A0A077ZEA3_TRITR Loading...

DUF1758 and DUF1759 and RVT 1 and Peptidase A17 d omain containing protein

AlphaFold DB , UniProt , Accession A0A077ZEA3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 925 aa.

						>A0A077ZEA3_TRITR|A0A077ZEA3
MDQLNRQKRSRAGLKARLTVLTKELKTACSTMQDTLAVEQLVTCVDAVAVKARSVQEELESLLSEEQVEQEVNVYMILERDIRALHVEARQYIEKSKEQTLSTKEVHNGRACAPVLPKWDLPKFNGDVLLFTAFWDNWCSRLDLSGVTKFVHLRTCLEGVAFDAIAGYSVTAANYAAAVATLKSRFGRPILIAEKHILELMQTEKCNRPRARELWQLHDTVTRNVRALVALNKDPSNETLSAAEVLLAVLKQKLPSIVRKRWESKVLAESQEEMTLDAFLEFLQSQVEIEDAAVNSEKEGCKNKRRTEPSELEQRRRKDWFPSAAALQATVHRRNMCSFCSGEHENATCQCFRNVDAKGRWKMVREKRACFLCLGSGYQMHECSKKEEGVQYHPMLMEKRRREKGQASENRKVQVGLAGMPTKGRVLLQTARAVMRTMNGDRTVVMCLLDAGSQRSFITEELANRMRINGPLEYVEISTLGGQSKYCKRIRRVQFALSALDSRERRGAKQWRTVKALCLSKICSPIQANPLLQRRWKHLHGLKLADQFPRECSKIDVLIGLDYYYDFVSQEVRHGHAGELVALRILFGWIVCGSIDEGNKVRNVRSLHAQVMEDPNEILTKLWDLEALGIRNAEEARRGQSTEAITHYIESITFEGERCVVRLPWKTDAVNLPNNYKQAKGRLFQIERKLNDRDVTRYLWRNMNTDIPPGIFRFKRLTFGLRSSPFLAIMVVQHRTRLHIETYKRAAEEVLSNMYVDDFLTSCTDSDEAEPLVDQLRKLMQLGGFNLTKWKCNSSSVAETIGVTDVTANNDRIVSKVLGVPWNLGQDALSFITPHDVISKSRETKRDHWQSGSGWNESIPDVLNAKWNRWKQELHMLPQLLVQRTLIPVDINAVTSIELHAFADASEKAYGAVVYLKVEAAQTTL
					

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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	61.9	Low	81.4	Confident	180 Å²	180	100.8 Å²	100.8	89%	0.887	46%	0.461	S	S	*	.				0	-57.8	0	-90.5	-87.8	-97.6	0	0	112.3	Q3 L4 N5	M1-Q3 PolarHBondContact O-N 3.3Å; M1-L4 PolarHBondContact O-N 2.94Å; M1-N5 PolarHBondContact O-N 3.01Å
2	D	78.8	Confident	81.7	Confident	119 Å²	119	96.5 Å²	96.5	64%	0.636	46%	0.457	S	S	*	.	H	α-helix	trans	-59	-43.9	-176.9	-79.6	-0.4	0	0	0	114.9	N5 R6	D2-N5 PolarHBondContact O-N 3.1Å; D2-R6 WeakPolarHBondContact O-CG 3.32Å; D2-R6 PolarHBondContact O-N 3.34Å
3	Q	80.4	Confident	82.2	Confident	122 Å²	122	91.8 Å²	91.8	57%	0.57	45%	0.449	S	S	*	.	H	α-helix	trans	-64.8	-44.7	178.8	-170.6	175.8	-7.4	0	0	111.9	M1 N5 R6 Q7 L62	M1-Q3 PolarHBondContact O-N 3.3Å; Q3-N5 VanDerWaalsContact C-N 3.32Å; Q3-N5 PolarHBondContact O-N 3.38Å; Q3-R6 WeakPolarHBondContact O-CB 3.44Å; Q3-R6 PolarHBondContact O-N 3.31Å; Q3-Q7 WeakPolarHBondContact O-CG 3.47Å; Q3-Q7 PolarHBondContact O-N 3.37Å; Q3-L62 HydrophobicContact CG-CD1 3.92Å
4	L	81.8	Confident	82.8	Confident	30 Å²	30	86.4 Å²	86.4	16%	0.157	42%	0.423	C	S	.	.	H	α-helix	trans	-59.4	-43.4	175.9	-177.3	67.3	0	0	0	111.5	M1 Q7 K8 L62 L63	M1-L4 PolarHBondContact O-N 2.94Å; L4-Q7 PolarHBondContact O-N 2.68Å; L4-K8 HydrophobicContact CG-CD 4.41Å; L4-K8 WeakPolarHBondContact O-CB 3.49Å; L4-K8 WeakPolarHBondContact O-CG 3.13Å; L4-K8 PolarHBondContact O-N 3.18Å; L4-L62 HydrophobicContact CD1-CB 3.75Å; L4-L63 HydrophobicContact CD1-CD2 3.69Å; L4-L63 HydrophobicContact CD1-CG 4.12Å; L4-L63 HydrophobicContact CD2-CD2 4.12Å; L4-L63 HydrophobicContact CG-CD2 4.5Å
5	N	80.9	Confident	83	Confident	71 Å²	71	85.9 Å²	85.9	38%	0.38	42%	0.418	S	S	.	.	H	α-helix	trans	-65.9	-37.6	176.9	-77.3	-25.6	0	0	0	112.5	M1 D2 Q3 R9	M1-N5 PolarHBondContact O-N 3.01Å; D2-N5 PolarHBondContact O-N 3.1Å; Q3-N5 VanDerWaalsContact C-N 3.32Å; Q3-N5 PolarHBondContact O-N 3.38Å; N5-R9 WeakPolarHBondContact O-CG 3.45Å; N5-R9 PolarHBondContact O-N 3.16Å
6	R	83.9	Confident	83.4	Confident	183 Å²	183	84.1 Å²	84.1	69%	0.691	42%	0.421	S	S	*	.	H	α-helix	trans	-63	-45.2	173.6	-73.6	176.9	-168.2	-164.6	4.9	111.4	D2 Q3 R9 S10	D2-R6 WeakPolarHBondContact O-CG 3.32Å; D2-R6 PolarHBondContact O-N 3.34Å; Q3-R6 WeakPolarHBondContact O-CB 3.44Å; Q3-R6 PolarHBondContact O-N 3.31Å; R6-R9 PolarHBondContact O-N 3.41Å; R6-S10 WeakPolarHBondContact O-CB 3.46Å; R6-S10 PolarHBondContact O-N 3.33Å
7	Q	85.6	Confident	83.8	Confident	28 Å²	28	88.8 Å²	88.8	13%	0.131	43%	0.433	C	S	.	.	H	α-helix	trans	-65.8	-42.7	178.2	-64.9	-59.6	-3	0	0	112	Q3 L4 R9 S10 R11 E58 L59 L62	Q3-Q7 WeakPolarHBondContact O-CG 3.47Å; Q3-Q7 PolarHBondContact O-N 3.37Å; L4-Q7 PolarHBondContact O-N 2.68Å; Q7-R9 VanDerWaalsContact C-N 3.3Å; Q7-R9 PolarHBondContact O-N 2.83Å; Q7-S10 PolarHBondContact O-N 3.36Å; Q7-S10 VanDerWaalsContact O-N 3.16Å; Q7-R11 WeakPolarHBondContact O-CB 3.37Å; Q7-R11 PolarHBondContact O-N 2.67Å; Q7-E58 PolarHBondContact NE2-OE2 3.41Å; Q7-L59 HydrophobicContact CB-CB 4.24Å; Q7-L59 HydrophobicContact CB-CD1 4.01Å; Q7-L59 HydrophobicContact CB-CG 4.38Å; Q7-L62 HydrophobicContact CG-CD1 4.01Å
8	K	83.4	Confident	84.2	Confident	73 Å²	73	83.8 Å²	83.8	32%	0.317	41%	0.409	S	S	.	.	H	α-helix	trans	-57.7	-41.7	174.8	-79.1	-179.2	177.3	-175.8	0	112.1	L4 A12 L59	L4-K8 HydrophobicContact CG-CD 4.41Å; L4-K8 WeakPolarHBondContact O-CB 3.49Å; L4-K8 WeakPolarHBondContact O-CG 3.13Å; L4-K8 PolarHBondContact O-N 3.18Å; K8-A12 WeakPolarHBondContact O-CB 3.42Å; K8-A12 PolarHBondContact O-N 2.94Å; K8-L59 HydrophobicContact CB-CD1 4.32Å; K8-L59 HydrophobicContact CG-CD1 3.68Å
