolarHBondContact O-CA 3.44Å; I340-I516 HydrophobicContact CD1-CG2 3.63Å; I340-I516 HydrophobicContact CG1-CG2 4.09Å; L355-I516 HydrophobicContact CD1-CD1 3.66Å; L483-I516 PolarHBondContact O-N 3.11Å; I484-I516 HydrophobicContact CG1-CB 4.32Å; I484-I516 HydrophobicContact CG1-CD1 4.29Å; A485-I516 PolarHBondContact N-O 3.42Å; I516-I518 HydrophobicContact CG2-CG1 4.33Å
517	F	96.1	Very high	89.7	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	106	-178	-160.4	-79.7	0	0	0	109.5	T337 L338 A339 I340 A485 P488 L501 I504 V515 T519 V524 I528	T337-F517 HydrophobicContact CG2-CB 4.03Å; L338-F517 PolarHBondContact O-N 3.28Å; A339-F517 CarbonylContact C-O 3.57Å; A339-F517 WeakPolarHBondContact CA-O 3.43Å; I340-F517 PolarHBondContact N-O 2.96Å; A485-F517 HydrophobicContact CB-CD2 4.24Å; P488-F517 HydrophobicContact CG-CD2 4.3Å; P488-F517 HydrophobicContact CG-CE1 4.11Å; P488-F517 HydrophobicContact CG-CE2 3.44Å; P488-F517 VanDerWaalsContact CG-CE2 3.44Å; P488-F517 HydrophobicContact CG-CZ 3.32Å; L501-F517 HydrophobicContact CD2-CE1 4.4Å; L501-F517 HydrophobicContact CD2-CE2 3.82Å; L501-F517 HydrophobicContact CD2-CZ 3.45Å; L501-F517 VanDerWaalsContact CD2-CZ 3.45Å; I504-F517 HydrophobicContact CD1-CE2 4.05Å; V515-F517 HydrophobicContact CG1-CB 4.36Å; V515-F517 HydrophobicContact CG1-CD2 4.46Å; F517-T519 HydrophobicContact CD1-CG2 3.77Å; F517-T519 HydrophobicContact CE1-CG2 3.87Å; F517-V524 HydrophobicContact CE1-CG1 3.65Å; F517-V524 HydrophobicContact CZ-CG1 3.91Å; F517-I528 HydrophobicContact CD1-CG2 4.3Å; F517-I528 HydrophobicContact CD2-CD1 3.95Å; F517-I528 HydrophobicContact CD2-CG2 4.34Å; F517-I528 HydrophobicContact CE1-CG2 4.48Å; F517-I528 HydrophobicContact CE2-CD1 3.79Å; F517-I528 HydrophobicContact CG-CG2 4.23Å
518	I	93.9	Very high	89.8	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.7	177.7	-66.2	158.9	0	0	0	108.5	I340 K348 A352 I484 A485 D486 E487 I516	I340-I518 HydrophobicContact CB-CG1 4.06Å; I340-I518 WeakPolarHBondContact O-CA 3.34Å; K348-I518 HydrophobicContact CB-CG1 4.4Å; K348-I518 HydrophobicContact CB-CG2 3.46Å; K348-I518 VanDerWaalsContact CB-CG2 3.46Å; K348-I518 HydrophobicContact CD-CG2 4.01Å; K348-I518 HydrophobicContact CG-CG2 4.35Å; K348-I518 WeakPolarHBondContact O-CD1 3.29Å; A352-I518 HydrophobicContact CB-CD1 3.57Å; I484-I518 HydrophobicContact CG2-CD1 4.33Å; A485-I518 PolarHBondContact O-N 2.96Å; D486-I518 HydrophobicContact CB-CD1 4.43Å; D486-I518 WeakPolarHBondContact OD1-CG2 3.35Å; E487-I518 WeakPolarHBondContact CA-O 3.21Å; E487-I518 PolarHBondContact N-O 3.45Å; I516-I518 HydrophobicContact CG2-CG1 4.33Å
519	T	88.6	Confident	89.9	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	154.5	178	-178.9	0	0	0	0	110.7	I340 V341 F517 D521 V525	I340-T519 PolarHBondContact O-N 3.41Å; V341-T519 WeakPolarHBondContact CA-O 3.29Å; V341-T519 HydrophobicContact CG1-CG2 4.3Å; F517-T519 HydrophobicContact CD1-CG2 3.77Å; F517-T519 HydrophobicContact CE1-CG2 3.87Å; T519-D521 PolarHBondContact OG1-N 3.3Å; T519-V525 HydrophobicContact CG2-CG2 3.38Å
520	H	83.5	Confident	90.2	Very high	25 Å²	25	20.2 Å²	20.2	12%	0.116	11%	0.109	C	C	.	.	S	Bend	trans	-96.9	-6.7	166.8	63.3	-78.4	0	0	0	112.7	E487 D772	E487-H520 VanDerWaalsContact CD-ND1 3.27Å; E487-H520 IonicContact OE1-CE1 3.54Å; E487-H520 IonicContact OE1-CG 3.94Å; E487-H520 PolarHBondContact OE1-N 3.5Å; E487-H520 IonicContact OE1-ND1 2.67Å; E487-H520 PolarHBondContact OE1-ND1 3.41Å; E487-H520 IonicContact OE2-CE1 2.89Å; E487-H520 PolarHBondContact OE2-CE1 2.83Å; E487-H520 IonicContact OE2-ND1 3.16Å; E487-H520 PolarHBondContact OE2-ND1 2.52Å; H520-D772 IonicContact CD2-OD1 2.77Å; H520-D772 IonicContact CG-OD1 2.65Å
521	D	82.9	Confident	90.7	Very high	28 Å²	28	16.8 Å²	16.8	15%	0.15	9%	0.091	C	C	.	.			trans	-91.7	102.7	-177.8	-172	-16.5	0	0	0	111.7	T519 G523 V524 V525	T519-D521 PolarHBondContact OG1-N 3.3Å; D521-G523 VanDerWaalsContact C-N 3.27Å; D521-G523 PolarHBondContact O-N 3.24Å; D521-G523 WeakPolarHBondContact OD1-CA 3.41Å; D521-G523 PolarHBondContact OD1-N 3.25Å; D521-V524 HydrophobicContact CB-CB 4.19Å; D521-V524 HydrophobicContact CB-CG2 4Å; D521-V524 WeakPolarHBondContact O-CB 3.5Å; D521-V524 PolarHBondContact O-N 2.89Å; D521-V524 PolarHBondContact OD1-N 3.35Å; D521-V525 VanDerWaalsContact O-CG2 3.28Å; D521-V525 WeakPolarHBondContact O-CG2 3.32Å; D521-V525 PolarHBondContact O-N 2.95Å; D521-V525 VanDerWaalsContact O-N 3.14Å
522	M	86.6	Confident	91.1	Very high	4 Å²	4	15.4 Å²	15.4	2%	0.02	8%	0.084	C	C	.	.	H	α-helix	trans	-64.3	-27.4	176	-69.5	-68.2	-177.9	0	0	113.3	V341 V524 V525 A526 F550 L561 L562 V565	V341-M522 HydrophobicContact CB-CE 3.93Å; V341-M522 HydrophobicContact CB-SD 4.43Å; V341-M522 HydrophobicContact CG1-SD 4.45Å; V341-M522 HydrophobicContact CG2-CE 3.5Å; V341-M522 VanDerWaalsContact CG2-CE 3.5Å; V341-M522 HydrophobicContact CG2-SD 4.26Å; M522-V524 VanDerWaalsContact C-N 3.28Å; M522-V524 PolarHBondContact O-N 3.36Å; M522-V525 PolarHBondContact O-N 2.78Å; M522-V525 HydrophobicContact SD-CG2 4.47Å; M522-A526 PolarHBondContact O-N 3.12Å; M522-F550 HydrophobicContact CB-CE1 4.28Å; M522-F550 HydrophobicContact CB-CZ 3.95Å; M522-F550 WeakPolarHBondContact O-CZ 3.4Å; M522-F550 HydrophobicContact SD-CE2 4.44Å; M522-F550 HydrophobicContact SD-CZ 4.15Å; M522-L561 HydrophobicContact CE-CB 3.86Å; M522-L561 HydrophobicContact CE-CD1 3.62Å; M522-L561 HydrophobicContact CE-CG 4.38Å; M522-L562 HydrophobicContact CB-CD2 4.35Å; M522-L562 HydrophobicContact CG-CD2 4.24Å; M522-L562 HydrophobicContact SD-CD2 4.31Å; M522-V565 HydrophobicContact CB-CG2 3.47Å; M522-V565 VanDerWaalsContact CB-CG2 3.47Å; M522-V565 HydrophobicContact CG-CG2 4Å
523	G	84.4	Confident	91.5	Very high	2 Å²	2	12.9 Å²	12.9	2%	0.021	7%	0.066	C	C	.	.	H	α-helix	trans	-62.5	-39.3	173.9	0	0	0	0	0	111.6	D521	D521-G523 VanDerWaalsContact C-N 3.27Å; D521-G523 PolarHBondContact O-N 3.24Å; D521-G523 WeakPolarHBondContact OD1-CA 3.41Å; D521-G523 PolarHBondContact OD1-N 3.25Å
524	V	87.5	Confident	91.6	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-67.6	-41.7	173.2	172.2	0	0	0	0	111.6	L501 F517 D521 M522 A526 E527 I528 P845	L501-V524 HydrophobicContact CD1-CB 4.36Å; L501-V524 HydrophobicContact CD1-CG1 3.76Å; L501-V524 HydrophobicContact CD1-CG2 4.05Å; L501-V524 HydrophobicContact CD2-CG1 3.52Å; L501-V524 HydrophobicContact CG-CG1 4.29Å; F517-V524 HydrophobicContact CE1-CG1 3.65Å; F517-V524 HydrophobicContact CZ-CG1 3.91Å; D521-V524 HydrophobicContact CB-CB 4.19Å; D521-V524 HydrophobicContact CB-CG2 4Å; D521-V524 WeakPolarHBondContact O-CB 3.5Å; D521-V524 PolarHBondContact O-N 2.89Å; D521-V524 PolarHBondContact OD1-N 3.35Å; M522-V524 VanDerWaalsContact C-N 3.28Å; M522-V524 PolarHBondContact O-N 3.36Å; V524-A526 VanDerWaalsContact C-N 3.32Å; V524-A526 PolarHBondContact O-N 2.83Å; V524-E527 PolarHBondContact O-N 3.45Å; V524-I528 HydrophobicContact CG1-CG2 4.3Å; V524-I528 WeakPolarHBondContact O-CG2 3.2Å; V524-I528 PolarHBondContact O-N 3.25Å; V524-I528 VanDerWaalsContact O-N 3.15Å; V524-P845 HydrophobicContact CG2-CG 4.29Å
525	V	91.4	Very high	91.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59	-44.4	179.4	176.2	0	0	0	0	111	A339 V341 T519 D521 M522 E527 I528 A529 V532 F550	A339-V525 HydrophobicContact CB-CG1 3.86Å; A339-V525 HydrophobicContact CB-CG2 4.21Å; V341-V525 HydrophobicContact CG1-CB 4.46Å; V341-V525 HydrophobicContact CG1-CG1 4.31Å; V341-V525 HydrophobicContact CG1-CG2 3.37Å; T519-V525 HydrophobicContact CG2-CG2 3.38Å; D521-V525 VanDerWaalsContact O-CG2 3.28Å; D521-V525 WeakPolarHBondContact O-CG2 3.32Å; D521-V525 PolarHBondContact O-N 2.95Å; D521-V525 VanDerWaalsContact O-N 3.14Å; M522-V525 PolarHBondContact O-N 2.78Å; M522-V525 HydrophobicContact SD-CG2 4.47Å; V525-E527 PolarHBondContact O-N 2.9Å; V525-I528 PolarHBondContact O-N 2.91Å; V525-A529 HydrophobicContact CG1-CB 3.82Å; V525-A529 WeakPolarHBondContact O-CB 3.1Å; V525-A529 PolarHBondContact O-N 2.99Å; V525-V532 HydrophobicContact CG1-CB 4.45Å; V525-V532 HydrophobicContact CG1-CG1 4.19Å; V525-V532 HydrophobicContact CG1-CG2 3.42Å; V525-V532 VanDerWaalsContact CG1-CG2 3.42Å; V525-F550 HydrophobicContact CB-CE2 4.43Å; V525-F550 HydrophobicContact CB-CZ 4.28Å; V525-F550 HydrophobicContact CG1-CE2 3.96Å; V525-F550 HydrophobicContact CG1-CZ 4.3Å
526	A	89.3	Confident	91.3	Very high	8 Å²	8	16.7 Å²	16.7	7%	0.066	8%	0.08	C	C	.	.	H	α-helix	trans	-57.8	-30.1	176.3	0	0	0	0	0	113	M522 V524 F550 P849	M522-A526 PolarHBondContact O-N 3.12Å; V524-A526 VanDerWaalsContact C-N 3.32Å; V524-A526 PolarHBondContact O-N 2.83Å; A526-F550 HydrophobicContact CB-CD1 4.3Å; A526-F550 HydrophobicContact CB-CE1 3.72Å; A526-F550 HydrophobicContact CB-CE2 4.48Å; A526-F550 HydrophobicContact CB-CZ 3.83Å; A526-P849 HydrophobicContact CB-CG 4.19Å
527	E	85.5	Confident	90.7	Very high	45 Å²	45	22.3 Å²	22.3	21%	0.21	11%	0.106	C	C	.	.	H	α-helix	trans	-86.1	-32.6	-176.4	-172.2	168.8	-179.9	0	0	113.5	K505 V524 V525 R853	K505-E527 PolarHBondContact NZ-O 3.23Å; V524-E527 PolarHBondContact O-N 3.45Å; V525-E527 PolarHBondContact O-N 2.9Å; E527-R853 IonicContact OE1-CZ 3.4Å; E527-R853 IonicContact OE1-NH1 3.61Å; E527-R853 PolarHBondContact OE1-NH1 3.31Å; E527-R853 VanDerWaalsContact OE1-NH1 3.13Å; E527-R853 IonicContact OE2-NH1 3.32Å; E527-R853 PolarHBondContact OE2-NH1 3Å
528	I	89.5	Confident	90.4	Very high	8 Å²	8	22.3 Å²	22.3	4%	0.041	11%	0.106	C	C	.	.	H	α-helix	trans	-116.3	-26.4	-168.8	-157.2	168.2	0	0	0	115.7	T337 L501 I504 F517 V524 V525	T337-I528 WeakPolarHBondContact CB-O 3.39Å; T337-I528 HydrophobicContact CG2-CG1 4.43Å; T337-I528 WeakPolarHBondContact CG2-O 3.43Å; T337-I528 PolarHBondContact OG1-O 2.81Å; L501-I528 HydrophobicContact CB-CD1 4.4Å; L501-I528 HydrophobicContact CD2-CD1 3.85Å; I504-I528 HydrophobicContact CB-CD1 4.38Å; I504-I528 HydrophobicContact CG2-CD1 4.18Å; F517-I528 HydrophobicContact CD1-CG2 4.3Å; F517-I528 HydrophobicContact CD2-CD1 3.95Å; F517-I528 HydrophobicContact CD2-CG2 4.34Å; F517-I528 HydrophobicContact CE1-CG2 4.48Å; F517-I528 HydrophobicContact CE2-CD1 3.79Å; F517-I528 HydrophobicContact CG-CG2 4.23Å; V524-I528 HydrophobicContact CG1-CG2 4.3Å; V524-I528 WeakPolarHBondContact O-CG2 3.2Å; V524-I528 PolarHBondContact O-N 3.25Å; V524-I528 VanDerWaalsContact O-N 3.15Å; V525-I528 PolarHBondContact O-N 2.91Å
529	A	93.7	Very high	90.4	Very high	7 Å²	7	26.3 Å²	26.3	6%	0.058	13%	0.125	C	C	.	.			trans	-84	141.6	-170.4	0	0	0	0	0	112.4	A339 V525 V532 V546	A339-A529 HydrophobicContact CB-CB 3.56Å; V525-A529 HydrophobicContact CG1-CB 3.82Å; V525-A529 WeakPolarHBondContact O-CB 3.1Å; V525-A529 PolarHBondContact O-N 2.99Å; A529-V532 HydrophobicContact CB-CG2 4.13Å; A529-V546 VanDerWaalsContact O-CG1 3.32Å; A529-V546 WeakPolarHBondContact O-CG1 3.4Å
530	D	94.9	Very high	90.6	Very high	87 Å²	87	28.5 Å²	28.5	47%	0.465	14%	0.143	S	C	.	.	S	Bend	trans	-89.5	-40.1	164.5	-58.7	-61.6	0	0	0	109.8	E336 T337 S545 V546	E336-D530 HydrophobicContact CG-CB 4.23Å; T337-D530 PolarHBondContact N-OD2 3.33Å; T337-D530 PolarHBondContact O-N 3.3Å; D530-S545 WeakPolarHBondContact O-CA 3.47Å; D530-V546 PolarHBondContact O-N 3.26Å; D530-V546 VanDerWaalsContact O-N 3.08Å
531	R	96.7	Very high	91.2	Very high	47 Å²	47	29.1 Å²	29.1	18%	0.177	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.6	-179.4	-153.6	173.3	76.4	-145.1	6.6	110.8	S331 E336 T337 L338 A339 G544	S331-R531 PolarHBondContact O-NH2 2.94Å; E336-R531 WeakPolarHBondContact OE1-CB 3.27Å; E336-R531 IonicContact OE1-CZ 3.64Å; E336-R531 IonicContact OE1-NE 2.96Å; E336-R531 IonicContact OE1-NH1 3.74Å; E336-R531 PolarHBondContact OE1-NH1 3.43Å; E336-R531 IonicContact OE2-NH1 3.08Å; E336-R531 PolarHBondContact OE2-NH1 3.48Å; T337-R531 PolarHBondContact O-N 3.37Å; L338-R531 CarbonylContact C-O 3.39Å; L338-R531 WeakPolarHBondContact CA-O 3.41Å; L338-R531 HydrophobicContact CD1-CB 4.09Å; L338-R531 HydrophobicContact CD1-CG 4.42Å; A339-R531 PolarHBondContact N-O 3.48Å; R531-G544 WeakPolarHBondContact CA-O 3.21Å; R531-G544 WeakPolarHBondContact CG-O 3.48Å
532	V	97.2	Very high	91.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	134.6	-177.5	-176	0	0	0	0	109.2	A339 V341 V525 A529 V534 T543 G544 V546 I549	A339-V532 HydrophobicContact CB-CG2 4.44Å; A339-V532 CarbonylContact O-C 3.51Å; A339-V532 WeakPolarHBondContact O-CA 3.45Å; V341-V532 HydrophobicContact CG1-CG1 4.11Å; V341-V532 HydrophobicContact CG2-CG1 3.55Å; V525-V532 HydrophobicContact CG1-CB 4.45Å; V525-V532 HydrophobicContact CG1-CG1 4.19Å; V525-V532 HydrophobicContact CG1-CG2 3.42Å; V525-V532 VanDerWaalsContact CG1-CG2 3.42Å; A529-V532 HydrophobicContact CB-CG2 4.13Å; V532-V534 HydrophobicContact CG1-CG2 4.21Å; V532-T543 VanDerWaalsContact O-CA 3.28Å; V532-T543 WeakPolarHBondContact O-CA 3.27Å; V532-T543 PolarHBondContact O-OG1 3.23Å; V532-G544 PolarHBondContact N-O 2.82Å; V532-G544 PolarHBondContact O-N 2.9Å; V532-G544 VanDerWaalsContact O-N 3.07Å; V532-V546 HydrophobicContact CG2-CB 4.15Å; V532-V546 HydrophobicContact CG2-CG2 4.21Å; V532-I549 HydrophobicContact CB-CB 4.43Å; V532-I549 HydrophobicContact CB-CG1 4.03Å; V532-I549 HydrophobicContact CB-CG2 4.45Å; V532-I549 HydrophobicContact CG1-CG2 4.28Å
533	L	97.1	Very high	92.3	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	112.9	171	-175	159	0	0	0	107.9	L328 F330 L338 A339 I340 V341 M535 A540	L328-L533 HydrophobicContact CD1-CD1 4.01Å; L328-L533 HydrophobicContact CD1-CD2 4.09Å; F330-L533 HydrophobicContact CB-CD1 3.78Å; F330-L533 HydrophobicContact CD1-CD1 3.99Å; F330-L533 HydrophobicContact CG-CD1 4.1Å; L338-L533 HydrophobicContact CD1-CB 4.19Å; A339-L533 PolarHBondContact O-N 2.92Å; I340-L533 WeakPolarHBondContact CA-O 3.37Å; I340-L533 HydrophobicContact CG2-CD2 4.37Å; V341-L533 PolarHBondContact N-O 3.04Å; L533-M535 HydrophobicContact CD2-CG 3.36Å; L533-M535 HydrophobicContact CD2-SD 4.28Å; L533-A540 HydrophobicContact CD1-CB 4.42Å; L533-A540 HydrophobicContact CD2-CB 3.87Å; L533-A540 HydrophobicContact CG-CB 4.16Å
534	V	95.7	Very high	92.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	118.3	179.8	-172.5	0	0	0	0	108.8	V341 V532 A540 V541 E542 Y557 T558 L561	V341-V534 HydrophobicContact CG2-CB 4.13Å; V341-V534 HydrophobicContact CG2-CG1 4.31Å; V341-V534 HydrophobicContact CG2-CG2 3.74Å; V341-V534 CarbonylContact O-C 3.59Å; V532-V534 HydrophobicContact CG1-CG2 4.21Å; V534-A540 CarbonylContact O-C 3.33Å; V534-A540 WeakPolarHBondContact O-CA 3.38Å; V534-V541 HydrophobicContact CB-CG2 4.12Å; V534-V541 HydrophobicContact CG1-CG2 3.85Å; V534-V541 WeakPolarHBondContact O-CG2 3.22Å; V534-V541 PolarHBondContact O-N 3.33Å; V534-E542 HydrophobicContact CB-CB 4.16Å; V534-E542 HydrophobicContact CG2-CB 4.17Å; V534-E542 PolarHBondContact N-O 3.16Å; V534-Y557 HydrophobicContact CG1-CD1 3.8Å; V534-Y557 HydrophobicContact CG1-CE1 3.98Å; V534-T558 HydrophobicContact CG2-CG2 4.04Å; V534-L561 HydrophobicContact CG1-CD1 4.01Å
535	M	93.9	Very high	93.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	133.5	175.7	-66.2	-172	74	0	0	111.4	V325 L328 I340 V341 S346 K348 L533 E539 Y557	V325-M535 HydrophobicContact CG1-CE 4.22Å; V325-M535 HydrophobicContact CG2-CE 4.21Å; L328-M535 HydrophobicContact CD2-CE 3.89Å; L328-M535 HydrophobicContact CD2-SD 4.23Å; I340-M535 HydrophobicContact CG2-CG 3.88Å; I340-M535 HydrophobicContact CG2-SD 3.45Å; I340-M535 WeakPolarHBondContact CG2-SD 3.16Å; V341-M535 PolarHBondContact O-N 2.86Å; S346-M535 WeakPolarHBondContact CB-O 3.38Å; S346-M535 WeakPolarHBondContact O-CE 3.4Å; K348-M535 HydrophobicContact CG-SD 4.36Å; L533-M535 HydrophobicContact CD2-CG 3.36Å; L533-M535 HydrophobicContact CD2-SD 4.28Å; M535-E539 CarbonylContact C-O 3.54Å; M535-E539 VanDerWaalsContact CA-O 3.24Å; M535-E539 WeakPolarHBondContact CA-O 3.31Å; M535-Y557 WeakPolarHBondContact O-CE1 3.35Å
536	Y	90.6	Very high	93.3	Very high	82 Å²	82	35.9 Å²	35.9	32%	0.322	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	127.4	173.3	-177.6	-119	0	0	0	109.5	G538 E539 Y557	Y536-G538 PolarHBondContact O-N 3.4Å; Y536-G538 VanDerWaalsContact O-N 3.14Å; Y536-E539 PolarHBondContact N-O 3.22Å; Y536-E539 PolarHBondContact O-N 3.27Å; Y536-Y557 AromaticContact CD2-CD1 3.97Å; Y536-Y557 HydrophobicContact CD2-CD1 3.97Å; Y536-Y557 AromaticContact CD2-CD2 3.6Å; Y536-Y557 HydrophobicContact CD2-CD2 3.6Å; Y536-Y557 AromaticContact CD2-CE1 3.74Å; Y536-Y557 HydrophobicContact CD2-CE1 3.74Å; Y536-Y557 AromaticContact CD2-CE2 3.39Å; Y536-Y557 HydrophobicContact CD2-CE2 3.39Å; Y536-Y557 AromaticContact CD2-CG 3.87Å; Y536-Y557 HydrophobicContact CD2-CG 3.87Å; Y536-Y557 AromaticContact CD2-CZ 3.45Å; Y536-Y557 VanDerWaalsContact CD2-CZ 3.45Å; Y536-Y557 AromaticContact CE2-CD2 3.79Å; Y536-Y557 HydrophobicContact CE2-CD2 3.79Å; Y536-Y557 AromaticContact CE2-CE2 3.65Å; Y536-Y557 HydrophobicContact CE2-CE2 3.65Å; Y536-Y557 HydrophobicContact CE2-CG 4.41Å; Y536-Y557 AromaticContact CG-CD1 3.97Å; Y536-Y557 HydrophobicContact CG-CD1 3.97Å; Y536-Y557 HydrophobicContact CG-CD2 4.19Å; Y536-Y557 HydrophobicContact CG-CE1 4.07Å; Y536-Y557 HydrophobicContact CG-CE2 4.32Å; Y536-Y557 HydrophobicContact CG-CG 4Å
537	Q	86.3	Confident	93.6	Very high	122 Å²	122	39.1 Å²	39.1	57%	0.57	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	39.7	178.2	-60.3	-173.7	-12.2	0	0	114.8
538	G	88.7	Confident	94	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	-2.4	178.5	0	0	0	0	0	115.3	A324 V325 R326 S346 Y536	A324-G538 WeakPolarHBondContact O-CA 3.31Å; V325-G538 CarbonylContact C-O 3.6Å; V325-G538 VanDerWaalsContact CA-O 3.3Å; V325-G538 WeakPolarHBondContact CA-O 3.23Å; R326-G538 PolarHBondContact N-O 3.03Å; S346-G538 VanDerWaalsContact O-CA 3.29Å; S346-G538 WeakPolarHBondContact O-CA 3.41Å; S346-G538 PolarHBondContact O-N 3.4Å; Y536-G538 PolarHBondContact O-N 3.4Å; Y536-G538 VanDerWaalsContact O-N 3.14Å
539	E	93.3	Very high	94.2	Very high	85 Å²	85	42.4 Å²	42.4	40%	0.397	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.5	-178.3	-70.9	173.9	-160.3	0	0	111.4	R326 M535 Y536 V541	R326-E539 HydrophobicContact CB-CG 3.89Å; R326-E539 WeakPolarHBondContact CD-OE1 3.31Å; R326-E539 IonicContact NH1-OE1 3.38Å; R326-E539 PolarHBondContact NH1-OE1 2.9Å; M535-E539 CarbonylContact C-O 3.54Å; M535-E539 VanDerWaalsContact CA-O 3.24Å; M535-E539 WeakPolarHBondContact CA-O 3.31Å; Y536-E539 PolarHBondContact N-O 3.22Å; Y536-E539 PolarHBondContact O-N 3.27Å; E539-V541 PolarHBondContact O-N 2.84Å
540	A	94.7	Very high	94.1	Very high	47 Å²	47	43.3 Å²	43.3	39%	0.388	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	109.8	167.6	0	0	0	0	0	109.3	L328 L533 V534	L328-A540 HydrophobicContact CD1-CB 3.65Å; L533-A540 HydrophobicContact CD1-CB 4.42Å; L533-A540 HydrophobicContact CD2-CB 3.87Å; L533-A540 HydrophobicContact CG-CB 4.16Å; V534-A540 CarbonylContact O-C 3.33Å; V534-A540 WeakPolarHBondContact O-CA 3.38Å
541	V	94.8	Very high	94	Very high	37 Å²	37	44.4 Å²	44.4	22%	0.224	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-21.9	-175.9	-66.7	0	0	0	0	113.5	V534 E539 Y557	V534-V541 HydrophobicContact CB-CG2 4.12Å; V534-V541 HydrophobicContact CG1-CG2 3.85Å; V534-V541 WeakPolarHBondContact O-CG2 3.22Å; V534-V541 PolarHBondContact O-N 3.33Å; E539-V541 PolarHBondContact O-N 2.84Å; V541-Y557 HydrophobicContact CG2-CD1 4.21Å
542	E	96	Very high	93.8	Very high	24 Å²	24	44.6 Å²	44.6	11%	0.112	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	143.6	176.4	-156.5	171.5	168.2	0	0	110.7	V534 I549 Q554 H555 T558	V534-E542 HydrophobicContact CB-CB 4.16Å; V534-E542 HydrophobicContact CG2-CB 4.17Å; V534-E542 PolarHBondContact N-O 3.16Å; E542-I549 HydrophobicContact CB-CD1 4.35Å; E542-I549 HydrophobicContact CG-CD1 3.63Å; E542-Q554 PolarHBondContact OE1-N 2.96Å; E542-Q554 PolarHBondContact OE2-N 3.07Å; E542-H555 HydrophobicContact CB-CB 4.2Å; E542-H555 WeakPolarHBondContact OE2-CB 3.33Å; E542-H555 PolarHBondContact OE2-N 3.26Å; E542-T558 WeakPolarHBondContact OE2-CB 3.4Å; E542-T558 PolarHBondContact OE2-OG1 3.25Å
543	T	96.3	Very high	93.6	Very high	88 Å²	88	45.7 Å²	45.7	54%	0.54	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	140.9	174.8	-174.7	0	0	0	0	110	V532	V532-T543 VanDerWaalsContact O-CA 3.28Å; V532-T543 WeakPolarHBondContact O-CA 3.27Å; V532-T543 PolarHBondContact O-OG1 3.23Å
544	G	95.9	Very high	93.5	Very high	11 Å²	11	52 Å²	52	11%	0.113	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.2	174.5	-177.9	0	0	0	0	0	112.2	R531 V532	R531-G544 WeakPolarHBondContact CA-O 3.21Å; R531-G544 WeakPolarHBondContact CG-O 3.48Å; V532-G544 PolarHBondContact N-O 2.82Å; V532-G544 PolarHBondContact O-N 2.9Å; V532-G544 VanDerWaalsContact O-N 3.07Å
545	S	96	Very high	93.4	Very high	40 Å²	40	54.8 Å²	54.8	28%	0.28	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	154.2	168.6	61.5	0	0	0	0	110.6	D530 E547 Q548 I549	D530-S545 WeakPolarHBondContact O-CA 3.47Å; S545-E547 PolarHBondContact O-N 3.37Å; S545-Q548 PolarHBondContact O-N 2.81Å; S545-Q548 VanDerWaalsContact O-N 3.09Å; S545-Q548 WeakPolarHBondContact OG-CB 3.35Å; S545-Q548 WeakPolarHBondContact OG-CG 3.33Å; S545-Q548 PolarHBondContact OG-N 2.75Å; S545-Q548 PolarHBondContact OG-OE1 3.02Å; S545-I549 PolarHBondContact O-N 2.8Å
546	V	94.4	Very high	93.4	Very high	14 Å²	14	59.1 Å²	59.1	9%	0.085	32%	0.317	C	S	.	.	H	α-helix	trans	-54	-41.6	176.9	67.2	0	0	0	0	111.8	A529 D530 V532 Q548 I549 F550 P849	A529-V546 VanDerWaalsContact O-CG1 3.32Å; A529-V546 WeakPolarHBondContact O-CG1 3.4Å; D530-V546 PolarHBondContact O-N 3.26Å; D530-V546 VanDerWaalsContact O-N 3.08Å; V532-V546 HydrophobicContact CG2-CB 4.15Å; V532-V546 HydrophobicContact CG2-CG2 4.21Å; V546-Q548 PolarHBondContact O-N 2.86Å; V546-I549 PolarHBondContact O-N 2.82Å; V546-F550 HydrophobicContact CG2-CD2 3.86Å; V546-F550 HydrophobicContact CG2-CE2 3.87Å; V546-F550 WeakPolarHBondContact O-CD2 3.28Å; V546-F550 PolarHBondContact O-N 2.88Å; V546-P849 HydrophobicContact CG1-CB 4.13Å; V546-P849 HydrophobicContact CG2-CB 4.09Å; V546-P849 HydrophobicContact CG2-CG 3.88Å
547	E	93.6	Very high	93.4	Very high	75 Å²	75	56.3 Å²	56.3	35%	0.35	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-45.9	176.6	-64.5	-67.3	166.8	0	0	112.1	S545 H551 P849	S545-E547 PolarHBondContact O-N 3.37Å; E547-H551 VanDerWaalsContact O-CB 3.29Å; E547-H551 WeakPolarHBondContact O-CB 3.33Å; E547-H551 PolarHBondContact O-CD2 2.79Å; E547-H551 VanDerWaalsContact O-CD2 3.29Å; E547-H551 PolarHBondContact O-N 2.97Å; E547-H551 IonicContact OE2-CD2 3.74Å; E547-H551 PolarHBondContact OE2-CD2 3.41Å; E547-H551 VanDerWaalsContact OE2-CD2 3.24Å; E547-H551 IonicContact OE2-NE2 3.42Å; E547-H551 PolarHBondContact OE2-NE2 2.88Å; E547-H551 VanDerWaalsContact OE2-NE2 3.1Å; E547-P849 WeakPolarHBondContact OE1-CB 3.11Å
548	Q	94.2	Very high	93.6	Very high	120 Å²	120	50.5 Å²	50.5	56%	0.561	28%	0.278	S	S	*	.	H	α-helix	trans	-64.5	-45.4	179.7	-75.7	164.1	-28.4	0	0	112.1	S545 V546 A552	S545-Q548 PolarHBondContact O-N 2.81Å; S545-Q548 VanDerWaalsContact O-N 3.09Å; S545-Q548 WeakPolarHBondContact OG-CB 3.35Å; S545-Q548 WeakPolarHBondContact OG-CG 3.33Å; S545-Q548 PolarHBondContact OG-N 2.75Å; S545-Q548 PolarHBondContact OG-OE1 3.02Å; V546-Q548 PolarHBondContact O-N 2.86Å; Q548-A552 CarbonylContact O-C 3.59Å; Q548-A552 WeakPolarHBondContact O-CA 3.12Å; Q548-A552 PolarHBondContact O-N 2.79Å
549	I	94.3	Very high	93.8	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-65.1	-41.3	-178.6	-69.1	-56.3	0	0	0	111.2	V532 E542 S545 V546 P553 T558 L562	V532-I549 HydrophobicContact CB-CB 4.43Å; V532-I549 HydrophobicContact CB-CG1 4.03Å; V532-I549 HydrophobicContact CB-CG2 4.45Å; V532-I549 HydrophobicContact CG1-CG2 4.28Å; E542-I549 HydrophobicContact CB-CD1 4.35Å; E542-I549 HydrophobicContact CG-CD1 3.63Å; S545-I549 PolarHBondContact O-N 2.8Å; V546-I549 PolarHBondContact O-N 2.82Å; I549-P553 WeakPolarHBondContact O-CB 3.22Å; I549-P553 WeakPolarHBondContact O-CD 3.37Å; I549-T558 HydrophobicContact CG2-CG2 3.87Å; I549-L562 VanDerWaalsContact O-CD1 3.29Å; I549-L562 WeakPolarHBondContact O-CD1 3.41Å
550	F	92.3	Very high	93.4	Very high	26 Å²	26	55.5 Å²	55.5	11%	0.114	31%	0.306	C	S	.	.	H	α-helix	trans	-77.4	-37.6	-178	-82	-108.3	0	0	0	113.1	M522 V525 A526 V546 L562 A847 P849	M522-F550 HydrophobicContact CB-CE1 4.28Å; M522-F550 HydrophobicContact CB-CZ 3.95Å; M522-F550 WeakPolarHBondContact O-CZ 3.4Å; M522-F550 HydrophobicContact SD-CE2 4.44Å; M522-F550 HydrophobicContact SD-CZ 4.15Å; V525-F550 HydrophobicContact CB-CE2 4.43Å; V525-F550 HydrophobicContact CB-CZ 4.28Å; V525-F550 HydrophobicContact CG1-CE2 3.96Å; V525-F550 HydrophobicContact CG1-CZ 4.3Å; A526-F550 HydrophobicContact CB-CD1 4.3Å; A526-F550 HydrophobicContact CB-CE1 3.72Å; A526-F550 HydrophobicContact CB-CE2 4.48Å; A526-F550 HydrophobicContact CB-CZ 3.83Å; V546-F550 HydrophobicContact CG2-CD2 3.86Å; V546-F550 HydrophobicContact CG2-CE2 3.87Å; V546-F550 WeakPolarHBondContact O-CD2 3.28Å; V546-F550 PolarHBondContact O-N 2.88Å; F550-L562 HydrophobicContact CD1-CD2 3.71Å; F550-L562 HydrophobicContact CD2-CD2 4.39Å; F550-L562 HydrophobicContact CE1-CD2 3.62Å; F550-L562 HydrophobicContact CE2-CD2 4.34Å; F550-L562 HydrophobicContact CG-CD2 4.1Å; F550-L562 HydrophobicContact CZ-CD2 3.94Å; F550-A847 HydrophobicContact CE1-CB 4.28Å; F550-P849 HydrophobicContact CB-CG 3.71Å; F550-P849 HydrophobicContact CD1-CG 4.07Å; F550-P849 HydrophobicContact CD2-CG 4.04Å; F550-P849 HydrophobicContact CG-CG 3.65Å
551	H	92.3	Very high	92.9	Very high	110 Å²	110	53.9 Å²	53.9	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-89.9	-30.1	-176.2	-68.1	-48.7	0	0	0	114.4	E547 E848	E547-H551 VanDerWaalsContact O-CB 3.29Å; E547-H551 WeakPolarHBondContact O-CB 3.33Å; E547-H551 PolarHBondContact O-CD2 2.79Å; E547-H551 VanDerWaalsContact O-CD2 3.29Å; E547-H551 PolarHBondContact O-N 2.97Å; E547-H551 IonicContact OE2-CD2 3.74Å; E547-H551 PolarHBondContact OE2-CD2 3.41Å; E547-H551 VanDerWaalsContact OE2-CD2 3.24Å; E547-H551 IonicContact OE2-NE2 3.42Å; E547-H551 PolarHBondContact OE2-NE2 2.88Å; E547-H551 VanDerWaalsContact OE2-NE2 3.1Å; H551-E848 IonicContact CE1-OE1 3.87Å; H551-E848 PolarHBondContact CE1-OE1 3.5Å; H551-E848 VanDerWaalsContact CE1-OE1 3.22Å; H551-E848 IonicContact NE2-OE1 2.74Å
552	A	92.8	Very high	92.6	Very high	52 Å²	52	53.3 Å²	53.3	43%	0.43	29%	0.287	S	S	.	.	S	Bend	trans	-139.6	55.5	-175.9	0	0	0	0	0	112.6	Q548 Q554	Q548-A552 CarbonylContact O-C 3.59Å; Q548-A552 WeakPolarHBondContact O-CA 3.12Å; Q548-A552 PolarHBondContact O-N 2.79Å; A552-Q554 PolarHBondContact O-N 2.82Å; A552-Q554 PolarHBondContact O-NE2 2.98Å
553	P	93.2	Very high	92	Very high	23 Å²	23	56.2 Å²	56.2	15%	0.149	32%	0.315	C	S	.	.			trans	-60.4	125.9	178	26.9	-36	0	0	0	111.1	I549 T558 R559 L562	I549-P553 WeakPolarHBondContact O-CB 3.22Å; I549-P553 WeakPolarHBondContact O-CD 3.37Å; P553-T558 HydrophobicContact CB-CG2 3.77Å; P553-R559 HydrophobicContact CB-CG 3.88Å; P553-R559 HydrophobicContact CG-CG 3.73Å; P553-R559 PolarHBondContact O-NE 3.11Å; P553-R559 PolarHBondContact O-NH2 2.69Å; P553-R559 VanDerWaalsContact O-NH2 3.11Å; P553-L562 HydrophobicContact CB-CD1 3.87Å; P553-L562 HydrophobicContact CG-CD1 3.8Å
554	Q	94.3	Very high	91	Very high	133 Å²	133	53.7 Å²	53.7	62%	0.621	30%	0.303	S	S	*	.			trans	-89.7	-42.2	-178.3	-60.9	-56.1	-48.1	0	0	111.8	E542 A552 R559	E542-Q554 PolarHBondContact OE1-N 2.96Å; E542-Q554 PolarHBondContact OE2-N 3.07Å; A552-Q554 PolarHBondContact O-N 2.82Å; A552-Q554 PolarHBondContact O-NE2 2.98Å; Q554-R559 PolarHBondContact O-NH2 2.85Å
555	H	94.8	Very high	90.1	Very high	59 Å²	59	53.6 Å²	53.6	27%	0.273	30%	0.3	S	S	.	.	S	Bend	trans	-81.1	137	-173.9	-167	-91.7	0	0	0	111.5	E542 Y557 T558 R559	E542-H555 HydrophobicContact CB-CB 4.2Å; E542-H555 WeakPolarHBondContact OE2-CB 3.33Å; E542-H555 PolarHBondContact OE2-N 3.26Å; H555-Y557 VanDerWaalsContact C-N 3.26Å; H555-Y557 WeakPolarHBondContact ND1-CB 3.38Å; H555-Y557 PolarHBondContact ND1-N 2.93Å; H555-Y557 VanDerWaalsContact ND1-N 3.18Å; H555-Y557 PolarHBondContact O-N 3.12Å; H555-T558 WeakPolarHBondContact O-CB 3.49Å; H555-T558 PolarHBondContact O-N 2.88Å; H555-T558 VanDerWaalsContact O-N 3.09Å; H555-R559 PolarHBondContact O-N 3.07Å; H555-R559 VanDerWaalsContact O-N 3.13Å
556	P	91.8	Very high	88.8	Confident	92 Å²	92	53.7 Å²	53.7	60%	0.597	30%	0.3	S	S	*	.	H	α-helix	trans	-55.8	-38	-180	-27.6	35.2	0	0	0	113.9	R559 A560	P556-R559 PolarHBondContact O-N 3.38Å; P556-A560 PolarHBondContact O-N 2.84Å
557	Y	90.8	Very high	87.8	Confident	22 Å²	22	58.9 Å²	58.9	9%	0.086	32%	0.323	C	S	.	.	H	α-helix	trans	-63.4	-43.8	176	-180	-115	0	0	0	112.3	E343 V534 M535 Y536 V541 H555 R559 A560 L561	E343-Y557 WeakPolarHBondContact CB-OH 3.2Å; E343-Y557 HydrophobicContact CG-CE2 4.47Å; E343-Y557 WeakPolarHBondContact CG-OH 3.43Å; E343-Y557 PolarHBondContact N-OH 3.45Å; E343-Y557 PolarHBondContact OE2-OH 2.94Å; V534-Y557 HydrophobicContact CG1-CD1 3.8Å; V534-Y557 HydrophobicContact CG1-CE1 3.98Å; M535-Y557 WeakPolarHBondContact O-CE1 3.35Å; Y536-Y557 AromaticContact CD2-CD1 3.97Å; Y536-Y557 HydrophobicContact CD2-CD1 3.97Å; Y536-Y557 AromaticContact CD2-CD2 3.6Å; Y536-Y557 HydrophobicContact CD2-CD2 3.6Å; Y536-Y557 AromaticContact CD2-CE1 3.74Å; Y536-Y557 HydrophobicContact CD2-CE1 3.74Å; Y536-Y557 AromaticContact CD2-CE2 3.39Å; Y536-Y557 HydrophobicContact CD2-CE2 3.39Å; Y536-Y557 AromaticContact CD2-CG 3.87Å; Y536-Y557 HydrophobicContact CD2-CG 3.87Å; Y536-Y557 AromaticContact CD2-CZ 3.45Å; Y536-Y557 VanDerWaalsContact CD2-CZ 3.45Å; Y536-Y557 AromaticContact CE2-CD2 3.79Å; Y536-Y557 HydrophobicContact CE2-CD2 3.79Å; Y536-Y557 AromaticContact CE2-CE2 3.65Å; Y536-Y557 HydrophobicContact CE2-CE2 3.65Å; Y536-Y557 HydrophobicContact CE2-CG 4.41Å; Y536-Y557 AromaticContact CG-CD1 3.97Å; Y536-Y557 HydrophobicContact CG-CD1 3.97Å; Y536-Y557 HydrophobicContact CG-CD2 4.19Å; Y536-Y557 HydrophobicContact CG-CE1 4.07Å; Y536-Y557 HydrophobicContact CG-CE2 4.32Å; Y536-Y557 HydrophobicContact CG-CG 4Å; V541-Y557 HydrophobicContact CG2-CD1 4.21Å; H555-Y557 VanDerWaalsContact C-N 3.26Å; H555-Y557 WeakPolarHBondContact ND1-CB 3.38Å; H555-Y557 PolarHBondContact ND1-N 2.93Å; H555-Y557 VanDerWaalsContact ND1-N 3.18Å; H555-Y557 PolarHBondContact O-N 3.12Å; Y557-R559 VanDerWaalsContact C-N 3.31Å; Y557-R559 PolarHBondContact O-N 3.13Å; Y557-A560 WeakPolarHBondContact O-CB 3.48Å; Y557-A560 PolarHBondContact O-N 2.88Å; Y557-A560 VanDerWaalsContact O-N 3.12Å; Y557-L561 HydrophobicContact CD1-CD1 3.81Å; Y557-L561 HydrophobicContact CD1-CG 4.29Å; Y557-L561 HydrophobicContact CD2-CG 4.48Å; Y557-L561 HydrophobicContact CE1-CD1 3.36Å; Y557-L561 HydrophobicContact CE1-CD2 4.46Å; Y557-L561 HydrophobicContact CE1-CG 3.97Å; Y557-L561 HydrophobicContact CE2-CD1 4.43Å; Y557-L561 HydrophobicContact CE2-CD2 4.21Å; Y557-L561 HydrophobicContact CE2-CG 4.15Å; Y557-L561 WeakPolarHBondContact O-CG 3.42Å; Y557-L561 PolarHBondContact O-N 2.73Å