9	R	84.8	Confident	84.4	Confident	203 Å²	203	83.8 Å²	83.8	77%	0.766	41%	0.414	S	S	*	.	H	α-helix	trans	-67.4	-43.6	174.9	-74	178.9	-177.9	-174.2	1.7	112.3	N5 R6 Q7 A12 G13	N5-R9 WeakPolarHBondContact O-CG 3.45Å; N5-R9 PolarHBondContact O-N 3.16Å; R6-R9 PolarHBondContact O-N 3.41Å; Q7-R9 VanDerWaalsContact C-N 3.3Å; Q7-R9 PolarHBondContact O-N 2.83Å; R9-A12 PolarHBondContact O-N 2.88Å; R9-G13 PolarHBondContact O-N 2.84Å
10	S	87.5	Confident	84.6	Confident	50 Å²	50	83.8 Å²	83.8	35%	0.35	42%	0.418	S	S	.	.	H	α-helix	trans	-59.9	-50.3	177.3	-173	0	0	0	0	111.3	R6 Q7 A12 G13 L14	R6-S10 WeakPolarHBondContact O-CB 3.46Å; R6-S10 PolarHBondContact O-N 3.33Å; Q7-S10 PolarHBondContact O-N 3.36Å; Q7-S10 VanDerWaalsContact O-N 3.16Å; S10-A12 PolarHBondContact O-N 3.32Å; S10-G13 PolarHBondContact O-N 3.32Å; S10-L14 WeakPolarHBondContact O-CG 3.35Å; S10-L14 PolarHBondContact O-N 3.05Å
11	R	86.2	Confident	84.9	Confident	50 Å²	50	81.2 Å²	81.2	19%	0.189	41%	0.406	C	S	.	.	H	α-helix	trans	-57.8	-45.4	175.1	-174.2	-150.2	57.5	170.3	-10	111.4	Q7 G13 L14 K15 V55 Q56 L59 E71	Q7-R11 WeakPolarHBondContact O-CB 3.37Å; Q7-R11 PolarHBondContact O-N 2.67Å; R11-G13 VanDerWaalsContact C-N 3.34Å; R11-G13 PolarHBondContact O-N 3.19Å; R11-L14 PolarHBondContact O-N 3.01Å; R11-K15 WeakPolarHBondContact O-CB 3.32Å; R11-K15 PolarHBondContact O-N 2.96Å; R11-V55 HydrophobicContact CB-CG1 3.88Å; R11-Q56 VanDerWaalsContact CD-OE1 3.28Å; R11-L59 HydrophobicContact CB-CD1 4.33Å; R11-E71 IonicContact CZ-OE1 3.58Å; R11-E71 IonicContact CZ-OE2 3.84Å; R11-E71 IonicContact NE-OE1 3.97Å; R11-E71 IonicContact NH1-OE1 2.86Å; R11-E71 PolarHBondContact NH1-OE1 3.48Å; R11-E71 IonicContact NH1-OE2 3.26Å; R11-E71 PolarHBondContact NH1-OE2 2.97Å
12	A	85.4	Confident	86.2	Confident	49 Å²	49	74 Å²	74	41%	0.405	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-41.8	177.8	0	0	0	0	0	112.3	K8 R9 S10 K15 A16	K8-A12 WeakPolarHBondContact O-CB 3.42Å; K8-A12 PolarHBondContact O-N 2.94Å; R9-A12 PolarHBondContact O-N 2.88Å; S10-A12 PolarHBondContact O-N 3.32Å; A12-K15 PolarHBondContact O-N 3.05Å; A12-A16 WeakPolarHBondContact O-CB 3.37Å; A12-A16 PolarHBondContact O-N 3.08Å
13	G	88.6	Confident	86.6	Confident	35 Å²	35	75.7 Å²	75.7	36%	0.361	37%	0.374	S	S	.	.	H	α-helix	trans	-63.9	-41.6	175.3	0	0	0	0	0	113	R9 S10 R11 A16 R17	R9-G13 PolarHBondContact O-N 2.84Å; S10-G13 PolarHBondContact O-N 3.32Å; R11-G13 VanDerWaalsContact C-N 3.34Å; R11-G13 PolarHBondContact O-N 3.19Å; G13-A16 PolarHBondContact O-N 3.08Å; G13-R17 WeakPolarHBondContact O-CG 3.42Å; G13-R17 PolarHBondContact O-N 2.91Å; G13-R17 VanDerWaalsContact O-N 3.1Å
14	L	90.8	Very high	87	Confident	17 Å²	17	74.4 Å²	74.4	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-68	-41	176.5	-69.9	168.9	0	0	0	111.9	S10 R11 R17 L18 V48 K51 A52 V55	S10-L14 WeakPolarHBondContact O-CG 3.35Å; S10-L14 PolarHBondContact O-N 3.05Å; R11-L14 PolarHBondContact O-N 3.01Å; L14-R17 PolarHBondContact O-N 2.74Å; L14-L18 PolarHBondContact O-N 3.35Å; L14-V48 HydrophobicContact CD2-CG1 4Å; L14-K51 HydrophobicContact CD1-CB 4.3Å; L14-K51 HydrophobicContact CD2-CB 4.17Å; L14-A52 HydrophobicContact CB-CB 4.09Å; L14-A52 HydrophobicContact CD1-CB 4.43Å; L14-V55 HydrophobicContact CD1-CB 4.1Å; L14-V55 HydrophobicContact CD1-CG2 3.72Å
15	K	85.4	Confident	87.4	Confident	78 Å²	78	73 Å²	73	34%	0.339	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-44.1	174.9	-171.2	171.9	-177.9	174.6	0	111.3	R11 A12 R17 L18 T19 L78	R11-K15 WeakPolarHBondContact O-CB 3.32Å; R11-K15 PolarHBondContact O-N 2.96Å; A12-K15 PolarHBondContact O-N 3.05Å; K15-R17 VanDerWaalsContact C-N 3.35Å; K15-R17 PolarHBondContact O-N 3.19Å; K15-L18 PolarHBondContact O-N 3.41Å; K15-T19 PolarHBondContact O-N 3.06Å; K15-T19 PolarHBondContact O-OG1 3.19Å; K15-L78 HydrophobicContact CD-CD2 4.48Å; K15-L78 HydrophobicContact CG-CD2 4.1Å
16	A	88.4	Confident	87.7	Confident	57 Å²	57	74.9 Å²	74.9	47%	0.471	37%	0.365	S	S	.	.	H	α-helix	trans	-60.7	-42.5	175.6	0	0	0	0	0	112.2	A12 G13 T19 V20	A12-A16 WeakPolarHBondContact O-CB 3.37Å; A12-A16 PolarHBondContact O-N 3.08Å; G13-A16 PolarHBondContact O-N 3.08Å; A16-T19 PolarHBondContact O-N 3.39Å; A16-V20 WeakPolarHBondContact O-CG2 3.35Å; A16-V20 PolarHBondContact O-N 3.36Å; A16-V20 VanDerWaalsContact O-N 3.08Å
17	R	91.1	Very high	87.9	Confident	164 Å²	164	69.3 Å²	69.3	62%	0.619	35%	0.352	S	S	*	.	H	α-helix	trans	-62.9	-43.9	174.8	-71.5	175.6	-173.1	-175.4	1.8	112.1	G13 L14 K15 T19 V20 L21 V48	G13-R17 WeakPolarHBondContact O-CG 3.42Å; G13-R17 PolarHBondContact O-N 2.91Å; G13-R17 VanDerWaalsContact O-N 3.1Å; L14-R17 PolarHBondContact O-N 2.74Å; K15-R17 VanDerWaalsContact C-N 3.35Å; K15-R17 PolarHBondContact O-N 3.19Å; R17-T19 VanDerWaalsContact C-N 3.34Å; R17-T19 PolarHBondContact O-N 2.83Å; R17-V20 PolarHBondContact O-N 2.83Å; R17-L21 WeakPolarHBondContact O-CG 3.32Å; R17-L21 PolarHBondContact O-N 3.05Å; R17-V48 HydrophobicContact CB-CG1 4.17Å
18	L	90.6	Very high	87.9	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-60.4	-43.7	174.7	-79.5	165	0	0	0	111.2	L14 K15 V20 L21 T22 V45 V48 A49 A52 L78 I82	L14-L18 PolarHBondContact O-N 3.35Å; K15-L18 PolarHBondContact O-N 3.41Å; L18-V20 VanDerWaalsContact C-N 3.32Å; L18-V20 PolarHBondContact O-N 3.18Å; L18-L21 PolarHBondContact O-N 3.3Å; L18-T22 WeakPolarHBondContact O-CB 3.28Å; L18-T22 PolarHBondContact O-N 3.42Å; L18-T22 PolarHBondContact O-OG1 3.12Å; L18-V45 HydrophobicContact CD2-CG1 4.19Å; L18-V48 HydrophobicContact CD1-CG1 4.35Å; L18-V48 HydrophobicContact CD2-CB 3.99Å; L18-V48 HydrophobicContact CD2-CG1 4.06Å; L18-V48 HydrophobicContact CG-CB 4.22Å; L18-V48 HydrophobicContact CG-CG1 3.71Å; L18-A49 HydrophobicContact CD2-CB 4.18Å; L18-A52 HydrophobicContact CD1-CB 3.79Å; L18-L78 HydrophobicContact CD1-CD2 4.11Å; L18-I82 HydrophobicContact CD1-CD1 4.23Å; L18-I82 HydrophobicContact CD2-CD1 4.11Å
19	T	87.6	Confident	87.9	Confident	84 Å²	84	65.2 Å²	65.2	52%	0.515	34%	0.335	S	S	.	.	H	α-helix	trans	-60.3	-40.9	177.2	-57.7	0	0	0	0	112.3	K15 A16 R17 K23	K15-T19 PolarHBondContact O-N 3.06Å; K15-T19 PolarHBondContact O-OG1 3.19Å; A16-T19 PolarHBondContact O-N 3.39Å; R17-T19 VanDerWaalsContact C-N 3.34Å; R17-T19 PolarHBondContact O-N 2.83Å; T19-K23 WeakPolarHBondContact O-CB 3.46Å; T19-K23 PolarHBondContact O-N 3.06Å
20	V	89.8	Confident	87.8	Confident	82 Å²	82	59.5 Å²	59.5	50%	0.497	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-51.9	176.1	174.1	0	0	0	0	110.9	A16 R17 L18 T22 K23 E24	A16-V20 WeakPolarHBondContact O-CG2 3.35Å; A16-V20 PolarHBondContact O-N 3.36Å; A16-V20 VanDerWaalsContact O-N 3.08Å; R17-V20 PolarHBondContact O-N 2.83Å; L18-V20 VanDerWaalsContact C-N 3.32Å; L18-V20 PolarHBondContact O-N 3.18Å; V20-T22 VanDerWaalsContact C-N 3.35Å; V20-T22 PolarHBondContact O-N 2.84Å; V20-K23 WeakPolarHBondContact O-CB 3.42Å; V20-K23 PolarHBondContact O-N 3.25Å; V20-K23 VanDerWaalsContact O-N 3.12Å; V20-E24 PolarHBondContact O-N 3.15Å
21	L	91	Very high	87.4	Confident	30 Å²	30	60.9 Å²	60.9	16%	0.157	33%	0.333	C	S	.	.	H	α-helix	trans	-62.6	-40.3	-179	-71.6	171.4	0	0	0	112.5	R17 L18 K23 E24 L25 L41 C44 V45 V48	R17-L21 WeakPolarHBondContact O-CG 3.32Å; R17-L21 PolarHBondContact O-N 3.05Å; L18-L21 PolarHBondContact O-N 3.3Å; L21-K23 VanDerWaalsContact C-N 3.32Å; L21-K23 PolarHBondContact O-N 3.27Å; L21-E24 PolarHBondContact O-N 3.39Å; L21-L25 VanDerWaalsContact O-CB 3.32Å; L21-L25 WeakPolarHBondContact O-CB 3.5Å; L21-L25 PolarHBondContact O-N 3.28Å; L21-L41 HydrophobicContact CD2-CD2 4.5Å; L21-C44 HydrophobicContact CD1-CB 4.37Å; L21-C44 HydrophobicContact CD2-CB 4.22Å; L21-V45 HydrophobicContact CB-CG2 3.78Å; L21-V48 HydrophobicContact CD1-CB 4.36Å; L21-V48 HydrophobicContact CD1-CG2 3.74Å
22	T	88.2	Confident	86.4	Confident	28 Å²	28	64.8 Å²	64.8	17%	0.172	36%	0.355	C	S	.	.	H	α-helix	trans	-64.1	-38.4	175.7	-62.2	0	0	0	0	110.8	L18 V20 K26 L85	L18-T22 WeakPolarHBondContact O-CB 3.28Å; L18-T22 PolarHBondContact O-N 3.42Å; L18-T22 PolarHBondContact O-OG1 3.12Å; V20-T22 VanDerWaalsContact C-N 3.35Å; V20-T22 PolarHBondContact O-N 2.84Å; T22-K26 WeakPolarHBondContact O-CB 3.4Å; T22-K26 PolarHBondContact O-N 3.45Å; T22-L85 HydrophobicContact CG2-CD1 3.51Å; T22-L85 HydrophobicContact CG2-CD2 3.54Å; T22-L85 HydrophobicContact CG2-CG 4.04Å; T22-L85 WeakPolarHBondContact O-CD2 3.44Å
23	K	88	Confident	85.4	Confident	156 Å²	156	67 Å²	67	68%	0.678	36%	0.357	S	S	*	.	H	α-helix	trans	-66.8	-44.3	174.7	-169.2	177.3	179.7	-178.6	0	111.2	T19 V20 L21 K26 T27	T19-K23 WeakPolarHBondContact O-CB 3.46Å; T19-K23 PolarHBondContact O-N 3.06Å; V20-K23 WeakPolarHBondContact O-CB 3.42Å; V20-K23 PolarHBondContact O-N 3.25Å; V20-K23 VanDerWaalsContact O-N 3.12Å; L21-K23 VanDerWaalsContact C-N 3.32Å; L21-K23 PolarHBondContact O-N 3.27Å; K23-K26 PolarHBondContact O-N 3.19Å; K23-T27 WeakPolarHBondContact O-CB 3.23Å; K23-T27 PolarHBondContact O-N 2.8Å; K23-T27 PolarHBondContact O-OG1 2.78Å
24	E	88.9	Confident	84.8	Confident	94 Å²	94	70.6 Å²	70.6	44%	0.439	37%	0.368	S	S	.	.	H	α-helix	trans	-60.7	-46.5	175.7	-74.1	177.5	179.2	0	0	112.1	V20 L21 K26 T27 A28 L41	V20-E24 PolarHBondContact O-N 3.15Å; L21-E24 PolarHBondContact O-N 3.39Å; E24-K26 PolarHBondContact O-N 2.84Å; E24-T27 PolarHBondContact O-N 3.46Å; E24-A28 WeakPolarHBondContact O-CB 3.5Å; E24-A28 PolarHBondContact O-N 2.96Å; E24-L41 HydrophobicContact CB-CD2 4.27Å