558	T	91.6	Very high	87	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-42.7	176.9	-49	0	0	0	0	111.1	V534 E542 I549 P553 H555 A560 L561 L562	V534-T558 HydrophobicContact CG2-CG2 4.04Å; E542-T558 WeakPolarHBondContact OE2-CB 3.4Å; E542-T558 PolarHBondContact OE2-OG1 3.25Å; I549-T558 HydrophobicContact CG2-CG2 3.87Å; P553-T558 HydrophobicContact CB-CG2 3.77Å; H555-T558 WeakPolarHBondContact O-CB 3.49Å; H555-T558 PolarHBondContact O-N 2.88Å; H555-T558 VanDerWaalsContact O-N 3.09Å; T558-A560 VanDerWaalsContact C-N 3.33Å; T558-A560 PolarHBondContact O-N 3.26Å; T558-L561 PolarHBondContact O-N 3.41Å; T558-L562 HydrophobicContact CG2-CD1 4.18Å; T558-L562 WeakPolarHBondContact O-CG 3.47Å; T558-L562 PolarHBondContact O-N 3.21Å
559	R	91.6	Very high	86.3	Confident	130 Å²	130	54.3 Å²	54.3	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-59.6	-43.4	174	-67.5	177.9	-173.8	168.7	6.5	112	P553 Q554 H555 P556 Y557 L562 A563	P553-R559 HydrophobicContact CB-CG 3.88Å; P553-R559 HydrophobicContact CG-CG 3.73Å; P553-R559 PolarHBondContact O-NE 3.11Å; P553-R559 PolarHBondContact O-NH2 2.69Å; P553-R559 VanDerWaalsContact O-NH2 3.11Å; Q554-R559 PolarHBondContact O-NH2 2.85Å; H555-R559 PolarHBondContact O-N 3.07Å; H555-R559 VanDerWaalsContact O-N 3.13Å; P556-R559 PolarHBondContact O-N 3.38Å; Y557-R559 VanDerWaalsContact C-N 3.31Å; Y557-R559 PolarHBondContact O-N 3.13Å; R559-L562 PolarHBondContact O-N 3.16Å; R559-A563 VanDerWaalsContact O-CB 3.28Å; R559-A563 WeakPolarHBondContact O-CB 3.25Å; R559-A563 PolarHBondContact O-N 3.36Å
560	A	86	Confident	85.7	Confident	60 Å²	60	57.8 Å²	57.8	50%	0.496	34%	0.342	S	S	.	.	H	α-helix	trans	-65.6	-42.8	178	0	0	0	0	0	112	P556 Y557 T558 A563 A564	P556-A560 PolarHBondContact O-N 2.84Å; Y557-A560 WeakPolarHBondContact O-CB 3.48Å; Y557-A560 PolarHBondContact O-N 2.88Å; Y557-A560 VanDerWaalsContact O-N 3.12Å; T558-A560 VanDerWaalsContact C-N 3.33Å; T558-A560 PolarHBondContact O-N 3.26Å; A560-A563 PolarHBondContact O-N 2.82Å; A560-A564 WeakPolarHBondContact O-CB 3.23Å; A560-A564 PolarHBondContact O-N 2.96Å
561	L	84.7	Confident	85.2	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.073	34%	0.342	C	S	.	.	H	α-helix	trans	-59.6	-47.5	175.2	-74.3	178.5	0	0	0	111.6	E343 M522 V534 Y557 T558 A564 V565	E343-L561 HydrophobicContact CG-CD2 4.18Å; M522-L561 HydrophobicContact CE-CB 3.86Å; M522-L561 HydrophobicContact CE-CD1 3.62Å; M522-L561 HydrophobicContact CE-CG 4.38Å; V534-L561 HydrophobicContact CG1-CD1 4.01Å; Y557-L561 HydrophobicContact CD1-CD1 3.81Å; Y557-L561 HydrophobicContact CD1-CG 4.29Å; Y557-L561 HydrophobicContact CD2-CG 4.48Å; Y557-L561 HydrophobicContact CE1-CD1 3.36Å; Y557-L561 HydrophobicContact CE1-CD2 4.46Å; Y557-L561 HydrophobicContact CE1-CG 3.97Å; Y557-L561 HydrophobicContact CE2-CD1 4.43Å; Y557-L561 HydrophobicContact CE2-CD2 4.21Å; Y557-L561 HydrophobicContact CE2-CG 4.15Å; Y557-L561 WeakPolarHBondContact O-CG 3.42Å; Y557-L561 PolarHBondContact O-N 2.73Å; T558-L561 PolarHBondContact O-N 3.41Å; L561-A564 PolarHBondContact O-N 3.04Å; L561-V565 WeakPolarHBondContact O-CG2 3.39Å; L561-V565 PolarHBondContact O-N 3.08Å
562	L	87.9	Confident	84.9	Confident	25 Å²	25	60.3 Å²	60.3	13%	0.131	35%	0.352	C	S	.	.	H	α-helix	trans	-65.7	-38.4	178.4	-71.3	169.6	0	0	0	112.5	M522 I549 F550 P553 T558 R559 A564 V565	M522-L562 HydrophobicContact CB-CD2 4.35Å; M522-L562 HydrophobicContact CG-CD2 4.24Å; M522-L562 HydrophobicContact SD-CD2 4.31Å; I549-L562 VanDerWaalsContact O-CD1 3.29Å; I549-L562 WeakPolarHBondContact O-CD1 3.41Å; F550-L562 HydrophobicContact CD1-CD2 3.71Å; F550-L562 HydrophobicContact CD2-CD2 4.39Å; F550-L562 HydrophobicContact CE1-CD2 3.62Å; F550-L562 HydrophobicContact CE2-CD2 4.34Å; F550-L562 HydrophobicContact CG-CD2 4.1Å; F550-L562 HydrophobicContact CZ-CD2 3.94Å; P553-L562 HydrophobicContact CB-CD1 3.87Å; P553-L562 HydrophobicContact CG-CD1 3.8Å; T558-L562 HydrophobicContact CG2-CD1 4.18Å; T558-L562 WeakPolarHBondContact O-CG 3.47Å; T558-L562 PolarHBondContact O-N 3.21Å; R559-L562 PolarHBondContact O-N 3.16Å; L562-A564 PolarHBondContact O-N 3.39Å; L562-V565 WeakPolarHBondContact O-CB 3.27Å; L562-V565 WeakPolarHBondContact O-CG2 3.1Å; L562-V565 PolarHBondContact O-N 3.18Å
563	A	83.2	Confident	84.5	Confident	84 Å²	84	59.6 Å²	59.6	69%	0.694	35%	0.349	S	S	*	.	H	α-helix	trans	-67.1	-26.6	176.2	0	0	0	0	0	112.9	R559 A560 V565	R559-A563 VanDerWaalsContact O-CB 3.28Å; R559-A563 WeakPolarHBondContact O-CB 3.25Å; R559-A563 PolarHBondContact O-N 3.36Å; A560-A563 PolarHBondContact O-N 2.82Å; A563-V565 VanDerWaalsContact C-N 3.33Å
564	A	76.4	Confident	84.1	Confident	35 Å²	35	63.9 Å²	63.9	29%	0.289	37%	0.368	S	S	.	.	H	α-helix	trans	-79	-15.6	177.8	0	0	0	0	0	113.3	A560 L561 L562 P566 V773	A560-A564 WeakPolarHBondContact O-CB 3.23Å; A560-A564 PolarHBondContact O-N 2.96Å; L561-A564 PolarHBondContact O-N 3.04Å; L562-A564 PolarHBondContact O-N 3.39Å; A564-P566 WeakPolarHBondContact O-CD 3.33Å; A564-V773 VanDerWaalsContact C-CG1 3.42Å; A564-V773 HydrophobicContact CB-CG1 3.87Å; A564-V773 WeakPolarHBondContact O-CG1 3.29Å
565	V	76.3	Confident	83.3	Confident	10 Å²	10	62.7 Å²	62.7	6%	0.061	37%	0.369	C	S	.	.	S	Bend	trans	-62.7	121.8	-177	-172.5	0	0	0	0	110.4	M522 L561 L562 A563 Q567 A847	M522-V565 HydrophobicContact CB-CG2 3.47Å; M522-V565 VanDerWaalsContact CB-CG2 3.47Å; M522-V565 HydrophobicContact CG-CG2 4Å; L561-V565 WeakPolarHBondContact O-CG2 3.39Å; L561-V565 PolarHBondContact O-N 3.08Å; L562-V565 WeakPolarHBondContact O-CB 3.27Å; L562-V565 WeakPolarHBondContact O-CG2 3.1Å; L562-V565 PolarHBondContact O-N 3.18Å; A563-V565 VanDerWaalsContact C-N 3.33Å; V565-Q567 PolarHBondContact O-N 3.1Å; V565-Q567 VanDerWaalsContact O-N 3.09Å; V565-A847 HydrophobicContact CG1-CB 3.85Å
566	P	68	Low	82.5	Confident	42 Å²	42	60.6 Å²	60.6	27%	0.273	36%	0.364	S	S	.	.			trans	-61	115.9	174.4	-23.2	34.7	0	0	0	109.9	A564 A802	A564-P566 WeakPolarHBondContact O-CD 3.33Å; P566-A802 HydrophobicContact CB-CB 3.41Å; P566-A802 VanDerWaalsContact CB-CB 3.41Å
567	Q	72.8	Confident	82	Confident	123 Å²	123	56.9 Å²	56.9	58%	0.575	34%	0.34	S	S	*	.			trans	-97.5	110.5	176.2	-65.1	-177.8	28.6	0	0	109	V565 G569 A570	V565-Q567 PolarHBondContact O-N 3.1Å; V565-Q567 VanDerWaalsContact O-N 3.09Å; Q567-G569 PolarHBondContact O-N 2.98Å; Q567-A570 HydrophobicContact CB-CB 4.22Å; Q567-A570 WeakPolarHBondContact O-CB 3.49Å; Q567-A570 PolarHBondContact O-N 2.84Å
568	L	77.3	Confident	81.4	Confident	62 Å²	62	59.4 Å²	59.4	33%	0.325	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	125.7	170.6	-171.9	74.3	0	0	0	109.3	M801 E805 F829 L841 V844	L568-M801 HydrophobicContact CD1-CB 4.19Å; L568-E805 WeakPolarHBondContact CA-OE2 3.4Å; L568-F829 HydrophobicContact CD1-CD1 3.78Å; L568-F829 HydrophobicContact CD1-CE1 3.57Å; L568-L841 HydrophobicContact CD1-CD2 4.23Å; L568-L841 HydrophobicContact CD2-CD2 4.31Å; L568-V844 HydrophobicContact CB-CG1 4.28Å; L568-V844 HydrophobicContact CD2-CB 4.11Å; L568-V844 HydrophobicContact CD2-CG1 4.33Å; L568-V844 HydrophobicContact CD2-CG2 4.25Å
569	G	80.8	Confident	80.4	Confident	37 Å²	37	61 Å²	61	38%	0.381	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	1.3	-174.6	0	0	0	0	0	114.5	Q567 M571 K572 E805	Q567-G569 PolarHBondContact O-N 2.98Å; G569-M571 PolarHBondContact O-N 3.06Å; G569-K572 WeakPolarHBondContact O-CB 3.37Å; G569-K572 PolarHBondContact O-N 3.11Å; G569-K572 VanDerWaalsContact O-N 3.09Å; G569-E805 VanDerWaalsContact CA-OE1 3.29Å; G569-E805 WeakPolarHBondContact CA-OE1 3.43Å; G569-E805 PolarHBondContact N-OE1 3.32Å; G569-E805 PolarHBondContact N-OE2 3.22Å
570	A	80.6	Confident	79	Confident	74 Å²	74	64.5 Å²	64.5	61%	0.612	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.5	172.5	0	0	0	0	0	112.8	Q567	Q567-A570 HydrophobicContact CB-CB 4.22Å; Q567-A570 WeakPolarHBondContact O-CB 3.49Å; Q567-A570 PolarHBondContact O-N 2.84Å
571	M	82.8	Confident	77.9	Confident	23 Å²	23	67.7 Å²	67.7	11%	0.113	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	19.1	178.2	-61	-72.4	-63.4	0	0	112.3	G569 G573 E574 G576 P578 E805 R825	G569-M571 PolarHBondContact O-N 3.06Å; M571-G573 PolarHBondContact O-N 3.04Å; M571-E574 HydrophobicContact CB-CB 4.39Å; M571-E574 HydrophobicContact CE-CB 3.87Å; M571-E574 HydrophobicContact CE-CG 4.16Å; M571-E574 WeakPolarHBondContact O-CB 3.46Å; M571-E574 PolarHBondContact O-N 3.15Å; M571-G576 WeakPolarHBondContact CE-O 3.18Å; M571-P578 HydrophobicContact CE-CB 4.39Å; M571-P578 HydrophobicContact CE-CG 4.5Å; M571-E805 HydrophobicContact CB-CG 3.96Å; M571-E805 HydrophobicContact CG-CG 4.22Å; M571-E805 PolarHBondContact N-OE1 3.14Å; M571-R825 PolarHBondContact O-NH1 3.34Å
572	K	84.3	Confident	77.6	Confident	167 Å²	167	74.1 Å²	74.1	73%	0.726	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	125.2	-179.6	-174.2	178.9	-176.3	-179.4	0	110.5	G569 E574	G569-K572 WeakPolarHBondContact O-CB 3.37Å; G569-K572 PolarHBondContact O-N 3.11Å; G569-K572 VanDerWaalsContact O-N 3.09Å; K572-E574 VanDerWaalsContact C-N 3.32Å
573	G	85	Confident	77.3	Confident	36 Å²	36	73.8 Å²	73.8	37%	0.371	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	-24.9	-176.1	0	0	0	0	0	113.9	M571 R826 E830	M571-G573 PolarHBondContact O-N 3.04Å; G573-R826 PolarHBondContact O-NH1 3.2Å; G573-R826 VanDerWaalsContact O-NH1 3.07Å; G573-E830 PolarHBondContact N-OE1 3.13Å
574	E	84.4	Confident	77.5	Confident	114 Å²	114	71.1 Å²	71.1	53%	0.533	40%	0.395	S	S	.	.			trans	-72.2	145.7	179.3	-62.5	-63.2	162.6	0	0	111.3	M571 K572 R825	M571-E574 HydrophobicContact CB-CB 4.39Å; M571-E574 HydrophobicContact CE-CB 3.87Å; M571-E574 HydrophobicContact CE-CG 4.16Å; M571-E574 WeakPolarHBondContact O-CB 3.46Å; M571-E574 PolarHBondContact O-N 3.15Å; K572-E574 VanDerWaalsContact C-N 3.32Å; E574-R825 VanDerWaalsContact C-NH2 3.26Å; E574-R825 VanDerWaalsContact O-CZ 3.28Å; E574-R825 PolarHBondContact O-NH1 3.39Å; E574-R825 VanDerWaalsContact O-NH1 3.12Å; E574-R825 PolarHBondContact O-NH2 3.49Å
575	T	78.9	Confident	77.9	Confident	107 Å²	107	73.7 Å²	73.7	66%	0.656	41%	0.407	S	S	*	.			trans	-94.2	-23.4	-176.7	51.1	0	0	0	0	114.6
576	G	77.1	Confident	78	Confident	15 Å²	15	79.3 Å²	79.3	16%	0.155	44%	0.437	C	S	.	.	S	Bend	trans	-143.5	-172.4	-175.8	0	0	0	0	0	112.2	M571 R825	M571-G576 WeakPolarHBondContact CE-O 3.18Å; G576-R825 PolarHBondContact O-NH2 3.3Å
577	P	80.4	Confident	78.9	Confident	14 Å²	14	80 Å²	80	9%	0.091	45%	0.451	C	S	.	.	S	Bend	trans	-64.4	159.9	170.4	28	-33.4	0	0	0	111.2	I579 L784 R806 H809	P577-I579 HydrophobicContact CG-CD1 4.39Å; P577-I579 PolarHBondContact O-N 3.12Å; P577-L784 HydrophobicContact CB-CD2 3.77Å; P577-L784 HydrophobicContact CG-CD2 4.35Å; P577-R806 WeakPolarHBondContact CA-O 3.46Å; P577-R806 WeakPolarHBondContact CB-O 3.37Å; P577-H809 WeakPolarHBondContact CD-NE2 3.47Å; P577-H809 VanDerWaalsContact CG-CE1 3.41Å; P577-H809 WeakPolarHBondContact CG-CE1 3.43Å
578	P	78.5	Confident	79.7	Confident	76 Å²	76	80.8 Å²	80.8	49%	0.494	46%	0.455	S	S	.	.	S	Bend	trans	-77.3	64.8	-176	33.9	-36.2	0	0	0	111.8	M571 L784 R806	M571-P578 HydrophobicContact CE-CB 4.39Å; M571-P578 HydrophobicContact CE-CG 4.5Å; P578-L784 HydrophobicContact CG-CD1 4.33Å; P578-R806 WeakPolarHBondContact CD-O 3.33Å; P578-R806 HydrophobicContact CG-CG 4.39Å
579	I	70.4	Confident	80.5	Confident	33 Å²	33	78.5 Å²	78.5	17%	0.169	44%	0.444	C	S	.	.			trans	-121	131.4	174.1	-53.3	173	0	0	0	107.9	P577 Q581 T583 L784	P577-I579 HydrophobicContact CG-CD1 4.39Å; P577-I579 PolarHBondContact O-N 3.12Å; I579-Q581 HydrophobicContact CG2-CB 4.5Å; I579-Q581 PolarHBondContact O-N 3.24Å; I579-T583 HydrophobicContact CD1-CG2 4.16Å; I579-T583 HydrophobicContact CG2-CG2 4.47Å; I579-L784 HydrophobicContact CD1-CB 3.93Å; I579-L784 HydrophobicContact CD1-CD2 3.7Å; I579-L784 HydrophobicContact CD1-CG 4.33Å; I579-L784 HydrophobicContact CG1-CB 4.22Å; I579-L784 HydrophobicContact CG1-CD2 4.18Å
580	E	62.7	Low	81.2	Confident	204 Å²	204	77 Å²	77	95%	0.953	43%	0.427	S	S	*	.	S	Bend	trans	-64.4	-23.2	-179.7	-65.6	-176.3	164.9	0	0	113.7
581	Q	63.5	Low	81.9	Confident	127 Å²	127	73.5 Å²	73.5	59%	0.593	40%	0.398	S	S	*	.	S	Bend	trans	-105.8	133.9	-176.5	-66.1	179.3	3.6	0	0	111.2	I579 T583	I579-Q581 HydrophobicContact CG2-CB 4.5Å; I579-Q581 PolarHBondContact O-N 3.24Å; Q581-T583 PolarHBondContact O-N 2.91Å
582	K	78.9	Confident	82.5	Confident	148 Å²	148	75.8 Å²	75.8	64%	0.643	41%	0.406	S	S	*	.			trans	-66.1	105	169.4	-172.8	-173.3	175.2	-164.5	0	108.4	V584 D586	K582-V584 WeakPolarHBondContact CE-O 3.22Å; K582-D586 IonicContact NZ-OD1 3.43Å; K582-D586 PolarHBondContact NZ-OD1 3.04Å; K582-D586 IonicContact NZ-OD2 3.56Å; K582-D586 PolarHBondContact NZ-OD2 2.93Å; K582-D586 VanDerWaalsContact NZ-OD2 3.1Å
583	T	81.9	Confident	83	Confident	18 Å²	18	67.8 Å²	67.8	11%	0.11	37%	0.371	C	S	.	.			trans	-79.7	-28.5	179	55.9	0	0	0	0	112.5	I579 Q581 V585 G627 Q787 R788 H809	I579-T583 HydrophobicContact CD1-CG2 4.16Å; I579-T583 HydrophobicContact CG2-CG2 4.47Å; Q581-T583 PolarHBondContact O-N 2.91Å; T583-V585 PolarHBondContact O-N 2.78Å; T583-G627 WeakPolarHBondContact CB-O 3.44Å; T583-G627 PolarHBondContact OG1-O 2.89Å; T583-Q787 HydrophobicContact CG2-CG 4.16Å; T583-R788 HydrophobicContact CG2-CB 4.44Å; T583-H809 PolarHBondContact OG1-NE2 3.31Å
584	V	87.4	Confident	83.5	Confident	29 Å²	29	69.6 Å²	69.6	18%	0.176	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-71.6	120.6	-178.4	-172.6	0	0	0	0	110.6	K582 W625 P626 E628	K582-V584 WeakPolarHBondContact CE-O 3.22Å; V584-W625 HydrophobicContact CG1-CB 3.97Å; V584-P626 WeakPolarHBondContact CA-O 3.13Å; V584-E628 HydrophobicContact CG1-CB 4.3Å; V584-E628 HydrophobicContact CG2-CB 3.91Å; V584-E628 HydrophobicContact CG2-CG 4.06Å
585	V	82.9	Confident	84	Confident	89 Å²	89	68.6 Å²	68.6	54%	0.539	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-92.3	128	177.3	-174	0	0	0	0	109.7	T583 P626	T583-V585 PolarHBondContact O-N 2.78Å; V585-P626 HydrophobicContact CB-CB 4.32Å; V585-P626 PolarHBondContact N-O 2.83Å; V585-P626 VanDerWaalsContact N-O 3.14Å
586	D	80.4	Confident	84.7	Confident	128 Å²	128	63.5 Å²	63.5	68%	0.684	33%	0.333	S	S	*	.	S	Bend	trans	-69.1	138	176.4	-56.4	-40.3	0	0	0	109.8	K582	K582-D586 IonicContact NZ-OD1 3.43Å; K582-D586 PolarHBondContact NZ-OD1 3.04Å; K582-D586 IonicContact NZ-OD2 3.56Å; K582-D586 PolarHBondContact NZ-OD2 2.93Å; K582-D586 VanDerWaalsContact NZ-OD2 3.1Å
587	G	85	Confident	85.5	Confident	56 Å²	56	63.5 Å²	63.5	58%	0.577	33%	0.33	S	S	*	.	S	Bend	trans	151.9	-153.7	-177.3	0	0	0	0	0	113.4
588	E	90.9	Very high	86.1	Confident	139 Å²	139	62.8 Å²	62.8	65%	0.65	33%	0.326	S	S	*	.	S	Bend	trans	-76	146.1	173.5	-70.3	-65.4	139.4	0	0	111.1	R592	E588-R592 IonicContact OE2-CZ 3.02Å; E588-R592 IonicContact OE2-NH1 3.87Å; E588-R592 IonicContact OE2-NH2 3.34Å; E588-R592 PolarHBondContact OE2-NH2 3.43Å
589	P	94.2	Very high	86.7	Confident	14 Å²	14	61.1 Å²	61.1	9%	0.091	31%	0.31	C	S	.	.			trans	-63.2	140	175.8	27.3	-34	0	0	0	111.2	L591 R592 D623 L624	P589-L591 VanDerWaalsContact C-N 3.26Å; P589-L591 PolarHBondContact O-N 3.42Å; P589-R592 VanDerWaalsContact CD-NH2 3.26Å; P589-R592 HydrophobicContact CG-CB 4.09Å; P589-R592 VanDerWaalsContact CG-NH2 3.31Å; P589-D623 HydrophobicContact CB-CB 4.01Å; P589-D623 HydrophobicContact CG-CB 4.39Å; P589-L624 CarbonylContact C-O 3.51Å; P589-L624 VanDerWaalsContact CA-O 3.31Å; P589-L624 WeakPolarHBondContact CA-O 3.44Å; P589-L624 VanDerWaalsContact CB-O 3.27Å; P589-L624 WeakPolarHBondContact CB-O 3.45Å
590	V	94.4	Very high	87.6	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.03	32%	0.318	C	S	.	.	S	Bend	trans	-68	-32.4	174.1	65.7	0	0	0	0	110.8	L624 P626 F660 N661 K760 V761 A793	V590-L624 HydrophobicContact CG1-CD2 4.18Å; V590-L624 HydrophobicContact CG1-CG 4.11Å; V590-L624 WeakPolarHBondContact CG1-O 3.42Å; V590-L624 PolarHBondContact N-O 3.43Å; V590-P626 HydrophobicContact CB-CG 4.23Å; V590-F660 HydrophobicContact CG2-CD2 4.38Å; V590-F660 HydrophobicContact CG2-CE2 3.74Å; V590-F660 HydrophobicContact CG2-CZ 4.37Å; V590-F660 WeakPolarHBondContact O-CA 3.41Å; V590-F660 WeakPolarHBondContact O-CD2 3.39Å; V590-N661 PolarHBondContact O-N 3.02Å; V590-K760 HydrophobicContact CG2-CB 4.3Å; V590-V761 HydrophobicContact CB-CG2 4.45Å; V590-V761 HydrophobicContact CG1-CG2 3.72Å; V590-V761 HydrophobicContact CG2-CG2 3.82Å; V590-A793 HydrophobicContact CG1-CB 3.76Å
591	L	95	Very high	88.7	Confident	1 Å²	1	57 Å²	57	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	126	176.1	179.2	71.8	0	0	0	109.9	P589 V593 L624 L647 I658 I659 F660	P589-L591 VanDerWaalsContact C-N 3.26Å; P589-L591 PolarHBondContact O-N 3.42Å; L591-V593 HydrophobicContact CD2-CG2 4.35Å; L591-V593 HydrophobicContact CG-CG2 4.14Å; L591-L624 HydrophobicContact CB-CB 4.18Å; L591-L624 HydrophobicContact CB-CD2 4.34Å; L591-L624 HydrophobicContact CD2-CD2 4.44Å; L591-L624 PolarHBondContact N-O 3.21Å; L591-L624 PolarHBondContact O-N 3.45Å; L591-L647 HydrophobicContact CD2-CD1 4.1Å; L591-L647 HydrophobicContact CD2-CD2 4.32Å; L591-I658 HydrophobicContact CD1-CG2 3.77Å; L591-I659 CarbonylContact C-O 3.45Å; L591-I659 WeakPolarHBondContact CA-O 3.48Å; L591-F660 HydrophobicContact CD1-CB 4.37Å; L591-F660 HydrophobicContact CD1-CD2 4.38Å
592	R	96.3	Very high	89.5	Confident	71 Å²	71	54 Å²	54	27%	0.268	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.1	178.4	167.7	176.7	-58	153.3	7.4	108.9	E588 P589 R594 D623 I659	E588-R592 IonicContact OE2-CZ 3.02Å; E588-R592 IonicContact OE2-NH1 3.87Å; E588-R592 IonicContact OE2-NH2 3.34Å; E588-R592 PolarHBondContact OE2-NH2 3.43Å; P589-R592 VanDerWaalsContact CD-NH2 3.26Å; P589-R592 HydrophobicContact CG-CB 4.09Å; P589-R592 VanDerWaalsContact CG-NH2 3.31Å; R592-R594 HydrophobicContact CG-CG 4.29Å; R592-D623 WeakPolarHBondContact CB-OD1 3.24Å; R592-D623 VanDerWaalsContact CG-OD1 3.28Å; R592-D623 WeakPolarHBondContact CG-OD1 3.36Å; R592-D623 IonicContact NE-OD1 3.58Å; R592-I659 HydrophobicContact CB-CB 4.13Å; R592-I659 HydrophobicContact CG-CD1 4.39Å; R592-I659 PolarHBondContact N-O 3.15Å; R592-I659 PolarHBondContact O-N 3.06Å
593	V	95.8	Very high	89.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.1	-178.5	-174.1	0	0	0	0	108.5	L591 L596 S621 F622 L647	L591-V593 HydrophobicContact CD2-CG2 4.35Å; L591-V593 HydrophobicContact CG-CG2 4.14Å; V593-L596 HydrophobicContact CG1-CB 3.77Å; V593-L596 HydrophobicContact CG1-CD2 4.18Å; V593-S621 VanDerWaalsContact O-CA 3.27Å; V593-S621 WeakPolarHBondContact O-CA 3.31Å; V593-F622 HydrophobicContact CB-CD1 4.28Å; V593-F622 HydrophobicContact CB-CE1 4.12Å; V593-F622 HydrophobicContact CB-CE2 4.41Å; V593-F622 HydrophobicContact CB-CG 4.5Å; V593-F622 HydrophobicContact CB-CZ 4.2Å; V593-F622 HydrophobicContact CG1-CE1 4.31Å; V593-F622 HydrophobicContact CG2-CD2 4.29Å; V593-F622 HydrophobicContact CG2-CE1 4.06Å; V593-F622 HydrophobicContact CG2-CE2 3.76Å; V593-F622 HydrophobicContact CG2-CZ 3.64Å; V593-F622 PolarHBondContact N-O 2.8Å; V593-F622 PolarHBondContact O-N 2.76Å; V593-F622 VanDerWaalsContact O-O 3.12Å; V593-L647 HydrophobicContact CB-CD2 4.48Å; V593-L647 HydrophobicContact CG1-CD2 4.24Å; V593-L647 HydrophobicContact CG2-CD2 3.39Å
594	R	95.2	Very high	88.8	Confident	73 Å²	73	56.7 Å²	56.7	28%	0.275	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	124.9	-179.8	-62.8	-63.8	-179.9	-96.5	3.2	110.4	R592 L596 F622 D623 G656 E657	R592-R594 HydrophobicContact CG-CG 4.29Å; R594-L596 PolarHBondContact O-N 3.26Å; R594-L596 VanDerWaalsContact O-N 3.17Å; R594-F622 PolarHBondContact NH1-O 3.3Å; R594-D623 IonicContact CZ-OD1 3.7Å; R594-D623 IonicContact CZ-OD2 3.7Å; R594-D623 IonicContact NH1-OD1 3.32Å; R594-D623 PolarHBondContact NH1-OD1 3.49Å; R594-D623 IonicContact NH1-OD2 3.6Å; R594-D623 IonicContact NH2-OD1 2.92Å; R594-D623 PolarHBondContact NH2-OD1 3.26Å; R594-D623 IonicContact NH2-OD2 3.74Å; R594-D623 PolarHBondContact NH2-OD2 3.24Å; R594-G656 CarbonylContact O-C 3.56Å; R594-G656 WeakPolarHBondContact O-CA 3.47Å; R594-E657 HydrophobicContact CB-CB 4.43Å; R594-E657 PolarHBondContact N-O 2.89Å; R594-E657 PolarHBondContact O-N 3.01Å
595	N	93.8	Very high	87.7	Confident	93 Å²	93	58.4 Å²	58.4	50%	0.497	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50	38.9	173.4	-57.5	-44.4	0	0	0	114.5	V597 V620 S621 G655 G656	N595-V597 PolarHBondContact O-N 3.39Å; N595-V620 PolarHBondContact N-O 2.91Å; N595-S621 PolarHBondContact N-OG 3.14Å; N595-G655 CarbonylContact O-C 3.15Å; N595-G656 WeakPolarHBondContact O-CA 3.25Å; N595-G656 PolarHBondContact O-N 2.88Å
596	L	94.1	Very high	86.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	129.1	-179	-179	65.6	0	0	0	110.7	V593 R594 V617 K619 V620 T643 A646 I658	V593-L596 HydrophobicContact CG1-CB 3.77Å; V593-L596 HydrophobicContact CG1-CD2 4.18Å; R594-L596 PolarHBondContact O-N 3.26Å; R594-L596 VanDerWaalsContact O-N 3.17Å; L596-V617 HydrophobicContact CB-CG1 4.39Å; L596-V617 HydrophobicContact CD2-CG1 4.16Å; L596-V617 HydrophobicContact CG-CG1 4.1Å; L596-K619 WeakPolarHBondContact O-CA 3.41Å; L596-K619 PolarHBondContact O-N 3.31Å; L596-V620 HydrophobicContact CB-CB 4.37Å; L596-V620 PolarHBondContact N-O 3.29Å; L596-V620 PolarHBondContact O-N 3.42Å; L596-V620 VanDerWaalsContact O-N 3.12Å; L596-T643 HydrophobicContact CD2-CG2 4.12Å; L596-A646 HydrophobicContact CD1-CB 4.38Å; L596-A646 HydrophobicContact CD2-CB 4.1Å; L596-I658 HydrophobicContact CD1-CD1 4.08Å; L596-I658 HydrophobicContact CD1-CG1 4.34Å
597	V	94.5	Very high	86.8	Confident	15 Å²	15	63.1 Å²	63.1	9%	0.091	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131	176	177.6	0	0	0	0	109.8	N595 R599 V617 K619 S653 Q654 G655	N595-V597 PolarHBondContact O-N 3.39Å; V597-R599 HydrophobicContact CG1-CG 4.09Å; V597-V617 CarbonylContact C-O 3.58Å; V597-V617 VanDerWaalsContact CA-O 3.31Å; V597-V617 WeakPolarHBondContact CA-O 3.23Å; V597-K619 HydrophobicContact CG2-CG 4.2Å; V597-S653 CarbonylContact O-C 3.55Å; V597-S653 VanDerWaalsContact O-CA 3.24Å; V597-S653 WeakPolarHBondContact O-CA 3.37Å; V597-S653 VanDerWaalsContact O-CB 3.3Å; V597-S653 WeakPolarHBondContact O-CB 3.21Å; V597-Q654 HydrophobicContact CG1-CB 4.38Å; V597-Q654 PolarHBondContact O-N 3.15Å; V597-Q654 PolarHBondContact O-OE1 3.2Å; V597-G655 PolarHBondContact N-O 3.14Å
598	T	92.5	Very high	86.2	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	115.2	176.3	-53.1	0	0	0	0	110.4	F600 A616 V617 T642 V651	T598-F600 HydrophobicContact CG2-CE2 4.18Å; T598-F600 HydrophobicContact CG2-CZ 4.17Å; T598-A616 PolarHBondContact O-N 3.35Å; T598-V617 PolarHBondContact N-O 3.08Å; T598-V617 PolarHBondContact O-N 2.83Å; T598-T642 HydrophobicContact CG2-CG2 3.52Å; T598-V651 HydrophobicContact CG2-CG1 3.47Å; T598-V651 VanDerWaalsContact CG2-CG1 3.47Å
599	R	91.9	Very high	85.6	Confident	40 Å²	40	66.5 Å²	66.5	15%	0.151	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.8	-177.4	-59.6	-179.7	-176.8	171.7	2.7	111.1	V597 V614 H615 E618 Q654	V597-R599 HydrophobicContact CG1-CG 4.09Å; R599-V614 CarbonylContact C-O 3.55Å; R599-V614 VanDerWaalsContact CA-O 3.23Å; R599-V614 WeakPolarHBondContact CA-O 3.2Å; R599-H615 PolarHBondContact NE-CE1 2.99Å; R599-E618 IonicContact CZ-OE1 3.86Å; R599-E618 IonicContact CZ-OE2 3.22Å; R599-E618 IonicContact NE-OE1 2.76Å; R599-E618 PolarHBondContact NE-OE1 3.33Å; R599-E618 IonicContact NE-OE2 3.41Å; R599-E618 IonicContact NH2-OE1 2.58Å; R599-E618 PolarHBondContact NH2-OE1 3.29Å; R599-E618 IonicContact NH2-OE2 3.22Å; R599-E618 PolarHBondContact NH2-OE2 2.95Å; R599-Q654 PolarHBondContact O-NE2 3.3Å; R599-Q654 VanDerWaalsContact O-NE2 3.12Å
600	F	88.3	Confident	84.9	Confident	76 Å²	76	67.6 Å²	67.6	33%	0.333	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.8	176.3	-61.9	-83.2	0	0	0	111.5	T598 L602 E613 V614 A616 T642 V651	T598-F600 HydrophobicContact CG2-CE2 4.18Å; T598-F600 HydrophobicContact CG2-CZ 4.17Å; F600-L602 PolarHBondContact O-N 2.89Å; F600-E613 CarbonylContact O-C 3.59Å; F600-E613 WeakPolarHBondContact O-CA 3.5Å; F600-V614 HydrophobicContact CB-CB 4.29Å; F600-V614 PolarHBondContact N-O 3.43Å; F600-V614 PolarHBondContact O-N 3.33Å; F600-A616 HydrophobicContact CD2-CB 3.82Å; F600-A616 HydrophobicContact CE2-CB 3.63Å; F600-T642 HydrophobicContact CE2-CG2 3.67Å; F600-T642 HydrophobicContact CZ-CG2 3.88Å; F600-V651 HydrophobicContact CE1-CG1 3.6Å; F600-V651 HydrophobicContact CE1-CG2 4.36Å; F600-V651 HydrophobicContact CZ-CB 4.49Å; F600-V651 HydrophobicContact CZ-CG1 3.55Å; F600-V651 HydrophobicContact CZ-CG2 4.18Å
601	P	86.9	Confident	84.2	Confident	74 Å²	74	70.1 Å²	70.1	48%	0.481	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	130.2	-179.6	28.6	-33.8	0	0	0	111.5	V610	P601-V610 HydrophobicContact CB-CB 4.33Å; P601-V610 HydrophobicContact CB-CG1 3.51Å; P601-V610 HydrophobicContact CB-CG2 3.78Å
602	L	80	Confident	83.7	Confident	65 Å²	65	76.3 Å²	76.3	34%	0.34	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	117.6	168.5	-64.3	176.1	0	0	0	109.4	F600 T611 R612 V614 I867	F600-L602 PolarHBondContact O-N 2.89Å; L602-T611 PolarHBondContact O-N 2.75Å; L602-T611 VanDerWaalsContact O-N 3.14Å; L602-R612 WeakPolarHBondContact CA-O 3.19Å; L602-R612 HydrophobicContact CB-CB 4.09Å; L602-R612 WeakPolarHBondContact CB-O 3.26Å; L602-R612 HydrophobicContact CD1-CB 4.17Å; L602-R612 PolarHBondContact N-O 2.98Å; L602-R612 PolarHBondContact O-N 3.43Å; L602-V614 HydrophobicContact CD1-CG2 3.72Å; L602-V614 HydrophobicContact CD2-CG2 3.84Å; L602-V614 HydrophobicContact CG-CG2 3.76Å; L602-I867 HydrophobicContact CD1-CB 4.49Å; L602-I867 HydrophobicContact CD1-CD1 4Å; L602-I867 HydrophobicContact CD1-CG1 4.14Å; L602-I867 HydrophobicContact CD1-CG2 3.57Å
603	R	76.6	Confident	83.3	Confident	162 Å²	162	74.5 Å²	74.5	61%	0.611	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	138.1	176.8	-62.6	-179.3	-178.6	-174.1	2.6	110.6	N608 R609 V610	R603-N608 WeakPolarHBondContact CB-OD1 3.27Å; R603-N608 WeakPolarHBondContact CD-O 3.46Å; R603-N608 WeakPolarHBondContact CD-OD1 2.98Å; R603-R609 CarbonylContact C-O 3.58Å; R603-R609 VanDerWaalsContact CA-O 3.27Å; R603-R609 WeakPolarHBondContact CA-O 3.44Å; R603-V610 HydrophobicContact CG-CG2 3.82Å
604	S	68	Low	82.8	Confident	61 Å²	61	75.9 Å²	75.9	43%	0.427	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	167.2	175.6	78.1	0	0	0	0	112.4	R609 T611	S604-R609 PolarHBondContact N-O 3.15Å; S604-R609 PolarHBondContact O-N 3.14Å; S604-T611 PolarHBondContact OG-OG1 3.4Å
605	G	65.2	Low	82.6	Confident	65 Å²	65	72.4 Å²	72.4	67%	0.67	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	171	177.1	0	0	0	0	0	115	L607 N608	G605-L607 PolarHBondContact O-N 3.28Å; G605-L607 VanDerWaalsContact O-N 3.15Å; G605-N608 PolarHBondContact O-N 2.97Å
606	L	65.5	Low	82.4	Confident	190 Å²	190	68.2 Å²	68.2	100%	0.995	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.6	-178.1	-85.7	132.8	0	0	0	114.3
607	L	78.1	Confident	82.4	Confident	125 Å²	125	68.2 Å²	68.2	65%	0.654	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	6.3	179.9	-62.9	176.2	0	0	0	113.5	G605 R609	G605-L607 PolarHBondContact O-N 3.28Å; G605-L607 VanDerWaalsContact O-N 3.15Å; L607-R609 HydrophobicContact CB-CG 3.97Å; L607-R609 PolarHBondContact O-N 2.92Å
608	N	72.9	Confident	82.3	Confident	96 Å²	96	67.6 Å²	67.6	51%	0.513	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	40.6	-179.5	-159.6	19.2	0	0	0	113.6	R603 G605	R603-N608 WeakPolarHBondContact CB-OD1 3.27Å; R603-N608 WeakPolarHBondContact CD-O 3.46Å; R603-N608 WeakPolarHBondContact CD-OD1 2.98Å; G605-N608 PolarHBondContact O-N 2.97Å
609	R	78.1	Confident	82.3	Confident	170 Å²	170	70.6 Å²	70.6	64%	0.642	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	146.8	-176.6	-72.1	-178.3	175.4	174.9	-1.2	110.8	R603 S604 L607 T611	R603-R609 CarbonylContact C-O 3.58Å; R603-R609 VanDerWaalsContact CA-O 3.27Å; R603-R609 WeakPolarHBondContact CA-O 3.44Å; S604-R609 PolarHBondContact N-O 3.15Å; S604-R609 PolarHBondContact O-N 3.14Å; L607-R609 HydrophobicContact CB-CG 3.97Å; L607-R609 PolarHBondContact O-N 2.92Å; R609-T611 PolarHBondContact O-N 3.05Å
610	V	80.2	Confident	82.4	Confident	37 Å²	37	68.8 Å²	68.8	22%	0.224	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	110	171.6	-175.2	0	0	0	0	108.8	P601 R603 E613	P601-V610 HydrophobicContact CB-CB 4.33Å; P601-V610 HydrophobicContact CB-CG1 3.51Å; P601-V610 HydrophobicContact CB-CG2 3.78Å; R603-V610 HydrophobicContact CG-CG2 3.82Å; V610-E613 HydrophobicContact CG1-CG 4.44Å
611	T	80.1	Confident	82.8	Confident	59 Å²	59	67.1 Å²	67.1	36%	0.362	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-26	-178.9	52	0	0	0	0	112.7	L602 S604 R609 R870	L602-T611 PolarHBondContact O-N 2.75Å; L602-T611 VanDerWaalsContact O-N 3.14Å; S604-T611 PolarHBondContact OG-OG1 3.4Å; R609-T611 PolarHBondContact O-N 3.05Å; T611-R870 PolarHBondContact O-N 2.84Å
612	R	84.4	Confident	83.2	Confident	131 Å²	131	63.9 Å²	63.9	49%	0.494	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	162.8	-177.9	-66.7	-171.6	-178.8	-158.8	0.2	110	L602 I867 H868 L869	L602-R612 WeakPolarHBondContact CA-O 3.19Å; L602-R612 HydrophobicContact CB-CB 4.09Å; L602-R612 WeakPolarHBondContact CB-O 3.26Å; L602-R612 HydrophobicContact CD1-CB 4.17Å; L602-R612 PolarHBondContact N-O 2.98Å; L602-R612 PolarHBondContact O-N 3.43Å; R612-I867 HydrophobicContact CB-CG2 3.93Å; R612-I867 HydrophobicContact CG-CG2 4.42Å; R612-H868 CarbonylContact C-O 3.55Å; R612-H868 VanDerWaalsContact CA-O 3.26Å; R612-H868 WeakPolarHBondContact CA-O 3.2Å; R612-H868 WeakPolarHBondContact CB-O 3.44Å; R612-L869 HydrophobicContact CG-CD2 4.38Å
613	E	86.7	Confident	84	Confident	33 Å²	33	62.3 Å²	62.3	15%	0.154	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	137.2	177.1	-66.1	179.5	157.2	0	0	109.4	F600 V610 I867 H868 R870	F600-E613 CarbonylContact O-C 3.59Å; F600-E613 WeakPolarHBondContact O-CA 3.5Å; V610-E613 HydrophobicContact CG1-CG 4.44Å; E613-I867 WeakPolarHBondContact O-CA 3.4Å; E613-H868 PolarHBondContact N-O 2.7Å; E613-H868 PolarHBondContact O-N 2.83Å; E613-R870 HydrophobicContact CG-CB 4.35Å; E613-R870 HydrophobicContact CG-CG 4.33Å
614	V	86.5	Confident	84.9	Confident	28 Å²	28	54.6 Å²	54.6	17%	0.17	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	113.8	167.7	-173.4	0	0	0	0	107.5	R599 F600 L602 A616 N866 I867	R599-V614 CarbonylContact C-O 3.55Å; R599-V614 VanDerWaalsContact CA-O 3.23Å; R599-V614 WeakPolarHBondContact CA-O 3.2Å; F600-V614 HydrophobicContact CB-CB 4.29Å; F600-V614 PolarHBondContact N-O 3.43Å; F600-V614 PolarHBondContact O-N 3.33Å; L602-V614 HydrophobicContact CD1-CG2 3.72Å; L602-V614 HydrophobicContact CD2-CG2 3.84Å; L602-V614 HydrophobicContact CG-CG2 3.76Å; V614-A616 VanDerWaalsContact C-N 3.32Å; V614-A616 PolarHBondContact O-N 3.05Å; V614-A616 VanDerWaalsContact O-N 3.09Å; V614-N866 CarbonylContact C-O 3.59Å; V614-N866 WeakPolarHBondContact CA-O 3.48Å; V614-N866 WeakPolarHBondContact CG1-ND2 3.47Å; V614-I867 HydrophobicContact CG2-CG1 4.25Å
615	H	90.8	Very high	86.2	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	79	175.1	-73.3	-142.1	0	0	0	108.8	R599 E618 N866 H868 E872	R599-H615 PolarHBondContact NE-CE1 2.99Å; H615-E618 HydrophobicContact CB-CG 3.81Å; H615-E618 IonicContact CE1-OE1 3.75Å; H615-E618 IonicContact CG-OE1 3.93Å; H615-E618 IonicContact ND1-OE1 2.8Å; H615-E618 PolarHBondContact ND1-OE1 3.1Å; H615-N866 PolarHBondContact N-O 2.81Å; H615-N866 PolarHBondContact O-ND2 2.99Å; H615-H868 AromaticContact CD2-CD2 3.79Å; H615-H868 AromaticContact CG-CD2 3.47Å; H615-H868 VanDerWaalsContact CG-CD2 3.47Å; H615-H868 AromaticContact ND1-CD2 3.72Å; H615-E872 PolarHBondContact CE1-O 3.03Å