25	L	89.4	Confident	84.4	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-62.6	-42.7	177.8	-179.3	55.1	0	0	0	111.2	L21 A28 C29 V38 L41 V42 V45 L85 A89	L21-L25 VanDerWaalsContact O-CB 3.32Å; L21-L25 WeakPolarHBondContact O-CB 3.5Å; L21-L25 PolarHBondContact O-N 3.28Å; L25-A28 PolarHBondContact O-N 2.97Å; L25-C29 PolarHBondContact O-N 3.49Å; L25-C29 PolarHBondContact O-SG 3.25Å; L25-V38 HydrophobicContact CD1-CG1 3.78Å; L25-L41 HydrophobicContact CB-CB 4.31Å; L25-L41 HydrophobicContact CD1-CB 3.8Å; L25-V42 HydrophobicContact CD1-CG2 4.04Å; L25-V42 HydrophobicContact CD2-CG2 3.81Å; L25-V45 HydrophobicContact CD2-CG2 4.15Å; L25-L85 HydrophobicContact CB-CD2 3.8Å; L25-L85 HydrophobicContact CD2-CD2 3.6Å; L25-L85 HydrophobicContact CG-CD2 3.72Å; L25-A89 HydrophobicContact CD1-CB 4.26Å; L25-A89 HydrophobicContact CD2-CB 4.45Å
26	K	88	Confident	84.2	Confident	112 Å²	112	72.4 Å²	72.4	49%	0.487	38%	0.382	S	S	.	.	H	α-helix	trans	-64.5	-41.5	175.5	-161.4	170.9	-170.3	172.3	0	112.1	T22 K23 E24 C29 S30 L85	T22-K26 WeakPolarHBondContact O-CB 3.4Å; T22-K26 PolarHBondContact O-N 3.45Å; K23-K26 PolarHBondContact O-N 3.19Å; E24-K26 PolarHBondContact O-N 2.84Å; K26-C29 PolarHBondContact O-N 2.66Å; K26-S30 WeakPolarHBondContact O-CB 3.34Å; K26-S30 PolarHBondContact O-N 3.38Å; K26-S30 PolarHBondContact O-OG 2.87Å; K26-L85 HydrophobicContact CB-CD1 4.42Å; K26-L85 HydrophobicContact CD-CD1 4.31Å
27	T	87.1	Confident	83.9	Confident	66 Å²	66	71.2 Å²	71.2	41%	0.405	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-43.5	173.8	-59.1	0	0	0	0	111.1	K23 E24 C29 S30 T31	K23-T27 WeakPolarHBondContact O-CB 3.23Å; K23-T27 PolarHBondContact O-N 2.8Å; K23-T27 PolarHBondContact O-OG1 2.78Å; E24-T27 PolarHBondContact O-N 3.46Å; T27-C29 PolarHBondContact O-N 3.44Å; T27-S30 WeakPolarHBondContact CA-OG 3.39Å; T27-S30 PolarHBondContact O-N 3.5Å; T27-S30 PolarHBondContact O-OG 3.06Å; T27-T31 HydrophobicContact CG2-CG2 3.92Å; T27-T31 WeakPolarHBondContact O-CB 3.16Å; T27-T31 WeakPolarHBondContact O-CG2 3.13Å; T27-T31 PolarHBondContact O-N 2.79Å; T27-T31 PolarHBondContact O-OG1 2.56Å
28	A	85.2	Confident	83.8	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.008	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-44.5	177.7	0	0	0	0	0	112	E24 L25 S30 M32 Q33 V38 L41	E24-A28 WeakPolarHBondContact O-CB 3.5Å; E24-A28 PolarHBondContact O-N 2.96Å; L25-A28 PolarHBondContact O-N 2.97Å; A28-S30 VanDerWaalsContact C-N 3.33Å; A28-S30 PolarHBondContact O-N 3.42Å; A28-M32 PolarHBondContact O-N 3.1Å; A28-Q33 HydrophobicContact CB-CB 4.37Å; A28-Q33 PolarHBondContact O-N 3.26Å; A28-V38 HydrophobicContact CB-CG2 4.19Å; A28-L41 HydrophobicContact CB-CD1 3.74Å
29	C	84.5	Confident	83.6	Confident	13 Å²	13	67.1 Å²	67.1	9%	0.088	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-37.2	174.3	-67.5	0	0	0	0	112.5	L25 K26 T27 Y92	L25-C29 PolarHBondContact O-N 3.49Å; L25-C29 PolarHBondContact O-SG 3.25Å; K26-C29 PolarHBondContact O-N 2.66Å; T27-C29 PolarHBondContact O-N 3.44Å; C29-Y92 WeakPolarHBondContact O-CD2 3.32Å
30	S	83.1	Confident	83.6	Confident	83 Å²	83	69 Å²	69	58%	0.58	36%	0.363	S	S	*	.	H	α-helix	trans	-80.4	-31.8	-179.2	68.1	0	0	0	0	114.9	K26 T27 A28 M32	K26-S30 WeakPolarHBondContact O-CB 3.34Å; K26-S30 PolarHBondContact O-N 3.38Å; K26-S30 PolarHBondContact O-OG 2.87Å; T27-S30 WeakPolarHBondContact CA-OG 3.39Å; T27-S30 PolarHBondContact O-N 3.5Å; T27-S30 PolarHBondContact O-OG 3.06Å; A28-S30 VanDerWaalsContact C-N 3.33Å; A28-S30 PolarHBondContact O-N 3.42Å; S30-M32 VanDerWaalsContact C-N 3.31Å
31	T	78.6	Confident	83.6	Confident	80 Å²	80	66.4 Å²	66.4	49%	0.491	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	5.6	-176.6	53.6	0	0	0	0	113.2	T27	T27-T31 HydrophobicContact CG2-CG2 3.92Å; T27-T31 WeakPolarHBondContact O-CB 3.16Å; T27-T31 WeakPolarHBondContact O-CG2 3.13Å; T27-T31 PolarHBondContact O-N 2.79Å; T27-T31 PolarHBondContact O-OG1 2.56Å
32	M	65.1	Low	83.6	Confident	131 Å²	131	66.2 Å²	66.2	65%	0.645	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	49.6	-178.5	-64.2	-132.4	162.3	0	0	113.6	A28 S30 Y92	A28-M32 PolarHBondContact O-N 3.1Å; S30-M32 VanDerWaalsContact C-N 3.31Å; M32-Y92 VanDerWaalsContact CA-OH 3.24Å; M32-Y92 WeakPolarHBondContact CA-OH 3.14Å; M32-Y92 HydrophobicContact CE-CE2 4.32Å; M32-Y92 HydrophobicContact CG-CE2 4.18Å; M32-Y92 HydrophobicContact SD-CE2 4.41Å
33	Q	64.7	Low	83.7	Confident	97 Å²	97	69.3 Å²	69.3	45%	0.453	37%	0.365	S	S	.	.			trans	-71.9	161.8	172	-72.7	-172.5	-16	0	0	112.2	A28 T35 Y92	A28-Q33 HydrophobicContact CB-CB 4.37Å; A28-Q33 PolarHBondContact O-N 3.26Å; Q33-T35 PolarHBondContact O-N 2.92Å; Q33-Y92 PolarHBondContact O-OH 3.32Å
34	D	75.4	Confident	83.8	Confident	110 Å²	110	64.8 Å²	64.8	59%	0.588	35%	0.352	S	S	*	.			trans	-44.9	130	176.6	-174.1	-13.5	0	0	0	111.9	L36 A37 V38	D34-L36 PolarHBondContact O-N 2.89Å; D34-L36 VanDerWaalsContact O-N 3.11Å; D34-L36 PolarHBondContact OD1-N 3.39Å; D34-A37 HydrophobicContact CB-CB 4.41Å; D34-A37 WeakPolarHBondContact O-CA 3.35Å; D34-A37 VanDerWaalsContact O-CB 3.31Å; D34-A37 WeakPolarHBondContact O-CB 3.46Å; D34-A37 PolarHBondContact O-N 3.18Å; D34-V38 PolarHBondContact O-N 2.68Å
35	T	82.8	Confident	84	Confident	37 Å²	37	60.4 Å²	60.4	23%	0.227	33%	0.332	C	S	.	.	H	α-helix	trans	-51.9	-35.8	179.6	-36.9	0	0	0	0	111.9	Q33 A37 V38 E39 I93 S96	Q33-T35 PolarHBondContact O-N 2.92Å; T35-A37 VanDerWaalsContact C-N 3.33Å; T35-A37 PolarHBondContact O-N 3.02Å; T35-V38 PolarHBondContact O-N 3.49Å; T35-E39 PolarHBondContact O-N 3.22Å; T35-I93 HydrophobicContact CG2-CB 4.14Å; T35-I93 HydrophobicContact CG2-CG1 3.89Å; T35-I93 HydrophobicContact CG2-CG2 3.93Å; T35-S96 WeakPolarHBondContact CG2-OG 3.46Å; T35-S96 PolarHBondContact OG1-OG 3.2Å; T35-S96 VanDerWaalsContact OG1-OG 3.09Å
36	L	80.4	Confident	84.1	Confident	96 Å²	96	64 Å²	64	50%	0.503	35%	0.351	S	S	.	.	H	α-helix	trans	-65.3	-36.4	177.8	-169.6	71.7	0	0	0	112.1	D34 E39 Q40	D34-L36 PolarHBondContact O-N 2.89Å; D34-L36 VanDerWaalsContact O-N 3.11Å; D34-L36 PolarHBondContact OD1-N 3.39Å; L36-E39 PolarHBondContact O-N 2.86Å; L36-Q40 WeakPolarHBondContact O-CG 3.38Å; L36-Q40 PolarHBondContact O-N 3.35Å
37	A	83	Confident	84.2	Confident	31 Å²	31	61.2 Å²	61.2	26%	0.256	35%	0.349	S	S	.	.	H	α-helix	trans	-66.6	-39.2	177	0	0	0	0	0	111.2	D34 T35 Q40 L41	D34-A37 HydrophobicContact CB-CB 4.41Å; D34-A37 WeakPolarHBondContact O-CA 3.35Å; D34-A37 VanDerWaalsContact O-CB 3.31Å; D34-A37 WeakPolarHBondContact O-CB 3.46Å; D34-A37 PolarHBondContact O-N 3.18Å; T35-A37 VanDerWaalsContact C-N 3.33Å; T35-A37 PolarHBondContact O-N 3.02Å; A37-Q40 PolarHBondContact O-N 2.82Å; A37-L41 WeakPolarHBondContact O-CG 3.47Å; A37-L41 PolarHBondContact O-N 2.86Å
38	V	88.4	Confident	84.4	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63.6	-44.8	174.6	179	0	0	0	0	111.1	L25 A28 D34 T35 Q40 L41 V42 A89 Y92 I93	L25-V38 HydrophobicContact CD1-CG1 3.78Å; A28-V38 HydrophobicContact CB-CG2 4.19Å; D34-V38 PolarHBondContact O-N 2.68Å; T35-V38 PolarHBondContact O-N 3.49Å; V38-Q40 VanDerWaalsContact C-N 3.34Å; V38-Q40 PolarHBondContact O-N 3.06Å; V38-L41 PolarHBondContact O-N 2.79Å; V38-V42 WeakPolarHBondContact O-CG2 3.42Å; V38-V42 PolarHBondContact O-N 2.83Å; V38-A89 HydrophobicContact CG1-CB 4.13Å; V38-Y92 HydrophobicContact CG1-CD1 4.38Å; V38-Y92 HydrophobicContact CG2-CD1 3.96Å; V38-Y92 HydrophobicContact CG2-CE1 3.9Å; V38-I93 HydrophobicContact CG1-CD1 4.26Å; V38-I93 HydrophobicContact CG1-CG1 4.23Å
39	E	87	Confident	84.7	Confident	79 Å²	79	59.9 Å²	59.9	37%	0.369	34%	0.343	S	S	.	.	H	α-helix	trans	-62	-39.6	177.3	-74.4	-177.9	170.2	0	0	112.5	T35 L36 T43 I93	T35-E39 PolarHBondContact O-N 3.22Å; L36-E39 PolarHBondContact O-N 2.86Å; E39-T43 PolarHBondContact O-N 3.1Å; E39-T43 VanDerWaalsContact O-N 3.14Å; E39-T43 PolarHBondContact O-OG1 2.9Å; E39-I93 HydrophobicContact CG-CD1 3.69Å; E39-I93 HydrophobicContact CG-CG1 4.3Å
40	Q	88	Confident	84.9	Confident	122 Å²	122	64.2 Å²	64.2	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-66.6	-40.8	175	-74.2	-174.2	-3.3	0	0	112.4	L36 A37 V38 T43 C44	L36-Q40 WeakPolarHBondContact O-CG 3.38Å; L36-Q40 PolarHBondContact O-N 3.35Å; A37-Q40 PolarHBondContact O-N 2.82Å; V38-Q40 VanDerWaalsContact C-N 3.34Å; V38-Q40 PolarHBondContact O-N 3.06Å; Q40-T43 PolarHBondContact O-N 2.95Å; Q40-C44 PolarHBondContact O-N 2.87Å; Q40-C44 PolarHBondContact O-SG 2.82Å
41	L	88.9	Confident	85.2	Confident	28 Å²	28	66.8 Å²	66.8	15%	0.147	37%	0.369	C	S	.	.	H	α-helix	trans	-64.6	-40.4	176.8	-78.7	169.8	0	0	0	112	L21 E24 L25 A28 A37 V38 T43 C44 V45	L21-L41 HydrophobicContact CD2-CD2 4.5Å; E24-L41 HydrophobicContact CB-CD2 4.27Å; L25-L41 HydrophobicContact CB-CB 4.31Å; L25-L41 HydrophobicContact CD1-CB 3.8Å; A28-L41 HydrophobicContact CB-CD1 3.74Å; A37-L41 WeakPolarHBondContact O-CG 3.47Å; A37-L41 PolarHBondContact O-N 2.86Å; V38-L41 PolarHBondContact O-N 2.79Å; L41-T43 VanDerWaalsContact C-N 3.35Å; L41-T43 PolarHBondContact O-N 3.39Å; L41-C44 WeakPolarHBondContact O-CB 3.15Å; L41-C44 PolarHBondContact O-N 2.8Å; L41-V45 WeakPolarHBondContact O-CG2 3.46Å; L41-V45 PolarHBondContact O-N 2.88Å
42	V	91.8	Very high	85.7	Confident	26 Å²	26	63.1 Å²	63.1	16%	0.158	35%	0.347	C	S	.	.	H	α-helix	trans	-57.3	-48.6	172.7	167.5	0	0	0	0	110.8	L25 V38 C44 V45 D46 A89	L25-V42 HydrophobicContact CD1-CG2 4.04Å; L25-V42 HydrophobicContact CD2-CG2 3.81Å; V38-V42 WeakPolarHBondContact O-CG2 3.42Å; V38-V42 PolarHBondContact O-N 2.83Å; V42-C44 VanDerWaalsContact C-N 3.26Å; V42-C44 PolarHBondContact O-N 2.94Å; V42-V45 PolarHBondContact O-N 3.17Å; V42-V45 VanDerWaalsContact O-N 3.13Å; V42-D46 PolarHBondContact O-N 3Å; V42-A89 HydrophobicContact CG2-CB 3.75Å