616	A	89.2	Confident	87.6	Confident	5 Å²	5	53.4 Å²	53.4	4%	0.041	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	-33.4	-172.7	0	0	0	0	0	112.6	T598 F600 V614 G639 T642 G817	T598-A616 PolarHBondContact O-N 3.35Å; F600-A616 HydrophobicContact CD2-CB 3.82Å; F600-A616 HydrophobicContact CE2-CB 3.63Å; V614-A616 VanDerWaalsContact C-N 3.32Å; V614-A616 PolarHBondContact O-N 3.05Å; V614-A616 VanDerWaalsContact O-N 3.09Å; A616-G639 WeakPolarHBondContact O-CA 3.45Å; A616-T642 HydrophobicContact CB-CG2 3.87Å; A616-G817 WeakPolarHBondContact O-CA 3.38Å
617	V	93.4	Very high	88.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	126.2	176	-173.9	0	0	0	0	108	L596 V597 T598 V620 T642 T643	L596-V617 HydrophobicContact CB-CG1 4.39Å; L596-V617 HydrophobicContact CD2-CG1 4.16Å; L596-V617 HydrophobicContact CG-CG1 4.1Å; V597-V617 CarbonylContact C-O 3.58Å; V597-V617 VanDerWaalsContact CA-O 3.31Å; V597-V617 WeakPolarHBondContact CA-O 3.23Å; T598-V617 PolarHBondContact N-O 3.08Å; T598-V617 PolarHBondContact O-N 2.83Å; V617-V620 HydrophobicContact CG1-CB 3.76Å; V617-V620 HydrophobicContact CG1-CG2 3.49Å; V617-V620 VanDerWaalsContact CG1-CG2 3.49Å; V617-T642 HydrophobicContact CG2-CG2 3.76Å; V617-T643 WeakPolarHBondContact CG2-OG1 3.35Å
618	E	93.6	Very high	89.7	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.009	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	107.5	-177.6	-73.1	-63.3	147.6	0	0	110.8	R599 H615 V620 G817 Q818 V874	R599-E618 IonicContact CZ-OE1 3.86Å; R599-E618 IonicContact CZ-OE2 3.22Å; R599-E618 IonicContact NE-OE1 2.76Å; R599-E618 PolarHBondContact NE-OE1 3.33Å; R599-E618 IonicContact NE-OE2 3.41Å; R599-E618 IonicContact NH2-OE1 2.58Å; R599-E618 PolarHBondContact NH2-OE1 3.29Å; R599-E618 IonicContact NH2-OE2 3.22Å; R599-E618 PolarHBondContact NH2-OE2 2.95Å; H615-E618 HydrophobicContact CB-CG 3.81Å; H615-E618 IonicContact CE1-OE1 3.75Å; H615-E618 IonicContact CG-OE1 3.93Å; H615-E618 IonicContact ND1-OE1 2.8Å; H615-E618 PolarHBondContact ND1-OE1 3.1Å; E618-V620 VanDerWaalsContact C-N 3.26Å; E618-V620 PolarHBondContact O-N 3.24Å; E618-G817 PolarHBondContact N-O 2.87Å; E618-Q818 HydrophobicContact CB-CG 3.94Å; E618-Q818 WeakPolarHBondContact O-CG 3.37Å; E618-V874 HydrophobicContact CG-CB 4.34Å
619	K	92.6	Very high	90.8	Very high	63 Å²	63	34.1 Å²	34.1	27%	0.274	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	57.5	35.8	172.6	-57	175.2	-177.2	159.4	0	113.5	L596 V597 S621 V874 A876	L596-K619 WeakPolarHBondContact O-CA 3.41Å; L596-K619 PolarHBondContact O-N 3.31Å; V597-K619 HydrophobicContact CG2-CG 4.2Å; K619-S621 PolarHBondContact O-N 2.91Å; K619-V874 PolarHBondContact NZ-O 3.47Å; K619-A876 HydrophobicContact CB-CB 4.34Å; K619-A876 HydrophobicContact CD-CB 3.5Å
620	V	94.5	Very high	91.8	Very high	2 Å²	2	26 Å²	26	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	130	178.7	168.3	0	0	0	0	110.7	N595 L596 V617 E618 F622 T643 M814 G817 I819	N595-V620 PolarHBondContact N-O 2.91Å; L596-V620 HydrophobicContact CB-CB 4.37Å; L596-V620 PolarHBondContact N-O 3.29Å; L596-V620 PolarHBondContact O-N 3.42Å; L596-V620 VanDerWaalsContact O-N 3.12Å; V617-V620 HydrophobicContact CG1-CB 3.76Å; V617-V620 HydrophobicContact CG1-CG2 3.49Å; V617-V620 VanDerWaalsContact CG1-CG2 3.49Å; E618-V620 VanDerWaalsContact C-N 3.26Å; E618-V620 PolarHBondContact O-N 3.24Å; V620-F622 HydrophobicContact CG1-CD1 3.78Å; V620-F622 HydrophobicContact CG1-CE1 3.83Å; V620-T643 HydrophobicContact CG1-CG2 4.32Å; V620-M814 HydrophobicContact CG2-CE 3.85Å; V620-G817 VanDerWaalsContact CG2-O 3.27Å; V620-G817 WeakPolarHBondContact CG2-O 3.39Å; V620-I819 HydrophobicContact CG1-CD1 3.75Å; V620-I819 HydrophobicContact CG1-CG1 4.17Å; V620-I819 HydrophobicContact CG2-CG1 4.43Å
621	S	95.6	Very high	92.6	Very high	40 Å²	40	24.3 Å²	24.3	28%	0.28	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	129.9	179.3	-58.3	0	0	0	0	110.8	V593 N595 K619	V593-S621 VanDerWaalsContact O-CA 3.27Å; V593-S621 WeakPolarHBondContact O-CA 3.31Å; N595-S621 PolarHBondContact N-OG 3.14Å; K619-S621 PolarHBondContact O-N 2.91Å
622	F	96.2	Very high	93.3	Very high	7 Å²	7	21.5 Å²	21.5	3%	0.031	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	166.5	172.7	60.4	-94	0	0	0	110.7	V593 R594 V620 L630 T643 L647 L795 I819 I822	V593-F622 HydrophobicContact CB-CD1 4.28Å; V593-F622 HydrophobicContact CB-CE1 4.12Å; V593-F622 HydrophobicContact CB-CE2 4.41Å; V593-F622 HydrophobicContact CB-CG 4.5Å; V593-F622 HydrophobicContact CB-CZ 4.2Å; V593-F622 HydrophobicContact CG1-CE1 4.31Å; V593-F622 HydrophobicContact CG2-CD2 4.29Å; V593-F622 HydrophobicContact CG2-CE1 4.06Å; V593-F622 HydrophobicContact CG2-CE2 3.76Å; V593-F622 HydrophobicContact CG2-CZ 3.64Å; V593-F622 PolarHBondContact N-O 2.8Å; V593-F622 PolarHBondContact O-N 2.76Å; V593-F622 VanDerWaalsContact O-O 3.12Å; R594-F622 PolarHBondContact NH1-O 3.3Å; V620-F622 HydrophobicContact CG1-CD1 3.78Å; V620-F622 HydrophobicContact CG1-CE1 3.83Å; F622-L630 HydrophobicContact CB-CD2 4.05Å; F622-L630 HydrophobicContact CD2-CD2 3.39Å; F622-L630 HydrophobicContact CE2-CD2 3.98Å; F622-L630 HydrophobicContact CG-CD2 3.84Å; F622-T643 HydrophobicContact CE1-CG2 4.05Å; F622-T643 HydrophobicContact CZ-CG2 4.47Å; F622-L647 HydrophobicContact CZ-CD1 4.08Å; F622-L795 HydrophobicContact CE2-CD1 4.22Å; F622-L795 HydrophobicContact CZ-CD1 4.22Å; F622-L795 HydrophobicContact CZ-CD2 4.23Å; F622-I819 HydrophobicContact CB-CD1 4.48Å; F622-I819 HydrophobicContact CD1-CD1 4.07Å; F622-I822 HydrophobicContact CB-CD1 4.09Å
623	D	96	Very high	93.8	Very high	31 Å²	31	15.2 Å²	15.2	17%	0.166	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	147.9	169.9	-69.8	-35.8	0	0	0	108.2	P589 R592 R594 W625	P589-D623 HydrophobicContact CB-CB 4.01Å; P589-D623 HydrophobicContact CG-CB 4.39Å; R592-D623 WeakPolarHBondContact CB-OD1 3.24Å; R592-D623 VanDerWaalsContact CG-OD1 3.28Å; R592-D623 WeakPolarHBondContact CG-OD1 3.36Å; R592-D623 IonicContact NE-OD1 3.58Å; R594-D623 IonicContact CZ-OD1 3.7Å; R594-D623 IonicContact CZ-OD2 3.7Å; R594-D623 IonicContact NH1-OD1 3.32Å; R594-D623 PolarHBondContact NH1-OD1 3.49Å; R594-D623 IonicContact NH1-OD2 3.6Å; R594-D623 IonicContact NH2-OD1 2.92Å; R594-D623 PolarHBondContact NH2-OD1 3.26Å; R594-D623 IonicContact NH2-OD2 3.74Å; R594-D623 PolarHBondContact NH2-OD2 3.24Å; D623-W625 HydrophobicContact CB-CE3 4.3Å; D623-W625 HydrophobicContact CB-CH2 3.39Å; D623-W625 HydrophobicContact CB-CZ2 3.85Å; D623-W625 HydrophobicContact CB-CZ3 3.65Å; D623-W625 WeakPolarHBondContact O-CZ3 3.25Å
624	L	96.3	Very high	93.8	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.2	172.3	176.1	72.2	0	0	0	107.6	P589 V590 L591 L630 V761 A793 Y794	P589-L624 CarbonylContact C-O 3.51Å; P589-L624 VanDerWaalsContact CA-O 3.31Å; P589-L624 WeakPolarHBondContact CA-O 3.44Å; P589-L624 VanDerWaalsContact CB-O 3.27Å; P589-L624 WeakPolarHBondContact CB-O 3.45Å; V590-L624 HydrophobicContact CG1-CD2 4.18Å; V590-L624 HydrophobicContact CG1-CG 4.11Å; V590-L624 WeakPolarHBondContact CG1-O 3.42Å; V590-L624 PolarHBondContact N-O 3.43Å; L591-L624 HydrophobicContact CB-CB 4.18Å; L591-L624 HydrophobicContact CB-CD2 4.34Å; L591-L624 HydrophobicContact CD2-CD2 4.44Å; L591-L624 PolarHBondContact N-O 3.21Å; L591-L624 PolarHBondContact O-N 3.45Å; L624-L630 HydrophobicContact CD1-CB 3.72Å; L624-V761 HydrophobicContact CD2-CG1 3.88Å; L624-V761 HydrophobicContact CD2-CG2 4.14Å; L624-A793 HydrophobicContact CD1-CB 4.3Å; L624-A793 HydrophobicContact CD2-CB 3.86Å; L624-A793 HydrophobicContact CG-CB 3.95Å; L624-Y794 WeakPolarHBondContact CD1-O 3.06Å
625	W	95.1	Very high	93.6	Very high	61 Å²	61	14.2 Å²	14.2	23%	0.231	7%	0.073	C	C	.	.			trans	-95.2	153.1	-177.3	-70	-99.1	0	0	0	111.4	V584 D623 G627 E628 A793	V584-W625 HydrophobicContact CG1-CB 3.97Å; D623-W625 HydrophobicContact CB-CE3 4.3Å; D623-W625 HydrophobicContact CB-CH2 3.39Å; D623-W625 HydrophobicContact CB-CZ2 3.85Å; D623-W625 HydrophobicContact CB-CZ3 3.65Å; D623-W625 WeakPolarHBondContact O-CZ3 3.25Å; W625-G627 PolarHBondContact O-N 3.38Å; W625-E628 HydrophobicContact CB-CB 4.01Å; W625-E628 PolarHBondContact N-OE2 3.47Å; W625-E628 WeakPolarHBondContact O-CB 3.42Å; W625-E628 PolarHBondContact O-N 2.91Å; W625-E628 VanDerWaalsContact O-N 3.14Å; W625-A793 VanDerWaalsContact O-CB 3.31Å; W625-A793 WeakPolarHBondContact O-CB 3.46Å
626	P	94.1	Very high	92.9	Very high	41 Å²	41	17.8 Å²	17.8	27%	0.266	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	133.7	174.8	-20.7	31	0	0	0	111.6	V584 V585 V590 E628	V584-P626 WeakPolarHBondContact CA-O 3.13Å; V585-P626 HydrophobicContact CB-CB 4.32Å; V585-P626 PolarHBondContact N-O 2.83Å; V585-P626 VanDerWaalsContact N-O 3.14Å; V590-P626 HydrophobicContact CB-CG 4.23Å; P626-E628 PolarHBondContact O-N 3.47Å
627	G	93.1	Very high	92.3	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.01	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	9.8	-178.5	0	0	0	0	0	115.5	T583 W625 Q787 G791	T583-G627 WeakPolarHBondContact CB-O 3.44Å; T583-G627 PolarHBondContact OG1-O 2.89Å; W625-G627 PolarHBondContact O-N 3.38Å; G627-Q787 PolarHBondContact O-NE2 3.48Å; G627-G791 PolarHBondContact N-O 3.32Å
628	E	95.1	Very high	91.9	Very high	5 Å²	5	20.8 Å²	20.8	2%	0.023	13%	0.128	C	C	.	.			trans	-94.9	148.3	178.3	-167.3	-151.4	-165.3	0	0	111.7	V584 W625 P626 A793 Y794 H809 R810	V584-E628 HydrophobicContact CG1-CB 4.3Å; V584-E628 HydrophobicContact CG2-CB 3.91Å; V584-E628 HydrophobicContact CG2-CG 4.06Å; W625-E628 HydrophobicContact CB-CB 4.01Å; W625-E628 PolarHBondContact N-OE2 3.47Å; W625-E628 WeakPolarHBondContact O-CB 3.42Å; W625-E628 PolarHBondContact O-N 2.91Å; W625-E628 VanDerWaalsContact O-N 3.14Å; P626-E628 PolarHBondContact O-N 3.47Å; E628-A793 CarbonylContact O-C 3.52Å; E628-A793 VanDerWaalsContact O-CA 3.28Å; E628-A793 WeakPolarHBondContact O-CA 3.26Å; E628-Y794 PolarHBondContact O-N 3.01Å; E628-H809 HydrophobicContact CG-CB 3.8Å; E628-R810 WeakPolarHBondContact OE1-CD 3.36Å; E628-R810 WeakPolarHBondContact OE1-CG 3.41Å; E628-R810 IonicContact OE1-NE 2.81Å
629	T	96.5	Very high	91.5	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	109.2	163	-54.6	0	0	0	0	109.8	Q787 Y794 F796 I807 H809 R810	T629-Q787 PolarHBondContact OG1-NE2 3.44Å; T629-Y794 WeakPolarHBondContact CA-O 3.36Å; T629-F796 HydrophobicContact CG2-CB 3.81Å; T629-I807 VanDerWaalsContact CB-O 3.3Å; T629-I807 WeakPolarHBondContact CB-O 3.41Å; T629-I807 HydrophobicContact CG2-CG1 4.32Å; T629-I807 HydrophobicContact CG2-CG2 4.3Å; T629-I807 WeakPolarHBondContact CG2-O 3.37Å; T629-I807 PolarHBondContact OG1-O 3.23Å; T629-H809 PolarHBondContact N-ND1 2.87Å; T629-H809 VanDerWaalsContact N-ND1 3.11Å; T629-H809 PolarHBondContact O-N 3.27Å; T629-R810 PolarHBondContact O-N 2.91Å
630	L	97.1	Very high	91.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	117	165.3	176.4	64.7	0	0	0	108.5	F622 L624 Y794 L795 F796 R810 A812 I822	F622-L630 HydrophobicContact CB-CD2 4.05Å; F622-L630 HydrophobicContact CD2-CD2 3.39Å; F622-L630 HydrophobicContact CE2-CD2 3.98Å; F622-L630 HydrophobicContact CG-CD2 3.84Å; L624-L630 HydrophobicContact CD1-CB 3.72Å; L630-Y794 PolarHBondContact N-O 3.44Å; L630-L795 HydrophobicContact CD2-CD1 4.22Å; L630-L795 HydrophobicContact CG-CD1 4.33Å; L630-L795 WeakPolarHBondContact O-CA 3.5Å; L630-F796 PolarHBondContact O-N 3.49Å; L630-R810 HydrophobicContact CD1-CB 3.7Å; L630-A812 HydrophobicContact CD1-CB 4.35Å; L630-I822 HydrophobicContact CD1-CD1 4.42Å
631	S	97.2	Very high	91.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	136.4	173.6	-83.9	0	0	0	0	112.9	F796 S808 R810 V811 A812	S631-F796 CarbonylContact C-O 3.52Å; S631-F796 WeakPolarHBondContact CA-O 3.47Å; S631-F796 WeakPolarHBondContact CB-O 3.33Å; S631-F796 WeakPolarHBondContact OG-CD1 3.41Å; S631-F796 PolarHBondContact OG-O 3.39Å; S631-S808 VanDerWaalsContact CB-OG 3.23Å; S631-S808 WeakPolarHBondContact CB-OG 3.45Å; S631-S808 PolarHBondContact OG-OG 2.99Å; S631-R810 PolarHBondContact N-O 3.11Å; S631-V811 CarbonylContact O-C 3.59Å; S631-V811 WeakPolarHBondContact O-CA 3.44Å; S631-A812 PolarHBondContact O-N 2.89Å
632	L	96.4	Very high	91	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	114.9	174.3	-166.1	64.2	0	0	0	108.4	K640 T643 L795 F796 I797 S798 A812 M814	L632-K640 HydrophobicContact CD2-CB 4.03Å; L632-K640 HydrophobicContact CG-CB 4.18Å; L632-K640 HydrophobicContact CG-CG 4.32Å; L632-T643 HydrophobicContact CD2-CG2 3.97Å; L632-L795 HydrophobicContact CB-CD1 4.35Å; L632-F796 PolarHBondContact N-O 3.23Å; L632-I797 HydrophobicContact CB-CG1 4.09Å; L632-I797 HydrophobicContact CD2-CG1 4.31Å; L632-I797 WeakPolarHBondContact O-CA 3.39Å; L632-S798 PolarHBondContact O-N 2.74Å; L632-A812 CarbonylContact C-O 3.55Å; L632-A812 WeakPolarHBondContact CA-O 3.37Å; L632-A812 HydrophobicContact CD1-CB 3.79Å; L632-M814 HydrophobicContact CD1-CG 3.49Å; L632-M814 VanDerWaalsContact CD1-CG 3.49Å; L632-M814 HydrophobicContact CD1-SD 3.52Å; L632-M814 VanDerWaalsContact CD1-SD 3.52Å; L632-M814 HydrophobicContact CD2-SD 3.51Å; L632-M814 VanDerWaalsContact CD2-SD 3.51Å; L632-M814 HydrophobicContact CG-CG 3.99Å; L632-M814 HydrophobicContact CG-SD 3.55Å; L632-M814 VanDerWaalsContact CG-SD 3.55Å
633	V	93.6	Very high	90.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	157.5	-168.2	-53	0	0	0	0	113.4	K640 S798 M801 V804 V811 A812 V813 M814	V633-K640 VanDerWaalsContact C-CD 3.49Å; V633-S798 VanDerWaalsContact CA-O 3.29Å; V633-S798 WeakPolarHBondContact CA-O 3.41Å; V633-S798 WeakPolarHBondContact CB-O 3.4Å; V633-S798 WeakPolarHBondContact CG1-O 3.41Å; V633-M801 HydrophobicContact CB-CE 3.53Å; V633-M801 HydrophobicContact CB-SD 4.47Å; V633-M801 HydrophobicContact CG1-CE 4.01Å; V633-M801 HydrophobicContact CG2-CE 3.88Å; V633-M801 HydrophobicContact CG2-SD 4.28Å; V633-V804 HydrophobicContact CG1-CB 4.28Å; V633-V804 HydrophobicContact CG1-CG1 3.88Å; V633-V804 HydrophobicContact CG1-CG2 3.55Å; V633-V811 HydrophobicContact CG1-CG1 4.18Å; V633-V811 HydrophobicContact CG2-CG1 3.8Å; V633-A812 PolarHBondContact N-O 3.39Å; V633-V813 HydrophobicContact CG2-CB 4.21Å; V633-V813 HydrophobicContact CG2-CG1 4.4Å; V633-V813 HydrophobicContact CG2-CG2 3.78Å; V633-V813 CarbonylContact O-C 3.51Å; V633-V813 WeakPolarHBondContact O-CA 3.43Å; V633-M814 PolarHBondContact O-N 3.36Å
634	G	87.9	Confident	90.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	11%	0.113	C	C	.	.			trans	150.3	170.1	-179.6	0	0	0	0	0	112.2	K640	G634-K640 WeakPolarHBondContact O-CE 3.37Å; G634-K640 PolarHBondContact O-NZ 2.73Å
635	E	81	Confident	90.4	Very high	39 Å²	39	20.9 Å²	20.9	18%	0.182	13%	0.127	C	C	.	.	S	Bend	trans	-59.5	165	176.4	-67.1	173.6	-166.5	0	0	112.5	T495 G637 S638 K640 Y836 L840	T495-E635 HydrophobicContact CG2-CG 3.99Å; T495-E635 WeakPolarHBondContact CG2-OE1 3.17Å; T495-E635 PolarHBondContact OG1-OE1 3.33Å; E635-G637 PolarHBondContact O-N 2.88Å; E635-S638 WeakPolarHBondContact O-CB 3.41Å; E635-S638 PolarHBondContact O-N 2.87Å; E635-S638 PolarHBondContact O-OG 3.12Å; E635-K640 PolarHBondContact O-NZ 2.95Å; E635-Y836 HydrophobicContact CG-CE2 4.02Å; E635-Y836 WeakPolarHBondContact CG-OH 3.37Å; E635-Y836 PolarHBondContact N-OH 2.9Å; E635-Y836 WeakPolarHBondContact OE1-CE2 3.32Å; E635-L840 HydrophobicContact CG-CD2 3.88Å
636	S	75.9	Confident	90.2	Very high	77 Å²	77	18 Å²	18	54%	0.538	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	136.9	174.2	-63.7	0	0	0	0	110.7	D493 S638	D493-S636 PolarHBondContact OD2-OG 3.3Å; S636-S638 VanDerWaalsContact C-N 3.33Å; S636-S638 PolarHBondContact O-N 3.22Å
637	G	76.5	Confident	90	Very high	61 Å²	61	16.1 Å²	16.1	63%	0.629	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.3	-0.4	-178.6	0	0	0	0	0	115.7	E635 G639	E635-G637 PolarHBondContact O-N 2.88Å; G637-G639 PolarHBondContact O-N 2.7Å
638	S	84.7	Confident	89.5	Confident	6 Å²	6	16.7 Å²	16.7	4%	0.042	11%	0.107	C	C	.	.	S	Bend	trans	-70	-8.3	178.3	69.6	0	0	0	0	115.3	E635 S636 K640 M814 G817	E635-S638 WeakPolarHBondContact O-CB 3.41Å; E635-S638 PolarHBondContact O-N 2.87Å; E635-S638 PolarHBondContact O-OG 3.12Å; S636-S638 VanDerWaalsContact C-N 3.33Å; S636-S638 PolarHBondContact O-N 3.22Å; S638-K640 VanDerWaalsContact OG-CG 3.27Å; S638-K640 WeakPolarHBondContact OG-CG 3.45Å; S638-M814 WeakPolarHBondContact CB-O 3.41Å; S638-M814 WeakPolarHBondContact O-CE 3.24Å; S638-G817 VanDerWaalsContact O-CA 3.26Å; S638-G817 WeakPolarHBondContact O-CA 3.4Å; S638-G817 PolarHBondContact O-N 2.89Å
639	G	86.6	Confident	89.1	Confident	6 Å²	6	20 Å²	20	6%	0.062	12%	0.119	C	C	.	.	S	Bend	trans	107	0.3	176.7	0	0	0	0	0	116.6	A616 G637 T642 T643	A616-G639 WeakPolarHBondContact O-CA 3.45Å; G637-G639 PolarHBondContact O-N 2.7Å; G639-T642 PolarHBondContact O-N 3.26Å; G639-T643 WeakPolarHBondContact O-CB 3.27Å; G639-T643 PolarHBondContact O-N 3.28Å; G639-T643 PolarHBondContact O-OG1 2.96Å
640	K	91.8	Very high	88.5	Confident	9 Å²	9	24 Å²	24	4%	0.039	14%	0.14	C	C	.	.	H	α-helix	trans	-59.7	-55.5	-172.5	-42.5	179.2	-62.6	-75.4	0	113.3	L632 V633 G634 E635 S638 T642 T643 G644 I797 M814	L632-K640 HydrophobicContact CD2-CB 4.03Å; L632-K640 HydrophobicContact CG-CB 4.18Å; L632-K640 HydrophobicContact CG-CG 4.32Å; V633-K640 VanDerWaalsContact C-CD 3.49Å; G634-K640 WeakPolarHBondContact O-CE 3.37Å; G634-K640 PolarHBondContact O-NZ 2.73Å; E635-K640 PolarHBondContact O-NZ 2.95Å; S638-K640 VanDerWaalsContact OG-CG 3.27Å; S638-K640 WeakPolarHBondContact OG-CG 3.45Å; K640-T642 VanDerWaalsContact C-N 3.31Å; K640-T642 PolarHBondContact O-N 3.1Å; K640-T643 VanDerWaalsContact O-CB 3.27Å; K640-T643 WeakPolarHBondContact O-CB 3.44Å; K640-T643 PolarHBondContact O-N 3.28Å; K640-T643 VanDerWaalsContact O-N 3.14Å; K640-G644 PolarHBondContact O-N 2.9Å; K640-I797 HydrophobicContact CB-CG1 4.44Å; K640-I797 HydrophobicContact CB-CG2 3.46Å; K640-I797 VanDerWaalsContact CB-CG2 3.46Å; K640-I797 HydrophobicContact CD-CG2 4.2Å; K640-I797 HydrophobicContact CG-CG2 4.44Å; K640-I797 WeakPolarHBondContact O-CD1 3.21Å; K640-M814 HydrophobicContact CB-SD 4.43Å; K640-M814 HydrophobicContact CG-CB 4.41Å; K640-M814 HydrophobicContact CG-SD 4.13Å
641	S	88.7	Confident	87.9	Confident	26 Å²	26	25.4 Å²	25.4	18%	0.182	15%	0.148	C	C	.	.	H	α-helix	trans	-67.7	-31.7	-179.8	-48.2	0	0	0	0	112.2	G644 R645 D765	S641-G644 PolarHBondContact O-N 3.01Å; S641-R645 VanDerWaalsContact CB-NH1 3.28Å; S641-R645 WeakPolarHBondContact O-CG 3.3Å; S641-R645 PolarHBondContact O-N 3.12Å; S641-D765 WeakPolarHBondContact CB-OD1 3.28Å; S641-D765 WeakPolarHBondContact CB-OD2 3.38Å; S641-D765 PolarHBondContact OG-OD1 2.91Å; S641-D765 PolarHBondContact OG-OD2 2.86Å
642	T	90.8	Very high	87.3	Confident	27 Å²	27	32.3 Å²	32.3	17%	0.166	18%	0.181	C	C	.	.	H	α-helix	trans	-66	-41.9	171.4	-57.4	0	0	0	0	111.1	T598 F600 A616 V617 G639 K640 G644 R645 A646	T598-T642 HydrophobicContact CG2-CG2 3.52Å; F600-T642 HydrophobicContact CE2-CG2 3.67Å; F600-T642 HydrophobicContact CZ-CG2 3.88Å; A616-T642 HydrophobicContact CB-CG2 3.87Å; V617-T642 HydrophobicContact CG2-CG2 3.76Å; G639-T642 PolarHBondContact O-N 3.26Å; K640-T642 VanDerWaalsContact C-N 3.31Å; K640-T642 PolarHBondContact O-N 3.1Å; T642-G644 PolarHBondContact O-N 3.2Å; T642-R645 PolarHBondContact O-N 2.97Å; T642-A646 VanDerWaalsContact O-CB 3.31Å; T642-A646 WeakPolarHBondContact O-CB 3.41Å; T642-A646 PolarHBondContact O-N 2.89Å
643	T	93.6	Very high	86.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.1	-50.8	173.9	-58.4	0	0	0	0	109.6	L596 V617 V620 F622 L632 G639 K640 R645 A646 L647	L596-T643 HydrophobicContact CD2-CG2 4.12Å; V617-T643 WeakPolarHBondContact CG2-OG1 3.35Å; V620-T643 HydrophobicContact CG1-CG2 4.32Å; F622-T643 HydrophobicContact CE1-CG2 4.05Å; F622-T643 HydrophobicContact CZ-CG2 4.47Å; L632-T643 HydrophobicContact CD2-CG2 3.97Å; G639-T643 WeakPolarHBondContact O-CB 3.27Å; G639-T643 PolarHBondContact O-N 3.28Å; G639-T643 PolarHBondContact O-OG1 2.96Å; K640-T643 VanDerWaalsContact O-CB 3.27Å; K640-T643 WeakPolarHBondContact O-CB 3.44Å; K640-T643 PolarHBondContact O-N 3.28Å; K640-T643 VanDerWaalsContact O-N 3.14Å; T643-R645 PolarHBondContact O-N 3.25Å; T643-A646 PolarHBondContact O-N 2.96Å; T643-L647 VanDerWaalsContact O-CG 3.3Å; T643-L647 WeakPolarHBondContact O-CG 3.38Å; T643-L647 PolarHBondContact O-N 3.45Å
644	G	92.4	Very high	86.5	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-55.2	-48	175.7	0	0	0	0	0	113.6	K640 S641 T642 L647 I763	K640-G644 PolarHBondContact O-N 2.9Å; S641-G644 PolarHBondContact O-N 3.01Å; T642-G644 PolarHBondContact O-N 3.2Å; G644-L647 PolarHBondContact O-N 3.13Å; G644-I763 WeakPolarHBondContact O-CD1 3.28Å
645	R	90.6	Very high	86.5	Confident	80 Å²	80	40.2 Å²	40.2	30%	0.302	23%	0.228	S	C	.	.	H	α-helix	trans	-66.2	-36.6	179.2	-73.2	-178.3	-179.7	89.2	-0.2	113.2	S641 T642 T643 L647 L648 R649 L650 V651 F682 D765	S641-R645 VanDerWaalsContact CB-NH1 3.28Å; S641-R645 WeakPolarHBondContact O-CG 3.3Å; S641-R645 PolarHBondContact O-N 3.12Å; T642-R645 PolarHBondContact O-N 2.97Å; T643-R645 PolarHBondContact O-N 3.25Å; R645-L647 VanDerWaalsContact C-N 3.31Å; R645-L647 PolarHBondContact O-N 3.3Å; R645-L648 PolarHBondContact O-N 2.65Å; R645-R649 PolarHBondContact O-N 2.82Å; R645-L650 HydrophobicContact CB-CB 4.13Å; R645-L650 HydrophobicContact CG-CD1 4.44Å; R645-L650 WeakPolarHBondContact O-CB 3.49Å; R645-L650 PolarHBondContact O-N 2.79Å; R645-V651 HydrophobicContact CB-CG2 3.99Å; R645-F682 HydrophobicContact CG-CE2 4.47Å; R645-F682 HydrophobicContact CG-CZ 4.31Å; R645-D765 IonicContact NH1-OD2 3.83Å; R645-D765 IonicContact NH2-OD2 3.05Å
646	A	91.1	Very high	86.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.7	-33.9	177.9	0	0	0	0	0	112.1	L596 T642 T643 L648 R649	L596-A646 HydrophobicContact CD1-CB 4.38Å; L596-A646 HydrophobicContact CD2-CB 4.1Å; T642-A646 VanDerWaalsContact O-CB 3.31Å; T642-A646 WeakPolarHBondContact O-CB 3.41Å; T642-A646 PolarHBondContact O-N 2.89Å; T643-A646 PolarHBondContact O-N 2.96Å; A646-L648 VanDerWaalsContact C-N 3.25Å; A646-L648 PolarHBondContact O-N 3.08Å; A646-R649 PolarHBondContact O-N 3.33Å
647	L	88.9	Confident	87.7	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-30.9	177.6	-64.2	167.7	0	0	0	113.5	L591 V593 F622 T643 G644 R645 I658 I763 L795	L591-L647 HydrophobicContact CD2-CD1 4.1Å; L591-L647 HydrophobicContact CD2-CD2 4.32Å; V593-L647 HydrophobicContact CB-CD2 4.48Å; V593-L647 HydrophobicContact CG1-CD2 4.24Å; V593-L647 HydrophobicContact CG2-CD2 3.39Å; F622-L647 HydrophobicContact CZ-CD1 4.08Å; T643-L647 VanDerWaalsContact O-CG 3.3Å; T643-L647 WeakPolarHBondContact O-CG 3.38Å; T643-L647 PolarHBondContact O-N 3.45Å; G644-L647 PolarHBondContact O-N 3.13Å; R645-L647 VanDerWaalsContact C-N 3.31Å; R645-L647 PolarHBondContact O-N 3.3Å; L647-I658 HydrophobicContact CD2-CD1 4.32Å; L647-I658 HydrophobicContact CD2-CG1 4.37Å; L647-I658 HydrophobicContact CD2-CG2 3.95Å; L647-I763 HydrophobicContact CB-CD1 4.02Å; L647-I763 HydrophobicContact CD1-CD1 4.1Å; L647-L795 HydrophobicContact CD1-CD2 3.4Å; L647-L795 VanDerWaalsContact CD1-CD2 3.4Å
648	L	84	Confident	88.5	Confident	13 Å²	13	36.8 Å²	36.8	7%	0.068	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	4	175	-74.9	177	0	0	0	113.6	R645 A646 L650 I680 F682 I763	R645-L648 PolarHBondContact O-N 2.65Å; A646-L648 VanDerWaalsContact C-N 3.25Å; A646-L648 PolarHBondContact O-N 3.08Å; L648-L650 HydrophobicContact CB-CD1 4.25Å; L648-L650 HydrophobicContact CB-CG 3.91Å; L648-L650 HydrophobicContact CD1-CD1 4.35Å; L648-L650 PolarHBondContact O-N 3.4Å; L648-I680 HydrophobicContact CD2-CB 3.58Å; L648-I680 HydrophobicContact CD2-CG2 3.42Å; L648-I680 VanDerWaalsContact CD2-CG2 3.42Å; L648-I680 HydrophobicContact CG-CG2 4.08Å; L648-F682 HydrophobicContact CD1-CB 3.79Å; L648-F682 HydrophobicContact CD1-CD2 3.67Å; L648-F682 HydrophobicContact CD1-CG 4.17Å; L648-I763 HydrophobicContact CD1-CD1 4.35Å; L648-I763 HydrophobicContact CG-CD1 4.22Å
649	R	85.3	Confident	88.9	Confident	74 Å²	74	38 Å²	38	28%	0.279	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	36.2	-171	-61.4	-177.9	64.1	-170	-3.4	112.8	R645 A646 D666 L668	R645-R649 PolarHBondContact O-N 2.82Å; A646-R649 PolarHBondContact O-N 3.33Å; R649-D666 PolarHBondContact NH1-O 2.96Å; R649-L668 PolarHBondContact NH1-O 3.45Å
650	L	83.9	Confident	89.1	Confident	86 Å²	86	38.2 Å²	38.2	45%	0.45	20%	0.199	S	C	.	.	S	Bend	trans	-76.2	-22.4	165.3	-60	177.5	0	0	0	110.7	R645 L648	R645-L650 HydrophobicContact CB-CB 4.13Å; R645-L650 HydrophobicContact CG-CD1 4.44Å; R645-L650 WeakPolarHBondContact O-CB 3.49Å; R645-L650 PolarHBondContact O-N 2.79Å; L648-L650 HydrophobicContact CB-CD1 4.25Å; L648-L650 HydrophobicContact CB-CG 3.91Å; L648-L650 HydrophobicContact CD1-CD1 4.35Å; L648-L650 PolarHBondContact O-N 3.4Å
651	V	85.6	Confident	89	Confident	28 Å²	28	41.5 Å²	41.5	17%	0.17	22%	0.217	C	C	.	.	S	Bend	trans	-126.3	139.5	166.6	177.5	0	0	0	0	107.6	T598 F600 R645	T598-V651 HydrophobicContact CG2-CG1 3.47Å; T598-V651 VanDerWaalsContact CG2-CG1 3.47Å; F600-V651 HydrophobicContact CE1-CG1 3.6Å; F600-V651 HydrophobicContact CE1-CG2 4.36Å; F600-V651 HydrophobicContact CZ-CB 4.49Å; F600-V651 HydrophobicContact CZ-CG1 3.55Å; F600-V651 HydrophobicContact CZ-CG2 4.18Å; R645-V651 HydrophobicContact CB-CG2 3.99Å
652	E	83.9	Confident	89	Confident	146 Å²	146	43.6 Å²	43.6	68%	0.682	24%	0.243	S	C	*	.			trans	-75	130.7	179.2	-152.7	170.4	-152.9	0	0	110.7
653	S	87.7	Confident	88.9	Confident	30 Å²	30	47.3 Å²	47.3	21%	0.21	26%	0.258	C	S	.	.			trans	-89.8	141.5	172.9	55.9	0	0	0	0	110.6	V597	V597-S653 CarbonylContact O-C 3.55Å; V597-S653 VanDerWaalsContact O-CA 3.24Å; V597-S653 WeakPolarHBondContact O-CA 3.37Å; V597-S653 VanDerWaalsContact O-CB 3.3Å; V597-S653 WeakPolarHBondContact O-CB 3.21Å
654	Q	86.5	Confident	88.7	Confident	110 Å²	110	51.7 Å²	51.7	51%	0.514	27%	0.274	S	S	.	.	S	Bend	trans	-91.2	-7.5	176.9	-66.1	79.6	16.7	0	0	112.9	V597 R599	V597-Q654 HydrophobicContact CG1-CB 4.38Å; V597-Q654 PolarHBondContact O-N 3.15Å; V597-Q654 PolarHBondContact O-OE1 3.2Å; R599-Q654 PolarHBondContact O-NE2 3.3Å; R599-Q654 VanDerWaalsContact O-NE2 3.12Å
655	G	86.1	Confident	88.4	Confident	26 Å²	26	51.8 Å²	51.8	27%	0.268	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.8	169.2	-179.6	0	0	0	0	0	113.2	N595 V597	N595-G655 CarbonylContact O-C 3.15Å; V597-G655 PolarHBondContact N-O 3.14Å
656	G	89.7	Confident	87.9	Confident	25 Å²	25	49.1 Å²	49.1	26%	0.258	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	96.8	-173.9	-178.3	0	0	0	0	0	113.9	R594 N595 R664	R594-G656 CarbonylContact O-C 3.56Å; R594-G656 WeakPolarHBondContact O-CA 3.47Å; N595-G656 WeakPolarHBondContact O-CA 3.25Å; N595-G656 PolarHBondContact O-N 2.88Å; G656-R664 PolarHBondContact O-NH2 3.4Å
657	E	92.8	Very high	87.6	Confident	79 Å²	79	53.8 Å²	53.8	37%	0.369	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.6	178.8	-42.7	-166.4	143	0	0	108.9	R594 R664	R594-E657 HydrophobicContact CB-CB 4.43Å; R594-E657 PolarHBondContact N-O 2.89Å; R594-E657 PolarHBondContact O-N 3.01Å; E657-R664 VanDerWaalsContact CD-NH1 3.31Å; E657-R664 IonicContact OE1-CZ 3.81Å; E657-R664 IonicContact OE1-NH1 3.03Å; E657-R664 PolarHBondContact OE1-NH1 2.76Å; E657-R664 IonicContact OE1-NH2 3.7Å
658	I	92.9	Very high	87.3	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118	174.7	-51.3	165.1	0	0	0	106.8	L591 L596 L647 R664 I665 D666	L591-I658 HydrophobicContact CD1-CG2 3.77Å; L596-I658 HydrophobicContact CD1-CD1 4.08Å; L596-I658 HydrophobicContact CD1-CG1 4.34Å; L647-I658 HydrophobicContact CD2-CD1 4.32Å; L647-I658 HydrophobicContact CD2-CG1 4.37Å; L647-I658 HydrophobicContact CD2-CG2 3.95Å; I658-R664 CarbonylContact O-C 3.59Å; I658-R664 WeakPolarHBondContact O-CA 3.25Å; I658-I665 HydrophobicContact CB-CD1 4.23Å; I658-I665 HydrophobicContact CB-CG1 3.76Å; I658-I665 HydrophobicContact CG2-CD1 3.53Å; I658-I665 HydrophobicContact CG2-CG1 3.57Å; I658-I665 VanDerWaalsContact O-CG1 3.25Å; I658-I665 WeakPolarHBondContact O-CG1 3.28Å; I658-I665 PolarHBondContact O-N 3.33Å; I658-D666 HydrophobicContact CD1-CB 4.42Å; I658-D666 HydrophobicContact CG1-CB 4.49Å; I658-D666 PolarHBondContact N-OD1 2.69Å
659	I	93.3	Very high	87.1	Confident	32 Å²	32	57.1 Å²	57.1	16%	0.164	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.5	-176.7	-59.8	167.8	0	0	0	108.1	L591 R592 G662 Q663 R664	L591-I659 CarbonylContact C-O 3.45Å; L591-I659 WeakPolarHBondContact CA-O 3.48Å; R592-I659 HydrophobicContact CB-CB 4.13Å; R592-I659 HydrophobicContact CG-CD1 4.39Å; R592-I659 PolarHBondContact N-O 3.15Å; R592-I659 PolarHBondContact O-N 3.06Å; I659-G662 VanDerWaalsContact CG2-C 3.47Å; I659-Q663 CarbonylContact C-O 3.51Å; I659-Q663 VanDerWaalsContact CA-O 3.31Å; I659-Q663 WeakPolarHBondContact CA-O 3.43Å; I659-R664 HydrophobicContact CG1-CB 4.5Å
660	F	92	Very high	86.7	Confident	10 Å²	10	58.9 Å²	58.9	4%	0.044	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.3	177.3	178.6	-105.9	0	0	0	109.8	V590 L591 G662 Q663 I665 L676 D679 I680 K760 V761	V590-F660 HydrophobicContact CG2-CD2 4.38Å; V590-F660 HydrophobicContact CG2-CE2 3.74Å; V590-F660 HydrophobicContact CG2-CZ 4.37Å; V590-F660 WeakPolarHBondContact O-CA 3.41Å; V590-F660 WeakPolarHBondContact O-CD2 3.39Å; L591-F660 HydrophobicContact CD1-CB 4.37Å; L591-F660 HydrophobicContact CD1-CD2 4.38Å; F660-G662 PolarHBondContact O-N 2.88Å; F660-Q663 PolarHBondContact N-O 3.02Å; F660-Q663 PolarHBondContact O-N 2.83Å; F660-I665 HydrophobicContact CB-CD1 4.14Å; F660-I665 HydrophobicContact CB-CG1 4.46Å; F660-I665 HydrophobicContact CB-CG2 3.8Å; F660-L676 HydrophobicContact CB-CD1 4.01Å; F660-L676 HydrophobicContact CD1-CD1 3.32Å; F660-L676 HydrophobicContact CE1-CD1 3.89Å; F660-L676 HydrophobicContact CG-CD1 3.72Å; F660-D679 HydrophobicContact CE1-CB 3.6Å; F660-D679 HydrophobicContact CZ-CB 3.53Å; F660-I680 HydrophobicContact CD2-CD1 3.62Å; F660-I680 HydrophobicContact CD2-CG1 4.01Å; F660-I680 HydrophobicContact CE1-CG1 4.43Å; F660-I680 HydrophobicContact CE2-CD1 3.84Å; F660-I680 HydrophobicContact CE2-CG1 3.67Å; F660-I680 HydrophobicContact CG-CD1 3.99Å; F660-I680 HydrophobicContact CZ-CD1 4.39Å; F660-I680 HydrophobicContact CZ-CG1 3.91Å; F660-K760 HydrophobicContact CZ-CB 4.27Å; F660-K760 HydrophobicContact CZ-CD 4.24Å; F660-V761 HydrophobicContact CE2-CG2 3.79Å
661	N	89.1	Confident	86.4	Confident	78 Å²	78	57.4 Å²	57.4	42%	0.417	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	43.7	-173.7	-73.2	-39.4	0	0	0	113.2	V590 Q663 K760	V590-N661 PolarHBondContact O-N 3.02Å; N661-Q663 PolarHBondContact O-N 3.18Å; N661-K760 WeakPolarHBondContact ND2-CD 3.3Å; N661-K760 PolarHBondContact ND2-NZ 3.4Å
662	G	88.2	Confident	86	Confident	70 Å²	70	62.1 Å²	62.1	72%	0.722	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	-6.2	-179	0	0	0	0	0	115.8	I659 F660	I659-G662 VanDerWaalsContact CG2-C 3.47Å; F660-G662 PolarHBondContact O-N 2.88Å