43	T	89.8	Confident	86.8	Confident	93 Å²	93	62.5 Å²	62.5	57%	0.571	34%	0.337	S	S	*	.	H	α-helix	trans	-59.4	-38.2	178.2	-53	0	0	0	0	111.8	E39 Q40 L41 A47	E39-T43 PolarHBondContact O-N 3.1Å; E39-T43 VanDerWaalsContact O-N 3.14Å; E39-T43 PolarHBondContact O-OG1 2.9Å; Q40-T43 PolarHBondContact O-N 2.95Å; L41-T43 VanDerWaalsContact C-N 3.35Å; L41-T43 PolarHBondContact O-N 3.39Å; T43-A47 WeakPolarHBondContact O-CB 3.29Å; T43-A47 PolarHBondContact O-N 2.97Å; T43-A47 VanDerWaalsContact O-N 3.1Å
44	C	90.7	Very high	88	Confident	61 Å²	61	60.6 Å²	60.6	41%	0.412	33%	0.334	S	S	.	.	H	α-helix	trans	-67.3	-42.2	176.1	-67.6	0	0	0	0	112.4	L21 Q40 L41 V42 A47 V48	L21-C44 HydrophobicContact CD1-CB 4.37Å; L21-C44 HydrophobicContact CD2-CB 4.22Å; Q40-C44 PolarHBondContact O-N 2.87Å; Q40-C44 PolarHBondContact O-SG 2.82Å; L41-C44 WeakPolarHBondContact O-CB 3.15Å; L41-C44 PolarHBondContact O-N 2.8Å; V42-C44 VanDerWaalsContact C-N 3.26Å; V42-C44 PolarHBondContact O-N 2.94Å; C44-A47 PolarHBondContact O-N 2.87Å; C44-V48 WeakPolarHBondContact O-CG2 3.44Å; C44-V48 PolarHBondContact O-N 3.36Å
45	V	91.9	Very high	88.6	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-47.9	175.5	171	0	0	0	0	110.3	L18 L21 L25 L41 V42 A47 V48 A49 I82	L18-V45 HydrophobicContact CD2-CG1 4.19Å; L21-V45 HydrophobicContact CB-CG2 3.78Å; L25-V45 HydrophobicContact CD2-CG2 4.15Å; L41-V45 WeakPolarHBondContact O-CG2 3.46Å; L41-V45 PolarHBondContact O-N 2.88Å; V42-V45 PolarHBondContact O-N 3.17Å; V42-V45 VanDerWaalsContact O-N 3.13Å; V45-A47 PolarHBondContact O-N 2.8Å; V45-V48 PolarHBondContact O-N 3.25Å; V45-A49 WeakPolarHBondContact O-CB 3.44Å; V45-A49 PolarHBondContact O-N 3.33Å; V45-I82 HydrophobicContact CG1-CG2 4.11Å
46	D	91.5	Very high	88.9	Confident	75 Å²	75	54.4 Å²	54.4	40%	0.401	30%	0.301	S	S	.	.	H	α-helix	trans	-58.9	-45.7	179	-81.6	-27.6	0	0	0	112.1	V42 V48 A49 V50 H86	V42-D46 PolarHBondContact O-N 3Å; D46-V48 VanDerWaalsContact C-N 3.3Å; D46-V48 PolarHBondContact O-N 2.8Å; D46-A49 PolarHBondContact O-N 3.01Å; D46-V50 WeakPolarHBondContact O-CG2 3.3Å; D46-V50 PolarHBondContact O-N 3.4Å; D46-H86 IonicContact OD1-CE1 2.65Å; D46-H86 PolarHBondContact OD1-CE1 3.01Å; D46-H86 IonicContact OD1-NE2 2.71Å; D46-H86 PolarHBondContact OD1-NE2 2.86Å; D46-H86 IonicContact OD2-NE2 3.44Å
47	A	90.8	Very high	89.2	Confident	55 Å²	55	55.3 Å²	55.3	46%	0.455	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-36	179.9	0	0	0	0	0	112.9	T43 C44 V45	T43-A47 WeakPolarHBondContact O-CB 3.29Å; T43-A47 PolarHBondContact O-N 2.97Å; T43-A47 VanDerWaalsContact O-N 3.1Å; C44-A47 PolarHBondContact O-N 2.87Å; V45-A47 PolarHBondContact O-N 2.8Å
48	V	90.8	Very high	89.4	Confident	24 Å²	24	58.1 Å²	58.1	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-78.9	-36.7	176.3	-175.2	0	0	0	0	111.1	L14 R17 L18 L21 C44 V45 D46 V50 K51 A52	L14-V48 HydrophobicContact CD2-CG1 4Å; R17-V48 HydrophobicContact CB-CG1 4.17Å; L18-V48 HydrophobicContact CD1-CG1 4.35Å; L18-V48 HydrophobicContact CD2-CB 3.99Å; L18-V48 HydrophobicContact CD2-CG1 4.06Å; L18-V48 HydrophobicContact CG-CB 4.22Å; L18-V48 HydrophobicContact CG-CG1 3.71Å; L21-V48 HydrophobicContact CD1-CB 4.36Å; L21-V48 HydrophobicContact CD1-CG2 3.74Å; C44-V48 WeakPolarHBondContact O-CG2 3.44Å; C44-V48 PolarHBondContact O-N 3.36Å; V45-V48 PolarHBondContact O-N 3.25Å; D46-V48 VanDerWaalsContact C-N 3.3Å; D46-V48 PolarHBondContact O-N 2.8Å; V48-V50 VanDerWaalsContact C-N 3.35Å; V48-V50 PolarHBondContact O-N 2.92Å; V48-K51 PolarHBondContact O-N 3.07Å; V48-A52 WeakPolarHBondContact O-CB 3.37Å; V48-A52 PolarHBondContact O-N 2.96Å
49	A	90.6	Very high	89.3	Confident	15 Å²	15	58.1 Å²	58.1	12%	0.124	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-40.7	178.5	0	0	0	0	0	112.1	L18 V45 D46 K51 A52 R53 I82	L18-A49 HydrophobicContact CD2-CB 4.18Å; V45-A49 WeakPolarHBondContact O-CB 3.44Å; V45-A49 PolarHBondContact O-N 3.33Å; D46-A49 PolarHBondContact O-N 3.01Å; A49-K51 VanDerWaalsContact C-N 3.34Å; A49-K51 PolarHBondContact O-N 3.4Å; A49-A52 PolarHBondContact O-N 2.88Å; A49-R53 PolarHBondContact O-N 3.47Å; A49-I82 HydrophobicContact CB-CD1 4.23Å
50	V	89.7	Confident	89.2	Confident	104 Å²	104	57 Å²	57	63%	0.63	31%	0.305	S	S	*	.	H	α-helix	trans	-60.4	-44.5	174.8	171.1	0	0	0	0	111.2	D46 V48 R53 S54	D46-V50 WeakPolarHBondContact O-CG2 3.3Å; D46-V50 PolarHBondContact O-N 3.4Å; V48-V50 VanDerWaalsContact C-N 3.35Å; V48-V50 PolarHBondContact O-N 2.92Å; V50-R53 PolarHBondContact O-N 2.83Å; V50-S54 PolarHBondContact O-N 3.47Å; V50-S54 VanDerWaalsContact O-N 3.11Å