663	Q	88.4	Confident	85.8	Confident	104 Å²	104	55.7 Å²	55.7	49%	0.486	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.6	177.8	-175.4	176.5	13.8	0	0	111.5	I659 F660 N661 I665	I659-Q663 CarbonylContact C-O 3.51Å; I659-Q663 VanDerWaalsContact CA-O 3.31Å; I659-Q663 WeakPolarHBondContact CA-O 3.43Å; F660-Q663 PolarHBondContact N-O 3.02Å; F660-Q663 PolarHBondContact O-N 2.83Å; N661-Q663 PolarHBondContact O-N 3.18Å; Q663-I665 PolarHBondContact O-N 2.92Å
664	R	89.9	Confident	85.3	Confident	93 Å²	93	58.6 Å²	58.6	35%	0.351	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	122	172.6	-170.9	175.5	177.8	153.1	3.2	110.9	G656 E657 I658 I659 D666	G656-R664 PolarHBondContact O-NH2 3.4Å; E657-R664 VanDerWaalsContact CD-NH1 3.31Å; E657-R664 IonicContact OE1-CZ 3.81Å; E657-R664 IonicContact OE1-NH1 3.03Å; E657-R664 PolarHBondContact OE1-NH1 2.76Å; E657-R664 IonicContact OE1-NH2 3.7Å; I658-R664 CarbonylContact O-C 3.59Å; I658-R664 WeakPolarHBondContact O-CA 3.25Å; I659-R664 HydrophobicContact CG1-CB 4.5Å; R664-D666 WeakPolarHBondContact CG-OD1 3.38Å; R664-D666 IonicContact CZ-OD2 3.7Å; R664-D666 VanDerWaalsContact CZ-OD2 3.31Å; R664-D666 IonicContact NE-OD1 2.77Å; R664-D666 PolarHBondContact NE-OD1 3.35Å; R664-D666 IonicContact NE-OD2 2.87Å; R664-D666 PolarHBondContact NE-OD2 3Å; R664-D666 IonicContact NH2-OD2 3.41Å; R664-D666 PolarHBondContact NH2-OD2 3.49Å
665	I	87.3	Confident	84.8	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	34%	0.341	C	S	.	.			trans	-106.7	-22	-171.3	60.3	161.3	0	0	0	114.8	I658 F660 Q663 T667 L668 L676	I658-I665 HydrophobicContact CB-CD1 4.23Å; I658-I665 HydrophobicContact CB-CG1 3.76Å; I658-I665 HydrophobicContact CG2-CD1 3.53Å; I658-I665 HydrophobicContact CG2-CG1 3.57Å; I658-I665 VanDerWaalsContact O-CG1 3.25Å; I658-I665 WeakPolarHBondContact O-CG1 3.28Å; I658-I665 PolarHBondContact O-N 3.33Å; F660-I665 HydrophobicContact CB-CD1 4.14Å; F660-I665 HydrophobicContact CB-CG1 4.46Å; F660-I665 HydrophobicContact CB-CG2 3.8Å; Q663-I665 PolarHBondContact O-N 2.92Å; I665-T667 PolarHBondContact O-N 3.06Å; I665-L668 HydrophobicContact CB-CD1 3.94Å; I665-L668 HydrophobicContact CG2-CD1 3.75Å; I665-L668 PolarHBondContact O-N 3Å; I665-L676 HydrophobicContact CB-CD2 3.86Å; I665-L676 HydrophobicContact CD1-CD1 4.16Å; I665-L676 HydrophobicContact CD1-CD2 3.5Å; I665-L676 HydrophobicContact CD1-CG 4.42Å; I665-L676 HydrophobicContact CG1-CD2 4.28Å; I665-L676 HydrophobicContact CG2-CD1 3.91Å; I665-L676 HydrophobicContact CG2-CD2 3.97Å
666	D	80.2	Confident	84.6	Confident	24 Å²	24	55.4 Å²	55.4	13%	0.128	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.1	177.7	51.2	-67.4	0	0	0	112.6	R649 I658 R664	R649-D666 PolarHBondContact NH1-O 2.96Å; I658-D666 HydrophobicContact CD1-CB 4.42Å; I658-D666 HydrophobicContact CG1-CB 4.49Å; I658-D666 PolarHBondContact N-OD1 2.69Å; R664-D666 WeakPolarHBondContact CG-OD1 3.38Å; R664-D666 IonicContact CZ-OD2 3.7Å; R664-D666 VanDerWaalsContact CZ-OD2 3.31Å; R664-D666 IonicContact NE-OD1 2.77Å; R664-D666 PolarHBondContact NE-OD1 3.35Å; R664-D666 IonicContact NE-OD2 2.87Å; R664-D666 PolarHBondContact NE-OD2 3Å; R664-D666 IonicContact NH2-OD2 3.41Å; R664-D666 PolarHBondContact NH2-OD2 3.49Å
667	T	83.1	Confident	84.3	Confident	98 Å²	98	59.2 Å²	59.2	60%	0.601	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	4.2	-179.1	61.3	0	0	0	0	114.4	I665	I665-T667 PolarHBondContact O-N 3.06Å
668	L	82.8	Confident	83.9	Confident	21 Å²	21	59.4 Å²	59.4	11%	0.11	34%	0.336	C	S	.	.			trans	-69	147	-177.6	-73	175.7	0	0	0	112.4	R649 I665 K672 L673	R649-L668 PolarHBondContact NH1-O 3.45Å; I665-L668 HydrophobicContact CB-CD1 3.94Å; I665-L668 HydrophobicContact CG2-CD1 3.75Å; I665-L668 PolarHBondContact O-N 3Å; L668-K672 HydrophobicContact CB-CB 4.25Å; L668-K672 HydrophobicContact CD1-CB 4.4Å; L668-K672 HydrophobicContact CD2-CB 4.02Å; L668-K672 HydrophobicContact CD2-CD 3.84Å; L668-K672 HydrophobicContact CG-CB 4.46Å; L668-L673 HydrophobicContact CB-CD2 4.22Å; L668-L673 HydrophobicContact CB-CG 4.26Å
669	S	81.2	Confident	83.8	Confident	64 Å²	64	61.8 Å²	61.8	45%	0.448	35%	0.348	S	S	.	.			trans	-68.6	155.2	171	64.3	0	0	0	0	111.3	G671 K672 L673	S669-G671 PolarHBondContact O-N 3.03Å; S669-G671 VanDerWaalsContact O-N 3.13Å; S669-K672 PolarHBondContact O-N 2.92Å; S669-L673 PolarHBondContact O-N 2.96Å; S669-L673 VanDerWaalsContact O-N 3.14Å
670	P	76.9	Confident	83.7	Confident	110 Å²	110	60.4 Å²	60.4	71%	0.714	34%	0.341	S	S	*	.	H	α-helix	trans	-50.7	-38.2	179.9	-30.1	36.3	0	0	0	115	L673	P670-L673 WeakPolarHBondContact O-CB 3.31Å; P670-L673 PolarHBondContact O-N 2.88Å
671	G	76	Confident	83.7	Confident	55 Å²	55	61.1 Å²	61.1	57%	0.567	34%	0.344	S	S	*	.	H	α-helix	trans	-67.4	-37.7	177.7	0	0	0	0	0	113.8	S669 L673 Q674	S669-G671 PolarHBondContact O-N 3.03Å; S669-G671 VanDerWaalsContact O-N 3.13Å; G671-L673 VanDerWaalsContact C-N 3.33Å; G671-Q674 PolarHBondContact O-N 3.46Å
672	K	77.7	Confident	83.8	Confident	128 Å²	128	58.3 Å²	58.3	56%	0.557	33%	0.329	S	S	*	.	H	α-helix	trans	-74	-25.8	177.1	-70.4	-172.4	178.4	-177	0	112.4	L668 S669 Q674 A675	L668-K672 HydrophobicContact CB-CB 4.25Å; L668-K672 HydrophobicContact CD1-CB 4.4Å; L668-K672 HydrophobicContact CD2-CB 4.02Å; L668-K672 HydrophobicContact CD2-CD 3.84Å; L668-K672 HydrophobicContact CG-CB 4.46Å; S669-K672 PolarHBondContact O-N 2.92Å; K672-Q674 PolarHBondContact O-N 2.87Å; K672-A675 PolarHBondContact O-N 2.92Å
673	L	79.4	Confident	84	Confident	10 Å²	10	55 Å²	55	5%	0.052	30%	0.295	C	S	.	.	H	α-helix	trans	-63.2	-27.8	173.3	-73.8	171.8	0	0	0	112.7	L668 S669 P670 G671 A675 L676 R677	L668-L673 HydrophobicContact CB-CD2 4.22Å; L668-L673 HydrophobicContact CB-CG 4.26Å; S669-L673 PolarHBondContact O-N 2.96Å; S669-L673 VanDerWaalsContact O-N 3.14Å; P670-L673 WeakPolarHBondContact O-CB 3.31Å; P670-L673 PolarHBondContact O-N 2.88Å; G671-L673 VanDerWaalsContact C-N 3.33Å; L673-A675 VanDerWaalsContact C-N 3.31Å; L673-A675 PolarHBondContact O-N 3.43Å; L673-L676 HydrophobicContact CD2-CD2 3.92Å; L673-L676 WeakPolarHBondContact O-CB 3.48Å; L673-L676 PolarHBondContact O-N 2.78Å; L673-R677 WeakPolarHBondContact O-CB 3.35Å; L673-R677 WeakPolarHBondContact O-CG 3.21Å; L673-R677 PolarHBondContact O-N 2.86Å
674	Q	77.2	Confident	83.9	Confident	91 Å²	91	53.6 Å²	53.6	43%	0.425	29%	0.287	S	S	.	.	H	α-helix	trans	-65.4	-35.2	178.8	-165.4	175.3	18.7	0	0	111.9	G671 K672 V707 H708	G671-Q674 PolarHBondContact O-N 3.46Å; K672-Q674 PolarHBondContact O-N 2.87Å; Q674-V707 PolarHBondContact NE2-O 3.17Å; Q674-H708 VanDerWaalsContact CG-CE1 3.41Å; Q674-H708 WeakPolarHBondContact CG-CE1 3.38Å; Q674-H708 PolarHBondContact O-CE1 3.45Å
675	A	77.5	Confident	83.3	Confident	58 Å²	58	53.4 Å²	53.4	48%	0.479	29%	0.29	S	S	.	.	H	α-helix	trans	-68.6	-42.4	174	0	0	0	0	0	111.7	K672 L673 R677 R678	K672-A675 PolarHBondContact O-N 2.92Å; L673-A675 VanDerWaalsContact C-N 3.31Å; L673-A675 PolarHBondContact O-N 3.43Å; A675-R677 VanDerWaalsContact C-N 3.31Å; A675-R677 PolarHBondContact O-N 2.82Å; A675-R678 WeakPolarHBondContact O-CB 3.43Å; A675-R678 PolarHBondContact O-N 2.65Å
676	L	81.3	Confident	82.6	Confident	11 Å²	11	57.3 Å²	57.3	6%	0.058	31%	0.311	C	S	.	.	H	α-helix	trans	-58.6	-42.1	175.2	177.7	70.8	0	0	0	112.4	F660 I665 L673 R678 D679 I680	F660-L676 HydrophobicContact CB-CD1 4.01Å; F660-L676 HydrophobicContact CD1-CD1 3.32Å; F660-L676 HydrophobicContact CE1-CD1 3.89Å; F660-L676 HydrophobicContact CG-CD1 3.72Å; I665-L676 HydrophobicContact CB-CD2 3.86Å; I665-L676 HydrophobicContact CD1-CD1 4.16Å; I665-L676 HydrophobicContact CD1-CD2 3.5Å; I665-L676 HydrophobicContact CD1-CG 4.42Å; I665-L676 HydrophobicContact CG1-CD2 4.28Å; I665-L676 HydrophobicContact CG2-CD1 3.91Å; I665-L676 HydrophobicContact CG2-CD2 3.97Å; L673-L676 HydrophobicContact CD2-CD2 3.92Å; L673-L676 WeakPolarHBondContact O-CB 3.48Å; L673-L676 PolarHBondContact O-N 2.78Å; L676-R678 PolarHBondContact O-N 3.44Å; L676-R678 VanDerWaalsContact O-N 3.09Å; L676-D679 PolarHBondContact O-N 2.94Å; L676-I680 HydrophobicContact CD1-CD1 3.66Å; L676-I680 HydrophobicContact CD1-CG1 4.11Å; L676-I680 HydrophobicContact CG-CD1 4.15Å; L676-I680 PolarHBondContact O-N 2.83Å
677	R	83.1	Confident	82.2	Confident	105 Å²	105	57 Å²	57	40%	0.396	31%	0.31	S	S	.	.	H	α-helix	trans	-67	-2.5	177.1	-73.8	176.7	-177.3	165.3	0.3	113.7	L673 A675 Q681	L673-R677 WeakPolarHBondContact O-CB 3.35Å; L673-R677 WeakPolarHBondContact O-CG 3.21Å; L673-R677 PolarHBondContact O-N 2.86Å; A675-R677 VanDerWaalsContact C-N 3.31Å; A675-R677 PolarHBondContact O-N 2.82Å; R677-Q681 PolarHBondContact O-NE2 3.25Å
678	R	84.7	Confident	81.6	Confident	84 Å²	84	57.3 Å²	57.3	32%	0.317	30%	0.301	S	S	.	.	H	α-helix	trans	-83.7	-43.1	165.2	-64	178.8	175.6	172.4	-2.4	111	A675 L676 Q681 H708	A675-R678 WeakPolarHBondContact O-CB 3.43Å; A675-R678 PolarHBondContact O-N 2.65Å; L676-R678 PolarHBondContact O-N 3.44Å; L676-R678 VanDerWaalsContact O-N 3.09Å; R678-Q681 PolarHBondContact O-NE2 3.47Å; R678-H708 VanDerWaalsContact NE-CG 3.33Å; R678-H708 PolarHBondContact NE-ND1 3.25Å; R678-H708 VanDerWaalsContact NE-ND1 3.2Å; R678-H708 PolarHBondContact NH2-O 2.87Å
679	D	90.3	Very high	81.2	Confident	50 Å²	50	59.9 Å²	59.9	27%	0.267	33%	0.326	S	S	.	.	H	α-helix	trans	-82.3	-21.2	-174.5	-67.9	-26.7	0	0	0	114.1	F660 L676 K760 V761	F660-D679 HydrophobicContact CE1-CB 3.6Å; F660-D679 HydrophobicContact CZ-CB 3.53Å; L676-D679 PolarHBondContact O-N 2.94Å; D679-K760 PolarHBondContact O-N 3.04Å; D679-V761 PolarHBondContact O-N 3.42Å
680	I	91.8	Very high	81	Confident	3 Å²	3	58 Å²	58	2%	0.015	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.2	176.8	-48	-179.1	0	0	0	109.6	L648 F660 L676 V761 I763	L648-I680 HydrophobicContact CD2-CB 3.58Å; L648-I680 HydrophobicContact CD2-CG2 3.42Å; L648-I680 VanDerWaalsContact CD2-CG2 3.42Å; L648-I680 HydrophobicContact CG-CG2 4.08Å; F660-I680 HydrophobicContact CD2-CD1 3.62Å; F660-I680 HydrophobicContact CD2-CG1 4.01Å; F660-I680 HydrophobicContact CE1-CG1 4.43Å; F660-I680 HydrophobicContact CE2-CD1 3.84Å; F660-I680 HydrophobicContact CE2-CG1 3.67Å; F660-I680 HydrophobicContact CG-CD1 3.99Å; F660-I680 HydrophobicContact CZ-CD1 4.39Å; F660-I680 HydrophobicContact CZ-CG1 3.91Å; L676-I680 HydrophobicContact CD1-CD1 3.66Å; L676-I680 HydrophobicContact CD1-CG1 4.11Å; L676-I680 HydrophobicContact CG-CD1 4.15Å; L676-I680 PolarHBondContact O-N 2.83Å; I680-V761 WeakPolarHBondContact CA-O 3.36Å; I680-V761 HydrophobicContact CG1-CB 4.25Å; I680-V761 HydrophobicContact CG2-CB 4.14Å; I680-V761 HydrophobicContact CG2-CG1 4.08Å; I680-I763 HydrophobicContact CG2-CD1 4.34Å; I680-I763 HydrophobicContact CG2-CG1 4.42Å
681	Q	92.3	Very high	81.4	Confident	25 Å²	25	53 Å²	53	12%	0.117	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	160.3	-179.4	-60.7	-65.6	-34.6	0	0	111.4	R677 R678 A754 P759 V761 I762 I763	R677-Q681 PolarHBondContact O-NE2 3.25Å; R678-Q681 PolarHBondContact O-NE2 3.47Å; Q681-A754 HydrophobicContact CB-CB 4.05Å; Q681-A754 VanDerWaalsContact CG-O 3.3Å; Q681-A754 WeakPolarHBondContact CG-O 3.44Å; Q681-P759 HydrophobicContact CB-CB 4.17Å; Q681-P759 HydrophobicContact CB-CG 4.32Å; Q681-P759 HydrophobicContact CG-CB 3.62Å; Q681-P759 HydrophobicContact CG-CG 3.93Å; Q681-V761 PolarHBondContact N-O 3.4Å; Q681-I762 HydrophobicContact CB-CG1 4.38Å; Q681-I762 WeakPolarHBondContact O-CA 3.31Å; Q681-I763 PolarHBondContact O-N 3.17Å
682	F	91.4	Very high	81.8	Confident	19 Å²	19	52.4 Å²	52.4	8%	0.083	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.9	-176.5	-155.9	-83.8	0	0	0	110.1	R645 L648 F684 I763 D765	R645-F682 HydrophobicContact CG-CE2 4.47Å; R645-F682 HydrophobicContact CG-CZ 4.31Å; L648-F682 HydrophobicContact CD1-CB 3.79Å; L648-F682 HydrophobicContact CD1-CD2 3.67Å; L648-F682 HydrophobicContact CD1-CG 4.17Å; F682-F684 HydrophobicContact CB-CE2 4.34Å; F682-F684 HydrophobicContact CB-CZ 4.26Å; F682-F684 HydrophobicContact CD1-CB 4.44Å; F682-F684 AromaticContact CD1-CD1 3.42Å; F682-F684 HydrophobicContact CD1-CD1 3.42Å; F682-F684 VanDerWaalsContact CD1-CD1 3.42Å; F682-F684 HydrophobicContact CD1-CD2 4.02Å; F682-F684 AromaticContact CD1-CE1 3.48Å; F682-F684 HydrophobicContact CD1-CE1 3.48Å; F682-F684 VanDerWaalsContact CD1-CE1 3.48Å; F682-F684 HydrophobicContact CD1-CE2 4.07Å; F682-F684 AromaticContact CD1-CG 3.7Å; F682-F684 HydrophobicContact CD1-CG 3.7Å; F682-F684 AromaticContact CD1-CZ 3.82Å; F682-F684 HydrophobicContact CD1-CZ 3.82Å; F682-F684 AromaticContact CE1-CD1 3.49Å; F682-F684 HydrophobicContact CE1-CD1 3.49Å; F682-F684 VanDerWaalsContact CE1-CD1 3.49Å; F682-F684 AromaticContact CE1-CE1 3.79Å; F682-F684 HydrophobicContact CE1-CE1 3.79Å; F682-F684 HydrophobicContact CE1-CG 4.05Å; F682-F684 HydrophobicContact CG-CE1 4.23Å; F682-F684 HydrophobicContact CG-CZ 4.27Å; F682-I763 WeakPolarHBondContact CA-O 3.42Å; F682-I763 HydrophobicContact CD2-CB 3.63Å; F682-I763 HydrophobicContact CD2-CD1 4.13Å; F682-I763 HydrophobicContact CD2-CG1 4.41Å; F682-I763 HydrophobicContact CD2-CG2 3.78Å; F682-I763 HydrophobicContact CE2-CB 3.87Å; F682-I763 HydrophobicContact CE2-CD1 4.34Å; F682-I763 HydrophobicContact CE2-CG2 3.44Å; F682-I763 VanDerWaalsContact CE2-CG2 3.44Å; F682-I763 HydrophobicContact CG-CB 4.43Å; F682-I763 HydrophobicContact CZ-CG2 4.14Å; F682-D765 HydrophobicContact CE1-CB 3.54Å; F682-D765 HydrophobicContact CZ-CB 3.52Å
683	I	92.5	Very high	81.9	Confident	2 Å²	2	49 Å²	49	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.3	167.8	-60.2	169	0	0	0	106.3	I751 A754 I762 I763 D765 A767	I683-I751 HydrophobicContact CD1-CG1 3.85Å; I683-A754 HydrophobicContact CD1-CB 4.38Å; I683-A754 HydrophobicContact CG1-CB 3.83Å; I683-I762 HydrophobicContact CD1-CG2 3.61Å; I683-I762 HydrophobicContact CG1-CG2 3.9Å; I683-I763 PolarHBondContact N-O 2.74Å; I683-D765 PolarHBondContact O-N 3Å; I683-A767 HydrophobicContact CB-CB 4.46Å; I683-A767 HydrophobicContact CG2-CB 3.76Å
684	F	85	Confident	82.2	Confident	74 Å²	74	57.9 Å²	57.9	33%	0.325	29%	0.287	S	S	.	.			trans	-77.6	157.9	-177.3	-63.7	-84.2	0	0	0	112	F682 D686	F682-F684 HydrophobicContact CB-CE2 4.34Å; F682-F684 HydrophobicContact CB-CZ 4.26Å; F682-F684 HydrophobicContact CD1-CB 4.44Å; F682-F684 AromaticContact CD1-CD1 3.42Å; F682-F684 HydrophobicContact CD1-CD1 3.42Å; F682-F684 VanDerWaalsContact CD1-CD1 3.42Å; F682-F684 HydrophobicContact CD1-CD2 4.02Å; F682-F684 AromaticContact CD1-CE1 3.48Å; F682-F684 HydrophobicContact CD1-CE1 3.48Å; F682-F684 VanDerWaalsContact CD1-CE1 3.48Å; F682-F684 HydrophobicContact CD1-CE2 4.07Å; F682-F684 AromaticContact CD1-CG 3.7Å; F682-F684 HydrophobicContact CD1-CG 3.7Å; F682-F684 AromaticContact CD1-CZ 3.82Å; F682-F684 HydrophobicContact CD1-CZ 3.82Å; F682-F684 AromaticContact CE1-CD1 3.49Å; F682-F684 HydrophobicContact CE1-CD1 3.49Å; F682-F684 VanDerWaalsContact CE1-CD1 3.49Å; F682-F684 AromaticContact CE1-CE1 3.79Å; F682-F684 HydrophobicContact CE1-CE1 3.79Å; F682-F684 HydrophobicContact CE1-CG 4.05Å; F682-F684 HydrophobicContact CG-CE1 4.23Å; F682-F684 HydrophobicContact CG-CZ 4.27Å; F684-D686 PolarHBondContact O-N 2.99Å
685	Q	76.8	Confident	82.8	Confident	88 Å²	88	56.2 Å²	56.2	41%	0.411	28%	0.279	S	S	.	.	S	Bend	trans	-62.8	-35.6	-177.9	177.5	175.8	16	0	0	114.2	P687 D765 E766	Q685-P687 WeakPolarHBondContact O-CD 3.43Å; Q685-D765 WeakPolarHBondContact CA-O 3.4Å; Q685-D765 PolarHBondContact N-O 3.34Å; Q685-E766 HydrophobicContact CB-CB 4.2Å; Q685-E766 HydrophobicContact CG-CB 3.81Å
686	D	73.3	Confident	83.5	Confident	83 Å²	83	54.4 Å²	54.4	44%	0.444	26%	0.262	S	S	.	.			trans	-109.2	106.2	179.5	-177.9	-14.4	0	0	0	109.9	F684 Y688 A689 S690	F684-D686 PolarHBondContact O-N 2.99Å; D686-Y688 VanDerWaalsContact C-N 3.27Å; D686-Y688 PolarHBondContact O-N 2.96Å; D686-Y688 WeakPolarHBondContact OD1-CA 3.39Å; D686-Y688 WeakPolarHBondContact OD1-CB 3.39Å; D686-Y688 PolarHBondContact OD1-N 3.22Å; D686-A689 HydrophobicContact CB-CB 3.99Å; D686-A689 PolarHBondContact OD1-N 3.38Å; D686-A689 VanDerWaalsContact OD1-N 3.08Å; D686-A689 WeakPolarHBondContact OD2-CB 3.41Å; D686-S690 WeakPolarHBondContact O-CB 3.32Å; D686-S690 PolarHBondContact O-N 3.3Å; D686-S690 VanDerWaalsContact O-N 3.09Å; D686-S690 PolarHBondContact O-OG 3.37Å
687	P	72.5	Confident	84.1	Confident	19 Å²	19	53.9 Å²	53.9	12%	0.123	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-38.4	178.7	-28.2	39.4	0	0	0	112.6	Q685 S690 L691 R746 Q747	Q685-P687 WeakPolarHBondContact O-CD 3.43Å; P687-S690 PolarHBondContact O-N 2.87Å; P687-S690 PolarHBondContact O-OG 3.12Å; P687-L691 WeakPolarHBondContact O-CG 3.23Å; P687-L691 PolarHBondContact O-N 2.99Å; P687-R746 HydrophobicContact CB-CB 3.85Å; P687-Q747 HydrophobicContact CG-CB 4.49Å
688	Y	69.5	Low	84.5	Confident	103 Å²	103	49.3 Å²	49.3	40%	0.404	25%	0.245	S	C	.	.	H	α-helix	trans	-70.8	-49.6	-175.8	-172	-95.5	0	0	0	110.6	D686 S690 L691	D686-Y688 VanDerWaalsContact C-N 3.27Å; D686-Y688 PolarHBondContact O-N 2.96Å; D686-Y688 WeakPolarHBondContact OD1-CA 3.39Å; D686-Y688 WeakPolarHBondContact OD1-CB 3.39Å; D686-Y688 PolarHBondContact OD1-N 3.22Å; Y688-S690 PolarHBondContact O-N 2.9Å; Y688-L691 PolarHBondContact O-N 3.43Å; Y688-L691 VanDerWaalsContact O-N 3.16Å
689	A	74.1	Confident	84.8	Confident	76 Å²	76	47.7 Å²	47.7	63%	0.628	24%	0.243	S	C	*	.	H	α-helix	trans	-65.9	-20.2	176.8	0	0	0	0	0	113.5	D686	D686-A689 HydrophobicContact CB-CB 3.99Å; D686-A689 PolarHBondContact OD1-N 3.38Å; D686-A689 VanDerWaalsContact OD1-N 3.08Å; D686-A689 WeakPolarHBondContact OD2-CB 3.41Å
690	S	77.9	Confident	84.9	Confident	24 Å²	24	45.4 Å²	45.4	17%	0.168	23%	0.231	C	C	.	.	H	α-helix	trans	-80.6	-18.9	176.5	81.3	0	0	0	0	114.1	D686 P687 Y688 C750 R753	D686-S690 WeakPolarHBondContact O-CB 3.32Å; D686-S690 PolarHBondContact O-N 3.3Å; D686-S690 VanDerWaalsContact O-N 3.09Å; D686-S690 PolarHBondContact O-OG 3.37Å; P687-S690 PolarHBondContact O-N 2.87Å; P687-S690 PolarHBondContact O-OG 3.12Å; Y688-S690 PolarHBondContact O-N 2.9Å; S690-C750 PolarHBondContact OG-SG 3.06Å; S690-R753 PolarHBondContact O-NH1 3.01Å
691	L	84.7	Confident	85	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.026	23%	0.23	C	C	.	.	S	Bend	trans	-102.4	140.5	178.1	-62.3	171.1	0	0	0	109.4	P687 Y688 P693 P738 I749	P687-L691 WeakPolarHBondContact O-CG 3.23Å; P687-L691 PolarHBondContact O-N 2.99Å; Y688-L691 PolarHBondContact O-N 3.43Å; Y688-L691 VanDerWaalsContact O-N 3.16Å; L691-P693 WeakPolarHBondContact O-CD 3.2Å; L691-P738 HydrophobicContact CB-CB 4.21Å; L691-P738 HydrophobicContact CB-CG 3.87Å; L691-P738 HydrophobicContact CD1-CB 4.15Å; L691-P738 HydrophobicContact CD1-CG 4.29Å; L691-I749 HydrophobicContact CD1-CG2 4.05Å; L691-I749 HydrophobicContact CD2-CG2 4Å
692	D	84.7	Confident	85	Confident	43 Å²	43	44.3 Å²	44.3	23%	0.23	23%	0.226	C	C	.	.			trans	-77.3	116.1	171.8	-172.4	-23.8	0	0	0	108.1	R694 Q695	D692-R694 PolarHBondContact O-N 2.87Å; D692-R694 WeakPolarHBondContact OD1-CB 3.37Å; D692-R694 IonicContact OD1-CZ 3.76Å; D692-R694 PolarHBondContact OD1-N 2.72Å; D692-R694 IonicContact OD1-NE 3.47Å; D692-R694 PolarHBondContact OD1-NE 3.38Å; D692-R694 VanDerWaalsContact OD1-NE 3.08Å; D692-R694 IonicContact OD1-NH2 3.34Å; D692-R694 IonicContact OD2-CZ 2.7Å; D692-R694 IonicContact OD2-NE 3.9Å; D692-R694 IonicContact OD2-NH2 3.01Å; D692-R694 PolarHBondContact OD2-NH2 2.81Å; D692-Q695 HydrophobicContact CB-CB 4.22Å; D692-Q695 HydrophobicContact CB-CG 3.99Å; D692-Q695 PolarHBondContact O-N 3.47Å; D692-Q695 PolarHBondContact OD2-NE2 3.27Å
693	P	80.5	Confident	84.9	Confident	56 Å²	56	46.6 Å²	46.6	36%	0.364	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-13.2	-176.4	26.2	-35.1	0	0	0	113.5	L691	L691-P693 WeakPolarHBondContact O-CD 3.2Å
694	R	86.3	Confident	84.7	Confident	197 Å²	197	47.3 Å²	47.3	74%	0.743	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-4.9	178.2	-55.4	169.6	-62.3	166.8	9.1	113.5	D692	D692-R694 PolarHBondContact O-N 2.87Å; D692-R694 WeakPolarHBondContact OD1-CB 3.37Å; D692-R694 IonicContact OD1-CZ 3.76Å; D692-R694 PolarHBondContact OD1-N 2.72Å; D692-R694 IonicContact OD1-NE 3.47Å; D692-R694 PolarHBondContact OD1-NE 3.38Å; D692-R694 VanDerWaalsContact OD1-NE 3.08Å; D692-R694 IonicContact OD1-NH2 3.34Å; D692-R694 IonicContact OD2-CZ 2.7Å; D692-R694 IonicContact OD2-NE 3.9Å; D692-R694 IonicContact OD2-NH2 3.01Å; D692-R694 PolarHBondContact OD2-NH2 2.81Å
695	Q	88.3	Confident	84.8	Confident	55 Å²	55	44 Å²	44	26%	0.257	23%	0.227	S	C	.	.	S	Bend	trans	-105.1	146.4	177.2	-67.8	-174.9	53.3	0	0	110.3	D692 D699 P738	D692-Q695 HydrophobicContact CB-CB 4.22Å; D692-Q695 HydrophobicContact CB-CG 3.99Å; D692-Q695 PolarHBondContact O-N 3.47Å; D692-Q695 PolarHBondContact OD2-NE2 3.27Å; Q695-D699 HydrophobicContact CB-CB 4.35Å; Q695-P738 WeakPolarHBondContact O-CD 3.41Å
696	T	92.4	Very high	85.3	Confident	20 Å²	20	46.9 Å²	46.9	12%	0.123	23%	0.234	C	C	.	.			trans	-64.1	159	171.9	69.3	0	0	0	0	110.6	G698 D699 S700 A734 R736 Y737	T696-G698 PolarHBondContact O-N 2.89Å; T696-D699 PolarHBondContact O-N 3.44Å; T696-D699 WeakPolarHBondContact OG1-CB 3.4Å; T696-D699 PolarHBondContact OG1-N 2.88Å; T696-D699 VanDerWaalsContact OG1-N 3.11Å; T696-D699 PolarHBondContact OG1-OD2 3.12Å; T696-S700 WeakPolarHBondContact O-CB 3.23Å; T696-S700 PolarHBondContact O-N 3.48Å; T696-S700 PolarHBondContact O-OG 3.44Å; T696-A734 WeakPolarHBondContact CB-O 3.49Å; T696-R736 CarbonylContact C-O 3.52Å; T696-R736 WeakPolarHBondContact CA-O 3.38Å; T696-Y737 HydrophobicContact CG2-CE1 4.19Å
697	I	93.2	Very high	85.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.4	-40	173.4	-65.3	-41.2	0	0	0	111.1	S700 I701 L724 A734 R736 P738 F741 I749	I697-S700 PolarHBondContact O-N 3.17Å; I697-I701 HydrophobicContact CG2-CD1 3.67Å; I697-I701 HydrophobicContact CG2-CG1 4.31Å; I697-I701 WeakPolarHBondContact O-CG1 3.4Å; I697-I701 PolarHBondContact O-N 2.88Å; I697-L724 HydrophobicContact CG2-CD2 4.02Å; I697-A734 PolarHBondContact N-O 3.22Å; I697-R736 WeakPolarHBondContact CG1-O 3.22Å; I697-R736 PolarHBondContact N-O 2.92Å; I697-P738 HydrophobicContact CD1-CB 4.43Å; I697-P738 HydrophobicContact CD1-CG 3.96Å; I697-F741 HydrophobicContact CD1-CD2 4.07Å; I697-F741 HydrophobicContact CD1-CE2 3.85Å; I697-F741 HydrophobicContact CG1-CD2 3.97Å; I697-F741 HydrophobicContact CG1-CE2 3.25Å; I697-F741 HydrophobicContact CG1-CZ 3.75Å; I697-I749 HydrophobicContact CD1-CD1 3.61Å; I697-I749 HydrophobicContact CD1-CG1 4.46Å; I697-I749 HydrophobicContact CD1-CG2 4.19Å; I697-I749 HydrophobicContact CG1-CD1 3.81Å; I697-I749 HydrophobicContact CG2-CB 4.5Å; I697-I749 HydrophobicContact CG2-CD1 4.02Å; I697-I749 HydrophobicContact CG2-CG1 3.83Å; I697-I749 HydrophobicContact CG2-CG2 3.86Å
698	G	92.8	Very high	86.3	Confident	9 Å²	9	47.4 Å²	47.4	9%	0.093	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-44.8	178.4	0	0	0	0	0	112.4	T696 I701 I702 A734	T696-G698 PolarHBondContact O-N 2.89Å; G698-I701 PolarHBondContact O-N 3.24Å; G698-I702 WeakPolarHBondContact O-CG2 3.18Å; G698-I702 PolarHBondContact O-N 2.87Å; G698-I702 VanDerWaalsContact O-N 3.07Å; G698-A734 PolarHBondContact N-O 3.4Å
699	D	91.5	Very high	86.9	Confident	50 Å²	50	45.6 Å²	45.6	27%	0.267	25%	0.251	S	S	.	.	H	α-helix	trans	-64.5	-41.6	175.4	-73.4	-50.7	0	0	0	112	Q695 T696 I701 I702 E703 R706	Q695-D699 HydrophobicContact CB-CB 4.35Å; T696-D699 PolarHBondContact O-N 3.44Å; T696-D699 WeakPolarHBondContact OG1-CB 3.4Å; T696-D699 PolarHBondContact OG1-N 2.88Å; T696-D699 VanDerWaalsContact OG1-N 3.11Å; T696-D699 PolarHBondContact OG1-OD2 3.12Å; D699-I701 PolarHBondContact O-N 2.76Å; D699-I702 WeakPolarHBondContact O-CG2 3.48Å; D699-I702 PolarHBondContact O-N 2.96Å; D699-E703 WeakPolarHBondContact O-CB 3.35Å; D699-E703 PolarHBondContact O-N 3.48Å; D699-R706 IonicContact OD1-CZ 2.8Å; D699-R706 VanDerWaalsContact OD1-CZ 3.28Å; D699-R706 IonicContact OD1-NH1 2.75Å; D699-R706 PolarHBondContact OD1-NH1 3.31Å; D699-R706 IonicContact OD1-NH2 3.7Å; D699-R706 PolarHBondContact OD1-NH2 2.92Å
700	S	92.1	Very high	87.2	Confident	3 Å²	3	45 Å²	45	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-40.1	177.8	-61.7	0	0	0	0	112.6	T696 I697 R753	T696-S700 WeakPolarHBondContact O-CB 3.23Å; T696-S700 PolarHBondContact O-N 3.48Å; T696-S700 PolarHBondContact O-OG 3.44Å; I697-S700 PolarHBondContact O-N 3.17Å; S700-R753 VanDerWaalsContact O-CD 3.28Å; S700-R753 WeakPolarHBondContact O-CD 3.29Å; S700-R753 WeakPolarHBondContact O-CG 3.38Å; S700-R753 PolarHBondContact O-NE 2.71Å
701	I	93	Very high	87.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-72.2	-37.6	179	-69.7	171	0	0	0	111.4	I697 G698 D699 P704 V720 L723 L724 I749 A752	I697-I701 HydrophobicContact CG2-CD1 3.67Å; I697-I701 HydrophobicContact CG2-CG1 4.31Å; I697-I701 WeakPolarHBondContact O-CG1 3.4Å; I697-I701 PolarHBondContact O-N 2.88Å; G698-I701 PolarHBondContact O-N 3.24Å; D699-I701 PolarHBondContact O-N 2.76Å; I701-P704 VanDerWaalsContact O-CD 3.31Å; I701-P704 WeakPolarHBondContact O-CD 3.33Å; I701-V720 HydrophobicContact CB-CG2 4.43Å; I701-V720 HydrophobicContact CG2-CG2 4.15Å; I701-L723 HydrophobicContact CG2-CB 4.33Å; I701-L723 HydrophobicContact CG2-CD1 3.53Å; I701-L724 HydrophobicContact CD1-CD2 3.54Å; I701-L724 HydrophobicContact CD1-CG 3.96Å; I701-I749 HydrophobicContact CD1-CG2 4.36Å; I701-I749 HydrophobicContact CG1-CG2 4.23Å; I701-A752 HydrophobicContact CD1-CB 3.94Å; I701-A752 HydrophobicContact CG1-CB 4.31Å
702	I	91.9	Very high	86.6	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-84.4	-18.6	-177.3	-157.3	77.4	0	0	0	113.4	G698 D699 P704 L705 R706 A716 V720	G698-I702 WeakPolarHBondContact O-CG2 3.18Å; G698-I702 PolarHBondContact O-N 2.87Å; G698-I702 VanDerWaalsContact O-N 3.07Å; D699-I702 WeakPolarHBondContact O-CG2 3.48Å; D699-I702 PolarHBondContact O-N 2.96Å; I702-P704 VanDerWaalsContact C-CD 3.4Å; I702-P704 VanDerWaalsContact C-N 3.32Å; I702-L705 HydrophobicContact CD1-CB 4.12Å; I702-L705 HydrophobicContact CD1-CD1 3.49Å; I702-L705 VanDerWaalsContact CD1-CD1 3.49Å; I702-L705 HydrophobicContact CD1-CG 4.43Å; I702-L705 HydrophobicContact CG1-CB 4.25Å; I702-L705 HydrophobicContact CG1-CD1 4.44Å; I702-L705 WeakPolarHBondContact O-CA 3.4Å; I702-L705 WeakPolarHBondContact O-CB 3.43Å; I702-L705 PolarHBondContact O-N 3.15Å; I702-R706 HydrophobicContact CG1-CG 4.41Å; I702-R706 HydrophobicContact CG2-CG 4.26Å; I702-R706 VanDerWaalsContact CG2-CZ 3.48Å; I702-R706 PolarHBondContact O-N 3.37Å; I702-A716 HydrophobicContact CD1-CB 3.49Å; I702-A716 VanDerWaalsContact CD1-CB 3.49Å; I702-A716 HydrophobicContact CG1-CB 3.79Å; I702-V720 HydrophobicContact CB-CG2 3.99Å; I702-V720 HydrophobicContact CD1-CG2 3.98Å
703	E	89.5	Confident	85.9	Confident	66 Å²	66	53.1 Å²	53.1	31%	0.308	30%	0.299	S	S	.	.	H	α-helix	trans	-45.9	-47	-179.7	-177.5	-167.6	-157.9	0	0	113.4	D699 L705 R706 V707 R753	D699-E703 WeakPolarHBondContact O-CB 3.35Å; D699-E703 PolarHBondContact O-N 3.48Å; E703-L705 VanDerWaalsContact C-N 3.29Å; E703-L705 PolarHBondContact O-N 3.22Å; E703-R706 PolarHBondContact O-N 3.27Å; E703-V707 HydrophobicContact CG-CG2 4.26Å; E703-V707 WeakPolarHBondContact O-CG2 3.46Å; E703-V707 PolarHBondContact O-N 3.11Å; E703-R753 IonicContact OE2-CZ 2.75Å; E703-R753 IonicContact OE2-NE 2.67Å; E703-R753 IonicContact OE2-NH2 3.27Å; E703-R753 PolarHBondContact OE2-NH2 2.86Å
704	P	88.5	Confident	85.5	Confident	17 Å²	17	59.6 Å²	59.6	11%	0.11	32%	0.322	C	S	.	.	H	α-helix	trans	-60.3	-38.2	177.9	-20.9	33.7	0	0	0	112.7	I701 I702 H708 R753 L757	I701-P704 VanDerWaalsContact O-CD 3.31Å; I701-P704 WeakPolarHBondContact O-CD 3.33Å; I702-P704 VanDerWaalsContact C-CD 3.4Å; I702-P704 VanDerWaalsContact C-N 3.32Å; P704-H708 PolarHBondContact O-CD2 2.89Å; P704-H708 PolarHBondContact O-N 3Å; P704-R753 HydrophobicContact CG-CG 3.85Å; P704-L757 HydrophobicContact CB-CD1 3.54Å; P704-L757 HydrophobicContact CB-CD2 4.48Å; P704-L757 HydrophobicContact CB-CG 3.93Å
705	L	87.9	Confident	85.3	Confident	5 Å²	5	55 Å²	55	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-67.5	-42.5	176.9	-72.7	162.7	0	0	0	111.3	I702 E703 H708 G709 L710 L711 R719 A756 L757	I702-L705 HydrophobicContact CD1-CB 4.12Å; I702-L705 HydrophobicContact CD1-CD1 3.49Å; I702-L705 VanDerWaalsContact CD1-CD1 3.49Å; I702-L705 HydrophobicContact CD1-CG 4.43Å; I702-L705 HydrophobicContact CG1-CB 4.25Å; I702-L705 HydrophobicContact CG1-CD1 4.44Å; I702-L705 WeakPolarHBondContact O-CA 3.4Å; I702-L705 WeakPolarHBondContact O-CB 3.43Å; I702-L705 PolarHBondContact O-N 3.15Å; E703-L705 VanDerWaalsContact C-N 3.29Å; E703-L705 PolarHBondContact O-N 3.22Å; L705-H708 CarbonylContact O-C 3.53Å; L705-H708 PolarHBondContact O-N 3.21Å; L705-G709 PolarHBondContact O-N 3.35Å; L705-L710 HydrophobicContact CD2-CB 3.79Å; L705-L710 HydrophobicContact CD2-CD1 4.2Å; L705-L710 PolarHBondContact O-N 2.83Å; L705-L711 HydrophobicContact CD1-CD1 4.11Å; L705-L711 HydrophobicContact CD2-CD1 4.14Å; L705-R719 HydrophobicContact CD1-CG 3.91Å; L705-A756 HydrophobicContact CD1-CB 4.1Å; L705-A756 HydrophobicContact CG-CB 4.29Å; L705-L757 HydrophobicContact CD2-CD2 3.76Å; L705-L757 HydrophobicContact CG-CD2 4.2Å
706	R	87	Confident	85.1	Confident	149 Å²	149	53.1 Å²	53.1	56%	0.562	31%	0.306	S	S	*	.	H	α-helix	trans	-61	-47.6	175.1	-70.1	-178.3	177.4	155.8	2.5	111.8	D699 I702 E703 H708 G709	D699-R706 IonicContact OD1-CZ 2.8Å; D699-R706 VanDerWaalsContact OD1-CZ 3.28Å; D699-R706 IonicContact OD1-NH1 2.75Å; D699-R706 PolarHBondContact OD1-NH1 3.31Å; D699-R706 IonicContact OD1-NH2 3.7Å; D699-R706 PolarHBondContact OD1-NH2 2.92Å; I702-R706 HydrophobicContact CG1-CG 4.41Å; I702-R706 HydrophobicContact CG2-CG 4.26Å; I702-R706 VanDerWaalsContact CG2-CZ 3.48Å; I702-R706 PolarHBondContact O-N 3.37Å; E703-R706 PolarHBondContact O-N 3.27Å; R706-H708 PolarHBondContact O-N 3.17Å; R706-G709 PolarHBondContact O-N 3.21Å
707	V	85.7	Confident	84.8	Confident	90 Å²	90	55.4 Å²	55.4	55%	0.545	33%	0.326	S	S	.	.	H	α-helix	trans	-59.6	-32.4	178.4	169.4	0	0	0	0	112	Q674 E703	Q674-V707 PolarHBondContact NE2-O 3.17Å; E703-V707 HydrophobicContact CG-CG2 4.26Å; E703-V707 WeakPolarHBondContact O-CG2 3.46Å; E703-V707 PolarHBondContact O-N 3.11Å
708	H	81.4	Confident	84.6	Confident	22 Å²	22	58.3 Å²	58.3	10%	0.102	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	0.3	177.2	-76.5	-61	0	0	0	114.3	Q674 R678 P704 L705 R706 L710 L757	Q674-H708 VanDerWaalsContact CG-CE1 3.41Å; Q674-H708 WeakPolarHBondContact CG-CE1 3.38Å; Q674-H708 PolarHBondContact O-CE1 3.45Å; R678-H708 VanDerWaalsContact NE-CG 3.33Å; R678-H708 PolarHBondContact NE-ND1 3.25Å; R678-H708 VanDerWaalsContact NE-ND1 3.2Å; R678-H708 PolarHBondContact NH2-O 2.87Å; P704-H708 PolarHBondContact O-CD2 2.89Å; P704-H708 PolarHBondContact O-N 3Å; L705-H708 CarbonylContact O-C 3.53Å; L705-H708 PolarHBondContact O-N 3.21Å; R706-H708 PolarHBondContact O-N 3.17Å; H708-L710 VanDerWaalsContact C-N 3.3Å; H708-L710 HydrophobicContact CB-CD1 3.98Å; H708-L710 HydrophobicContact CB-CG 4.05Å; H708-L710 PolarHBondContact O-N 2.92Å; H708-L757 HydrophobicContact CB-CD2 4.41Å
709	G	81.2	Confident	84.6	Confident	66 Å²	66	59.8 Å²	59.8	68%	0.68	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	32.3	-178.6	0	0	0	0	0	113.5	L705 R706	L705-G709 PolarHBondContact O-N 3.35Å; R706-G709 PolarHBondContact O-N 3.21Å
710	L	81.3	Confident	84.7	Confident	64 Å²	64	57.8 Å²	57.8	34%	0.335	34%	0.343	S	S	.	.			trans	-106	145.1	-179.3	-60.9	174.4	0	0	0	110.4	L705 H708 L757	L705-L710 HydrophobicContact CD2-CB 3.79Å; L705-L710 HydrophobicContact CD2-CD1 4.2Å; L705-L710 PolarHBondContact O-N 2.83Å; H708-L710 VanDerWaalsContact C-N 3.3Å; H708-L710 HydrophobicContact CB-CD1 3.98Å; H708-L710 HydrophobicContact CB-CG 4.05Å; H708-L710 PolarHBondContact O-N 2.92Å; L710-L757 HydrophobicContact CD1-CD2 3.97Å
711	L	78.9	Confident	84.7	Confident	68 Å²	68	58.9 Å²	58.9	36%	0.356	35%	0.352	S	S	.	.	S	Bend	trans	53.2	65.8	174.5	-61.4	174.1	0	0	0	115.2	L705 D715 R719	L705-L711 HydrophobicContact CD1-CD1 4.11Å; L705-L711 HydrophobicContact CD2-CD1 4.14Å; L711-D715 HydrophobicContact CD2-CB 4.11Å; L711-R719 HydrophobicContact CD1-CB 4.22Å; L711-R719 HydrophobicContact CD1-CG 4.04Å
712	P	69.9	Low	84.8	Confident	112 Å²	112	62.5 Å²	62.5	73%	0.727	37%	0.366	S	S	*	.			trans	-70.8	147.6	174.2	30.4	-33.8	0	0	0	112.3
713	G	69.6	Low	84.9	Confident	62 Å²	62	62.2 Å²	62.2	64%	0.639	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	-138	168	0	0	0	0	0	114.9	D715 A716	G713-D715 PolarHBondContact O-N 3.09Å; G713-A716 VanDerWaalsContact O-CB 3.29Å; G713-A716 WeakPolarHBondContact O-CB 3.45Å; G713-A716 PolarHBondContact O-N 3.06Å; G713-A716 VanDerWaalsContact O-N 3.16Å
714	K	73.1	Confident	85.2	Confident	191 Å²	191	59.1 Å²	59.1	83%	0.83	35%	0.35	S	S	*	.	H	α-helix	trans	-62.6	-29.3	-171.2	-68.3	-175.1	177.1	-177.3	0	113.7	A716 A717 A718	K714-A716 PolarHBondContact O-N 3.24Å; K714-A717 PolarHBondContact O-N 3.11Å; K714-A718 PolarHBondContact O-N 3.25Å
715	D	81.1	Confident	85.5	Confident	102 Å²	102	63.8 Å²	63.8	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-65.7	-26.7	179.7	-61.6	-19.3	0	0	0	112.1	L711 G713 R719	L711-D715 HydrophobicContact CD2-CB 4.11Å; G713-D715 PolarHBondContact O-N 3.09Å; D715-R719 VanDerWaalsContact O-CB 3.31Å; D715-R719 WeakPolarHBondContact O-CB 3.47Å; D715-R719 PolarHBondContact O-N 2.78Å
716	A	84.6	Confident	85.7	Confident	15 Å²	15	69 Å²	69	12%	0.124	39%	0.389	C	S	.	.	H	α-helix	trans	-64.3	-48.6	175	0	0	0	0	0	112.2	I702 G713 K714 A718 R719 V720	I702-A716 HydrophobicContact CD1-CB 3.49Å; I702-A716 VanDerWaalsContact CD1-CB 3.49Å; I702-A716 HydrophobicContact CG1-CB 3.79Å; G713-A716 VanDerWaalsContact O-CB 3.29Å; G713-A716 WeakPolarHBondContact O-CB 3.45Å; G713-A716 PolarHBondContact O-N 3.06Å; G713-A716 VanDerWaalsContact O-N 3.16Å; K714-A716 PolarHBondContact O-N 3.24Å; A716-A718 PolarHBondContact O-N 3.3Å; A716-R719 WeakPolarHBondContact O-CB 3.41Å; A716-R719 PolarHBondContact O-N 3.37Å; A716-V720 WeakPolarHBondContact O-CG2 3.48Å; A716-V720 PolarHBondContact O-N 2.89Å
717	A	85.7	Confident	86	Confident	67 Å²	67	61.9 Å²	61.9	55%	0.554	36%	0.363	S	S	*	.	H	α-helix	trans	-62.9	-42.4	179.4	0	0	0	0	0	111.7	K714 R719 V720 A721	K714-A717 PolarHBondContact O-N 3.11Å; A717-R719 VanDerWaalsContact C-N 3.32Å; A717-R719 PolarHBondContact O-N 2.8Å; A717-V720 PolarHBondContact O-N 3.22Å; A717-A721 WeakPolarHBondContact O-CB 3.36Å; A717-A721 PolarHBondContact O-N 2.87Å
718	A	90.5	Very high	86.2	Confident	62 Å²	62	60.2 Å²	60.2	51%	0.512	36%	0.364	S	S	.	.	H	α-helix	trans	-62.4	-39.5	174.9	0	0	0	0	0	112	K714 A716 A721 W722	K714-A718 PolarHBondContact O-N 3.25Å; A716-A718 PolarHBondContact O-N 3.3Å; A718-A721 PolarHBondContact O-N 2.6Å; A718-W722 WeakPolarHBondContact O-CB 3.49Å; A718-W722 PolarHBondContact O-N 3.14Å
719	R	91.6	Very high	86.7	Confident	40 Å²	40	59.7 Å²	59.7	15%	0.151	36%	0.362	C	S	.	.	H	α-helix	trans	-64.6	-43.1	175.7	-177.8	60.1	172.4	-178.9	2.6	112	L705 L711 D715 A716 A717 W722 L723 L755 A756 N758	L705-R719 HydrophobicContact CD1-CG 3.91Å; L711-R719 HydrophobicContact CD1-CB 4.22Å; L711-R719 HydrophobicContact CD1-CG 4.04Å; D715-R719 VanDerWaalsContact O-CB 3.31Å; D715-R719 WeakPolarHBondContact O-CB 3.47Å; D715-R719 PolarHBondContact O-N 2.78Å; A716-R719 WeakPolarHBondContact O-CB 3.41Å; A716-R719 PolarHBondContact O-N 3.37Å; A717-R719 VanDerWaalsContact C-N 3.32Å; A717-R719 PolarHBondContact O-N 2.8Å; R719-W722 PolarHBondContact O-N 3.41Å; R719-L723 HydrophobicContact CG-CD1 3.99Å; R719-L723 HydrophobicContact CG-CG 4.49Å; R719-L723 WeakPolarHBondContact O-CB 3.48Å; R719-L723 VanDerWaalsContact O-CG 3.22Å; R719-L723 WeakPolarHBondContact O-CG 3.34Å; R719-L723 PolarHBondContact O-N 2.77Å; R719-L755 PolarHBondContact NH2-O 2.89Å; R719-A756 PolarHBondContact NH2-O 2.79Å; R719-A756 VanDerWaalsContact NH2-O 3.12Å; R719-N758 VanDerWaalsContact NH2-CG 3.29Å; R719-N758 PolarHBondContact NH2-ND2 3.2Å; R719-N758 PolarHBondContact NH2-OD1 2.96Å
720	V	93.2	Very high	87.2	Confident	8 Å²	8	60.9 Å²	60.9	5%	0.048	35%	0.352	C	S	.	.	H	α-helix	trans	-61.5	-49	176	169.5	0	0	0	0	110.7	I701 I702 A716 A717 W722 L723 L724 A734	I701-V720 HydrophobicContact CB-CG2 4.43Å; I701-V720 HydrophobicContact CG2-CG2 4.15Å; I702-V720 HydrophobicContact CB-CG2 3.99Å; I702-V720 HydrophobicContact CD1-CG2 3.98Å; A716-V720 WeakPolarHBondContact O-CG2 3.48Å; A716-V720 PolarHBondContact O-N 2.89Å; A717-V720 PolarHBondContact O-N 3.22Å; V720-W722 VanDerWaalsContact C-N 3.34Å; V720-W722 PolarHBondContact O-N 3.42Å; V720-L723 PolarHBondContact O-N 3.46Å; V720-L724 HydrophobicContact CG1-CD1 3.96Å; V720-L724 HydrophobicContact CG1-CG 4.4Å; V720-L724 WeakPolarHBondContact O-CG 3.21Å; V720-L724 PolarHBondContact O-N 2.85Å; V720-A734 HydrophobicContact CG1-CB 3.89Å
721	A	93.8	Very high	87.7	Confident	26 Å²	26	60 Å²	60	22%	0.215	35%	0.351	C	S	.	.	H	α-helix	trans	-55.5	-49.1	177.7	0	0	0	0	0	111.6	A717 A718 L723 L724 E725 P731	A717-A721 WeakPolarHBondContact O-CB 3.36Å; A717-A721 PolarHBondContact O-N 2.87Å; A718-A721 PolarHBondContact O-N 2.6Å; A721-L723 PolarHBondContact O-N 3.09Å; A721-L724 PolarHBondContact O-N 2.89Å; A721-E725 WeakPolarHBondContact O-CG 3.16Å; A721-E725 PolarHBondContact O-N 3.38Å; A721-P731 HydrophobicContact CB-CB 3.82Å; A721-P731 HydrophobicContact CB-CG 4.13Å
722	W	94.1	Very high	88.3	Confident	75 Å²	75	62 Å²	62	28%	0.284	36%	0.358	S	S	.	.	H	α-helix	trans	-63.1	-39.9	177.6	178.9	92.7	0	0	0	112.7	A718 R719 V720 E725 R726 F790	A718-W722 WeakPolarHBondContact O-CB 3.49Å; A718-W722 PolarHBondContact O-N 3.14Å; R719-W722 PolarHBondContact O-N 3.41Å; V720-W722 VanDerWaalsContact C-N 3.34Å; V720-W722 PolarHBondContact O-N 3.42Å; W722-E725 PolarHBondContact O-N 2.95Å; W722-R726 HydrophobicContact CD2-CG 3.96Å; W722-R726 HydrophobicContact CE3-CG 4.09Å; W722-R726 HydrophobicContact CH2-CG 4.09Å; W722-R726 HydrophobicContact CZ2-CG 3.92Å; W722-R726 HydrophobicContact CZ3-CG 4.14Å; W722-R726 WeakPolarHBondContact O-CG 3.25Å; W722-R726 PolarHBondContact O-N 3.15Å; W722-F790 AromaticContact CH2-CE1 3.58Å; W722-F790 HydrophobicContact CH2-CE1 3.58Å; W722-F790 AromaticContact CH2-CZ 3.35Å; W722-F790 HydrophobicContact CH2-CZ 3.35Å; W722-F790 HydrophobicContact CZ2-CE1 4.26Å; W722-F790 AromaticContact CZ2-CZ 3.93Å; W722-F790 HydrophobicContact CZ2-CZ 3.93Å; W722-F790 HydrophobicContact CZ3-CZ 4.31Å
723	L	94.4	Very high	89.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65.3	-41	177.4	-75.4	166.5	0	0	0	111.6	I701 R719 V720 A721 R726 V727 A752 L755 A756	I701-L723 HydrophobicContact CG2-CB 4.33Å; I701-L723 HydrophobicContact CG2-CD1 3.53Å; R719-L723 HydrophobicContact CG-CD1 3.99Å; R719-L723 HydrophobicContact CG-CG 4.49Å; R719-L723 WeakPolarHBondContact O-CB 3.48Å; R719-L723 VanDerWaalsContact O-CG 3.22Å; R719-L723 WeakPolarHBondContact O-CG 3.34Å; R719-L723 PolarHBondContact O-N 2.77Å; V720-L723 PolarHBondContact O-N 3.46Å; A721-L723 PolarHBondContact O-N 3.09Å; L723-R726 PolarHBondContact O-N 3.1Å; L723-V727 WeakPolarHBondContact O-CG2 3.45Å; L723-V727 PolarHBondContact O-N 3.26Å; L723-A752 HydrophobicContact CB-CB 4.2Å; L723-L755 HydrophobicContact CD2-CB 3.71Å; L723-A756 HydrophobicContact CD1-CB 3.92Å
724	L	95.3	Very high	90.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-47.6	175.7	-73.8	172.3	0	0	0	111	I697 I701 V720 A721 R726 V727 G728 L729 A734	I697-L724 HydrophobicContact CG2-CD2 4.02Å; I701-L724 HydrophobicContact CD1-CD2 3.54Å; I701-L724 HydrophobicContact CD1-CG 3.96Å; V720-L724 HydrophobicContact CG1-CD1 3.96Å; V720-L724 HydrophobicContact CG1-CG 4.4Å; V720-L724 WeakPolarHBondContact O-CG 3.21Å; V720-L724 PolarHBondContact O-N 2.85Å; A721-L724 PolarHBondContact O-N 2.89Å; L724-R726 VanDerWaalsContact C-N 3.31Å; L724-R726 PolarHBondContact O-N 2.75Å; L724-V727 CarbonylContact O-C 3.55Å; L724-V727 WeakPolarHBondContact O-CG2 3.3Å; L724-V727 PolarHBondContact O-N 2.92Å; L724-V727 VanDerWaalsContact O-N 3.15Å; L724-G728 PolarHBondContact O-N 2.84Å; L724-L729 CarbonylContact C-O 3.58Å; L724-L729 HydrophobicContact CB-CB 4.17Å; L724-L729 HydrophobicContact CD2-CB 4.03Å; L724-L729 HydrophobicContact CD2-CD1 3.91Å; L724-L729 WeakPolarHBondContact O-CA 3.5Å; L724-L729 PolarHBondContact O-N 2.94Å; L724-L729 VanDerWaalsContact O-O 3.1Å; L724-A734 HydrophobicContact CD1-CB 3.83Å
725	E	94.6	Very high	91.2	Very high	115 Å²	115	56.2 Å²	56.2	54%	0.537	30%	0.301	S	S	.	.	H	α-helix	trans	-59.3	-42.4	176.9	-72.5	173.4	173.4	0	0	111.9	A721 W722 V727 G728 L729 P731	A721-E725 WeakPolarHBondContact O-CG 3.16Å; A721-E725 PolarHBondContact O-N 3.38Å; W722-E725 PolarHBondContact O-N 2.95Å; E725-V727 PolarHBondContact O-N 2.94Å; E725-G728 PolarHBondContact O-N 3.28Å; E725-L729 WeakPolarHBondContact CA-O 3.43Å; E725-L729 PolarHBondContact N-O 3.43Å; E725-P731 HydrophobicContact CG-CG 3.93Å; E725-P731 WeakPolarHBondContact OE1-CG 3.37Å
726	R	93.2	Very high	91.5	Very high	114 Å²	114	55.7 Å²	55.7	43%	0.43	29%	0.292	S	S	.	.	H	α-helix	trans	-61.4	-30.8	178.5	-72.4	-70	170.1	-176	-4.2	113.4	W722 L723 L724 G728 L782 D789	W722-R726 HydrophobicContact CD2-CG 3.96Å; W722-R726 HydrophobicContact CE3-CG 4.09Å; W722-R726 HydrophobicContact CH2-CG 4.09Å; W722-R726 HydrophobicContact CZ2-CG 3.92Å; W722-R726 HydrophobicContact CZ3-CG 4.14Å; W722-R726 WeakPolarHBondContact O-CG 3.25Å; W722-R726 PolarHBondContact O-N 3.15Å; L723-R726 PolarHBondContact O-N 3.1Å; L724-R726 VanDerWaalsContact C-N 3.31Å; L724-R726 PolarHBondContact O-N 2.75Å; R726-G728 VanDerWaalsContact C-N 3.34Å; R726-L782 WeakPolarHBondContact O-CD1 3.41Å; R726-D789 IonicContact NH1-OD2 3.13Å
727	V	92.5	Very high	91.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	9.9	175.7	-56.8	0	0	0	0	112.9	L723 L724 E725 L729 R748 I751 A752 L755 L782	L723-V727 WeakPolarHBondContact O-CG2 3.45Å; L723-V727 PolarHBondContact O-N 3.26Å; L724-V727 CarbonylContact O-C 3.55Å; L724-V727 WeakPolarHBondContact O-CG2 3.3Å; L724-V727 PolarHBondContact O-N 2.92Å; L724-V727 VanDerWaalsContact O-N 3.15Å; E725-V727 PolarHBondContact O-N 2.94Å; V727-L729 HydrophobicContact CG2-CB 4.43Å; V727-L729 HydrophobicContact CG2-CD1 4Å; V727-L729 HydrophobicContact CG2-CG 4.12Å; V727-R748 HydrophobicContact CB-CB 3.97Å; V727-R748 HydrophobicContact CG2-CB 3.96Å; V727-R748 WeakPolarHBondContact O-CD 3.34Å; V727-R748 WeakPolarHBondContact O-CG 3.36Å; V727-R748 PolarHBondContact O-NH1 3.4Å; V727-I751 HydrophobicContact CG1-CB 4.34Å; V727-I751 HydrophobicContact CG1-CG2 4Å; V727-A752 HydrophobicContact CG1-CB 3.86Å; V727-A752 HydrophobicContact CG2-CB 3.93Å; V727-L755 HydrophobicContact CG1-CD1 4.29Å; V727-L782 HydrophobicContact CB-CD2 4.02Å; V727-L782 HydrophobicContact CG1-CD2 4.24Å
728	G	90.6	Very high	91.6	Very high	56 Å²	56	55.4 Å²	55.4	58%	0.577	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	30.1	177	0	0	0	0	0	114.4	L724 E725 R726	L724-G728 PolarHBondContact O-N 2.84Å; E725-G728 PolarHBondContact O-N 3.28Å; R726-G728 VanDerWaalsContact C-N 3.34Å
729	L	92	Very high	91.1	Very high	11 Å²	11	58 Å²	58	6%	0.058	28%	0.275	C	S	.	.			trans	-115.3	153.6	174.2	-63.8	176.2	0	0	0	110.5	L724 E725 V727 Q745 R748 I749	L724-L729 CarbonylContact C-O 3.58Å; L724-L729 HydrophobicContact CB-CB 4.17Å; L724-L729 HydrophobicContact CD2-CB 4.03Å; L724-L729 HydrophobicContact CD2-CD1 3.91Å; L724-L729 WeakPolarHBondContact O-CA 3.5Å; L724-L729 PolarHBondContact O-N 2.94Å; L724-L729 VanDerWaalsContact O-O 3.1Å; E725-L729 WeakPolarHBondContact CA-O 3.43Å; E725-L729 PolarHBondContact N-O 3.43Å; V727-L729 HydrophobicContact CG2-CB 4.43Å; V727-L729 HydrophobicContact CG2-CD1 4Å; V727-L729 HydrophobicContact CG2-CG 4.12Å; L729-Q745 HydrophobicContact CD2-CB 4.25Å; L729-Q745 HydrophobicContact CD2-CG 3.96Å; L729-R748 HydrophobicContact CD1-CB 4.06Å; L729-R748 HydrophobicContact CG-CB 4.38Å; L729-I749 HydrophobicContact CD1-CD1 4.31Å; L729-I749 HydrophobicContact CD1-CG1 3.6Å
730	L	92.4	Very high	90.5	Very high	90 Å²	90	60.8 Å²	60.8	47%	0.471	29%	0.289	S	S	.	.			trans	-79.2	144.7	178	-60.2	175.3	0	0	0	110.5	E732 H733	L730-E732 HydrophobicContact CB-CG 3.7Å; L730-E732 HydrophobicContact CD1-CG 4.37Å; L730-E732 WeakPolarHBondContact CD1-OE1 3.35Å; L730-E732 PolarHBondContact O-N 3.5Å; L730-E732 VanDerWaalsContact O-N 3.17Å; L730-H733 PolarHBondContact N-ND1 2.91Å; L730-H733 VanDerWaalsContact O-CB 3.23Å; L730-H733 WeakPolarHBondContact O-CB 3.19Å; L730-H733 PolarHBondContact O-N 3.31Å
731	P	91.2	Very high	89.8	Confident	47 Å²	47	60.7 Å²	60.7	31%	0.305	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-54	-33.8	176.7	-30.3	37	0	0	0	114.6	A721 E725 H733 A734	A721-P731 HydrophobicContact CB-CB 3.82Å; A721-P731 HydrophobicContact CB-CG 4.13Å; E725-P731 HydrophobicContact CG-CG 3.93Å; E725-P731 WeakPolarHBondContact OE1-CG 3.37Å; P731-H733 PolarHBondContact O-N 3.46Å; P731-A734 VanDerWaalsContact O-CB 3.25Å; P731-A734 WeakPolarHBondContact O-CB 3.27Å; P731-A734 PolarHBondContact O-N 2.85Å; P731-A734 VanDerWaalsContact O-N 3.11Å
732	E	90.1	Very high	88.9	Confident	110 Å²	110	62.2 Å²	62.2	51%	0.514	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-61.1	-22.4	176.9	64.8	-157.4	-137.3	0	0	114	L730 A734 W735	L730-E732 HydrophobicContact CB-CG 3.7Å; L730-E732 HydrophobicContact CD1-CG 4.37Å; L730-E732 WeakPolarHBondContact CD1-OE1 3.35Å; L730-E732 PolarHBondContact O-N 3.5Å; L730-E732 VanDerWaalsContact O-N 3.17Å; E732-A734 PolarHBondContact O-N 3.16Å; E732-W735 PolarHBondContact O-N 3.33Å
733	H	91.7	Very high	87.9	Confident	17 Å²	17	60 Å²	60	8%	0.079	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-65.5	-14.6	174.9	-67.9	169	0	0	0	113.1	L730 P731 W735 R736 F741	L730-H733 PolarHBondContact N-ND1 2.91Å; L730-H733 VanDerWaalsContact O-CB 3.23Å; L730-H733 WeakPolarHBondContact O-CB 3.19Å; L730-H733 PolarHBondContact O-N 3.31Å; P731-H733 PolarHBondContact O-N 3.46Å; H733-W735 PolarHBondContact O-N 3.41Å; H733-R736 PolarHBondContact CD2-NH1 2.99Å; H733-R736 PolarHBondContact NE2-NH1 3.09Å; H733-R736 PolarHBondContact O-N 3.08Å; H733-F741 HydrophobicContact CB-CE1 3.82Å; H733-F741 HydrophobicContact CB-CZ 3.74Å; H733-F741 AromaticContact CG-CE1 3.78Å; H733-F741 AromaticContact ND1-CE1 3.91Å
734	A	91.4	Very high	87.2	Confident	15 Å²	15	60.3 Å²	60.3	12%	0.124	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-57.8	-30.2	177.3	0	0	0	0	0	113.3	T696 I697 G698 V720 L724 P731 E732	T696-A734 WeakPolarHBondContact CB-O 3.49Å; I697-A734 PolarHBondContact N-O 3.22Å; G698-A734 PolarHBondContact N-O 3.4Å; V720-A734 HydrophobicContact CG1-CB 3.89Å; L724-A734 HydrophobicContact CD1-CB 3.83Å; P731-A734 VanDerWaalsContact O-CB 3.25Å; P731-A734 WeakPolarHBondContact O-CB 3.27Å; P731-A734 PolarHBondContact O-N 2.85Å; P731-A734 VanDerWaalsContact O-N 3.11Å; E732-A734 PolarHBondContact O-N 3.16Å
735	W	91.2	Very high	86.7	Confident	211 Å²	211	63.2 Å²	63.2	80%	0.799	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-86.6	-8.7	-176.2	-56.1	105.5	0	0	0	114.3	E732 H733	E732-W735 PolarHBondContact O-N 3.33Å; H733-W735 PolarHBondContact O-N 3.41Å
736	R	88.6	Confident	86.5	Confident	91 Å²	91	60.2 Å²	60.2	34%	0.343	30%	0.299	S	S	.	.	S	Bend	trans	-84.8	166.5	-179.8	-65.6	-173.5	-169	167.9	6.8	111.3	T696 I697 H733 E740 F741	T696-R736 CarbonylContact C-O 3.52Å; T696-R736 WeakPolarHBondContact CA-O 3.38Å; I697-R736 WeakPolarHBondContact CG1-O 3.22Å; I697-R736 PolarHBondContact N-O 2.92Å; H733-R736 PolarHBondContact CD2-NH1 2.99Å; H733-R736 PolarHBondContact NE2-NH1 3.09Å; H733-R736 PolarHBondContact O-N 3.08Å; R736-E740 VanDerWaalsContact CA-OE2 3.27Å; R736-E740 WeakPolarHBondContact CA-OE2 3.43Å; R736-E740 VanDerWaalsContact CB-OE2 3.25Å; R736-E740 WeakPolarHBondContact CB-OE2 3.42Å; R736-F741 HydrophobicContact CB-CE2 3.5Å; R736-F741 VanDerWaalsContact CB-CE2 3.5Å; R736-F741 HydrophobicContact CB-CZ 3.63Å; R736-F741 HydrophobicContact CG-CZ 4.36Å
737	Y	88.3	Confident	86.3	Confident	76 Å²	76	54.9 Å²	54.9	30%	0.298	28%	0.278	S	S	.	.			trans	-102.1	156.7	177.8	-67.5	-81.9	0	0	0	112.2	T696 H739 E740 F741	T696-Y737 HydrophobicContact CG2-CE1 4.19Å; Y737-H739 WeakPolarHBondContact CB-CE1 3.37Å; Y737-H739 PolarHBondContact O-N 3.03Å; Y737-E740 PolarHBondContact N-OE2 2.73Å; Y737-E740 WeakPolarHBondContact O-CB 3.45Å; Y737-E740 PolarHBondContact O-N 3.36Å; Y737-F741 VanDerWaalsContact O-CD2 3.23Å; Y737-F741 WeakPolarHBondContact O-CD2 3.38Å; Y737-F741 WeakPolarHBondContact O-CE2 3.38Å
738	P	83.5	Confident	86.3	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-54.6	-30	-176.1	-30	36	0	0	0	116.2	L691 Q695 I697 E740 R746	L691-P738 HydrophobicContact CB-CB 4.21Å; L691-P738 HydrophobicContact CB-CG 3.87Å; L691-P738 HydrophobicContact CD1-CB 4.15Å; L691-P738 HydrophobicContact CD1-CG 4.29Å; Q695-P738 WeakPolarHBondContact O-CD 3.41Å; I697-P738 HydrophobicContact CD1-CB 4.43Å; I697-P738 HydrophobicContact CD1-CG 3.96Å; P738-E740 VanDerWaalsContact C-N 3.27Å; P738-E740 PolarHBondContact O-N 3.1Å; P738-R746 WeakPolarHBondContact O-CD 3.22Å; P738-R746 PolarHBondContact O-NH1 2.64Å
739	H	78.9	Confident	86.4	Confident	116 Å²	116	54 Å²	54	54%	0.537	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-72.4	-20.1	-178.7	63.1	-92.7	0	0	0	113.1	Y737 F741	Y737-H739 WeakPolarHBondContact CB-CE1 3.37Å; Y737-H739 PolarHBondContact O-N 3.03Å; H739-F741 VanDerWaalsContact C-N 3.26Å; H739-F741 PolarHBondContact O-N 2.9Å
740	E	79.3	Confident	86.4	Confident	98 Å²	98	53.9 Å²	53.9	46%	0.458	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-81.7	0.6	179.8	-57.3	-179.3	87.4	0	0	113.6	R736 Y737 P738	R736-E740 VanDerWaalsContact CA-OE2 3.27Å; R736-E740 WeakPolarHBondContact CA-OE2 3.43Å; R736-E740 VanDerWaalsContact CB-OE2 3.25Å; R736-E740 WeakPolarHBondContact CB-OE2 3.42Å; Y737-E740 PolarHBondContact N-OE2 2.73Å; Y737-E740 WeakPolarHBondContact O-CB 3.45Å; Y737-E740 PolarHBondContact O-N 3.36Å; P738-E740 VanDerWaalsContact C-N 3.27Å; P738-E740 PolarHBondContact O-N 3.1Å
741	F	78.1	Confident	86.5	Confident	6 Å²	6	49.6 Å²	49.6	3%	0.026	24%	0.235	C	C	.	.	S	Bend	trans	-112.3	148.9	-177.3	-68.3	-83.4	0	0	0	112.4	I697 H733 R736 Y737 H739 Q745 R746 I749	I697-F741 HydrophobicContact CD1-CD2 4.07Å; I697-F741 HydrophobicContact CD1-CE2 3.85Å; I697-F741 HydrophobicContact CG1-CD2 3.97Å; I697-F741 HydrophobicContact CG1-CE2 3.25Å; I697-F741 HydrophobicContact CG1-CZ 3.75Å; H733-F741 HydrophobicContact CB-CE1 3.82Å; H733-F741 HydrophobicContact CB-CZ 3.74Å; H733-F741 AromaticContact CG-CE1 3.78Å; H733-F741 AromaticContact ND1-CE1 3.91Å; R736-F741 HydrophobicContact CB-CE2 3.5Å; R736-F741 VanDerWaalsContact CB-CE2 3.5Å; R736-F741 HydrophobicContact CB-CZ 3.63Å; R736-F741 HydrophobicContact CG-CZ 4.36Å; Y737-F741 VanDerWaalsContact O-CD2 3.23Å; Y737-F741 WeakPolarHBondContact O-CD2 3.38Å; Y737-F741 WeakPolarHBondContact O-CE2 3.38Å; H739-F741 VanDerWaalsContact C-N 3.26Å; H739-F741 PolarHBondContact O-N 2.9Å; F741-Q745 HydrophobicContact CB-CB 3.89Å; F741-Q745 HydrophobicContact CD1-CB 3.79Å; F741-Q745 HydrophobicContact CD1-CG 4.43Å; F741-Q745 HydrophobicContact CG-CB 4.27Å; F741-R746 HydrophobicContact CB-CG 3.81Å; F741-R746 PolarHBondContact O-NH1 3.06Å; F741-I749 HydrophobicContact CB-CD1 4.39Å; F741-I749 HydrophobicContact CD1-CD1 3.99Å; F741-I749 HydrophobicContact CD2-CD1 3.91Å; F741-I749 HydrophobicContact CE1-CD1 4.22Å; F741-I749 HydrophobicContact CE2-CD1 4.18Å; F741-I749 HydrophobicContact CG-CD1 3.81Å; F741-I749 HydrophobicContact CZ-CD1 4.31Å
742	S	74.6	Confident	86.7	Confident	58 Å²	58	47.3 Å²	47.3	41%	0.406	22%	0.221	S	C	.	.			trans	-67.4	161.2	169	77.3	0	0	0	0	111.4	G744 Q745 R746	S742-G744 PolarHBondContact O-N 3.1Å; S742-Q745 PolarHBondContact O-N 2.94Å; S742-Q745 WeakPolarHBondContact OG-CG 3.09Å; S742-Q745 PolarHBondContact OG-N 3.06Å; S742-Q745 PolarHBondContact OG-OE1 3Å; S742-R746 PolarHBondContact O-N 3.09Å
743	G	73.2	Confident	86.8	Confident	30 Å²	30	44.9 Å²	44.9	31%	0.309	21%	0.207	S	C	.	.	H	α-helix	trans	-53.4	-40.6	176.2	0	0	0	0	0	113	R746 Q747	G743-R746 PolarHBondContact O-N 3.5Å; G743-Q747 PolarHBondContact O-N 3.05Å
744	G	79.6	Confident	86.9	Confident	5 Å²	5	44.2 Å²	44.2	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-65.6	-39.7	175.7	0	0	0	0	0	114.3	S742 Q747 R748 I775	S742-G744 PolarHBondContact O-N 3.1Å; G744-Q747 WeakPolarHBondContact O-CB 3.28Å; G744-Q747 PolarHBondContact O-N 3.41Å; G744-R748 WeakPolarHBondContact O-CG 3.15Å; G744-R748 PolarHBondContact O-N 3.18Å; G744-I775 VanDerWaalsContact CA-CG2 3.4Å
745	Q	86.4	Confident	87	Confident	61 Å²	61	43.7 Å²	43.7	29%	0.285	20%	0.199	S	C	.	.	H	α-helix	trans	-69.2	-40.5	175.6	-70.2	172.7	-38.3	0	0	111.3	L729 F741 S742 Q747 R748 I749	L729-Q745 HydrophobicContact CD2-CB 4.25Å; L729-Q745 HydrophobicContact CD2-CG 3.96Å; F741-Q745 HydrophobicContact CB-CB 3.89Å; F741-Q745 HydrophobicContact CD1-CB 3.79Å; F741-Q745 HydrophobicContact CD1-CG 4.43Å; F741-Q745 HydrophobicContact CG-CB 4.27Å; S742-Q745 PolarHBondContact O-N 2.94Å; S742-Q745 WeakPolarHBondContact OG-CG 3.09Å; S742-Q745 PolarHBondContact OG-N 3.06Å; S742-Q745 PolarHBondContact OG-OE1 3Å; Q745-Q747 VanDerWaalsContact C-N 3.28Å; Q745-Q747 PolarHBondContact O-N 2.93Å; Q745-R748 WeakPolarHBondContact O-CB 3.31Å; Q745-R748 PolarHBondContact O-N 2.86Å; Q745-R748 VanDerWaalsContact O-N 3.15Å; Q745-I749 WeakPolarHBondContact O-CD1 3.39Å; Q745-I749 WeakPolarHBondContact O-CG1 3.07Å; Q745-I749 PolarHBondContact O-N 2.98Å
746	R	89.2	Confident	87.1	Confident	53 Å²	53	33.7 Å²	33.7	20%	0.2	16%	0.162	C	C	.	.	H	α-helix	trans	-58.9	-39.9	172.1	-72.7	-168.3	-84.9	-107.8	3.6	111.9	P687 P738 F741 S742 G743 I749 C750	P687-R746 HydrophobicContact CB-CB 3.85Å; P738-R746 WeakPolarHBondContact O-CD 3.22Å; P738-R746 PolarHBondContact O-NH1 2.64Å; F741-R746 HydrophobicContact CB-CG 3.81Å; F741-R746 PolarHBondContact O-NH1 3.06Å; S742-R746 PolarHBondContact O-N 3.09Å; G743-R746 PolarHBondContact O-N 3.5Å; R746-I749 WeakPolarHBondContact O-CB 3.38Å; R746-I749 PolarHBondContact O-N 3.48Å; R746-C750 PolarHBondContact O-N 3.06Å; R746-C750 PolarHBondContact O-SG 3.07Å
747	Q	89.1	Confident	87.1	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-62.2	-45.2	174.1	-170.3	65.9	40.6	0	0	111.9	P687 G743 G744 Q745 I749 C750 I751 A767 L771 I779	P687-Q747 HydrophobicContact CG-CB 4.49Å; G743-Q747 PolarHBondContact O-N 3.05Å; G744-Q747 WeakPolarHBondContact O-CB 3.28Å; G744-Q747 PolarHBondContact O-N 3.41Å; Q745-Q747 VanDerWaalsContact C-N 3.28Å; Q745-Q747 PolarHBondContact O-N 2.93Å; Q747-I749 VanDerWaalsContact C-N 3.29Å; Q747-I749 PolarHBondContact O-N 2.76Å; Q747-C750 WeakPolarHBondContact O-CB 3.44Å; Q747-C750 PolarHBondContact O-N 3.02Å; Q747-C750 VanDerWaalsContact O-N 3.14Å; Q747-I751 HydrophobicContact CG-CD1 4.24Å; Q747-I751 WeakPolarHBondContact O-CG1 3.48Å; Q747-I751 PolarHBondContact O-N 2.94Å; Q747-A767 WeakPolarHBondContact CG-O 3.22Å; Q747-A767 PolarHBondContact NE2-O 3.03Å; Q747-A767 VanDerWaalsContact NE2-O 3.11Å; Q747-A767 PolarHBondContact OE1-O 2.86Å; Q747-L771 HydrophobicContact CB-CD1 4.03Å; Q747-L771 HydrophobicContact CG-CD1 3.98Å; Q747-I779 HydrophobicContact CB-CD1 4.27Å; Q747-I779 HydrophobicContact CG-CD1 4.2Å; Q747-I779 HydrophobicContact CG-CG1 4.32Å; Q747-I779 HydrophobicContact CG-CG2 4.19Å
748	R	92.1	Very high	87.2	Confident	38 Å²	38	30.9 Å²	30.9	14%	0.143	16%	0.158	C	C	.	.	H	α-helix	trans	-57.7	-41.9	174.9	-71.9	167.8	-178	-89.2	6	111.4	V727 L729 G744 Q745 I751 A752 I779 L782	V727-R748 HydrophobicContact CB-CB 3.97Å; V727-R748 HydrophobicContact CG2-CB 3.96Å; V727-R748 WeakPolarHBondContact O-CD 3.34Å; V727-R748 WeakPolarHBondContact O-CG 3.36Å; V727-R748 PolarHBondContact O-NH1 3.4Å; L729-R748 HydrophobicContact CD1-CB 4.06Å; L729-R748 HydrophobicContact CG-CB 4.38Å; G744-R748 WeakPolarHBondContact O-CG 3.15Å; G744-R748 PolarHBondContact O-N 3.18Å; Q745-R748 WeakPolarHBondContact O-CB 3.31Å; Q745-R748 PolarHBondContact O-N 2.86Å; Q745-R748 VanDerWaalsContact O-N 3.15Å; R748-I751 WeakPolarHBondContact O-CB 3.31Å; R748-I751 PolarHBondContact O-N 3.07Å; R748-A752 PolarHBondContact O-N 3.19Å; R748-I779 HydrophobicContact CG-CD1 3.59Å; R748-L782 HydrophobicContact CG-CD2 4.09Å
749	I	93.5	Very high	87.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-44.5	174.4	-68.2	156.6	0	0	0	111.4	L691 I697 I701 L729 F741 Q745 R746 Q747 I751 A752 R753	L691-I749 HydrophobicContact CD1-CG2 4.05Å; L691-I749 HydrophobicContact CD2-CG2 4Å; I697-I749 HydrophobicContact CD1-CD1 3.61Å; I697-I749 HydrophobicContact CD1-CG1 4.46Å; I697-I749 HydrophobicContact CD1-CG2 4.19Å; I697-I749 HydrophobicContact CG1-CD1 3.81Å; I697-I749 HydrophobicContact CG2-CB 4.5Å; I697-I749 HydrophobicContact CG2-CD1 4.02Å; I697-I749 HydrophobicContact CG2-CG1 3.83Å; I697-I749 HydrophobicContact CG2-CG2 3.86Å; I701-I749 HydrophobicContact CD1-CG2 4.36Å; I701-I749 HydrophobicContact CG1-CG2 4.23Å; L729-I749 HydrophobicContact CD1-CD1 4.31Å; L729-I749 HydrophobicContact CD1-CG1 3.6Å; F741-I749 HydrophobicContact CB-CD1 4.39Å; F741-I749 HydrophobicContact CD1-CD1 3.99Å; F741-I749 HydrophobicContact CD2-CD1 3.91Å; F741-I749 HydrophobicContact CE1-CD1 4.22Å; F741-I749 HydrophobicContact CE2-CD1 4.18Å; F741-I749 HydrophobicContact CG-CD1 3.81Å; F741-I749 HydrophobicContact CZ-CD1 4.31Å; Q745-I749 WeakPolarHBondContact O-CD1 3.39Å; Q745-I749 WeakPolarHBondContact O-CG1 3.07Å; Q745-I749 PolarHBondContact O-N 2.98Å; R746-I749 WeakPolarHBondContact O-CB 3.38Å; R746-I749 PolarHBondContact O-N 3.48Å; Q747-I749 VanDerWaalsContact C-N 3.29Å; Q747-I749 PolarHBondContact O-N 2.76Å; I749-I751 VanDerWaalsContact C-N 3.31Å; I749-I751 PolarHBondContact O-N 3.37Å; I749-A752 WeakPolarHBondContact O-CB 3.47Å; I749-A752 PolarHBondContact O-N 3.43Å; I749-A752 VanDerWaalsContact O-N 3.17Å; I749-R753 PolarHBondContact O-N 3.44Å
750	C	93	Very high	88.4	Confident	8 Å²	8	30.3 Å²	30.3	5%	0.054	16%	0.155	C	C	.	.	H	α-helix	trans	-63	-38.7	177.5	-64.7	0	0	0	0	111.9	S690 R746 Q747 R753 A754	S690-C750 PolarHBondContact OG-SG 3.06Å; R746-C750 PolarHBondContact O-N 3.06Å; R746-C750 PolarHBondContact O-SG 3.07Å; Q747-C750 WeakPolarHBondContact O-CB 3.44Å; Q747-C750 PolarHBondContact O-N 3.02Å; Q747-C750 VanDerWaalsContact O-N 3.14Å; C750-R753 PolarHBondContact O-N 3.36Å; C750-A754 PolarHBondContact O-N 3.27Å
751	I	93.6	Very high	89.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.5	-46.2	172.3	-66.7	163.5	0	0	0	110.2	I683 V727 Q747 R748 I749 R753 A754 L755 I779 L782 L783 L786	I683-I751 HydrophobicContact CD1-CG1 3.85Å; V727-I751 HydrophobicContact CG1-CB 4.34Å; V727-I751 HydrophobicContact CG1-CG2 4Å; Q747-I751 HydrophobicContact CG-CD1 4.24Å; Q747-I751 WeakPolarHBondContact O-CG1 3.48Å; Q747-I751 PolarHBondContact O-N 2.94Å; R748-I751 WeakPolarHBondContact O-CB 3.31Å; R748-I751 PolarHBondContact O-N 3.07Å; I749-I751 VanDerWaalsContact C-N 3.31Å; I749-I751 PolarHBondContact O-N 3.37Å; I751-R753 VanDerWaalsContact C-N 3.33Å; I751-R753 PolarHBondContact O-N 3.31Å; I751-A754 PolarHBondContact O-N 3.27Å; I751-L755 HydrophobicContact CG2-CD1 3.99Å; I751-L755 HydrophobicContact CG2-CG 4.38Å; I751-L755 VanDerWaalsContact O-CG 3.31Å; I751-L755 WeakPolarHBondContact O-CG 3.31Å; I751-L755 PolarHBondContact O-N 2.95Å; I751-I779 HydrophobicContact CD1-CD1 4.43Å; I751-I779 HydrophobicContact CD1-CG2 3.84Å; I751-L782 HydrophobicContact CD1-CD2 3.94Å; I751-L782 HydrophobicContact CG2-CD2 4.46Å; I751-L783 HydrophobicContact CD1-CD2 4.11Å; I751-L783 HydrophobicContact CG1-CD2 4.34Å; I751-L786 HydrophobicContact CG2-CD1 3.42Å; I751-L786 VanDerWaalsContact CG2-CD1 3.42Å
752	A	94.5	Very high	90	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.2	-42.3	176.9	0	0	0	0	0	112.3	I701 L723 V727 R748 I749 L755 A756	I701-A752 HydrophobicContact CD1-CB 3.94Å; I701-A752 HydrophobicContact CG1-CB 4.31Å; L723-A752 HydrophobicContact CB-CB 4.2Å; V727-A752 HydrophobicContact CG1-CB 3.86Å; V727-A752 HydrophobicContact CG2-CB 3.93Å; R748-A752 PolarHBondContact O-N 3.19Å; I749-A752 WeakPolarHBondContact O-CB 3.47Å; I749-A752 PolarHBondContact O-N 3.43Å; I749-A752 VanDerWaalsContact O-N 3.17Å; A752-L755 PolarHBondContact O-N 2.98Å; A752-A756 PolarHBondContact O-N 2.95Å; A752-A756 VanDerWaalsContact O-N 3.12Å
753	R	93.8	Very high	91	Very high	58 Å²	58	22.6 Å²	22.6	22%	0.219	11%	0.113	C	C	.	.	H	α-helix	trans	-61.4	-43.5	174.6	-175.8	179.3	177.7	-156.7	4.8	111.8	S690 S700 E703 P704 I749 C750 I751 L755 A756	S690-R753 PolarHBondContact O-NH1 3.01Å; S700-R753 VanDerWaalsContact O-CD 3.28Å; S700-R753 WeakPolarHBondContact O-CD 3.29Å; S700-R753 WeakPolarHBondContact O-CG 3.38Å; S700-R753 PolarHBondContact O-NE 2.71Å; E703-R753 IonicContact OE2-CZ 2.75Å; E703-R753 IonicContact OE2-NE 2.67Å; E703-R753 IonicContact OE2-NH2 3.27Å; E703-R753 PolarHBondContact OE2-NH2 2.86Å; P704-R753 HydrophobicContact CG-CG 3.85Å; I749-R753 PolarHBondContact O-N 3.44Å; C750-R753 PolarHBondContact O-N 3.36Å; I751-R753 VanDerWaalsContact C-N 3.33Å; I751-R753 PolarHBondContact O-N 3.31Å; R753-L755 VanDerWaalsContact C-N 3.32Å; R753-L755 PolarHBondContact O-N 3.11Å; R753-A756 VanDerWaalsContact O-CB 3.25Å; R753-A756 WeakPolarHBondContact O-CB 3.41Å; R753-A756 PolarHBondContact O-N 2.81Å
754	A	92.9	Very high	92	Very high	4 Å²	4	21.2 Å²	21.2	3%	0.033	10%	0.098	C	C	.	.	H	α-helix	trans	-64.6	-35.4	175.1	0	0	0	0	0	112.2	Q681 I683 C750 I751 A756 P759 I762	Q681-A754 HydrophobicContact CB-CB 4.05Å; Q681-A754 VanDerWaalsContact CG-O 3.3Å; Q681-A754 WeakPolarHBondContact CG-O 3.44Å; I683-A754 HydrophobicContact CD1-CB 4.38Å; I683-A754 HydrophobicContact CG1-CB 3.83Å; C750-A754 PolarHBondContact O-N 3.27Å; I751-A754 PolarHBondContact O-N 3.27Å; A754-A756 VanDerWaalsContact C-N 3.27Å; A754-A756 PolarHBondContact O-N 3.19Å; A754-P759 WeakPolarHBondContact O-CD 3.19Å; A754-P759 WeakPolarHBondContact O-CG 3.39Å; A754-I762 HydrophobicContact CB-CD1 4.43Å