51	K	89.5	Confident	89.1	Confident	137 Å²	137	55.7 Å²	55.7	60%	0.596	31%	0.309	S	S	*	.	H	α-helix	trans	-66.1	-40.5	176.9	-69.1	178.5	-177.9	178.1	0	112	L14 V48 A49 R53 S54 V55	L14-K51 HydrophobicContact CD1-CB 4.3Å; L14-K51 HydrophobicContact CD2-CB 4.17Å; V48-K51 PolarHBondContact O-N 3.07Å; A49-K51 VanDerWaalsContact C-N 3.34Å; A49-K51 PolarHBondContact O-N 3.4Å; K51-R53 VanDerWaalsContact C-N 3.3Å; K51-R53 PolarHBondContact O-N 3.22Å; K51-S54 PolarHBondContact O-N 3.47Å; K51-V55 WeakPolarHBondContact O-CG2 3.04Å; K51-V55 PolarHBondContact O-N 3.46Å; K51-V55 VanDerWaalsContact O-N 3.07Å
52	A	88.3	Confident	88.9	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.017	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-40.8	177.3	0	0	0	0	0	111.2	L14 L18 V48 A49 V55 Q56 Y75	L14-A52 HydrophobicContact CB-CB 4.09Å; L14-A52 HydrophobicContact CD1-CB 4.43Å; L18-A52 HydrophobicContact CD1-CB 3.79Å; V48-A52 WeakPolarHBondContact O-CB 3.37Å; V48-A52 PolarHBondContact O-N 2.96Å; A49-A52 PolarHBondContact O-N 2.88Å; A52-V55 PolarHBondContact O-N 2.89Å; A52-Q56 VanDerWaalsContact O-CB 3.26Å; A52-Q56 WeakPolarHBondContact O-CB 3.49Å; A52-Q56 PolarHBondContact O-N 3.01Å; A52-Y75 VanDerWaalsContact C-OH 3.25Å; A52-Y75 HydrophobicContact CB-CE2 4.35Å; A52-Y75 WeakPolarHBondContact CB-OH 3.38Å
53	R	89.1	Confident	88.6	Confident	119 Å²	119	57 Å²	57	45%	0.449	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-44.3	178.1	-170.1	-179.7	-67	171.2	3.2	111.8	A49 V50 K51 V55 Q56 E57 Y75 E79	A49-R53 PolarHBondContact O-N 3.47Å; V50-R53 PolarHBondContact O-N 2.83Å; K51-R53 VanDerWaalsContact C-N 3.3Å; K51-R53 PolarHBondContact O-N 3.22Å; R53-V55 PolarHBondContact O-N 3.44Å; R53-Q56 WeakPolarHBondContact O-CB 3.37Å; R53-Q56 PolarHBondContact O-N 2.93Å; R53-Q56 VanDerWaalsContact O-N 3.16Å; R53-E57 WeakPolarHBondContact O-CG 3.35Å; R53-E57 PolarHBondContact O-N 3.27Å; R53-Y75 VanDerWaalsContact CA-OH 3.27Å; R53-Y75 WeakPolarHBondContact CA-OH 3.45Å; R53-Y75 PolarHBondContact N-OH 2.92Å; R53-E79 IonicContact CZ-OE1 2.91Å; R53-E79 IonicContact NE-OE1 3.78Å; R53-E79 PolarHBondContact NE-OE1 3.48Å; R53-E79 IonicContact NH2-OE1 3.18Å; R53-E79 PolarHBondContact NH2-OE1 3.16Å; R53-E79 IonicContact NH2-OE2 3.32Å
54	S	89.6	Confident	88.3	Confident	56 Å²	56	55.6 Å²	55.6	39%	0.392	31%	0.309	S	S	.	.	H	α-helix	trans	-60.1	-43.9	176	171.1	0	0	0	0	112.3	V50 K51 Q56 E57 E58	V50-S54 PolarHBondContact O-N 3.47Å; V50-S54 VanDerWaalsContact O-N 3.11Å; K51-S54 PolarHBondContact O-N 3.47Å; S54-Q56 VanDerWaalsContact C-N 3.32Å; S54-Q56 PolarHBondContact O-N 3.28Å; S54-E57 PolarHBondContact O-N 3.26Å; S54-E58 WeakPolarHBondContact O-CG 3.44Å; S54-E58 PolarHBondContact O-N 2.97Å; S54-E58 VanDerWaalsContact O-N 3.15Å
55	V	88.3	Confident	87.7	Confident	16 Å²	16	61 Å²	61	10%	0.097	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-34.5	175.9	169.2	0	0	0	0	111.9	R11 L14 K51 A52 R53 E58 L59	R11-V55 HydrophobicContact CB-CG1 3.88Å; L14-V55 HydrophobicContact CD1-CB 4.1Å; L14-V55 HydrophobicContact CD1-CG2 3.72Å; K51-V55 WeakPolarHBondContact O-CG2 3.04Å; K51-V55 PolarHBondContact O-N 3.46Å; K51-V55 VanDerWaalsContact O-N 3.07Å; A52-V55 PolarHBondContact O-N 2.89Å; R53-V55 PolarHBondContact O-N 3.44Å; V55-E58 PolarHBondContact O-N 3.29Å; V55-L59 WeakPolarHBondContact O-CB 3.49Å; V55-L59 PolarHBondContact O-N 3.41Å
56	Q	87.9	Confident	87	Confident	2 Å²	2	68.5 Å²	68.5	1%	0.009	36%	0.363	C	S	.	.	H	α-helix	trans	-65.1	-46.8	177	-180	65.8	22.6	0	0	111.3	R11 A52 R53 S54 E58 L59 E60 E71 Y75	R11-Q56 VanDerWaalsContact CD-OE1 3.28Å; A52-Q56 VanDerWaalsContact O-CB 3.26Å; A52-Q56 WeakPolarHBondContact O-CB 3.49Å; A52-Q56 PolarHBondContact O-N 3.01Å; R53-Q56 WeakPolarHBondContact O-CB 3.37Å; R53-Q56 PolarHBondContact O-N 2.93Å; R53-Q56 VanDerWaalsContact O-N 3.16Å; S54-Q56 VanDerWaalsContact C-N 3.32Å; S54-Q56 PolarHBondContact O-N 3.28Å; Q56-E58 VanDerWaalsContact C-N 3.3Å; Q56-E58 PolarHBondContact O-N 3.45Å; Q56-L59 WeakPolarHBondContact O-CB 3.46Å; Q56-L59 PolarHBondContact O-N 3.31Å; Q56-E60 VanDerWaalsContact CG-OE1 3.25Å; Q56-E60 WeakPolarHBondContact CG-OE1 3.26Å; Q56-E60 PolarHBondContact NE2-OE1 2.95Å; Q56-E60 WeakPolarHBondContact O-CG 3.48Å; Q56-E60 PolarHBondContact O-N 3.08Å; Q56-E71 PolarHBondContact NE2-OE1 3.44Å; Q56-E71 PolarHBondContact OE1-OE1 2.9Å; Q56-Y75 HydrophobicContact CB-CD1 4.48Å; Q56-Y75 HydrophobicContact CB-CD2 4.03Å; Q56-Y75 HydrophobicContact CB-CE1 4.34Å; Q56-Y75 HydrophobicContact CB-CE2 3.89Å; Q56-Y75 HydrophobicContact CB-CG 4.35Å; Q56-Y75 HydrophobicContact CG-CD1 3.82Å; Q56-Y75 HydrophobicContact CG-CD2 3.69Å; Q56-Y75 HydrophobicContact CG-CE1 4.15Å; Q56-Y75 HydrophobicContact CG-CE2 4.04Å; Q56-Y75 HydrophobicContact CG-CG 3.59Å
57	E	87.3	Confident	86.6	Confident	114 Å²	114	69.3 Å²	69.3	53%	0.533	36%	0.364	S	S	.	.	H	α-helix	trans	-59.7	-40.5	175.9	-70.8	167.8	-175.7	0	0	111.3	R53 S54 L59 S61	R53-E57 WeakPolarHBondContact O-CG 3.35Å; R53-E57 PolarHBondContact O-N 3.27Å; S54-E57 PolarHBondContact O-N 3.26Å; E57-L59 VanDerWaalsContact C-N 3.35Å; E57-L59 PolarHBondContact O-N 3.5Å; E57-S61 PolarHBondContact O-N 2.88Å