755	L	93.6	Very high	92.6	Very high	4 Å²	4	21 Å²	21	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-73.5	-15.8	177.2	-69.1	170.9	0	0	0	113.9	R719 L723 V727 I751 A752 R753 L757 N758 I762 L786 F790 I792	R719-L755 PolarHBondContact NH2-O 2.89Å; L723-L755 HydrophobicContact CD2-CB 3.71Å; V727-L755 HydrophobicContact CG1-CD1 4.29Å; I751-L755 HydrophobicContact CG2-CD1 3.99Å; I751-L755 HydrophobicContact CG2-CG 4.38Å; I751-L755 VanDerWaalsContact O-CG 3.31Å; I751-L755 WeakPolarHBondContact O-CG 3.31Å; I751-L755 PolarHBondContact O-N 2.95Å; A752-L755 PolarHBondContact O-N 2.98Å; R753-L755 VanDerWaalsContact C-N 3.32Å; R753-L755 PolarHBondContact O-N 3.11Å; L755-L757 PolarHBondContact O-N 2.86Å; L755-N758 PolarHBondContact O-N 3.05Å; L755-I762 HydrophobicContact CD2-CD1 4.17Å; L755-L786 HydrophobicContact CD1-CD1 3.72Å; L755-L786 HydrophobicContact CD1-CD2 3.52Å; L755-L786 HydrophobicContact CD1-CG 4.22Å; L755-L786 HydrophobicContact CD2-CD1 4.47Å; L755-L786 HydrophobicContact CD2-CD2 4.34Å; L755-L786 HydrophobicContact CG-CD1 4.48Å; L755-F790 HydrophobicContact CD2-CD2 4.49Å; L755-I792 HydrophobicContact CD2-CD1 3.5Å
756	A	92.4	Very high	92.6	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.008	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-38.6	-172.4	0	0	0	0	0	112.9	L705 R719 L723 A752 R753 A754	L705-A756 HydrophobicContact CD1-CB 4.1Å; L705-A756 HydrophobicContact CG-CB 4.29Å; R719-A756 PolarHBondContact NH2-O 2.79Å; R719-A756 VanDerWaalsContact NH2-O 3.12Å; L723-A756 HydrophobicContact CD1-CB 3.92Å; A752-A756 PolarHBondContact O-N 2.95Å; A752-A756 VanDerWaalsContact O-N 3.12Å; R753-A756 VanDerWaalsContact O-CB 3.25Å; R753-A756 WeakPolarHBondContact O-CB 3.41Å; R753-A756 PolarHBondContact O-N 2.81Å; A754-A756 VanDerWaalsContact C-N 3.27Å; A754-A756 PolarHBondContact O-N 3.19Å
757	L	89.6	Confident	92.5	Very high	16 Å²	16	16 Å²	16	8%	0.084	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	7.3	-176.8	-65.7	167.8	0	0	0	115.1	P704 L705 H708 L710 L755	P704-L757 HydrophobicContact CB-CD1 3.54Å; P704-L757 HydrophobicContact CB-CD2 4.48Å; P704-L757 HydrophobicContact CB-CG 3.93Å; L705-L757 HydrophobicContact CD2-CD2 3.76Å; L705-L757 HydrophobicContact CG-CD2 4.2Å; H708-L757 HydrophobicContact CB-CD2 4.41Å; L710-L757 HydrophobicContact CD1-CD2 3.97Å; L755-L757 PolarHBondContact O-N 2.86Å
758	N	89.9	Confident	92.3	Very high	91 Å²	91	16 Å²	16	49%	0.487	8%	0.075	S	C	.	.			trans	51	61.3	-174.4	-61.8	-49.4	0	0	0	113	R719 L755	R719-N758 VanDerWaalsContact NH2-CG 3.29Å; R719-N758 PolarHBondContact NH2-ND2 3.2Å; R719-N758 PolarHBondContact NH2-OD1 2.96Å; L755-N758 PolarHBondContact O-N 3.05Å
759	P	93.5	Very high	91.2	Very high	7 Å²	7	15 Å²	15	5%	0.045	7%	0.074	C	C	.	.			trans	-66.9	154.2	-175.5	28.8	-35.6	0	0	0	113.3	Q681 A754 I762	Q681-P759 HydrophobicContact CB-CB 4.17Å; Q681-P759 HydrophobicContact CB-CG 4.32Å; Q681-P759 HydrophobicContact CG-CB 3.62Å; Q681-P759 HydrophobicContact CG-CG 3.93Å; A754-P759 WeakPolarHBondContact O-CD 3.19Å; A754-P759 WeakPolarHBondContact O-CG 3.39Å; P759-I762 HydrophobicContact CB-CG1 4.09Å; P759-I762 HydrophobicContact CG-CD1 3.69Å; P759-I762 HydrophobicContact CG-CG1 3.58Å
760	K	94.1	Very high	89.9	Confident	98 Å²	98	18.5 Å²	18.5	43%	0.426	10%	0.103	S	C	.	.	S	Bend	trans	-89.1	-31.7	167	-64.5	179	179.4	173.7	0	111.9	V590 F660 N661 D679 A793	V590-K760 HydrophobicContact CG2-CB 4.3Å; F660-K760 HydrophobicContact CZ-CB 4.27Å; F660-K760 HydrophobicContact CZ-CD 4.24Å; N661-K760 WeakPolarHBondContact ND2-CD 3.3Å; N661-K760 PolarHBondContact ND2-NZ 3.4Å; D679-K760 PolarHBondContact O-N 3.04Å; K760-A793 PolarHBondContact O-N 3.19Å
761	V	95.5	Very high	89	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.1	178.7	177.2	0	0	0	0	109.7	V590 L624 F660 D679 I680 Q681 A793	V590-V761 HydrophobicContact CB-CG2 4.45Å; V590-V761 HydrophobicContact CG1-CG2 3.72Å; V590-V761 HydrophobicContact CG2-CG2 3.82Å; L624-V761 HydrophobicContact CD2-CG1 3.88Å; L624-V761 HydrophobicContact CD2-CG2 4.14Å; F660-V761 HydrophobicContact CE2-CG2 3.79Å; D679-V761 PolarHBondContact O-N 3.42Å; I680-V761 WeakPolarHBondContact CA-O 3.36Å; I680-V761 HydrophobicContact CG1-CB 4.25Å; I680-V761 HydrophobicContact CG2-CB 4.14Å; I680-V761 HydrophobicContact CG2-CG1 4.08Å; Q681-V761 PolarHBondContact N-O 3.4Å; V761-A793 CarbonylContact C-O 3.51Å; V761-A793 VanDerWaalsContact CA-O 3.27Å; V761-A793 WeakPolarHBondContact CA-O 3.29Å; V761-A793 HydrophobicContact CG2-CB 4.26Å
762	I	96.1	Very high	87.9	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.4	168.1	-64.4	-177.9	0	0	0	108.6	Q681 I683 A754 L755 P759 I792 A793 Y794 L795	Q681-I762 HydrophobicContact CB-CG1 4.38Å; Q681-I762 WeakPolarHBondContact O-CA 3.31Å; I683-I762 HydrophobicContact CD1-CG2 3.61Å; I683-I762 HydrophobicContact CG1-CG2 3.9Å; A754-I762 HydrophobicContact CB-CD1 4.43Å; L755-I762 HydrophobicContact CD2-CD1 4.17Å; P759-I762 HydrophobicContact CB-CG1 4.09Å; P759-I762 HydrophobicContact CG-CD1 3.69Å; P759-I762 HydrophobicContact CG-CG1 3.58Å; I762-I792 HydrophobicContact CB-CG2 4.02Å; I762-I792 HydrophobicContact CD1-CD1 3.97Å; I762-I792 HydrophobicContact CD1-CG2 3.95Å; I762-I792 HydrophobicContact CG1-CG2 3.74Å; I762-A793 PolarHBondContact N-O 3.46Å; I762-Y794 HydrophobicContact CB-CD1 3.65Å; I762-Y794 HydrophobicContact CB-CE1 3.57Å; I762-Y794 HydrophobicContact CD1-CE1 3.96Å; I762-Y794 HydrophobicContact CG1-CE1 4.22Å; I762-Y794 HydrophobicContact CG2-CD1 3.98Å; I762-Y794 HydrophobicContact CG2-CE1 3.81Å; I762-Y794 WeakPolarHBondContact O-CA 3.41Å; I762-L795 PolarHBondContact O-N 2.9Å
763	I	95.7	Very high	86.9	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	112.9	168.4	-54.6	177.3	0	0	0	107.1	G644 L647 L648 I680 Q681 F682 I683 L795 I797	G644-I763 WeakPolarHBondContact O-CD1 3.28Å; L647-I763 HydrophobicContact CB-CD1 4.02Å; L647-I763 HydrophobicContact CD1-CD1 4.1Å; L648-I763 HydrophobicContact CD1-CD1 4.35Å; L648-I763 HydrophobicContact CG-CD1 4.22Å; I680-I763 HydrophobicContact CG2-CD1 4.34Å; I680-I763 HydrophobicContact CG2-CG1 4.42Å; Q681-I763 PolarHBondContact O-N 3.17Å; F682-I763 WeakPolarHBondContact CA-O 3.42Å; F682-I763 HydrophobicContact CD2-CB 3.63Å; F682-I763 HydrophobicContact CD2-CD1 4.13Å; F682-I763 HydrophobicContact CD2-CG1 4.41Å; F682-I763 HydrophobicContact CD2-CG2 3.78Å; F682-I763 HydrophobicContact CE2-CB 3.87Å; F682-I763 HydrophobicContact CE2-CD1 4.34Å; F682-I763 HydrophobicContact CE2-CG2 3.44Å; F682-I763 VanDerWaalsContact CE2-CG2 3.44Å; F682-I763 HydrophobicContact CG-CB 4.43Å; F682-I763 HydrophobicContact CZ-CG2 4.14Å; I683-I763 PolarHBondContact N-O 2.74Å; I763-L795 WeakPolarHBondContact CA-O 3.43Å; I763-L795 HydrophobicContact CG1-CB 4.29Å; I763-L795 HydrophobicContact CG1-CD2 4.38Å; I763-L795 HydrophobicContact CG2-CD2 4.27Å; I763-I797 HydrophobicContact CG2-CD1 3.86Å
764	A	94.7	Very high	85.8	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	99.7	178.8	0	0	0	0	0	109	E766 A767 L795 F796 I797	A764-E766 PolarHBondContact O-N 3.12Å; A764-A767 HydrophobicContact CB-CB 3.93Å; A764-L795 PolarHBondContact N-O 2.88Å; A764-F796 HydrophobicContact CB-CD2 3.8Å; A764-F796 HydrophobicContact CB-CE2 4.27Å; A764-I797 PolarHBondContact O-N 3.09Å
765	D	91.7	Very high	85.1	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	97.3	-177	-167.4	20.8	0	0	0	110.3	S641 R645 F682 I683 Q685 A767 I797	S641-D765 WeakPolarHBondContact CB-OD1 3.28Å; S641-D765 WeakPolarHBondContact CB-OD2 3.38Å; S641-D765 PolarHBondContact OG-OD1 2.91Å; S641-D765 PolarHBondContact OG-OD2 2.86Å; R645-D765 IonicContact NH1-OD2 3.83Å; R645-D765 IonicContact NH2-OD2 3.05Å; F682-D765 HydrophobicContact CE1-CB 3.54Å; F682-D765 HydrophobicContact CZ-CB 3.52Å; I683-D765 PolarHBondContact O-N 3Å; Q685-D765 WeakPolarHBondContact CA-O 3.4Å; Q685-D765 PolarHBondContact N-O 3.34Å; D765-A767 PolarHBondContact O-N 3.39Å; D765-A767 VanDerWaalsContact O-N 3.15Å; D765-I797 HydrophobicContact CB-CD1 4.34Å; D765-I797 WeakPolarHBondContact OD1-CG2 3.21Å
766	E	87.2	Confident	84.6	Confident	9 Å²	9	20.9 Å²	20.9	4%	0.042	12%	0.119	C	C	.	.	S	Bend	trans	55.9	33.3	179.2	-62.9	-74	-174.6	0	0	112.7	Q685 A764 V768 S769 I797 S798 H799	Q685-E766 HydrophobicContact CB-CB 4.2Å; Q685-E766 HydrophobicContact CG-CB 3.81Å; A764-E766 PolarHBondContact O-N 3.12Å; E766-V768 PolarHBondContact O-N 3.22Å; E766-S769 WeakPolarHBondContact CB-OG 3.29Å; E766-S769 VanDerWaalsContact O-CB 3.3Å; E766-S769 WeakPolarHBondContact O-CB 3.39Å; E766-S769 PolarHBondContact O-N 3.23Å; E766-S769 PolarHBondContact O-OG 2.89Å; E766-I797 WeakPolarHBondContact CA-O 3.31Å; E766-I797 PolarHBondContact N-O 2.81Å; E766-S798 WeakPolarHBondContact OE1-CA 3.44Å; E766-S798 WeakPolarHBondContact OE2-CA 3.42Å; E766-S798 PolarHBondContact OE2-OG 2.84Å; E766-H799 IonicContact OE1-CE1 3.82Å; E766-H799 IonicContact OE1-CG 3.27Å; E766-H799 PolarHBondContact OE1-N 3.44Å; E766-H799 VanDerWaalsContact OE1-N 3.07Å; E766-H799 IonicContact OE1-ND1 3.13Å; E766-H799 PolarHBondContact OE1-ND1 2.91Å; E766-H799 IonicContact OE2-CE1 2.9Å; E766-H799 PolarHBondContact OE2-CE1 2.86Å; E766-H799 IonicContact OE2-ND1 3.31Å; E766-H799 PolarHBondContact OE2-ND1 2.8Å
767	A	86.7	Confident	84.1	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.008	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-3.8	-171.8	0	0	0	0	0	115.6	I683 Q747 A764 D765	I683-A767 HydrophobicContact CB-CB 4.46Å; I683-A767 HydrophobicContact CG2-CB 3.76Å; Q747-A767 WeakPolarHBondContact CG-O 3.22Å; Q747-A767 PolarHBondContact NE2-O 3.03Å; Q747-A767 VanDerWaalsContact NE2-O 3.11Å; Q747-A767 PolarHBondContact OE1-O 2.86Å; A764-A767 HydrophobicContact CB-CB 3.93Å; D765-A767 PolarHBondContact O-N 3.39Å; D765-A767 VanDerWaalsContact O-N 3.15Å
768	V	84.8	Confident	83.9	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.006	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.1	3.2	173.3	-53.6	0	0	0	0	112.8	E766 R776 I779 I780 F796 V803	E766-V768 PolarHBondContact O-N 3.22Å; V768-R776 HydrophobicContact CB-CG 4.01Å; V768-R776 HydrophobicContact CG2-CG 4.05Å; V768-I779 HydrophobicContact CG1-CB 4.1Å; V768-I779 HydrophobicContact CG1-CG2 3.66Å; V768-I780 HydrophobicContact CG1-CG1 4.44Å; V768-F796 HydrophobicContact CG2-CZ 4.13Å; V768-V803 HydrophobicContact CG2-CB 4.48Å; V768-V803 HydrophobicContact CG2-CG1 3.75Å; V768-V803 HydrophobicContact CG2-CG2 4.06Å
769	S	68.6	Low	83.9	Confident	18 Å²	18	21 Å²	21	13%	0.126	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	147.5	171.9	76.2	0	0	0	0	109.2	E766 L771	E766-S769 WeakPolarHBondContact CB-OG 3.29Å; E766-S769 VanDerWaalsContact O-CB 3.3Å; E766-S769 WeakPolarHBondContact O-CB 3.39Å; E766-S769 PolarHBondContact O-N 3.23Å; E766-S769 PolarHBondContact O-OG 2.89Å; S769-L771 PolarHBondContact O-N 2.87Å
770	A	66	Low	83.8	Confident	73 Å²	73	21 Å²	21	60%	0.603	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	9	-176.3	0	0	0	0	0	117
771	L	73.6	Confident	83.5	Confident	10 Å²	10	19.4 Å²	19.4	5%	0.052	12%	0.117	C	C	.	.	S	Bend	trans	-95.3	142.8	170.2	-59.1	179.8	0	0	0	111.6	Q747 S769 I775 R776 I779	Q747-L771 HydrophobicContact CB-CD1 4.03Å; Q747-L771 HydrophobicContact CG-CD1 3.98Å; S769-L771 PolarHBondContact O-N 2.87Å; L771-I775 HydrophobicContact CB-CB 4.44Å; L771-I775 HydrophobicContact CB-CG2 4.13Å; L771-I775 HydrophobicContact CD1-CG2 4Å; L771-I775 HydrophobicContact CD2-CG2 4.35Å; L771-I775 HydrophobicContact CG-CG2 4.4Å; L771-R776 PolarHBondContact O-NH2 3.47Å; L771-R776 VanDerWaalsContact O-NH2 3.16Å; L771-I779 HydrophobicContact CD1-CG1 3.82Å
772	D	72	Confident	83.4	Confident	20 Å²	20	20 Å²	20	11%	0.107	12%	0.121	C	C	.	.			trans	-50.9	148.1	170.3	-69.2	-20	0	0	0	110.8	S344 H520 S774 I775 R776	S344-D772 WeakPolarHBondContact CB-OD2 3.36Å; S344-D772 PolarHBondContact N-OD2 2.68Å; S344-D772 PolarHBondContact OG-OD1 2.96Å; S344-D772 PolarHBondContact OG-OD2 3.18Å; H520-D772 IonicContact CD2-OD1 2.77Å; H520-D772 IonicContact CG-OD1 2.65Å; D772-S774 VanDerWaalsContact C-N 3.29Å; D772-S774 PolarHBondContact O-N 2.92Å; D772-I775 HydrophobicContact CB-CB 4.42Å; D772-I775 HydrophobicContact CB-CG1 4.19Å; D772-I775 PolarHBondContact O-N 3.39Å; D772-R776 WeakPolarHBondContact O-CB 3.43Å; D772-R776 PolarHBondContact O-N 2.91Å
773	V	71.8	Confident	83.2	Confident	8 Å²	8	20.1 Å²	20.1	5%	0.048	12%	0.121	C	C	.	.	H	α-helix	trans	-57.2	-40.5	-174.4	175.2	0	0	0	0	112.6	A564 R776 G777	A564-V773 VanDerWaalsContact C-CG1 3.42Å; A564-V773 HydrophobicContact CB-CG1 3.87Å; A564-V773 WeakPolarHBondContact O-CG1 3.29Å; V773-R776 PolarHBondContact O-N 3.43Å; V773-G777 PolarHBondContact O-N 2.74Å
774	S	70.9	Confident	83.1	Confident	24 Å²	24	20.4 Å²	20.4	17%	0.168	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-42.1	176.8	58.2	0	0	0	0	112.3	E343 D772 Q778	E343-S774 WeakPolarHBondContact OE1-CB 3.4Å; E343-S774 PolarHBondContact OE1-OG 3.45Å; D772-S774 VanDerWaalsContact C-N 3.29Å; D772-S774 PolarHBondContact O-N 2.92Å; S774-Q778 WeakPolarHBondContact O-CG 3.35Å; S774-Q778 PolarHBondContact O-N 2.96Å
775	I	78.6	Confident	82.9	Confident	35 Å²	35	23.6 Å²	23.6	18%	0.179	14%	0.14	C	C	.	.	H	α-helix	trans	-69.3	-41.7	177.8	-61	-57.5	0	0	0	111.2	G744 L771 D772 G777 Q778 I779	G744-I775 VanDerWaalsContact CA-CG2 3.4Å; L771-I775 HydrophobicContact CB-CB 4.44Å; L771-I775 HydrophobicContact CB-CG2 4.13Å; L771-I775 HydrophobicContact CD1-CG2 4Å; L771-I775 HydrophobicContact CD2-CG2 4.35Å; L771-I775 HydrophobicContact CG-CG2 4.4Å; D772-I775 HydrophobicContact CB-CB 4.42Å; D772-I775 HydrophobicContact CB-CG1 4.19Å; D772-I775 PolarHBondContact O-N 3.39Å; I775-G777 VanDerWaalsContact C-N 3.31Å; I775-G777 PolarHBondContact O-N 3.4Å; I775-Q778 WeakPolarHBondContact O-CB 3.39Å; I775-Q778 PolarHBondContact O-N 2.75Å; I775-I779 HydrophobicContact CG2-CG1 4.2Å; I775-I779 WeakPolarHBondContact O-CG1 3.42Å; I775-I779 PolarHBondContact O-N 3.17Å
776	R	83.5	Confident	83	Confident	27 Å²	27	23.8 Å²	23.8	10%	0.102	14%	0.141	C	C	.	.	H	α-helix	trans	-52.9	-48.4	177.5	-176.3	179.7	-57	171.3	17.2	111.4	V768 L771 D772 V773 Q778 I779 I780 D800 V803	V768-R776 HydrophobicContact CB-CG 4.01Å; V768-R776 HydrophobicContact CG2-CG 4.05Å; L771-R776 PolarHBondContact O-NH2 3.47Å; L771-R776 VanDerWaalsContact O-NH2 3.16Å; D772-R776 WeakPolarHBondContact O-CB 3.43Å; D772-R776 PolarHBondContact O-N 2.91Å; V773-R776 PolarHBondContact O-N 3.43Å; R776-Q778 VanDerWaalsContact C-N 3.34Å; R776-Q778 PolarHBondContact O-N 3.1Å; R776-I779 PolarHBondContact O-N 3.02Å; R776-I780 HydrophobicContact CG-CD1 4.22Å; R776-I780 WeakPolarHBondContact O-CG1 3.34Å; R776-I780 PolarHBondContact O-N 3.44Å; R776-D800 IonicContact CZ-OD2 2.87Å; R776-D800 IonicContact NH1-OD2 2.6Å; R776-D800 PolarHBondContact NH1-OD2 2.95Å; R776-V803 HydrophobicContact CG-CG2 4.04Å
777	G	82.6	Confident	83.2	Confident	22 Å²	22	23.4 Å²	23.4	23%	0.227	14%	0.139	C	C	.	.	H	α-helix	trans	-60	-40.8	176.6	0	0	0	0	0	113.3	V773 I775 I780 N781	V773-G777 PolarHBondContact O-N 2.74Å; I775-G777 VanDerWaalsContact C-N 3.31Å; I775-G777 PolarHBondContact O-N 3.4Å; G777-I780 PolarHBondContact O-N 3.03Å; G777-N781 PolarHBondContact O-N 3.04Å; G777-N781 VanDerWaalsContact O-N 3.12Å; G777-N781 PolarHBondContact O-ND2 3.5Å
778	Q	85.3	Confident	83.4	Confident	89 Å²	89	28.2 Å²	28.2	42%	0.416	16%	0.157	S	C	.	.	H	α-helix	trans	-66.6	-40.7	177.3	-63.5	173.9	10.8	0	0	112.6	S774 I775 R776 N781 L782	S774-Q778 WeakPolarHBondContact O-CG 3.35Å; S774-Q778 PolarHBondContact O-N 2.96Å; I775-Q778 WeakPolarHBondContact O-CB 3.39Å; I775-Q778 PolarHBondContact O-N 2.75Å; R776-Q778 VanDerWaalsContact C-N 3.34Å; R776-Q778 PolarHBondContact O-N 3.1Å; Q778-N781 PolarHBondContact O-N 2.81Å; Q778-L782 WeakPolarHBondContact O-CB 3.42Å; Q778-L782 PolarHBondContact O-N 3.1Å
779	I	89.8	Confident	83.6	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-39.3	177.5	-61.6	-59.8	0	0	0	111	Q747 R748 I751 V768 L771 I775 R776 L782 L783	Q747-I779 HydrophobicContact CB-CD1 4.27Å; Q747-I779 HydrophobicContact CG-CD1 4.2Å; Q747-I779 HydrophobicContact CG-CG1 4.32Å; Q747-I779 HydrophobicContact CG-CG2 4.19Å; R748-I779 HydrophobicContact CG-CD1 3.59Å; I751-I779 HydrophobicContact CD1-CD1 4.43Å; I751-I779 HydrophobicContact CD1-CG2 3.84Å; V768-I779 HydrophobicContact CG1-CB 4.1Å; V768-I779 HydrophobicContact CG1-CG2 3.66Å; L771-I779 HydrophobicContact CD1-CG1 3.82Å; I775-I779 HydrophobicContact CG2-CG1 4.2Å; I775-I779 WeakPolarHBondContact O-CG1 3.42Å; I775-I779 PolarHBondContact O-N 3.17Å; R776-I779 PolarHBondContact O-N 3.02Å; I779-L782 WeakPolarHBondContact O-CB 3.21Å; I779-L782 PolarHBondContact O-N 3.31Å; I779-L783 HydrophobicContact CG2-CD1 4.41Å; I779-L783 HydrophobicContact CG2-CG 4.45Å; I779-L783 WeakPolarHBondContact O-CG 3.43Å; I779-L783 PolarHBondContact O-N 3.24Å
780	I	90	Very high	84.6	Confident	5 Å²	5	34.3 Å²	34.3	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-48.2	174.9	-67.1	164.1	0	0	0	110.6	V768 R776 G777 L782 L783 L784 V803 R806 I807	V768-I780 HydrophobicContact CG1-CG1 4.44Å; R776-I780 HydrophobicContact CG-CD1 4.22Å; R776-I780 WeakPolarHBondContact O-CG1 3.34Å; R776-I780 PolarHBondContact O-N 3.44Å; G777-I780 PolarHBondContact O-N 3.03Å; I780-L782 VanDerWaalsContact C-N 3.3Å; I780-L782 PolarHBondContact O-N 3.08Å; I780-L783 PolarHBondContact O-N 2.77Å; I780-L784 HydrophobicContact CG2-CD1 4.1Å; I780-L784 HydrophobicContact CG2-CG 4.46Å; I780-L784 WeakPolarHBondContact O-CG 3.5Å; I780-L784 PolarHBondContact O-N 3.01Å; I780-V803 HydrophobicContact CD1-CB 4.27Å; I780-V803 HydrophobicContact CD1-CG1 3.78Å; I780-V803 HydrophobicContact CD1-CG2 4.02Å; I780-V803 HydrophobicContact CG1-CG1 4.17Å; I780-R806 HydrophobicContact CG2-CG 4.11Å; I780-I807 HydrophobicContact CG2-CB 4.33Å; I780-I807 HydrophobicContact CG2-CG1 4.49Å
781	N	89.2	Confident	85.8	Confident	65 Å²	65	32.8 Å²	32.8	35%	0.348	18%	0.176	S	C	.	.	H	α-helix	trans	-60.7	-41.8	178	-67	-17.3	0	0	0	111.3	G777 Q778 L783 L784 D785 R806	G777-N781 PolarHBondContact O-N 3.04Å; G777-N781 VanDerWaalsContact O-N 3.12Å; G777-N781 PolarHBondContact O-ND2 3.5Å; Q778-N781 PolarHBondContact O-N 2.81Å; N781-L783 PolarHBondContact O-N 2.72Å; N781-L784 PolarHBondContact O-N 3.08Å; N781-D785 PolarHBondContact O-N 3.49Å; N781-R806 PolarHBondContact OD1-NH2 2.82Å
782	L	92	Very high	86.8	Confident	14 Å²	14	32.3 Å²	32.3	7%	0.073	17%	0.174	C	C	.	.	H	α-helix	trans	-58	-47.1	173.9	173.7	62.2	0	0	0	111.9	R726 V727 R748 I751 Q778 I779 I780 L784 D785 L786	R726-L782 WeakPolarHBondContact O-CD1 3.41Å; V727-L782 HydrophobicContact CB-CD2 4.02Å; V727-L782 HydrophobicContact CG1-CD2 4.24Å; R748-L782 HydrophobicContact CG-CD2 4.09Å; I751-L782 HydrophobicContact CD1-CD2 3.94Å; I751-L782 HydrophobicContact CG2-CD2 4.46Å; Q778-L782 WeakPolarHBondContact O-CB 3.42Å; Q778-L782 PolarHBondContact O-N 3.1Å; I779-L782 WeakPolarHBondContact O-CB 3.21Å; I779-L782 PolarHBondContact O-N 3.31Å; I780-L782 VanDerWaalsContact C-N 3.3Å; I780-L782 PolarHBondContact O-N 3.08Å; L782-L784 VanDerWaalsContact C-N 3.32Å; L782-L784 PolarHBondContact O-N 3.38Å; L782-D785 PolarHBondContact O-N 3.32Å; L782-L786 HydrophobicContact CD1-CD1 3.9Å; L782-L786 HydrophobicContact CD1-CD2 4.43Å; L782-L786 HydrophobicContact CD1-CG 3.97Å; L782-L786 HydrophobicContact CG-CD1 3.88Å; L782-L786 HydrophobicContact CG-CG 4.38Å; L782-L786 WeakPolarHBondContact O-CB 3.34Å; L782-L786 WeakPolarHBondContact O-CG 3.36Å; L782-L786 PolarHBondContact O-N 3.14Å
783	L	93.3	Very high	87.9	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-40.3	178.3	-69	176	0	0	0	111.9	I751 I779 I780 N781 L786 Q787 Y794 F796 I807	I751-L783 HydrophobicContact CD1-CD2 4.11Å; I751-L783 HydrophobicContact CG1-CD2 4.34Å; I779-L783 HydrophobicContact CG2-CD1 4.41Å; I779-L783 HydrophobicContact CG2-CG 4.45Å; I779-L783 WeakPolarHBondContact O-CG 3.43Å; I779-L783 PolarHBondContact O-N 3.24Å; I780-L783 PolarHBondContact O-N 2.77Å; N781-L783 PolarHBondContact O-N 2.72Å; L783-L786 PolarHBondContact O-N 3.14Å; L783-Q787 PolarHBondContact O-N 3.01Å; L783-Y794 HydrophobicContact CB-CE2 4.33Å; L783-Y794 HydrophobicContact CD2-CE1 4.12Å; L783-Y794 WeakPolarHBondContact O-CE2 3.32Å; L783-Y794 PolarHBondContact O-OH 3.22Å; L783-F796 HydrophobicContact CD1-CD2 4.43Å; L783-F796 HydrophobicContact CD1-CE2 3.93Å; L783-I807 HydrophobicContact CB-CD1 4.01Å; L783-I807 HydrophobicContact CD1-CD1 3.86Å
784	L	92.2	Very high	89.1	Confident	7 Å²	7	31 Å²	31	4%	0.037	17%	0.166	C	C	.	.	H	α-helix	trans	-63.6	-43.9	175.6	-68.3	173.7	0	0	0	111.8	P577 P578 I579 I780 N781 L782 Q787 R788 I807	P577-L784 HydrophobicContact CB-CD2 3.77Å; P577-L784 HydrophobicContact CG-CD2 4.35Å; P578-L784 HydrophobicContact CG-CD1 4.33Å; I579-L784 HydrophobicContact CD1-CB 3.93Å; I579-L784 HydrophobicContact CD1-CD2 3.7Å; I579-L784 HydrophobicContact CD1-CG 4.33Å; I579-L784 HydrophobicContact CG1-CB 4.22Å; I579-L784 HydrophobicContact CG1-CD2 4.18Å; I780-L784 HydrophobicContact CG2-CD1 4.1Å; I780-L784 HydrophobicContact CG2-CG 4.46Å; I780-L784 WeakPolarHBondContact O-CG 3.5Å; I780-L784 PolarHBondContact O-N 3.01Å; N781-L784 PolarHBondContact O-N 3.08Å; L782-L784 VanDerWaalsContact C-N 3.32Å; L782-L784 PolarHBondContact O-N 3.38Å; L784-Q787 WeakPolarHBondContact O-CB 3.42Å; L784-Q787 PolarHBondContact O-N 3.36Å; L784-R788 PolarHBondContact O-N 3.04Å; L784-R788 VanDerWaalsContact O-N 3.08Å; L784-I807 HydrophobicContact CD2-CG1 3.9Å; L784-I807 HydrophobicContact CG-CG1 4.39Å
785	D	91.7	Very high	90.4	Very high	67 Å²	67	29.9 Å²	29.9	36%	0.358	16%	0.158	S	C	.	.	H	α-helix	trans	-62.5	-43.6	175.8	-73.5	-37.8	0	0	0	111.2	N781 L782 Q787 R788 D789	N781-D785 PolarHBondContact O-N 3.49Å; L782-D785 PolarHBondContact O-N 3.32Å; D785-Q787 PolarHBondContact O-N 3.13Å; D785-R788 PolarHBondContact O-N 2.87Å; D785-R788 IonicContact OD1-CZ 3.92Å; D785-R788 IonicContact OD1-NH1 2.74Å; D785-R788 IonicContact OD1-NH2 2.8Å; D785-R788 PolarHBondContact OD1-NH2 3.4Å; D785-D789 WeakPolarHBondContact O-CB 3.25Å; D785-D789 VanDerWaalsContact O-CG 3.24Å; D785-D789 PolarHBondContact O-N 3.34Å
786	L	92.3	Very high	91.2	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-65	-37.1	176.5	-66.7	169.5	0	0	0	112.5	I751 L755 L782 L783 R788 D789 F790	I751-L786 HydrophobicContact CG2-CD1 3.42Å; I751-L786 VanDerWaalsContact CG2-CD1 3.42Å; L755-L786 HydrophobicContact CD1-CD1 3.72Å; L755-L786 HydrophobicContact CD1-CD2 3.52Å; L755-L786 HydrophobicContact CD1-CG 4.22Å; L755-L786 HydrophobicContact CD2-CD1 4.47Å; L755-L786 HydrophobicContact CD2-CD2 4.34Å; L755-L786 HydrophobicContact CG-CD1 4.48Å; L782-L786 HydrophobicContact CD1-CD1 3.9Å; L782-L786 HydrophobicContact CD1-CD2 4.43Å; L782-L786 HydrophobicContact CD1-CG 3.97Å; L782-L786 HydrophobicContact CG-CD1 3.88Å; L782-L786 HydrophobicContact CG-CG 4.38Å; L782-L786 WeakPolarHBondContact O-CB 3.34Å; L782-L786 WeakPolarHBondContact O-CG 3.36Å; L782-L786 PolarHBondContact O-N 3.14Å; L783-L786 PolarHBondContact O-N 3.14Å; L786-R788 VanDerWaalsContact C-N 3.33Å; L786-D789 PolarHBondContact O-N 3.39Å; L786-F790 HydrophobicContact CB-CD2 4.33Å; L786-F790 HydrophobicContact CD2-CD2 3.88Å; L786-F790 HydrophobicContact CD2-CE2 3.57Å; L786-F790 WeakPolarHBondContact O-CB 3.33Å; L786-F790 WeakPolarHBondContact O-CD2 3.29Å; L786-F790 PolarHBondContact O-N 3.16Å
787	Q	92.9	Very high	91.7	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-59.8	-46.5	173.1	178.5	160.9	75.8	0	0	111.1	T583 G627 T629 L783 L784 D785 G791 I792 Y794 H809	T583-Q787 HydrophobicContact CG2-CG 4.16Å; G627-Q787 PolarHBondContact O-NE2 3.48Å; T629-Q787 PolarHBondContact OG1-NE2 3.44Å; L783-Q787 PolarHBondContact O-N 3.01Å; L784-Q787 WeakPolarHBondContact O-CB 3.42Å; L784-Q787 PolarHBondContact O-N 3.36Å; D785-Q787 PolarHBondContact O-N 3.13Å; Q787-G791 WeakPolarHBondContact O-CA 3.29Å; Q787-G791 PolarHBondContact O-N 3.27Å; Q787-I792 WeakPolarHBondContact CG-O 3.3Å; Q787-I792 PolarHBondContact NE2-O 3.06Å; Q787-I792 VanDerWaalsContact NE2-O 3.15Å; Q787-Y794 HydrophobicContact CB-CD2 4.35Å; Q787-Y794 HydrophobicContact CB-CE2 3.83Å; Q787-H809 PolarHBondContact OE1-CE1 2.9Å
788	R	89.8	Confident	92	Very high	102 Å²	102	26 Å²	26	39%	0.385	13%	0.134	S	C	.	.	H	α-helix	trans	-63.9	-47	178.9	-178.1	-173.1	62.2	-146.8	-15.9	111.3	T583 L784 D785 L786	T583-R788 HydrophobicContact CG2-CB 4.44Å; L784-R788 PolarHBondContact O-N 3.04Å; L784-R788 VanDerWaalsContact O-N 3.08Å; D785-R788 PolarHBondContact O-N 2.87Å; D785-R788 IonicContact OD1-CZ 3.92Å; D785-R788 IonicContact OD1-NH1 2.74Å; D785-R788 IonicContact OD1-NH2 2.8Å; D785-R788 PolarHBondContact OD1-NH2 3.4Å; L786-R788 VanDerWaalsContact C-N 3.33Å
789	D	89.3	Confident	92	Very high	80 Å²	80	23.1 Å²	23.1	43%	0.428	12%	0.121	S	C	.	.	H	α-helix	trans	-75.9	-31.7	-171.4	-69.5	7.9	0	0	0	112.8	R726 D785 L786	R726-D789 IonicContact NH1-OD2 3.13Å; D785-D789 WeakPolarHBondContact O-CB 3.25Å; D785-D789 VanDerWaalsContact O-CG 3.24Å; D785-D789 PolarHBondContact O-N 3.34Å; L786-D789 PolarHBondContact O-N 3.39Å
790	F	89.6	Confident	91.6	Very high	67 Å²	67	24 Å²	24	29%	0.294	13%	0.126	S	C	.	.	H	α-helix	trans	-113.1	-7.5	-175.4	-63.2	-77.7	0	0	0	114.6	W722 L755 L786 I792	W722-F790 AromaticContact CH2-CE1 3.58Å; W722-F790 HydrophobicContact CH2-CE1 3.58Å; W722-F790 AromaticContact CH2-CZ 3.35Å; W722-F790 HydrophobicContact CH2-CZ 3.35Å; W722-F790 HydrophobicContact CZ2-CE1 4.26Å; W722-F790 AromaticContact CZ2-CZ 3.93Å; W722-F790 HydrophobicContact CZ2-CZ 3.93Å; W722-F790 HydrophobicContact CZ3-CZ 4.31Å; L755-F790 HydrophobicContact CD2-CD2 4.49Å; L786-F790 HydrophobicContact CB-CD2 4.33Å; L786-F790 HydrophobicContact CD2-CD2 3.88Å; L786-F790 HydrophobicContact CD2-CE2 3.57Å; L786-F790 WeakPolarHBondContact O-CB 3.33Å; L786-F790 WeakPolarHBondContact O-CD2 3.29Å; L786-F790 PolarHBondContact O-N 3.16Å; F790-I792 VanDerWaalsContact C-N 3.28Å; F790-I792 HydrophobicContact CB-CD1 3.59Å; F790-I792 HydrophobicContact CB-CG1 3.65Å; F790-I792 HydrophobicContact CD2-CD1 4.31Å; F790-I792 HydrophobicContact CG-CD1 4.19Å; F790-I792 PolarHBondContact O-N 3.35Å
791	G	91.1	Very high	91.5	Very high	40 Å²	40	24.1 Å²	24.1	41%	0.412	13%	0.126	S	C	.	.			trans	67.8	26.3	-176.1	0	0	0	0	0	113.7	G627 Q787	G627-G791 PolarHBondContact N-O 3.32Å; Q787-G791 WeakPolarHBondContact O-CA 3.29Å; Q787-G791 PolarHBondContact O-N 3.27Å
792	I	94.1	Very high	91.3	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	11%	0.114	C	C	.	.			trans	-70.7	130.7	-174.8	-65.2	160.4	0	0	0	110.5	L755 I762 Q787 F790 Y794	L755-I792 HydrophobicContact CD2-CD1 3.5Å; I762-I792 HydrophobicContact CB-CG2 4.02Å; I762-I792 HydrophobicContact CD1-CD1 3.97Å; I762-I792 HydrophobicContact CD1-CG2 3.95Å; I762-I792 HydrophobicContact CG1-CG2 3.74Å; Q787-I792 WeakPolarHBondContact CG-O 3.3Å; Q787-I792 PolarHBondContact NE2-O 3.06Å; Q787-I792 VanDerWaalsContact NE2-O 3.15Å; F790-I792 VanDerWaalsContact C-N 3.28Å; F790-I792 HydrophobicContact CB-CD1 3.59Å; F790-I792 HydrophobicContact CB-CG1 3.65Å; F790-I792 HydrophobicContact CD2-CD1 4.31Å; F790-I792 HydrophobicContact CG-CD1 4.19Å; F790-I792 PolarHBondContact O-N 3.35Å; I792-Y794 HydrophobicContact CG2-CD1 4.07Å; I792-Y794 HydrophobicContact CG2-CE1 3.75Å; I792-Y794 HydrophobicContact CG2-CE2 4.28Å; I792-Y794 HydrophobicContact CG2-CG 4.44Å
793	A	96.3	Very high	91.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	132.8	165.5	0	0	0	0	0	110.5	V590 L624 W625 E628 K760 V761 I762	V590-A793 HydrophobicContact CG1-CB 3.76Å; L624-A793 HydrophobicContact CD1-CB 4.3Å; L624-A793 HydrophobicContact CD2-CB 3.86Å; L624-A793 HydrophobicContact CG-CB 3.95Å; W625-A793 VanDerWaalsContact O-CB 3.31Å; W625-A793 WeakPolarHBondContact O-CB 3.46Å; E628-A793 CarbonylContact O-C 3.52Å; E628-A793 VanDerWaalsContact O-CA 3.28Å; E628-A793 WeakPolarHBondContact O-CA 3.26Å; K760-A793 PolarHBondContact O-N 3.19Å; V761-A793 CarbonylContact C-O 3.51Å; V761-A793 VanDerWaalsContact CA-O 3.27Å; V761-A793 WeakPolarHBondContact CA-O 3.29Å; V761-A793 HydrophobicContact CG2-CB 4.26Å; I762-A793 PolarHBondContact N-O 3.46Å
794	Y	96.9	Very high	91	Very high	1 Å²	1	20.8 Å²	20.8	0%	0.004	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.7	178.9	-71.3	-64.9	0	0	0	111.5	L624 E628 T629 L630 I762 L783 Q787 I792	L624-Y794 WeakPolarHBondContact CD1-O 3.06Å; E628-Y794 PolarHBondContact O-N 3.01Å; T629-Y794 WeakPolarHBondContact CA-O 3.36Å; L630-Y794 PolarHBondContact N-O 3.44Å; I762-Y794 HydrophobicContact CB-CD1 3.65Å; I762-Y794 HydrophobicContact CB-CE1 3.57Å; I762-Y794 HydrophobicContact CD1-CE1 3.96Å; I762-Y794 HydrophobicContact CG1-CE1 4.22Å; I762-Y794 HydrophobicContact CG2-CD1 3.98Å; I762-Y794 HydrophobicContact CG2-CE1 3.81Å; I762-Y794 WeakPolarHBondContact O-CA 3.41Å; L783-Y794 HydrophobicContact CB-CE2 4.33Å; L783-Y794 HydrophobicContact CD2-CE1 4.12Å; L783-Y794 WeakPolarHBondContact O-CE2 3.32Å; L783-Y794 PolarHBondContact O-OH 3.22Å; Q787-Y794 HydrophobicContact CB-CD2 4.35Å; Q787-Y794 HydrophobicContact CB-CE2 3.83Å; I792-Y794 HydrophobicContact CG2-CD1 4.07Å; I792-Y794 HydrophobicContact CG2-CE1 3.75Å; I792-Y794 HydrophobicContact CG2-CE2 4.28Å; I792-Y794 HydrophobicContact CG2-CG 4.44Å
795	L	97.1	Very high	90.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	99.9	153.9	-178.7	66.5	0	0	0	107.2	F622 L630 L632 L647 I762 I763 A764	F622-L795 HydrophobicContact CE2-CD1 4.22Å; F622-L795 HydrophobicContact CZ-CD1 4.22Å; F622-L795 HydrophobicContact CZ-CD2 4.23Å; L630-L795 HydrophobicContact CD2-CD1 4.22Å; L630-L795 HydrophobicContact CG-CD1 4.33Å; L630-L795 WeakPolarHBondContact O-CA 3.5Å; L632-L795 HydrophobicContact CB-CD1 4.35Å; L647-L795 HydrophobicContact CD1-CD2 3.4Å; L647-L795 VanDerWaalsContact CD1-CD2 3.4Å; I762-L795 PolarHBondContact O-N 2.9Å; I763-L795 WeakPolarHBondContact CA-O 3.43Å; I763-L795 HydrophobicContact CG1-CB 4.29Å; I763-L795 HydrophobicContact CG1-CD2 4.38Å; I763-L795 HydrophobicContact CG2-CD2 4.27Å; A764-L795 PolarHBondContact N-O 2.88Å
796	F	96.4	Very high	90.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	102.9	-172.9	-171.9	-91.6	0	0	0	110.8	T629 L630 S631 L632 A764 V768 L783 V803 I807	T629-F796 HydrophobicContact CG2-CB 3.81Å; L630-F796 PolarHBondContact O-N 3.49Å; S631-F796 CarbonylContact C-O 3.52Å; S631-F796 WeakPolarHBondContact CA-O 3.47Å; S631-F796 WeakPolarHBondContact CB-O 3.33Å; S631-F796 WeakPolarHBondContact OG-CD1 3.41Å; S631-F796 PolarHBondContact OG-O 3.39Å; L632-F796 PolarHBondContact N-O 3.23Å; A764-F796 HydrophobicContact CB-CD2 3.8Å; A764-F796 HydrophobicContact CB-CE2 4.27Å; V768-F796 HydrophobicContact CG2-CZ 4.13Å; L783-F796 HydrophobicContact CD1-CD2 4.43Å; L783-F796 HydrophobicContact CD1-CE2 3.93Å; F796-V803 HydrophobicContact CE1-CG1 3.65Å; F796-V803 HydrophobicContact CZ-CG1 3.67Å; F796-I807 HydrophobicContact CD1-CG2 3.87Å; F796-I807 HydrophobicContact CD2-CD1 3.93Å; F796-I807 HydrophobicContact CE1-CG2 4.02Å; F796-I807 HydrophobicContact CE2-CD1 3.9Å; F796-I807 HydrophobicContact CG-CD1 4.48Å; F796-I807 HydrophobicContact CG-CG2 4.15Å; F796-I807 HydrophobicContact CZ-CD1 4.44Å; F796-I807 HydrophobicContact CZ-CG2 4.44Å
797	I	94.2	Very high	90.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121.9	-179.7	-63.5	158.5	0	0	0	108.5	L632 K640 I763 A764 D765 E766	L632-I797 HydrophobicContact CB-CG1 4.09Å; L632-I797 HydrophobicContact CD2-CG1 4.31Å; L632-I797 WeakPolarHBondContact O-CA 3.39Å; K640-I797 HydrophobicContact CB-CG1 4.44Å; K640-I797 HydrophobicContact CB-CG2 3.46Å; K640-I797 VanDerWaalsContact CB-CG2 3.46Å; K640-I797 HydrophobicContact CD-CG2 4.2Å; K640-I797 HydrophobicContact CG-CG2 4.44Å; K640-I797 WeakPolarHBondContact O-CD1 3.21Å; I763-I797 HydrophobicContact CG2-CD1 3.86Å; A764-I797 PolarHBondContact O-N 3.09Å; D765-I797 HydrophobicContact CB-CD1 4.34Å; D765-I797 WeakPolarHBondContact OD1-CG2 3.21Å; E766-I797 WeakPolarHBondContact CA-O 3.31Å; E766-I797 PolarHBondContact N-O 2.81Å
798	S	89.4	Confident	90.8	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.007	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	155.4	173.4	-168.5	0	0	0	0	112.9	L632 V633 E766 D800	L632-S798 PolarHBondContact O-N 2.74Å; V633-S798 VanDerWaalsContact CA-O 3.29Å; V633-S798 WeakPolarHBondContact CA-O 3.41Å; V633-S798 WeakPolarHBondContact CB-O 3.4Å; V633-S798 WeakPolarHBondContact CG1-O 3.41Å; E766-S798 WeakPolarHBondContact OE1-CA 3.44Å; E766-S798 WeakPolarHBondContact OE2-CA 3.42Å; E766-S798 PolarHBondContact OE2-OG 2.84Å; S798-D800 PolarHBondContact OG-N 3.14Å; S798-D800 VanDerWaalsContact OG-N 3.11Å
799	H	83.8	Confident	91.1	Very high	29 Å²	29	18.9 Å²	18.9	13%	0.134	10%	0.099	C	C	.	.	S	Bend	trans	-95.6	-10.7	165.8	62.3	-82.3	0	0	0	113.2	L492 D493 E766 M801	L492-H799 PolarHBondContact O-NE2 3.23Å; D493-H799 HydrophobicContact CB-CB 4.28Å; E766-H799 IonicContact OE1-CE1 3.82Å; E766-H799 IonicContact OE1-CG 3.27Å; E766-H799 PolarHBondContact OE1-N 3.44Å; E766-H799 VanDerWaalsContact OE1-N 3.07Å; E766-H799 IonicContact OE1-ND1 3.13Å; E766-H799 PolarHBondContact OE1-ND1 2.91Å; E766-H799 IonicContact OE2-CE1 2.9Å; E766-H799 PolarHBondContact OE2-CE1 2.86Å; E766-H799 IonicContact OE2-ND1 3.31Å; E766-H799 PolarHBondContact OE2-ND1 2.8Å; H799-M801 WeakPolarHBondContact O-CE 3.07Å; H799-M801 PolarHBondContact O-N 2.89Å
800	D	82.7	Confident	91.4	Very high	20 Å²	20	17.4 Å²	17.4	11%	0.107	9%	0.087	C	C	.	.			trans	-84.1	103.4	-180	-174.3	-22.3	0	0	0	110.5	R776 S798 A802 V803 V804	R776-D800 IonicContact CZ-OD2 2.87Å; R776-D800 IonicContact NH1-OD2 2.6Å; R776-D800 PolarHBondContact NH1-OD2 2.95Å; S798-D800 PolarHBondContact OG-N 3.14Å; S798-D800 VanDerWaalsContact OG-N 3.11Å; D800-A802 VanDerWaalsContact C-N 3.29Å; D800-A802 PolarHBondContact O-N 3.2Å; D800-A802 WeakPolarHBondContact OD1-CB 3.12Å; D800-A802 PolarHBondContact OD1-N 3.12Å; D800-V803 HydrophobicContact CB-CB 4.12Å; D800-V803 HydrophobicContact CB-CG2 3.97Å; D800-V803 VanDerWaalsContact CG-CG2 3.44Å; D800-V803 PolarHBondContact O-N 3.28Å; D800-V803 PolarHBondContact OD1-N 3.18Å; D800-V803 VanDerWaalsContact OD2-CG2 3.23Å; D800-V803 WeakPolarHBondContact OD2-CG2 3.46Å; D800-V804 WeakPolarHBondContact O-CG2 3.33Å; D800-V804 PolarHBondContact O-N 2.91Å; D800-V804 VanDerWaalsContact O-N 3.09Å
801	M	87.2	Confident	91.7	Very high	6 Å²	6	14.2 Å²	14.2	3%	0.03	7%	0.073	C	C	.	.	H	α-helix	trans	-63.9	-33.3	-180	-61.8	-61.4	112.5	0	0	112.8	L568 V633 H799 V804 E805 F829 L841 V844	L568-M801 HydrophobicContact CD1-CB 4.19Å; V633-M801 HydrophobicContact CB-CE 3.53Å; V633-M801 HydrophobicContact CB-SD 4.47Å; V633-M801 HydrophobicContact CG1-CE 4.01Å; V633-M801 HydrophobicContact CG2-CE 3.88Å; V633-M801 HydrophobicContact CG2-SD 4.28Å; H799-M801 WeakPolarHBondContact O-CE 3.07Å; H799-M801 PolarHBondContact O-N 2.89Å; M801-V804 PolarHBondContact O-N 2.9Å; M801-E805 PolarHBondContact O-N 3.3Å; M801-F829 HydrophobicContact CB-CE1 4.02Å; M801-F829 HydrophobicContact CB-CZ 4.17Å; M801-F829 WeakPolarHBondContact O-CE1 3.38Å; M801-F829 WeakPolarHBondContact O-CZ 3.23Å; M801-F829 HydrophobicContact SD-CZ 4.43Å; M801-L841 HydrophobicContact CB-CD2 4.21Å; M801-L841 HydrophobicContact CG-CD2 4.11Å; M801-L841 HydrophobicContact SD-CD2 4.43Å; M801-V844 HydrophobicContact CB-CG2 3.64Å; M801-V844 HydrophobicContact CG-CG2 3.72Å
802	A	84.7	Confident	92	Very high	10 Å²	10	12.3 Å²	12.3	8%	0.083	5%	0.054	C	C	.	.	H	α-helix	trans	-71.5	-35	-176.4	0	0	0	0	0	111.2	P566 D800	P566-A802 HydrophobicContact CB-CB 3.41Å; P566-A802 VanDerWaalsContact CB-CB 3.41Å; D800-A802 VanDerWaalsContact C-N 3.29Å; D800-A802 PolarHBondContact O-N 3.2Å; D800-A802 WeakPolarHBondContact OD1-CB 3.12Å; D800-A802 PolarHBondContact OD1-N 3.12Å
803	V	87.7	Confident	92.1	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.006	5%	0.054	C	C	.	.	H	α-helix	trans	-64.8	-48.2	169.4	171.1	0	0	0	0	111.1	V768 R776 I780 F796 D800 E805 R806 I807	V768-V803 HydrophobicContact CG2-CB 4.48Å; V768-V803 HydrophobicContact CG2-CG1 3.75Å; V768-V803 HydrophobicContact CG2-CG2 4.06Å; R776-V803 HydrophobicContact CG-CG2 4.04Å; I780-V803 HydrophobicContact CD1-CB 4.27Å; I780-V803 HydrophobicContact CD1-CG1 3.78Å; I780-V803 HydrophobicContact CD1-CG2 4.02Å; I780-V803 HydrophobicContact CG1-CG1 4.17Å; F796-V803 HydrophobicContact CE1-CG1 3.65Å; F796-V803 HydrophobicContact CZ-CG1 3.67Å; D800-V803 HydrophobicContact CB-CB 4.12Å; D800-V803 HydrophobicContact CB-CG2 3.97Å; D800-V803 VanDerWaalsContact CG-CG2 3.44Å; D800-V803 PolarHBondContact O-N 3.28Å; D800-V803 PolarHBondContact OD1-N 3.18Å; D800-V803 VanDerWaalsContact OD2-CG2 3.23Å; D800-V803 WeakPolarHBondContact OD2-CG2 3.46Å; V803-E805 VanDerWaalsContact C-N 3.26Å; V803-E805 PolarHBondContact O-N 3.45Å; V803-R806 PolarHBondContact O-N 3.24Å; V803-R806 VanDerWaalsContact O-N 3.08Å; V803-I807 PolarHBondContact O-N 3.07Å
804	V	91.6	Very high	92	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-58	-41.1	-179.3	167.2	0	0	0	0	110.5	V633 D800 M801 R806 I807 S808 V811 F829	V633-V804 HydrophobicContact CG1-CB 4.28Å; V633-V804 HydrophobicContact CG1-CG1 3.88Å; V633-V804 HydrophobicContact CG1-CG2 3.55Å; D800-V804 WeakPolarHBondContact O-CG2 3.33Å; D800-V804 PolarHBondContact O-N 2.91Å; D800-V804 VanDerWaalsContact O-N 3.09Å; M801-V804 PolarHBondContact O-N 2.9Å; V804-R806 PolarHBondContact O-N 2.98Å; V804-I807 PolarHBondContact O-N 3.17Å; V804-S808 WeakPolarHBondContact CG1-OG 3.34Å; V804-S808 WeakPolarHBondContact O-CB 3.35Å; V804-S808 PolarHBondContact O-N 3.02Å; V804-S808 VanDerWaalsContact O-N 3.08Å; V804-S808 PolarHBondContact O-OG 2.99Å; V804-V811 HydrophobicContact CG1-CG1 4.13Å; V804-V811 HydrophobicContact CG1-CG2 3.81Å; V804-F829 HydrophobicContact CB-CZ 4.08Å; V804-F829 HydrophobicContact CG1-CE2 3.79Å; V804-F829 HydrophobicContact CG1-CZ 3.75Å
805	E	90.8	Very high	91.7	Very high	7 Å²	7	13.6 Å²	13.6	3%	0.033	6%	0.059	C	C	.	.	H	α-helix	trans	-56.4	-38.4	178	-161.7	-175.4	-179.9	0	0	112.4	L568 G569 M571 M801 V803 R825 F829	L568-E805 WeakPolarHBondContact CA-OE2 3.4Å; G569-E805 VanDerWaalsContact CA-OE1 3.29Å; G569-E805 WeakPolarHBondContact CA-OE1 3.43Å; G569-E805 PolarHBondContact N-OE1 3.32Å; G569-E805 PolarHBondContact N-OE2 3.22Å; M571-E805 HydrophobicContact CB-CG 3.96Å; M571-E805 HydrophobicContact CG-CG 4.22Å; M571-E805 PolarHBondContact N-OE1 3.14Å; M801-E805 PolarHBondContact O-N 3.3Å; V803-E805 VanDerWaalsContact C-N 3.26Å; V803-E805 PolarHBondContact O-N 3.45Å; E805-R825 WeakPolarHBondContact O-CD 3.47Å; E805-R825 PolarHBondContact O-NE 3.14Å; E805-F829 HydrophobicContact CB-CD1 3.96Å; E805-F829 HydrophobicContact CB-CE1 3.56Å; E805-F829 HydrophobicContact CB-CZ 3.97Å; E805-F829 HydrophobicContact CG-CD1 3.75Å; E805-F829 HydrophobicContact CG-CE1 3.91Å; E805-F829 HydrophobicContact CG-CG 4.25Å
806	R	89.3	Confident	91.2	Very high	99 Å²	99	15.7 Å²	15.7	37%	0.374	7%	0.07	S	C	.	.	H	α-helix	trans	-80.5	-35.5	-175.2	-174	174	175.9	134	-0.7	113.7	P577 P578 I780 N781 V803 V804	P577-R806 WeakPolarHBondContact CA-O 3.46Å; P577-R806 WeakPolarHBondContact CB-O 3.37Å; P578-R806 WeakPolarHBondContact CD-O 3.33Å; P578-R806 HydrophobicContact CG-CG 4.39Å; I780-R806 HydrophobicContact CG2-CG 4.11Å; N781-R806 PolarHBondContact OD1-NH2 2.82Å; V803-R806 PolarHBondContact O-N 3.24Å; V803-R806 VanDerWaalsContact O-N 3.08Å; V804-R806 PolarHBondContact O-N 2.98Å
807	I	91.4	Very high	90.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-98.1	-20.6	-171.9	-158.7	173.4	0	0	0	113.9	T629 I780 L783 L784 F796 V803 V804	T629-I807 VanDerWaalsContact CB-O 3.3Å; T629-I807 WeakPolarHBondContact CB-O 3.41Å; T629-I807 HydrophobicContact CG2-CG1 4.32Å; T629-I807 HydrophobicContact CG2-CG2 4.3Å; T629-I807 WeakPolarHBondContact CG2-O 3.37Å; T629-I807 PolarHBondContact OG1-O 3.23Å; I780-I807 HydrophobicContact CG2-CB 4.33Å; I780-I807 HydrophobicContact CG2-CG1 4.49Å; L783-I807 HydrophobicContact CB-CD1 4.01Å; L783-I807 HydrophobicContact CD1-CD1 3.86Å; L784-I807 HydrophobicContact CD2-CG1 3.9Å; L784-I807 HydrophobicContact CG-CG1 4.39Å; F796-I807 HydrophobicContact CD1-CG2 3.87Å; F796-I807 HydrophobicContact CD2-CD1 3.93Å; F796-I807 HydrophobicContact CE1-CG2 4.02Å; F796-I807 HydrophobicContact CE2-CD1 3.9Å; F796-I807 HydrophobicContact CG-CD1 4.48Å; F796-I807 HydrophobicContact CG-CG2 4.15Å; F796-I807 HydrophobicContact CZ-CD1 4.44Å; F796-I807 HydrophobicContact CZ-CG2 4.44Å; V803-I807 PolarHBondContact O-N 3.07Å; V804-I807 PolarHBondContact O-N 3.17Å
808	S	94.2	Very high	90.9	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	7%	0.073	C	C	.	.			trans	-90.4	140.1	-166.2	-51.1	0	0	0	0	113.7	S631 V804 R825	S631-S808 VanDerWaalsContact CB-OG 3.23Å; S631-S808 WeakPolarHBondContact CB-OG 3.45Å; S631-S808 PolarHBondContact OG-OG 2.99Å; V804-S808 WeakPolarHBondContact CG1-OG 3.34Å; V804-S808 WeakPolarHBondContact O-CB 3.35Å; V804-S808 PolarHBondContact O-N 3.02Å; V804-S808 VanDerWaalsContact O-N 3.08Å; V804-S808 PolarHBondContact O-OG 2.99Å; S808-R825 WeakPolarHBondContact O-CB 3.29Å
809	H	94.4	Very high	91.2	Very high	35 Å²	35	16.6 Å²	16.6	16%	0.162	7%	0.074	C	C	.	.	S	Bend	trans	-84.8	-41.9	160.4	-63	81.2	0	0	0	110	P577 T583 E628 T629 Q787 R825	P577-H809 WeakPolarHBondContact CD-NE2 3.47Å; P577-H809 VanDerWaalsContact CG-CE1 3.41Å; P577-H809 WeakPolarHBondContact CG-CE1 3.43Å; T583-H809 PolarHBondContact OG1-NE2 3.31Å; E628-H809 HydrophobicContact CG-CB 3.8Å; T629-H809 PolarHBondContact N-ND1 2.87Å; T629-H809 VanDerWaalsContact N-ND1 3.11Å; T629-H809 PolarHBondContact O-N 3.27Å; Q787-H809 PolarHBondContact OE1-CE1 2.9Å; H809-R825 PolarHBondContact O-N 2.66Å
810	R	95.9	Very high	91.7	Very high	48 Å²	48	15.2 Å²	15.2	18%	0.181	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	155.2	-179.5	-76.8	-179.6	29.8	164.9	-0.8	111.8	E628 T629 L630 S631 G823	E628-R810 WeakPolarHBondContact OE1-CD 3.36Å; E628-R810 WeakPolarHBondContact OE1-CG 3.41Å; E628-R810 IonicContact OE1-NE 2.81Å; T629-R810 PolarHBondContact O-N 2.91Å; L630-R810 HydrophobicContact CD1-CB 3.7Å; S631-R810 PolarHBondContact N-O 3.11Å; R810-G823 CarbonylContact C-O 3.54Å; R810-G823 VanDerWaalsContact CA-O 3.3Å; R810-G823 WeakPolarHBondContact CA-O 3.46Å
811	V	97	Very high	92.4	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.006	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	131.4	-174	-176.2	0	0	0	0	108.6	S631 V633 V804 V813 I822 G823 R825 V828 F829	S631-V811 CarbonylContact O-C 3.59Å; S631-V811 WeakPolarHBondContact O-CA 3.44Å; V633-V811 HydrophobicContact CG1-CG1 4.18Å; V633-V811 HydrophobicContact CG2-CG1 3.8Å; V804-V811 HydrophobicContact CG1-CG1 4.13Å; V804-V811 HydrophobicContact CG1-CG2 3.81Å; V811-V813 HydrophobicContact CG1-CG2 4.49Å; V811-I822 CarbonylContact O-C 3.56Å; V811-I822 VanDerWaalsContact O-CA 3.24Å; V811-I822 WeakPolarHBondContact O-CA 3.31Å; V811-G823 PolarHBondContact N-O 3.46Å; V811-G823 PolarHBondContact O-N 3.05Å; V811-R825 HydrophobicContact CG2-CB 3.99Å; V811-R825 HydrophobicContact CG2-CG 4.1Å; V811-V828 HydrophobicContact CB-CB 4.3Å; V811-V828 HydrophobicContact CB-CG1 4.26Å; V811-V828 HydrophobicContact CB-CG2 4.3Å; V811-V828 HydrophobicContact CG1-CG1 4.1Å; V811-F829 HydrophobicContact CG1-CE2 4.37Å; V811-F829 HydrophobicContact CG2-CD2 4.32Å; V811-F829 HydrophobicContact CG2-CE2 3.83Å
812	A	97.3	Very high	92.8	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.6	173.1	0	0	0	0	0	109.1	L630 S631 L632 V633 I819 E821 I822	L630-A812 HydrophobicContact CD1-CB 4.35Å; S631-A812 PolarHBondContact O-N 2.89Å; L632-A812 CarbonylContact C-O 3.55Å; L632-A812 WeakPolarHBondContact CA-O 3.37Å; L632-A812 HydrophobicContact CD1-CB 3.79Å; V633-A812 PolarHBondContact N-O 3.39Å; A812-I819 HydrophobicContact CB-CD1 4.1Å; A812-I819 HydrophobicContact CB-CG1 4.47Å; A812-I819 HydrophobicContact CB-CG2 4.41Å; A812-E821 CarbonylContact C-O 3.57Å; A812-E821 WeakPolarHBondContact CA-O 3.33Å; A812-I822 HydrophobicContact CB-CB 4.19Å; A812-I822 HydrophobicContact CB-CD1 3.79Å; A812-I822 HydrophobicContact CB-CG1 3.83Å
813	V	95.8	Very high	93.4	Very high	1 Å²	1	14 Å²	14	1%	0.006	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	118.3	179.8	-174	0	0	0	0	108.9	V633 V811 I819 V820 E821 V828 Y836 T837 L840	V633-V813 HydrophobicContact CG2-CB 4.21Å; V633-V813 HydrophobicContact CG2-CG1 4.4Å; V633-V813 HydrophobicContact CG2-CG2 3.78Å; V633-V813 CarbonylContact O-C 3.51Å; V633-V813 WeakPolarHBondContact O-CA 3.43Å; V811-V813 HydrophobicContact CG1-CG2 4.49Å; V813-I819 CarbonylContact O-C 3.57Å; V813-I819 WeakPolarHBondContact O-CA 3.44Å; V813-V820 HydrophobicContact CB-CG2 4.27Å; V813-V820 HydrophobicContact CG1-CG2 4.05Å; V813-V820 WeakPolarHBondContact O-CG2 3.46Å; V813-V820 PolarHBondContact O-N 2.83Å; V813-E821 HydrophobicContact CB-CB 4.21Å; V813-E821 HydrophobicContact CG2-CB 4.22Å; V813-E821 PolarHBondContact N-O 3.07Å; V813-V828 HydrophobicContact CG2-CG1 4.12Å; V813-Y836 HydrophobicContact CG1-CD1 3.68Å; V813-Y836 HydrophobicContact CG1-CE1 3.69Å; V813-T837 HydrophobicContact CG2-CG2 3.98Å; V813-L840 HydrophobicContact CG1-CD1 3.78Å
814	M	93.7	Very high	93.7	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.3	175.9	-72.9	-172.2	79.6	0	0	112.5	V620 L632 V633 S638 K640 Q818 I819 Y836	V620-M814 HydrophobicContact CG2-CE 3.85Å; L632-M814 HydrophobicContact CD1-CG 3.49Å; L632-M814 VanDerWaalsContact CD1-CG 3.49Å; L632-M814 HydrophobicContact CD1-SD 3.52Å; L632-M814 VanDerWaalsContact CD1-SD 3.52Å; L632-M814 HydrophobicContact CD2-SD 3.51Å; L632-M814 VanDerWaalsContact CD2-SD 3.51Å; L632-M814 HydrophobicContact CG-CG 3.99Å; L632-M814 HydrophobicContact CG-SD 3.55Å; L632-M814 VanDerWaalsContact CG-SD 3.55Å; V633-M814 PolarHBondContact O-N 3.36Å; S638-M814 WeakPolarHBondContact CB-O 3.41Å; S638-M814 WeakPolarHBondContact O-CE 3.24Å; K640-M814 HydrophobicContact CB-SD 4.43Å; K640-M814 HydrophobicContact CG-CB 4.41Å; K640-M814 HydrophobicContact CG-SD 4.13Å; M814-Q818 CarbonylContact C-O 3.26Å; M814-Q818 VanDerWaalsContact CA-O 3.22Å; M814-Q818 WeakPolarHBondContact CA-O 3.4Å; M814-I819 HydrophobicContact CG-CG1 4.03Å; M814-Y836 VanDerWaalsContact O-CE1 3.3Å; M814-Y836 WeakPolarHBondContact O-CE1 3.41Å; M814-Y836 PolarHBondContact O-OH 3.19Å
815	Y	90.3	Very high	93.8	Very high	28 Å²	28	16.1 Å²	16.1	11%	0.11	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	129.4	173.7	-176.3	-112.2	0	0	0	109.2	G817 Q818 Y836 P864 Y895 M898	Y815-G817 VanDerWaalsContact C-N 3.27Å; Y815-G817 PolarHBondContact O-N 2.99Å; Y815-Q818 PolarHBondContact N-O 3.43Å; Y815-Q818 PolarHBondContact O-N 2.77Å; Y815-Y836 HydrophobicContact CD2-CD1 4.03Å; Y815-Y836 AromaticContact CD2-CD2 3.54Å; Y815-Y836 HydrophobicContact CD2-CD2 3.54Å; Y815-Y836 AromaticContact CD2-CE1 3.84Å; Y815-Y836 HydrophobicContact CD2-CE1 3.84Å; Y815-Y836 AromaticContact CD2-CE2 3.36Å; Y815-Y836 HydrophobicContact CD2-CE2 3.36Å; Y815-Y836 AromaticContact CD2-CG 3.85Å; Y815-Y836 HydrophobicContact CD2-CG 3.85Å; Y815-Y836 AromaticContact CD2-CZ 3.49Å; Y815-Y836 VanDerWaalsContact CD2-CZ 3.49Å; Y815-Y836 AromaticContact CE2-CD2 3.73Å; Y815-Y836 HydrophobicContact CE2-CD2 3.73Å; Y815-Y836 AromaticContact CE2-CE2 3.71Å; Y815-Y836 HydrophobicContact CE2-CE2 3.71Å; Y815-Y836 HydrophobicContact CE2-CG 4.34Å; Y815-Y836 HydrophobicContact CG-CD1 4.15Å; Y815-Y836 HydrophobicContact CG-CD2 4.32Å; Y815-Y836 HydrophobicContact CG-CE1 4.18Å; Y815-Y836 HydrophobicContact CG-CE2 4.38Å; Y815-Y836 HydrophobicContact CG-CG 4.18Å; Y815-P864 HydrophobicContact CE2-CG 4.39Å; Y815-P864 WeakPolarHBondContact OH-CG 3.44Å; Y815-Y895 AromaticContact CD1-CE1 3.69Å; Y815-Y895 HydrophobicContact CD1-CE1 3.69Å; Y815-Y895 AromaticContact CD1-CZ 3.75Å; Y815-Y895 WeakPolarHBondContact CD1-OH 3.33Å; Y815-Y895 HydrophobicContact CE1-CD1 4.43Å; Y815-Y895 AromaticContact CE1-CE1 3.45Å; Y815-Y895 HydrophobicContact CE1-CE1 3.45Å; Y815-Y895 VanDerWaalsContact CE1-CE1 3.45Å; Y815-Y895 AromaticContact CE1-CZ 3.71Å; Y815-M898 HydrophobicContact CE1-CE 4.24Å; Y815-M898 HydrophobicContact CE2-CE 4.47Å; Y815-M898 VanDerWaalsContact OH-CE 3.27Å; Y815-M898 WeakPolarHBondContact OH-CE 3.36Å
816	L	86.7	Confident	93.9	Very high	44 Å²	44	20.7 Å²	20.7	23%	0.23	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	44.9	179.4	-58.1	173.1	0	0	0	114.1	Q818 P864	L816-Q818 VanDerWaalsContact C-N 3.3Å; L816-Q818 PolarHBondContact O-N 3.09Å; L816-P864 HydrophobicContact CD1-CB 3.71Å; L816-P864 HydrophobicContact CD1-CG 4.17Å; L816-P864 HydrophobicContact CD2-CB 3.9Å; L816-P864 HydrophobicContact CD2-CG 4.12Å; L816-P864 WeakPolarHBondContact CD2-O 3.4Å; L816-P864 HydrophobicContact CG-CB 4.37Å
817	G	90.8	Very high	94.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-2.7	177.9	0	0	0	0	0	115.4	A616 E618 V620 S638 Y815	A616-G817 WeakPolarHBondContact O-CA 3.38Å; E618-G817 PolarHBondContact N-O 2.87Å; V620-G817 VanDerWaalsContact CG2-O 3.27Å; V620-G817 WeakPolarHBondContact CG2-O 3.39Å; S638-G817 VanDerWaalsContact O-CA 3.26Å; S638-G817 WeakPolarHBondContact O-CA 3.4Å; S638-G817 PolarHBondContact O-N 2.89Å; Y815-G817 VanDerWaalsContact C-N 3.27Å; Y815-G817 PolarHBondContact O-N 2.99Å
818	Q	94	Very high	94.2	Very high	12 Å²	12	17.4 Å²	17.4	6%	0.056	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	149.8	-176.2	-53.8	-168.7	-48.7	0	0	112	E618 M814 Y815 L816 A875 V877	E618-Q818 HydrophobicContact CB-CG 3.94Å; E618-Q818 WeakPolarHBondContact O-CG 3.37Å; M814-Q818 CarbonylContact C-O 3.26Å; M814-Q818 VanDerWaalsContact CA-O 3.22Å; M814-Q818 WeakPolarHBondContact CA-O 3.4Å; Y815-Q818 PolarHBondContact N-O 3.43Å; Y815-Q818 PolarHBondContact O-N 2.77Å; L816-Q818 VanDerWaalsContact C-N 3.3Å; L816-Q818 PolarHBondContact O-N 3.09Å; Q818-A875 PolarHBondContact NE2-O 3.17Å; Q818-V877 HydrophobicContact CB-CG2 3.92Å; Q818-V877 VanDerWaalsContact OE1-CG1 3.26Å
819	I	95.5	Very high	94.2	Very high	8 Å²	8	18.5 Å²	18.5	4%	0.041	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.7	168.6	-67.6	175.5	0	0	0	108.2	V620 F622 A812 V813 M814 I822 V877 L879	V620-I819 HydrophobicContact CG1-CD1 3.75Å; V620-I819 HydrophobicContact CG1-CG1 4.17Å; V620-I819 HydrophobicContact CG2-CG1 4.43Å; F622-I819 HydrophobicContact CB-CD1 4.48Å; F622-I819 HydrophobicContact CD1-CD1 4.07Å; A812-I819 HydrophobicContact CB-CD1 4.1Å; A812-I819 HydrophobicContact CB-CG1 4.47Å; A812-I819 HydrophobicContact CB-CG2 4.41Å; V813-I819 CarbonylContact O-C 3.57Å; V813-I819 WeakPolarHBondContact O-CA 3.44Å; M814-I819 HydrophobicContact CG-CG1 4.03Å; I819-I822 HydrophobicContact CG2-CB 3.89Å; I819-I822 HydrophobicContact CG2-CG2 4.13Å; I819-V877 WeakPolarHBondContact O-CG2 3.5Å; I819-L879 HydrophobicContact CG2-CD1 4.42Å
820	V	95.1	Very high	94	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-19.1	-179.2	-65.3	0	0	0	0	113.4	V813 Y836 A889	V813-V820 HydrophobicContact CB-CG2 4.27Å; V813-V820 HydrophobicContact CG1-CG2 4.05Å; V813-V820 WeakPolarHBondContact O-CG2 3.46Å; V813-V820 PolarHBondContact O-N 2.83Å; V820-Y836 HydrophobicContact CG2-CD1 4.17Å; V820-A889 HydrophobicContact CB-CB 4.19Å; V820-A889 HydrophobicContact CG1-CB 4.49Å; V820-A889 WeakPolarHBondContact O-CB 3.4Å; V820-A889 PolarHBondContact O-N 2.7Å
821	E	96.5	Very high	93.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	133.3	174.6	-178.9	159.6	-164.9	0	0	108.9	A812 V813 V828 Q833 H834 T837 H886 Y887 V888	A812-E821 CarbonylContact C-O 3.57Å; A812-E821 WeakPolarHBondContact CA-O 3.33Å; V813-E821 HydrophobicContact CB-CB 4.21Å; V813-E821 HydrophobicContact CG2-CB 4.22Å; V813-E821 PolarHBondContact N-O 3.07Å; E821-V828 HydrophobicContact CG-CG2 4.47Å; E821-Q833 PolarHBondContact OE1-N 2.96Å; E821-H834 HydrophobicContact CB-CB 4.14Å; E821-H834 WeakPolarHBondContact OE2-CB 3.42Å; E821-H834 PolarHBondContact OE2-N 3.45Å; E821-T837 WeakPolarHBondContact OE2-CB 3.34Å; E821-T837 PolarHBondContact OE2-OG1 2.96Å; E821-H886 IonicContact OE1-CD2 3.78Å; E821-H886 IonicContact OE1-CE1 3.66Å; E821-H886 PolarHBondContact OE1-CE1 2.99Å; E821-H886 IonicContact OE1-NE2 2.69Å; E821-H886 PolarHBondContact OE1-NE2 3.06Å; E821-Y887 CarbonylContact C-O 3.52Å; E821-Y887 WeakPolarHBondContact CA-O 3.41Å; E821-V888 HydrophobicContact CG-CG2 4.02Å
822	I	97.1	Very high	93.6	Very high	11 Å²	11	23.6 Å²	23.6	6%	0.056	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	136	176.7	-175.2	171	0	0	0	110.2	F622 L630 V811 A812 I819 L879 H886 Y887	F622-I822 HydrophobicContact CB-CD1 4.09Å; L630-I822 HydrophobicContact CD1-CD1 4.42Å; V811-I822 CarbonylContact O-C 3.56Å; V811-I822 VanDerWaalsContact O-CA 3.24Å; V811-I822 WeakPolarHBondContact O-CA 3.31Å; A812-I822 HydrophobicContact CB-CB 4.19Å; A812-I822 HydrophobicContact CB-CD1 3.79Å; A812-I822 HydrophobicContact CB-CG1 3.83Å; I819-I822 HydrophobicContact CG2-CB 3.89Å; I819-I822 HydrophobicContact CG2-CG2 4.13Å; I822-L879 HydrophobicContact CG2-CD1 4.13Å; I822-H886 CarbonylContact O-C 3.56Å; I822-H886 WeakPolarHBondContact O-CA 3.17Å; I822-Y887 HydrophobicContact CG2-CD2 4.44Å; I822-Y887 PolarHBondContact N-O 3Å; I822-Y887 PolarHBondContact O-N 3.46Å
823	G	95.7	Very high	93.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.3	-173.8	175.8	0	0	0	0	0	114.6	R810 V811 G885	R810-G823 CarbonylContact C-O 3.54Å; R810-G823 VanDerWaalsContact CA-O 3.3Å; R810-G823 WeakPolarHBondContact CA-O 3.46Å; V811-G823 PolarHBondContact N-O 3.46Å; V811-G823 PolarHBondContact O-N 3.05Å; G823-G885 VanDerWaalsContact CA-O 3.3Å; G823-G885 WeakPolarHBondContact CA-O 3.23Å
824	P	94.6	Very high	93.3	Very high	44 Å²	44	26.4 Å²	26.4	29%	0.286	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	139.2	170.5	-23.5	33.8	0	0	0	110.6	R826 A827 V828	P824-R826 PolarHBondContact O-N 2.91Å; P824-R826 VanDerWaalsContact O-N 3.16Å; P824-A827 HydrophobicContact CB-CB 4.4Å; P824-A827 PolarHBondContact O-N 3.47Å; P824-V828 PolarHBondContact O-N 3.28Å; P824-V828 VanDerWaalsContact O-N 3.15Å
825	R	94.2	Very high	93.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-48.3	-47.8	-178.9	179.6	-85.8	-62.2	167.1	0.1	111.5	M571 E574 G576 E805 S808 H809 V811 A827 V828 F829	M571-R825 PolarHBondContact O-NH1 3.34Å; E574-R825 VanDerWaalsContact C-NH2 3.26Å; E574-R825 VanDerWaalsContact O-CZ 3.28Å; E574-R825 PolarHBondContact O-NH1 3.39Å; E574-R825 VanDerWaalsContact O-NH1 3.12Å; E574-R825 PolarHBondContact O-NH2 3.49Å; G576-R825 PolarHBondContact O-NH2 3.3Å; E805-R825 WeakPolarHBondContact O-CD 3.47Å; E805-R825 PolarHBondContact O-NE 3.14Å; S808-R825 WeakPolarHBondContact O-CB 3.29Å; H809-R825 PolarHBondContact O-N 2.66Å; V811-R825 HydrophobicContact CG2-CB 3.99Å; V811-R825 HydrophobicContact CG2-CG 4.1Å; R825-A827 VanDerWaalsContact C-N 3.34Å; R825-A827 PolarHBondContact O-N 3.22Å; R825-V828 PolarHBondContact O-N 3.08Å; R825-F829 HydrophobicContact CG-CD2 4.01Å; R825-F829 HydrophobicContact CG-CE2 4.25Å; R825-F829 WeakPolarHBondContact O-CB 3.42Å; R825-F829 VanDerWaalsContact O-CD2 3.3Å; R825-F829 WeakPolarHBondContact O-CD2 3.48Å; R825-F829 PolarHBondContact O-N 2.99Å
826	R	92.9	Very high	93	Very high	104 Å²	104	26.3 Å²	26.3	39%	0.392	14%	0.135	S	C	.	.	H	α-helix	trans	-54.3	-46.5	177.4	-172.9	177.3	172	177.3	-7.8	113	G573 P824 E830	G573-R826 PolarHBondContact O-NH1 3.2Å; G573-R826 VanDerWaalsContact O-NH1 3.07Å; P824-R826 PolarHBondContact O-N 2.91Å; P824-R826 VanDerWaalsContact O-N 3.16Å; R826-E830 HydrophobicContact CG-CG 4.13Å; R826-E830 WeakPolarHBondContact CG-OE1 3.35Å; R826-E830 WeakPolarHBondContact CG-OE2 3.49Å; R826-E830 IonicContact CZ-OE2 3.69Å; R826-E830 IonicContact NE-OE1 3.7Å; R826-E830 IonicContact NE-OE2 2.72Å; R826-E830 PolarHBondContact NE-OE2 2.89Å; R826-E830 IonicContact NH2-OE2 3.47Å; R826-E830 WeakPolarHBondContact O-CB 3.35Å; R826-E830 WeakPolarHBondContact O-CG 3.23Å; R826-E830 PolarHBondContact O-N 3.03Å
827	A	93.5	Very high	93.2	Very high	27 Å²	27	24.4 Å²	24.4	22%	0.223	13%	0.125	C	C	.	.	H	α-helix	trans	-68.2	-42.9	-176.4	0	0	0	0	0	112	P824 R825 N831 H886	P824-A827 HydrophobicContact CB-CB 4.4Å; P824-A827 PolarHBondContact O-N 3.47Å; R825-A827 VanDerWaalsContact C-N 3.34Å; R825-A827 PolarHBondContact O-N 3.22Å; A827-N831 CarbonylContact O-C 3.56Å; A827-N831 VanDerWaalsContact O-C 3.26Å; A827-N831 WeakPolarHBondContact O-CA 3.49Å; A827-N831 PolarHBondContact O-N 2.81Å; A827-H886 HydrophobicContact CB-CB 4.24Å
828	V	93.9	Very high	93.2	Very high	3 Å²	3	30.3 Å²	30.3	2%	0.018	15%	0.148	C	C	.	.	H	α-helix	trans	-68.1	-38	179.4	179	0	0	0	0	111.7	V811 V813 E821 P824 R825 P832 T837	V811-V828 HydrophobicContact CB-CB 4.3Å; V811-V828 HydrophobicContact CB-CG1 4.26Å; V811-V828 HydrophobicContact CB-CG2 4.3Å; V811-V828 HydrophobicContact CG1-CG1 4.1Å; V813-V828 HydrophobicContact CG2-CG1 4.12Å; E821-V828 HydrophobicContact CG-CG2 4.47Å; P824-V828 PolarHBondContact O-N 3.28Å; P824-V828 VanDerWaalsContact O-N 3.15Å; R825-V828 PolarHBondContact O-N 3.08Å; V828-P832 WeakPolarHBondContact O-CA 3.32Å; V828-P832 WeakPolarHBondContact O-CB 3.5Å; V828-T837 HydrophobicContact CG1-CG2 3.95Å
829	F	92.8	Very high	92.9	Very high	22 Å²	22	31.7 Å²	31.7	10%	0.096	15%	0.154	C	C	.	.	H	α-helix	trans	-82.6	-42.6	-178.3	-84.3	-105.4	0	0	0	113.6	L568 M801 V804 E805 V811 R825 L841	L568-F829 HydrophobicContact CD1-CD1 3.78Å; L568-F829 HydrophobicContact CD1-CE1 3.57Å; M801-F829 HydrophobicContact CB-CE1 4.02Å; M801-F829 HydrophobicContact CB-CZ 4.17Å; M801-F829 WeakPolarHBondContact O-CE1 3.38Å; M801-F829 WeakPolarHBondContact O-CZ 3.23Å; M801-F829 HydrophobicContact SD-CZ 4.43Å; V804-F829 HydrophobicContact CB-CZ 4.08Å; V804-F829 HydrophobicContact CG1-CE2 3.79Å; V804-F829 HydrophobicContact CG1-CZ 3.75Å; E805-F829 HydrophobicContact CB-CD1 3.96Å; E805-F829 HydrophobicContact CB-CE1 3.56Å; E805-F829 HydrophobicContact CB-CZ 3.97Å; E805-F829 HydrophobicContact CG-CD1 3.75Å; E805-F829 HydrophobicContact CG-CE1 3.91Å; E805-F829 HydrophobicContact CG-CG 4.25Å; V811-F829 HydrophobicContact CG1-CE2 4.37Å; V811-F829 HydrophobicContact CG2-CD2 4.32Å; V811-F829 HydrophobicContact CG2-CE2 3.83Å; R825-F829 HydrophobicContact CG-CD2 4.01Å; R825-F829 HydrophobicContact CG-CE2 4.25Å; R825-F829 WeakPolarHBondContact O-CB 3.42Å; R825-F829 VanDerWaalsContact O-CD2 3.3Å; R825-F829 WeakPolarHBondContact O-CD2 3.48Å; R825-F829 PolarHBondContact O-N 2.99Å; F829-L841 HydrophobicContact CD1-CD2 3.84Å; F829-L841 HydrophobicContact CE1-CD2 3.87Å; F829-L841 HydrophobicContact CG-CD2 4.47Å
830	E	91.6	Very high	92.4	Very high	73 Å²	73	31.4 Å²	31.4	34%	0.341	15%	0.152	S	C	.	.	H	α-helix	trans	-85.6	-25.3	-175.8	-62.6	-179.2	-177.2	0	0	113	G573 R826	G573-E830 PolarHBondContact N-OE1 3.13Å; R826-E830 HydrophobicContact CG-CG 4.13Å; R826-E830 WeakPolarHBondContact CG-OE1 3.35Å; R826-E830 WeakPolarHBondContact CG-OE2 3.49Å; R826-E830 IonicContact CZ-OE2 3.69Å; R826-E830 IonicContact NE-OE1 3.7Å; R826-E830 IonicContact NE-OE2 2.72Å; R826-E830 PolarHBondContact NE-OE2 2.89Å; R826-E830 IonicContact NH2-OE2 3.47Å; R826-E830 WeakPolarHBondContact O-CB 3.35Å; R826-E830 WeakPolarHBondContact O-CG 3.23Å; R826-E830 PolarHBondContact O-N 3.03Å
831	N	92.1	Very high	92.1	Very high	96 Å²	96	32.5 Å²	32.5	51%	0.513	16%	0.158	S	C	.	.	S	Bend	trans	-140.2	56.4	-178.5	-170.1	31.6	0	0	0	112.4	A827 Q833	A827-N831 CarbonylContact O-C 3.56Å; A827-N831 VanDerWaalsContact O-C 3.26Å; A827-N831 WeakPolarHBondContact O-CA 3.49Å; A827-N831 PolarHBondContact O-N 2.81Å; N831-Q833 PolarHBondContact ND2-NE2 2.94Å; N831-Q833 VanDerWaalsContact ND2-NE2 3.16Å; N831-Q833 PolarHBondContact O-N 3.46Å; N831-Q833 PolarHBondContact O-NE2 3.03Å; N831-Q833 PolarHBondContact OD1-NE2 3.31Å
832	P	91.9	Very high	91.5	Very high	22 Å²	22	35.7 Å²	35.7	14%	0.143	18%	0.184	C	C	.	.			trans	-59	122.9	179.6	26.4	-36.8	0	0	0	110.7	V828 T837 R838 L841	V828-P832 WeakPolarHBondContact O-CA 3.32Å; V828-P832 WeakPolarHBondContact O-CB 3.5Å; P832-T837 HydrophobicContact CB-CG2 3.7Å; P832-R838 HydrophobicContact CB-CG 3.92Å; P832-R838 HydrophobicContact CG-CG 3.89Å; P832-R838 PolarHBondContact O-NE 3.42Å; P832-R838 PolarHBondContact O-NH2 3.48Å; P832-L841 HydrophobicContact CB-CD1 3.71Å; P832-L841 HydrophobicContact CG-CD1 3.64Å
833	Q	93.1	Very high	90.8	Very high	60 Å²	60	35.4 Å²	35.4	28%	0.28	18%	0.183	S	C	.	.			trans	-93.4	-39.8	-177.2	-67.6	-52.5	-61.5	0	0	112.3	E821 N831 R838 V882 V888	E821-Q833 PolarHBondContact OE1-N 2.96Å; N831-Q833 PolarHBondContact ND2-NE2 2.94Å; N831-Q833 VanDerWaalsContact ND2-NE2 3.16Å; N831-Q833 PolarHBondContact O-N 3.46Å; N831-Q833 PolarHBondContact O-NE2 3.03Å; N831-Q833 PolarHBondContact OD1-NE2 3.31Å; Q833-R838 PolarHBondContact O-NH2 3.42Å; Q833-V882 HydrophobicContact CG-CG2 4.09Å; Q833-V888 HydrophobicContact CB-CB 4.29Å; Q833-V888 HydrophobicContact CB-CG1 3.82Å; Q833-V888 HydrophobicContact CB-CG2 3.63Å; Q833-V888 HydrophobicContact CG-CG2 4.03Å
834	H	92.5	Very high	90.1	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	19%	0.186	C	C	.	.	S	Bend	trans	-77.1	138	-174.6	-167	-103.2	0	0	0	111.3	E821 Y836 T837 R838 V888 A889 Y895	E821-H834 HydrophobicContact CB-CB 4.14Å; E821-H834 WeakPolarHBondContact OE2-CB 3.42Å; E821-H834 PolarHBondContact OE2-N 3.45Å; H834-Y836 VanDerWaalsContact C-N 3.27Å; H834-Y836 WeakPolarHBondContact ND1-CB 3.39Å; H834-Y836 PolarHBondContact ND1-N 3.45Å; H834-Y836 PolarHBondContact O-N 2.98Å; H834-T837 WeakPolarHBondContact O-CB 3.35Å; H834-T837 PolarHBondContact O-N 2.99Å; H834-T837 VanDerWaalsContact O-N 3.09Å; H834-R838 PolarHBondContact O-N 3.34Å; H834-R838 VanDerWaalsContact O-N 3.1Å; H834-V888 HydrophobicContact CB-CG1 3.96Å; H834-A889 PolarHBondContact CD2-O 3.5Å; H834-Y895 AromaticContact CE1-CD1 3.81Å; H834-Y895 AromaticContact CE1-CE1 3.22Å; H834-Y895 WeakPolarHBondContact CE1-CE1 3.29Å; H834-Y895 AromaticContact CE1-CZ 3.67Å; H834-Y895 AromaticContact NE2-CE1 3.57Å; H834-Y895 AromaticContact NE2-CZ 3.63Å
835	P	89.3	Confident	89.1	Confident	23 Å²	23	34.6 Å²	34.6	15%	0.149	18%	0.178	C	C	.	.	H	α-helix	trans	-55.5	-40	-179.2	-27.4	35.2	0	0	0	113.7	R838 K839 P891 M898	P835-R838 WeakPolarHBondContact O-CB 3.23Å; P835-R838 PolarHBondContact O-N 3.23Å; P835-K839 PolarHBondContact O-N 2.87Å; P835-P891 HydrophobicContact CG-CB 4.25Å; P835-P891 HydrophobicContact CG-CG 3.99Å; P835-M898 HydrophobicContact CB-CB 4.5Å; P835-M898 HydrophobicContact CB-SD 4.24Å
836	Y	89	Confident	88.1	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-67.3	-38.7	177.7	173.4	-106.1	0	0	0	112.5	E635 V813 M814 Y815 V820 H834 R838 K839 L840	E635-Y836 HydrophobicContact CG-CE2 4.02Å; E635-Y836 WeakPolarHBondContact CG-OH 3.37Å; E635-Y836 PolarHBondContact N-OH 2.9Å; E635-Y836 WeakPolarHBondContact OE1-CE2 3.32Å; V813-Y836 HydrophobicContact CG1-CD1 3.68Å; V813-Y836 HydrophobicContact CG1-CE1 3.69Å; M814-Y836 VanDerWaalsContact O-CE1 3.3Å; M814-Y836 WeakPolarHBondContact O-CE1 3.41Å; M814-Y836 PolarHBondContact O-OH 3.19Å; Y815-Y836 HydrophobicContact CD2-CD1 4.03Å; Y815-Y836 AromaticContact CD2-CD2 3.54Å; Y815-Y836 HydrophobicContact CD2-CD2 3.54Å; Y815-Y836 AromaticContact CD2-CE1 3.84Å; Y815-Y836 HydrophobicContact CD2-CE1 3.84Å; Y815-Y836 AromaticContact CD2-CE2 3.36Å; Y815-Y836 HydrophobicContact CD2-CE2 3.36Å; Y815-Y836 AromaticContact CD2-CG 3.85Å; Y815-Y836 HydrophobicContact CD2-CG 3.85Å; Y815-Y836 AromaticContact CD2-CZ 3.49Å; Y815-Y836 VanDerWaalsContact CD2-CZ 3.49Å; Y815-Y836 AromaticContact CE2-CD2 3.73Å; Y815-Y836 HydrophobicContact CE2-CD2 3.73Å; Y815-Y836 AromaticContact CE2-CE2 3.71Å; Y815-Y836 HydrophobicContact CE2-CE2 3.71Å; Y815-Y836 HydrophobicContact CE2-CG 4.34Å; Y815-Y836 HydrophobicContact CG-CD1 4.15Å; Y815-Y836 HydrophobicContact CG-CD2 4.32Å; Y815-Y836 HydrophobicContact CG-CE1 4.18Å; Y815-Y836 HydrophobicContact CG-CE2 4.38Å; Y815-Y836 HydrophobicContact CG-CG 4.18Å; V820-Y836 HydrophobicContact CG2-CD1 4.17Å; H834-Y836 VanDerWaalsContact C-N 3.27Å; H834-Y836 WeakPolarHBondContact ND1-CB 3.39Å; H834-Y836 PolarHBondContact ND1-N 3.45Å; H834-Y836 PolarHBondContact O-N 2.98Å; Y836-R838 VanDerWaalsContact C-N 3.32Å; Y836-R838 PolarHBondContact O-N 3.27Å; Y836-K839 WeakPolarHBondContact O-CB 3.44Å; Y836-K839 PolarHBondContact O-N 3.23Å; Y836-K839 VanDerWaalsContact O-N 3.13Å; Y836-L840 HydrophobicContact CD1-CD1 4.02Å; Y836-L840 HydrophobicContact CD1-CG 4.44Å; Y836-L840 HydrophobicContact CE1-CD1 3.55Å; Y836-L840 HydrophobicContact CE1-CG 4.11Å; Y836-L840 HydrophobicContact CE2-CD2 4.27Å; Y836-L840 HydrophobicContact CE2-CG 4.28Å; Y836-L840 WeakPolarHBondContact O-CG 3.28Å; Y836-L840 PolarHBondContact O-N 2.98Å
837	T	91.1	Very high	87.3	Confident	4 Å²	4	34 Å²	34	3%	0.025	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-42.2	174.3	-50.7	0	0	0	0	111.1	V813 E821 V828 P832 H834 K839 L840 L841	V813-T837 HydrophobicContact CG2-CG2 3.98Å; E821-T837 WeakPolarHBondContact OE2-CB 3.34Å; E821-T837 PolarHBondContact OE2-OG1 2.96Å; V828-T837 HydrophobicContact CG1-CG2 3.95Å; P832-T837 HydrophobicContact CB-CG2 3.7Å; H834-T837 WeakPolarHBondContact O-CB 3.35Å; H834-T837 PolarHBondContact O-N 2.99Å; H834-T837 VanDerWaalsContact O-N 3.09Å; T837-K839 VanDerWaalsContact C-N 3.33Å; T837-K839 PolarHBondContact O-N 3.1Å; T837-L840 PolarHBondContact O-N 3.13Å; T837-L841 HydrophobicContact CG2-CD1 4.21Å; T837-L841 WeakPolarHBondContact O-CG 3.34Å; T837-L841 PolarHBondContact O-N 3.33Å
838	R	91.3	Very high	86.6	Confident	124 Å²	124	35.4 Å²	35.4	47%	0.468	19%	0.191	S	C	.	.	H	α-helix	trans	-61.8	-40.6	174	-65.3	177.3	-173.7	162.5	5.1	111.9	P832 Q833 H834 P835 Y836 A842	P832-R838 HydrophobicContact CB-CG 3.92Å; P832-R838 HydrophobicContact CG-CG 3.89Å; P832-R838 PolarHBondContact O-NE 3.42Å; P832-R838 PolarHBondContact O-NH2 3.48Å; Q833-R838 PolarHBondContact O-NH2 3.42Å; H834-R838 PolarHBondContact O-N 3.34Å; H834-R838 VanDerWaalsContact O-N 3.1Å; P835-R838 WeakPolarHBondContact O-CB 3.23Å; P835-R838 PolarHBondContact O-N 3.23Å; Y836-R838 VanDerWaalsContact C-N 3.32Å; Y836-R838 PolarHBondContact O-N 3.27Å; R838-A842 WeakPolarHBondContact O-CB 3.36Å; R838-A842 PolarHBondContact O-N 3.41Å
839	K	86.1	Confident	85.8	Confident	42 Å²	42	35.4 Å²	35.4	18%	0.183	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-45.5	176.8	-172.7	-179.2	177.2	-173	0	111.5	P835 Y836 T837 A842 A843 D861	P835-K839 PolarHBondContact O-N 2.87Å; Y836-K839 WeakPolarHBondContact O-CB 3.44Å; Y836-K839 PolarHBondContact O-N 3.23Å; Y836-K839 VanDerWaalsContact O-N 3.13Å; T837-K839 VanDerWaalsContact C-N 3.33Å; T837-K839 PolarHBondContact O-N 3.1Å; K839-A842 PolarHBondContact O-N 3.41Å; K839-A843 WeakPolarHBondContact O-CB 3.28Å; K839-A843 PolarHBondContact O-N 3.02Å; K839-A843 VanDerWaalsContact O-N 3.11Å; K839-D861 IonicContact NZ-OD2 2.76Å; K839-D861 PolarHBondContact NZ-OD2 3.08Å
840	L	86.3	Confident	84.9	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-58.7	-51.1	175.7	-71.7	176.3	0	0	0	111.7	V494 T495 E635 V813 Y836 T837 A842 A843	V494-L840 HydrophobicContact CG2-CD2 4.5Å; T495-L840 HydrophobicContact CG2-CD2 3.84Å; E635-L840 HydrophobicContact CG-CD2 3.88Å; V813-L840 HydrophobicContact CG1-CD1 3.78Å; Y836-L840 HydrophobicContact CD1-CD1 4.02Å; Y836-L840 HydrophobicContact CD1-CG 4.44Å; Y836-L840 HydrophobicContact CE1-CD1 3.55Å; Y836-L840 HydrophobicContact CE1-CG 4.11Å; Y836-L840 HydrophobicContact CE2-CD2 4.27Å; Y836-L840 HydrophobicContact CE2-CG 4.28Å; Y836-L840 WeakPolarHBondContact O-CG 3.28Å; Y836-L840 PolarHBondContact O-N 2.98Å; T837-L840 PolarHBondContact O-N 3.13Å; L840-A842 VanDerWaalsContact C-N 3.33Å; L840-A842 PolarHBondContact O-N 2.97Å; L840-A843 PolarHBondContact O-N 3.26Å
841	L	88	Confident	83.7	Confident	22 Å²	22	43.2 Å²	43.2	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-38.5	179.7	-70.3	168.7	0	0	0	112.1	L568 M801 F829 P832 T837 A843 V844	L568-L841 HydrophobicContact CD1-CD2 4.23Å; L568-L841 HydrophobicContact CD2-CD2 4.31Å; M801-L841 HydrophobicContact CB-CD2 4.21Å; M801-L841 HydrophobicContact CG-CD2 4.11Å; M801-L841 HydrophobicContact SD-CD2 4.43Å; F829-L841 HydrophobicContact CD1-CD2 3.84Å; F829-L841 HydrophobicContact CE1-CD2 3.87Å; F829-L841 HydrophobicContact CG-CD2 4.47Å; P832-L841 HydrophobicContact CB-CD1 3.71Å; P832-L841 HydrophobicContact CG-CD1 3.64Å; T837-L841 HydrophobicContact CG2-CD1 4.21Å; T837-L841 WeakPolarHBondContact O-CG 3.34Å; T837-L841 PolarHBondContact O-N 3.33Å; L841-A843 PolarHBondContact O-N 3.08Å; L841-V844 PolarHBondContact O-N 3.43Å
842	A	84.9	Confident	82.1	Confident	67 Å²	67	45.5 Å²	45.5	55%	0.554	24%	0.237	S	C	*	.	H	α-helix	trans	-68.8	-20.4	177.6	0	0	0	0	0	113.5	R838 K839 L840 R853	R838-A842 WeakPolarHBondContact O-CB 3.36Å; R838-A842 PolarHBondContact O-N 3.41Å; K839-A842 PolarHBondContact O-N 3.41Å; L840-A842 VanDerWaalsContact C-N 3.33Å; L840-A842 PolarHBondContact O-N 2.97Å; A842-R853 VanDerWaalsContact O-CZ 3.23Å; A842-R853 PolarHBondContact O-NE 2.8Å; A842-R853 PolarHBondContact O-NH2 3.05Å
843	A	81	Confident	80.5	Confident	5 Å²	5	48.1 Å²	48.1	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-84.8	-17.1	179.3	0	0	0	0	0	113.8	V494 T495 A498 K839 L840 L841 P845 R853	V494-A843 HydrophobicContact CB-CB 4.45Å; V494-A843 HydrophobicContact CG2-CB 4.26Å; T495-A843 HydrophobicContact CG2-CB 3.88Å; A498-A843 HydrophobicContact CB-CB 4.49Å; K839-A843 WeakPolarHBondContact O-CB 3.28Å; K839-A843 PolarHBondContact O-N 3.02Å; K839-A843 VanDerWaalsContact O-N 3.11Å; L840-A843 PolarHBondContact O-N 3.26Å; L841-A843 PolarHBondContact O-N 3.08Å; A843-P845 WeakPolarHBondContact O-CD 3.23Å; A843-R853 PolarHBondContact O-NH1 3.49Å; A843-R853 PolarHBondContact O-NH2 2.76Å
844	V	80.9	Confident	78.5	Confident	8 Å²	8	50 Å²	50	5%	0.048	26%	0.261	C	S	.	.	S	Bend	trans	-63.7	121.1	178.6	-175.4	0	0	0	0	111.1	L568 M801 L841 R853	L568-V844 HydrophobicContact CB-CG1 4.28Å; L568-V844 HydrophobicContact CD2-CB 4.11Å; L568-V844 HydrophobicContact CD2-CG1 4.33Å; L568-V844 HydrophobicContact CD2-CG2 4.25Å; M801-V844 HydrophobicContact CB-CG2 3.64Å; M801-V844 HydrophobicContact CG-CG2 3.72Å; L841-V844 PolarHBondContact O-N 3.43Å; V844-R853 PolarHBondContact O-NH2 3.47Å
845	P	74.2	Confident	76.6	Confident	19 Å²	19	56 Å²	56	12%	0.123	29%	0.289	C	S	.	.			trans	-55.7	141.2	178	-21.7	30.4	0	0	0	111.9	Q497 V524 A843	Q497-P845 VanDerWaalsContact NE2-CG 3.27Å; V524-P845 HydrophobicContact CG2-CG 4.29Å; A843-P845 WeakPolarHBondContact O-CD 3.23Å
846	V	74.6	Confident	74.7	Confident	63 Å²	63	65 Å²	65	38%	0.382	32%	0.32	S	S	.	.			trans	-110.2	125.7	178.7	-175.6	0	0	0	0	107.8	E848	V846-E848 HydrophobicContact CG1-CB 4Å; V846-E848 PolarHBondContact O-N 2.9Å
847	A	74.5	Confident	72.6	Confident	30 Å²	30	68.1 Å²	68.1	25%	0.248	34%	0.339	C	S	.	.	S	Bend	trans	-74.7	48.4	-179.1	0	0	0	0	0	113.1	F550 V565	F550-A847 HydrophobicContact CE1-CB 4.28Å; V565-A847 HydrophobicContact CG1-CB 3.85Å
848	E	79.7	Confident	70.6	Confident	55 Å²	55	70.2 Å²	70.2	26%	0.257	35%	0.35	S	S	.	.			trans	-138.8	99.2	-177.3	-179.4	57.2	-119.6	0	0	108.4	H551 V846 S850 R851	H551-E848 IonicContact CE1-OE1 3.87Å; H551-E848 PolarHBondContact CE1-OE1 3.5Å; H551-E848 VanDerWaalsContact CE1-OE1 3.22Å; H551-E848 IonicContact NE2-OE1 2.74Å; V846-E848 HydrophobicContact CG1-CB 4Å; V846-E848 PolarHBondContact O-N 2.9Å; E848-S850 WeakPolarHBondContact CG-OG 3.44Å; E848-S850 PolarHBondContact O-N 3.28Å; E848-S850 PolarHBondContact OE1-OG 3.28Å; E848-R851 HydrophobicContact CB-CB 4.33Å; E848-R851 HydrophobicContact CB-CG 4.28Å; E848-R851 HydrophobicContact CG-CB 4.19Å; E848-R851 HydrophobicContact CG-CG 3.77Å; E848-R851 PolarHBondContact O-N 3.26Å
849	P	77.7	Confident	68.3	Low	4 Å²	4	68.2 Å²	68.2	3%	0.026	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-32	-173.6	-25.6	35.4	0	0	0	113.5	A526 V546 E547 F550 R851	A526-P849 HydrophobicContact CB-CG 4.19Å; V546-P849 HydrophobicContact CG1-CB 4.13Å; V546-P849 HydrophobicContact CG2-CB 4.09Å; V546-P849 HydrophobicContact CG2-CG 3.88Å; E547-P849 WeakPolarHBondContact OE1-CB 3.11Å; F550-P849 HydrophobicContact CB-CG 3.71Å; F550-P849 HydrophobicContact CD1-CG 4.07Å; F550-P849 HydrophobicContact CD2-CG 4.04Å; F550-P849 HydrophobicContact CG-CG 3.65Å; P849-R851 PolarHBondContact O-N 3.14Å
850	S	73.1	Confident	66.4	Low	80 Å²	80	70.4 Å²	70.4	56%	0.559	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-22.7	177.5	68	0	0	0	0	113.7	E848 Q852	E848-S850 WeakPolarHBondContact CG-OG 3.44Å; E848-S850 PolarHBondContact O-N 3.28Å; E848-S850 PolarHBondContact OE1-OG 3.28Å; S850-Q852 VanDerWaalsContact C-N 3.32Å; S850-Q852 PolarHBondContact O-N 3.2Å; S850-Q852 VanDerWaalsContact O-N 3.16Å
851	R	66.6	Low	64.4	Low	179 Å²	179	72.8 Å²	72.8	68%	0.675	38%	0.382	S	S	*	.			trans	-89.4	63.2	177.8	-71.8	-177	-177.3	167.9	5	111.2	E848 P849 R853	E848-R851 HydrophobicContact CB-CB 4.33Å; E848-R851 HydrophobicContact CB-CG 4.28Å; E848-R851 HydrophobicContact CG-CB 4.19Å; E848-R851 HydrophobicContact CG-CG 3.77Å; E848-R851 PolarHBondContact O-N 3.26Å; P849-R851 PolarHBondContact O-N 3.14Å; R851-R853 PolarHBondContact O-N 3.48Å
852	Q	57.1	Low	62.4	Low	143 Å²	143	79 Å²	79	67%	0.668	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-64.3	123	170	-70.4	-169.8	2.4	0	0	110.2	S850	S850-Q852 VanDerWaalsContact C-N 3.32Å; S850-Q852 PolarHBondContact O-N 3.2Å; S850-Q852 VanDerWaalsContact O-N 3.16Å
853	R	59.5	Low	60.7	Low	77 Å²	77	81.1 Å²	81.1	29%	0.291	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-59.8	134.6	172.7	-75.5	180	177.3	150.8	-2.4	109.2	E527 A842 A843 V844 R851 Q855	E527-R853 IonicContact OE1-CZ 3.4Å; E527-R853 IonicContact OE1-NH1 3.61Å; E527-R853 PolarHBondContact OE1-NH1 3.31Å; E527-R853 VanDerWaalsContact OE1-NH1 3.13Å; E527-R853 IonicContact OE2-NH1 3.32Å; E527-R853 PolarHBondContact OE2-NH1 3Å; A842-R853 VanDerWaalsContact O-CZ 3.23Å; A842-R853 PolarHBondContact O-NE 2.8Å; A842-R853 PolarHBondContact O-NH2 3.05Å; A843-R853 PolarHBondContact O-NH1 3.49Å; A843-R853 PolarHBondContact O-NH2 2.76Å; V844-R853 PolarHBondContact O-NH2 3.47Å; R851-R853 PolarHBondContact O-N 3.48Å; R853-Q855 PolarHBondContact O-N 2.95Å
854	P	51.9	Low	59.8	Low	99 Å²	99	83.6 Å²	83.6	64%	0.643	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-53.6	139.3	167.3	19.3	-26.5	0	0	0	108.3	R856	P854-R856 PolarHBondContact O-N 3.43Å
855	Q	51.3	Low	59.1	Low	127 Å²	127	86.4 Å²	86.4	59%	0.593	45%	0.452	S	S	*	.			trans	-63.8	36.4	176.3	-85.1	-176.6	-8.4	0	0	113	R853 V857	R853-Q855 PolarHBondContact O-N 2.95Å; Q855-V857 VanDerWaalsContact C-N 3.25Å; Q855-V857 PolarHBondContact O-N 2.86Å
856	R	49.7	Very low	59.3	Low	212 Å²	212	87 Å²	87	80%	0.8	45%	0.454	S	S	*	.			trans	-63.3	99.2	165.9	-80.5	-175.7	172.9	169	-1.8	106.4	Q502 P854 L858	Q502-R856 PolarHBondContact NE2-O 2.89Å; P854-R856 PolarHBondContact O-N 3.43Å; R856-L858 PolarHBondContact O-N 3.06Å
857	V	44.5	Very low	59.6	Low	68 Å²	68	86.9 Å²	86.9	41%	0.412	45%	0.451	S	S	.	.			trans	-29.6	104.4	156.3	173.7	0	0	0	0	106.3	Q855 L859	Q855-V857 VanDerWaalsContact C-N 3.25Å; Q855-V857 PolarHBondContact O-N 2.86Å; V857-L859 PolarHBondContact O-N 3.09Å
858	L	49.8	Very low	60.1	Low	49 Å²	49	87.3 Å²	87.3	26%	0.257	45%	0.447	S	S	.	.			trans	-57.1	102.3	156.4	-83.2	160.8	0	0	0	103.2	R447 A498 Q499 R856 S860	R447-L858 PolarHBondContact NH1-O 3.49Å; A498-L858 HydrophobicContact CB-CD1 4Å; Q499-L858 HydrophobicContact CG-CB 3.86Å; Q499-L858 HydrophobicContact CG-CD1 3.72Å; Q499-L858 HydrophobicContact CG-CG 4.4Å; R856-L858 PolarHBondContact O-N 3.06Å; L858-S860 PolarHBondContact O-N 3.33Å
859	L	43.3	Very low	60.2	Low	82 Å²	82	89.6 Å²	89.6	43%	0.429	46%	0.461	S	S	.	.			trans	-50.3	133.6	-179.3	-84.6	151.6	0	0	0	106.2	V857 D861 R900	V857-L859 PolarHBondContact O-N 3.09Å; L859-D861 PolarHBondContact O-N 2.99Å; L859-R900 WeakPolarHBondContact CD1-OXT 3.44Å
860	S	44.8	Very low	60.5	Low	88 Å²	88	97.4 Å²	97.4	62%	0.615	49%	0.49	S	S	*	.			trans	-62.2	83.3	163.6	50.7	0	0	0	0	105.9	L858 D862	L858-S860 PolarHBondContact O-N 3.33Å; S860-D862 PolarHBondContact O-N 3.44Å
861	D	45.6	Very low	60.9	Low	52 Å²	52	96.3 Å²	96.3	28%	0.278	49%	0.491	S	S	.	.			trans	-59.2	127.7	165.8	-63.5	-29.4	0	0	0	104.8	K839 L859 L863	K839-D861 IonicContact NZ-OD2 2.76Å; K839-D861 PolarHBondContact NZ-OD2 3.08Å; L859-D861 PolarHBondContact O-N 2.99Å; D861-L863 VanDerWaalsContact C-N 3.35Å; D861-L863 PolarHBondContact O-N 2.83Å
862	D	45.6	Very low	61.7	Low	151 Å²	151	91.8 Å²	91.8	81%	0.807	48%	0.478	S	S	*	.			trans	-48.8	110.3	160.5	-81.5	-37.9	0	0	0	105.4	S860 P864	S860-D862 PolarHBondContact O-N 3.44Å; D862-P864 WeakPolarHBondContact O-CD 3.41Å
863	L	49.6	Very low	62.9	Low	113 Å²	113	92 Å²	92	59%	0.592	48%	0.479	S	S	*	.			trans	-57.7	113.5	-171.2	-92.7	95.5	0	0	0	106.7	P449 D861 S865	P449-L863 HydrophobicContact CG-CD1 4.3Å; D861-L863 VanDerWaalsContact C-N 3.35Å; D861-L863 PolarHBondContact O-N 2.83Å; L863-S865 PolarHBondContact O-N 3.27Å
864	P	62.4	Low	64	Low	56 Å²	56	89.8 Å²	89.8	36%	0.364	47%	0.474	S	S	.	.			trans	-61.9	133	-178.9	17.8	-20.7	0	0	0	107.5	Y815 L816 D862	Y815-P864 HydrophobicContact CE2-CG 4.39Å; Y815-P864 WeakPolarHBondContact OH-CG 3.44Å; L816-P864 HydrophobicContact CD1-CB 3.71Å; L816-P864 HydrophobicContact CD1-CG 4.17Å; L816-P864 HydrophobicContact CD2-CB 3.9Å; L816-P864 HydrophobicContact CD2-CG 4.12Å; L816-P864 WeakPolarHBondContact CD2-O 3.4Å; L816-P864 HydrophobicContact CG-CB 4.37Å; D862-P864 WeakPolarHBondContact O-CD 3.41Å
865	S	66.7	Low	65.4	Low	67 Å²	67	88.4 Å²	88.4	47%	0.469	47%	0.47	S	S	.	.			trans	-100.5	131.2	-174.1	-165.6	0	0	0	0	109.2	L863 I867	L863-S865 PolarHBondContact O-N 3.27Å; S865-I867 PolarHBondContact O-N 2.93Å; S865-I867 VanDerWaalsContact OG-CB 3.31Å; S865-I867 WeakPolarHBondContact OG-CB 3.35Å; S865-I867 WeakPolarHBondContact OG-CG1 3.22Å; S865-I867 PolarHBondContact OG-N 2.78Å
866	N	77.5	Confident	66.8	Low	31 Å²	31	85 Å²	85	17%	0.166	46%	0.464	C	S	.	.			trans	-83.8	18.8	165.1	65.2	-18.5	0	0	0	111.9	V614 H615 H868	V614-N866 CarbonylContact C-O 3.59Å; V614-N866 WeakPolarHBondContact CA-O 3.48Å; V614-N866 WeakPolarHBondContact CG1-ND2 3.47Å; H615-N866 PolarHBondContact N-O 2.81Å; H615-N866 PolarHBondContact O-ND2 2.99Å; N866-H868 PolarHBondContact O-CD2 3.16Å
867	I	81.6	Confident	68.4	Low	61 Å²	61	76.1 Å²	76.1	31%	0.313	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	112	176.8	-57.4	176.4	0	0	0	108.6	L602 R612 E613 V614 S865	L602-I867 HydrophobicContact CD1-CB 4.49Å; L602-I867 HydrophobicContact CD1-CD1 4Å; L602-I867 HydrophobicContact CD1-CG1 4.14Å; L602-I867 HydrophobicContact CD1-CG2 3.57Å; R612-I867 HydrophobicContact CB-CG2 3.93Å; R612-I867 HydrophobicContact CG-CG2 4.42Å; E613-I867 WeakPolarHBondContact O-CA 3.4Å; V614-I867 HydrophobicContact CG2-CG1 4.25Å; S865-I867 PolarHBondContact O-N 2.93Å; S865-I867 VanDerWaalsContact OG-CB 3.31Å; S865-I867 WeakPolarHBondContact OG-CB 3.35Å; S865-I867 WeakPolarHBondContact OG-CG1 3.22Å; S865-I867 PolarHBondContact OG-N 2.78Å
868	H	83.7	Confident	70.5	Confident	39 Å²	39	77 Å²	77	18%	0.181	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	165	179.9	-62.6	-86.3	0	0	0	111.2	R612 E613 H615 N866 E872	R612-H868 CarbonylContact C-O 3.55Å; R612-H868 VanDerWaalsContact CA-O 3.26Å; R612-H868 WeakPolarHBondContact CA-O 3.2Å; R612-H868 WeakPolarHBondContact CB-O 3.44Å; E613-H868 PolarHBondContact N-O 2.7Å; E613-H868 PolarHBondContact O-N 2.83Å; H615-H868 AromaticContact CD2-CD2 3.79Å; H615-H868 AromaticContact CG-CD2 3.47Å; H615-H868 VanDerWaalsContact CG-CD2 3.47Å; H615-H868 AromaticContact ND1-CD2 3.72Å; N866-H868 PolarHBondContact O-CD2 3.16Å; H868-E872 HydrophobicContact CB-CB 4.05Å; H868-E872 HydrophobicContact CB-CG 4.38Å; H868-E872 IonicContact ND1-OE1 3.53Å; H868-E872 PolarHBondContact ND1-OE1 3.39Å; H868-E872 IonicContact ND1-OE2 2.81Å
869	L	83.1	Confident	72.4	Confident	104 Å²	104	77.5 Å²	77.5	55%	0.545	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	146.4	168.2	-69.3	171.5	0	0	0	109.2	R612 G871 E872	R612-L869 HydrophobicContact CG-CD2 4.38Å; L869-G871 PolarHBondContact O-N 3.3Å; L869-G871 VanDerWaalsContact O-N 3.14Å; L869-E872 HydrophobicContact CB-CB 4.49Å; L869-E872 PolarHBondContact N-OE2 2.97Å; L869-E872 WeakPolarHBondContact O-CB 3.29Å; L869-E872 PolarHBondContact O-N 3.25Å
870	R	83.5	Confident	74.8	Confident	168 Å²	168	78 Å²	78	63%	0.634	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	124.1	179.1	-179.8	178.9	-176.8	-152.9	-4.8	110.5	T611 E613	T611-R870 PolarHBondContact O-N 2.84Å; E613-R870 HydrophobicContact CG-CB 4.35Å; E613-R870 HydrophobicContact CG-CG 4.33Å
871	G	81.4	Confident	77.1	Confident	57 Å²	57	77.5 Å²	77.5	59%	0.588	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	86	-3.4	179	0	0	0	0	0	115.6	L869	L869-G871 PolarHBondContact O-N 3.3Å; L869-G871 VanDerWaalsContact O-N 3.14Å
872	E	84.1	Confident	79.4	Confident	84 Å²	84	78.6 Å²	78.6	39%	0.393	45%	0.45	S	S	.	.			trans	-64.1	138.1	168.4	-168.2	-179.3	154.5	0	0	109.1	H615 H868 L869	H615-E872 PolarHBondContact CE1-O 3.03Å; H868-E872 HydrophobicContact CB-CB 4.05Å; H868-E872 HydrophobicContact CB-CG 4.38Å; H868-E872 IonicContact ND1-OE1 3.53Å; H868-E872 PolarHBondContact ND1-OE1 3.39Å; H868-E872 IonicContact ND1-OE2 2.81Å; L869-E872 HydrophobicContact CB-CB 4.49Å; L869-E872 PolarHBondContact N-OE2 2.97Å; L869-E872 WeakPolarHBondContact O-CB 3.29Å; L869-E872 PolarHBondContact O-N 3.25Å
873	E	80.9	Confident	81.5	Confident	148 Å²	148	72.6 Å²	72.6	69%	0.692	42%	0.423	S	S	*	.			trans	-107.3	137.3	177.1	-74.8	-161.4	177.9	0	0	111.2
874	V	82.2	Confident	83.5	Confident	29 Å²	29	73.2 Å²	73.2	18%	0.176	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-91.7	127.6	172.3	-176.4	0	0	0	0	109	E618 K619	E618-V874 HydrophobicContact CG-CB 4.34Å; K619-V874 PolarHBondContact NZ-O 3.47Å
875	A	81.9	Confident	84.8	Confident	70 Å²	70	72 Å²	72	58%	0.579	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-62.7	139.9	176.1	0	0	0	0	0	110.3	Q818 V877	Q818-A875 PolarHBondContact NE2-O 3.17Å; A875-V877 PolarHBondContact O-N 3.07Å
876	A	80.3	Confident	86.1	Confident	56 Å²	56	69.2 Å²	69.2	46%	0.463	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-67.4	132.8	175.1	0	0	0	0	0	109.2	K619 S878	K619-A876 HydrophobicContact CB-CB 4.34Å; K619-A876 HydrophobicContact CD-CB 3.5Å; A876-S878 PolarHBondContact O-N 3.12Å
877	V	84.1	Confident	87	Confident	25 Å²	25	72.5 Å²	72.5	15%	0.152	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-64.4	129	166.9	-78.6	0	0	0	0	110	Q818 I819 A875 A889	Q818-V877 HydrophobicContact CB-CG2 3.92Å; Q818-V877 VanDerWaalsContact OE1-CG1 3.26Å; I819-V877 WeakPolarHBondContact O-CG2 3.5Å; A875-V877 PolarHBondContact O-N 3.07Å; V877-A889 HydrophobicContact CB-CB 3.91Å; V877-A889 HydrophobicContact CG1-CB 4.16Å; V877-A889 HydrophobicContact CG2-CB 4.45Å
878	S	87.9	Confident	87.6	Confident	87 Å²	87	70.2 Å²	70.2	61%	0.608	41%	0.411	S	S	*	.			trans	-83.5	115	172.6	-174.2	0	0	0	0	109	A876	A876-S878 PolarHBondContact O-N 3.12Å
879	L	91.2	Very high	88	Confident	60 Å²	60	68.5 Å²	68.5	31%	0.314	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	124.3	177.6	-64	-179.9	0	0	0	110.7	I819 I822 A889	I819-L879 HydrophobicContact CG2-CD1 4.42Å; I822-L879 HydrophobicContact CG2-CD1 4.13Å; L879-A889 HydrophobicContact CD2-CB 3.89Å
880	Q	92.8	Very high	87.9	Confident	91 Å²	91	69.2 Å²	69.2	43%	0.425	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.6	177.6	-65.8	179.6	-11.3	0	0	110.3	V882 Y887 V888 Q890	Q880-V882 PolarHBondContact O-N 3.01Å; Q880-Y887 CarbonylContact O-C 3.54Å; Q880-Y887 VanDerWaalsContact O-CA 3.27Å; Q880-Y887 WeakPolarHBondContact O-CA 3.43Å; Q880-V888 PolarHBondContact N-O 2.66Å; Q880-V888 PolarHBondContact O-N 3.13Å; Q880-Q890 VanDerWaalsContact OE1-NE2 3.09Å
881	C	93.8	Very high	87.1	Confident	79 Å²	79	64.4 Å²	64.4	53%	0.534	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	119.1	175.4	-171	0	0	0	0	109.8	G883 H886 Y887	C881-G883 PolarHBondContact SG-O 3.01Å; C881-H886 WeakPolarHBondContact CA-O 3.34Å; C881-Y887 HydrophobicContact CB-CD1 3.89Å; C881-Y887 HydrophobicContact CB-CE1 3.72Å
882	V	93.1	Very high	86.1	Confident	75 Å²	75	65.5 Å²	65.5	46%	0.455	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-9	178.6	-62.7	0	0	0	0	112.6	Q833 Q880 H886 V888	Q833-V882 HydrophobicContact CG-CG2 4.09Å; Q880-V882 PolarHBondContact O-N 3.01Å; V882-H886 HydrophobicContact CG2-CB 3.96Å; V882-H886 VanDerWaalsContact CG2-CG 3.49Å; V882-H886 WeakPolarHBondContact CG2-ND1 3.3Å; V882-H886 WeakPolarHBondContact CG2-O 3.49Å; V882-H886 PolarHBondContact N-O 3.33Å; V882-V888 HydrophobicContact CB-CG2 4.39Å; V882-V888 HydrophobicContact CG1-CB 4.17Å; V882-V888 HydrophobicContact CG1-CG2 3.92Å; V882-V888 HydrophobicContact CG2-CG2 3.54Å
883	G	89.9	Confident	84.3	Confident	24 Å²	24	66.4 Å²	66.4	25%	0.247	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.2	174.6	178.6	0	0	0	0	0	111	C881 G885 H886	C881-G883 PolarHBondContact SG-O 3.01Å; G883-G885 PolarHBondContact O-N 3.02Å; G883-H886 PolarHBondContact N-O 3.45Å; G883-H886 PolarHBondContact O-N 3.42Å
884	P	90.4	Very high	82.8	Confident	127 Å²	127	65.6 Å²	65.6	83%	0.825	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	109.9	-178.2	-26.1	35.1	0	0	0	112.4	H886	P884-H886 PolarHBondContact O-N 3.14Å
885	G	90.2	Very high	81.3	Confident	31 Å²	31	64.9 Å²	64.9	32%	0.32	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	3.7	-178.1	0	0	0	0	0	115.6	G823 G883 Y887	G823-G885 VanDerWaalsContact CA-O 3.3Å; G823-G885 WeakPolarHBondContact CA-O 3.23Å; G883-G885 PolarHBondContact O-N 3.02Å; G885-Y887 WeakPolarHBondContact O-CD2 3.41Å
886	H	94.7	Very high	78.9	Confident	7 Å²	7	64.4 Å²	64.4	3%	0.032	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117	-178.6	-172.6	-171	0	0	0	110.2	E821 I822 A827 C881 V882 G883 P884	E821-H886 IonicContact OE1-CD2 3.78Å; E821-H886 IonicContact OE1-CE1 3.66Å; E821-H886 PolarHBondContact OE1-CE1 2.99Å; E821-H886 IonicContact OE1-NE2 2.69Å; E821-H886 PolarHBondContact OE1-NE2 3.06Å; I822-H886 CarbonylContact O-C 3.56Å; I822-H886 WeakPolarHBondContact O-CA 3.17Å; A827-H886 HydrophobicContact CB-CB 4.24Å; C881-H886 WeakPolarHBondContact CA-O 3.34Å; V882-H886 HydrophobicContact CG2-CB 3.96Å; V882-H886 VanDerWaalsContact CG2-CG 3.49Å; V882-H886 WeakPolarHBondContact CG2-ND1 3.3Å; V882-H886 WeakPolarHBondContact CG2-O 3.49Å; V882-H886 PolarHBondContact N-O 3.33Å; G883-H886 PolarHBondContact N-O 3.45Å; G883-H886 PolarHBondContact O-N 3.42Å; P884-H886 PolarHBondContact O-N 3.14Å
887	Y	96.2	Very high	76.8	Confident	101 Å²	101	69.4 Å²	69.4	40%	0.396	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.8	-174.6	-59.8	-93.3	0	0	0	111	E821 I822 Q880 C881 G885	E821-Y887 CarbonylContact C-O 3.52Å; E821-Y887 WeakPolarHBondContact CA-O 3.41Å; I822-Y887 HydrophobicContact CG2-CD2 4.44Å; I822-Y887 PolarHBondContact N-O 3Å; I822-Y887 PolarHBondContact O-N 3.46Å; Q880-Y887 CarbonylContact O-C 3.54Å; Q880-Y887 VanDerWaalsContact O-CA 3.27Å; Q880-Y887 WeakPolarHBondContact O-CA 3.43Å; C881-Y887 HydrophobicContact CB-CD1 3.89Å; C881-Y887 HydrophobicContact CB-CE1 3.72Å; G885-Y887 WeakPolarHBondContact O-CD2 3.41Å
888	V	94.6	Very high	74.9	Confident	12 Å²	12	70.2 Å²	70.2	7%	0.073	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.8	-170.5	-174.1	0	0	0	0	110.3	E821 Q833 H834 Q880 V882	E821-V888 HydrophobicContact CG-CG2 4.02Å; Q833-V888 HydrophobicContact CB-CB 4.29Å; Q833-V888 HydrophobicContact CB-CG1 3.82Å; Q833-V888 HydrophobicContact CB-CG2 3.63Å; Q833-V888 HydrophobicContact CG-CG2 4.03Å; H834-V888 HydrophobicContact CB-CG1 3.96Å; Q880-V888 PolarHBondContact N-O 2.66Å; Q880-V888 PolarHBondContact O-N 3.13Å; V882-V888 HydrophobicContact CB-CG2 4.39Å; V882-V888 HydrophobicContact CG1-CB 4.17Å; V882-V888 HydrophobicContact CG1-CG2 3.92Å; V882-V888 HydrophobicContact CG2-CG2 3.54Å
889	A	92.6	Very high	72.2	Confident	4 Å²	4	76.2 Å²	76.2	3%	0.033	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	142.5	173	0	0	0	0	0	110.6	V820 H834 V877 L879	V820-A889 HydrophobicContact CB-CB 4.19Å; V820-A889 HydrophobicContact CG1-CB 4.49Å; V820-A889 WeakPolarHBondContact O-CB 3.4Å; V820-A889 PolarHBondContact O-N 2.7Å; H834-A889 PolarHBondContact CD2-O 3.5Å; V877-A889 HydrophobicContact CB-CB 3.91Å; V877-A889 HydrophobicContact CG1-CB 4.16Å; V877-A889 HydrophobicContact CG2-CB 4.45Å; L879-A889 HydrophobicContact CD2-CB 3.89Å
890	Q	80.8	Confident	69.3	Low	119 Å²	119	85.9 Å²	85.9	56%	0.556	44%	0.443	S	S	*	.			trans	-66.4	133.7	167	-71.5	-163.5	-15.2	0	0	109.6	Q880 Q892	Q880-Q890 VanDerWaalsContact OE1-NE2 3.09Å; Q890-Q892 PolarHBondContact O-N 3.27Å
891	P	65.1	Low	68.1	Low	66 Å²	66	85.6 Å²	85.6	43%	0.429	44%	0.444	S	S	.	.			trans	-60.4	113.7	175.1	-16.2	27.8	0	0	0	109.1	P835 Y895	P835-P891 HydrophobicContact CG-CB 4.25Å; P835-P891 HydrophobicContact CG-CG 3.99Å; P891-Y895 HydrophobicContact CB-CD2 4.23Å; P891-Y895 HydrophobicContact CB-CG 4.06Å
892	Q	61	Low	66.7	Low	81 Å²	81	85.9 Å²	85.9	38%	0.379	44%	0.439	S	S	.	.			trans	-60.4	162.7	168	-58.1	-176.6	8.7	0	0	110.9	Q890 E894 Y895	Q890-Q892 PolarHBondContact O-N 3.27Å; Q892-E894 PolarHBondContact O-N 3.13Å; Q892-E894 VanDerWaalsContact O-N 3.09Å; Q892-Y895 HydrophobicContact CB-CD2 3.73Å; Q892-Y895 HydrophobicContact CB-CE2 3.76Å; Q892-Y895 HydrophobicContact CG-CD2 4.46Å; Q892-Y895 HydrophobicContact CG-CE2 4.04Å; Q892-Y895 VanDerWaalsContact O-CB 3.32Å; Q892-Y895 WeakPolarHBondContact O-CB 3.39Å; Q892-Y895 VanDerWaalsContact O-CD2 3.26Å; Q892-Y895 WeakPolarHBondContact O-CD2 3.36Å; Q892-Y895 PolarHBondContact O-N 2.63Å
893	S	46.2	Very low	65.3	Low	103 Å²	103	86.6 Å²	86.6	72%	0.72	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-57.9	-26.2	-178.6	62.8	0	0	0	0	113.8	Y895 A896	S893-Y895 PolarHBondContact O-N 3.38Å; S893-A896 WeakPolarHBondContact O-CB 3.44Å; S893-A896 PolarHBondContact O-N 2.83Å
894	E	50.3	Low	63.8	Low	131 Å²	131	90.2 Å²	90.2	61%	0.612	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-62.1	-29.1	172.6	-70.6	-177.3	159	0	0	112.7	Q892 A896	Q892-E894 PolarHBondContact O-N 3.13Å; Q892-E894 VanDerWaalsContact O-N 3.09Å; E894-A896 PolarHBondContact O-N 2.99Å
895	Y	50.5	Low	62.2	Low	13 Å²	13	87.9 Å²	87.9	5%	0.051	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-74	-12.8	173.7	-60.1	-90	0	0	0	113.1	Y815 H834 P891 Q892 S893 F897 M898	Y815-Y895 AromaticContact CD1-CE1 3.69Å; Y815-Y895 HydrophobicContact CD1-CE1 3.69Å; Y815-Y895 AromaticContact CD1-CZ 3.75Å; Y815-Y895 WeakPolarHBondContact CD1-OH 3.33Å; Y815-Y895 HydrophobicContact CE1-CD1 4.43Å; Y815-Y895 AromaticContact CE1-CE1 3.45Å; Y815-Y895 HydrophobicContact CE1-CE1 3.45Å; Y815-Y895 VanDerWaalsContact CE1-CE1 3.45Å; Y815-Y895 AromaticContact CE1-CZ 3.71Å; H834-Y895 AromaticContact CE1-CD1 3.81Å; H834-Y895 AromaticContact CE1-CE1 3.22Å; H834-Y895 WeakPolarHBondContact CE1-CE1 3.29Å; H834-Y895 AromaticContact CE1-CZ 3.67Å; H834-Y895 AromaticContact NE2-CE1 3.57Å; H834-Y895 AromaticContact NE2-CZ 3.63Å; P891-Y895 HydrophobicContact CB-CD2 4.23Å; P891-Y895 HydrophobicContact CB-CG 4.06Å; Q892-Y895 HydrophobicContact CB-CD2 3.73Å; Q892-Y895 HydrophobicContact CB-CE2 3.76Å; Q892-Y895 HydrophobicContact CG-CD2 4.46Å; Q892-Y895 HydrophobicContact CG-CE2 4.04Å; Q892-Y895 VanDerWaalsContact O-CB 3.32Å; Q892-Y895 WeakPolarHBondContact O-CB 3.39Å; Q892-Y895 VanDerWaalsContact O-CD2 3.26Å; Q892-Y895 WeakPolarHBondContact O-CD2 3.36Å; Q892-Y895 PolarHBondContact O-N 2.63Å; S893-Y895 PolarHBondContact O-N 3.38Å; Y895-F897 PolarHBondContact O-N 2.89Å; Y895-M898 HydrophobicContact CD1-CE 3.28Å; Y895-M898 HydrophobicContact CD1-SD 3.89Å; Y895-M898 HydrophobicContact CE1-CE 3.75Å; Y895-M898 HydrophobicContact CG-CE 4.22Å; Y895-M898 WeakPolarHBondContact O-CB 3.42Å; Y895-M898 PolarHBondContact O-N 3.27Å
896	A	31.9	Very low	60.3	Low	61 Å²	61	91.7 Å²	91.7	50%	0.504	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-61.9	-24.1	178.3	0	0	0	0	0	111.9	S893 E894 M898 R899	S893-A896 WeakPolarHBondContact O-CB 3.44Å; S893-A896 PolarHBondContact O-N 2.83Å; E894-A896 PolarHBondContact O-N 2.99Å; A896-M898 VanDerWaalsContact C-N 3.3Å; A896-M898 PolarHBondContact O-N 3.46Å; A896-R899 PolarHBondContact O-N 3.49Å
897	F	36.6	Very low	57.8	Low	160 Å²	160	97.8 Å²	97.8	70%	0.702	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-68.1	-27.3	172.7	-73	-82.8	0	0	0	113	Y895 R899	Y895-F897 PolarHBondContact O-N 2.89Å; F897-R899 PolarHBondContact O-N 3.38Å
898	M	42.3	Very low	54.9	Low	43 Å²	43	97.5 Å²	97.5	21%	0.212	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-74.1	-6	178.2	-58.5	-173.5	-156.8	0	0	114.1	Y815 P835 Y895 A896	Y815-M898 HydrophobicContact CE1-CE 4.24Å; Y815-M898 HydrophobicContact CE2-CE 4.47Å; Y815-M898 VanDerWaalsContact OH-CE 3.27Å; Y815-M898 WeakPolarHBondContact OH-CE 3.36Å; P835-M898 HydrophobicContact CB-CB 4.5Å; P835-M898 HydrophobicContact CB-SD 4.24Å; Y895-M898 HydrophobicContact CD1-CE 3.28Å; Y895-M898 HydrophobicContact CD1-SD 3.89Å; Y895-M898 HydrophobicContact CE1-CE 3.75Å; Y895-M898 HydrophobicContact CG-CE 4.22Å; Y895-M898 WeakPolarHBondContact O-CB 3.42Å; Y895-M898 PolarHBondContact O-N 3.27Å; A896-M898 VanDerWaalsContact C-N 3.3Å; A896-M898 PolarHBondContact O-N 3.46Å
899	R	32.5	Very low	51.6	Low	213 Å²	213	104.7 Å²	104.7	80%	0.804	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-87	-2.1	179.8	-76.8	-167.7	179.1	-168.1	1.6	114.3	A896 F897	A896-R899 PolarHBondContact O-N 3.49Å; F897-R899 PolarHBondContact O-N 3.38Å
900	R	29.3	Very low	47.9	Very low	262 Å²	262	113.8 Å²	113.8	99%	0.989	54%	0.542	S	S	*	.			trans	-110.1	0	177.8	-67	-175	-179.4	-174	1.2	110.4	L859	L859-R900 WeakPolarHBondContact CD1-OXT 3.44Å

Retrieved 900 of 900 residues in 897.5 ms (Link to these results)

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