58	E	87.7	Confident	86.2	Confident	90 Å²	90	68.4 Å²	68.4	42%	0.421	35%	0.353	S	S	.	.	H	α-helix	trans	-64.5	-37.8	173.4	-73.4	-179.2	-164.6	0	0	112.4	Q7 S54 V55 Q56 S61 L62	Q7-E58 PolarHBondContact NE2-OE2 3.41Å; S54-E58 WeakPolarHBondContact O-CG 3.44Å; S54-E58 PolarHBondContact O-N 2.97Å; S54-E58 VanDerWaalsContact O-N 3.15Å; V55-E58 PolarHBondContact O-N 3.29Å; Q56-E58 VanDerWaalsContact C-N 3.3Å; Q56-E58 PolarHBondContact O-N 3.45Å; E58-S61 PolarHBondContact O-N 3.04Å; E58-S61 PolarHBondContact O-OG 3.08Å; E58-L62 WeakPolarHBondContact O-CG 3.35Å
59	L	85.6	Confident	85.7	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-71.4	-39.3	179.8	-171	145.6	0	0	0	112	Q7 K8 R11 V55 Q56 E57 S61 L62 L63 E71	Q7-L59 HydrophobicContact CB-CB 4.24Å; Q7-L59 HydrophobicContact CB-CD1 4.01Å; Q7-L59 HydrophobicContact CB-CG 4.38Å; K8-L59 HydrophobicContact CB-CD1 4.32Å; K8-L59 HydrophobicContact CG-CD1 3.68Å; R11-L59 HydrophobicContact CB-CD1 4.33Å; V55-L59 WeakPolarHBondContact O-CB 3.49Å; V55-L59 PolarHBondContact O-N 3.41Å; Q56-L59 WeakPolarHBondContact O-CB 3.46Å; Q56-L59 PolarHBondContact O-N 3.31Å; E57-L59 VanDerWaalsContact C-N 3.35Å; E57-L59 PolarHBondContact O-N 3.5Å; L59-S61 PolarHBondContact O-N 3.39Å; L59-L62 PolarHBondContact O-N 3.02Å; L59-L62 VanDerWaalsContact O-N 3.08Å; L59-L63 HydrophobicContact CD2-CD1 3.52Å; L59-L63 HydrophobicContact CD2-CG 4.21Å; L59-E71 HydrophobicContact CD2-CG 3.53Å
60	E	85	Confident	85.2	Confident	57 Å²	57	79.8 Å²	79.8	27%	0.266	40%	0.402	S	S	.	.	H	α-helix	trans	-59.6	-36.2	174.2	-73	169.9	-165.3	0	0	111.5	Q56 L62 V68 V72	Q56-E60 VanDerWaalsContact CG-OE1 3.25Å; Q56-E60 WeakPolarHBondContact CG-OE1 3.26Å; Q56-E60 PolarHBondContact NE2-OE1 2.95Å; Q56-E60 WeakPolarHBondContact O-CG 3.48Å; Q56-E60 PolarHBondContact O-N 3.08Å; E60-L62 PolarHBondContact O-N 3.36Å; E60-V68 HydrophobicContact CB-CG1 4.5Å; E60-V68 HydrophobicContact CG-CG1 4.41Å; E60-V68 WeakPolarHBondContact O-CG2 3.15Å; E60-V72 HydrophobicContact CG-CG2 4.17Å; E60-V72 WeakPolarHBondContact OE1-CG2 3.47Å
61	S	85.7	Confident	84.8	Confident	94 Å²	94	76 Å²	76	66%	0.657	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.1	176.5	79.3	0	0	0	0	114.8	E57 E58 L59	E57-S61 PolarHBondContact O-N 2.88Å; E58-S61 PolarHBondContact O-N 3.04Å; E58-S61 PolarHBondContact O-OG 3.08Å; L59-S61 PolarHBondContact O-N 3.39Å
62	L	86.2	Confident	84.5	Confident	60 Å²	60	71.2 Å²	71.2	31%	0.314	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-2.1	-175	-63.2	173.8	0	0	0	114.1	Q3 L4 Q7 E58 L59 E60	Q3-L62 HydrophobicContact CG-CD1 3.92Å; L4-L62 HydrophobicContact CD1-CB 3.75Å; Q7-L62 HydrophobicContact CG-CD1 4.01Å; E58-L62 WeakPolarHBondContact O-CG 3.35Å; L59-L62 PolarHBondContact O-N 3.02Å; L59-L62 VanDerWaalsContact O-N 3.08Å; E60-L62 PolarHBondContact O-N 3.36Å
63	L	84.5	Confident	84.2	Confident	22 Å²	22	75.6 Å²	75.6	12%	0.115	38%	0.383	C	S	.	.	S	Bend	trans	-103.9	157.7	-176.3	-71.4	177.1	0	0	0	111.7	L4 L59 Q67 V68 E71	L4-L63 HydrophobicContact CD1-CD2 3.69Å; L4-L63 HydrophobicContact CD1-CG 4.12Å; L4-L63 HydrophobicContact CD2-CD2 4.12Å; L4-L63 HydrophobicContact CG-CD2 4.5Å; L59-L63 HydrophobicContact CD2-CD1 3.52Å; L59-L63 HydrophobicContact CD2-CG 4.21Å; L63-Q67 HydrophobicContact CB-CB 3.96Å; L63-Q67 HydrophobicContact CD1-CB 4.29Å; L63-Q67 HydrophobicContact CD2-CB 4.08Å; L63-Q67 VanDerWaalsContact CD2-OE1 3.28Å; L63-Q67 HydrophobicContact CG-CB 4.35Å; L63-V68 HydrophobicContact CB-CG2 3.61Å; L63-E71 HydrophobicContact CD1-CB 3.83Å; L63-E71 HydrophobicContact CD1-CG 3.73Å
64	S	82.6	Confident	83.8	Confident	62 Å²	62	73 Å²	73	43%	0.434	38%	0.38	S	S	.	.			trans	-72.7	157.6	168.7	61.5	0	0	0	0	111.1	E66 Q67 V68	S64-E66 VanDerWaalsContact C-N 3.31Å; S64-E66 PolarHBondContact O-N 3.4Å; S64-Q67 CarbonylContact O-C 3.58Å; S64-Q67 WeakPolarHBondContact O-CA 3.4Å; S64-Q67 WeakPolarHBondContact O-CB 3.5Å; S64-Q67 PolarHBondContact O-N 2.81Å; S64-Q67 WeakPolarHBondContact OG-CG 3.16Å; S64-V68 WeakPolarHBondContact O-CG2 3.24Å; S64-V68 PolarHBondContact O-N 3.02Å
65	E	78.6	Confident	83.6	Confident	176 Å²	176	71 Å²	71	82%	0.822	36%	0.364	S	S	*	.	H	α-helix	trans	-51.4	-45.1	-176.3	-75	-171.6	154.4	0	0	113.5	Q67 V68 E69	E65-Q67 VanDerWaalsContact C-N 3.31Å; E65-Q67 PolarHBondContact O-N 3.17Å; E65-V68 PolarHBondContact O-N 3.14Å; E65-E69 PolarHBondContact O-N 3.29Å
66	E	78.5	Confident	83.4	Confident	158 Å²	158	74.6 Å²	74.6	74%	0.738	38%	0.381	S	S	*	.	H	α-helix	trans	-62.7	-36.4	177.3	-67.9	178.3	170.6	0	0	112.7	S64	S64-E66 VanDerWaalsContact C-N 3.31Å; S64-E66 PolarHBondContact O-N 3.4Å
67	Q	82.8	Confident	83.2	Confident	92 Å²	92	79 Å²	79	43%	0.43	40%	0.404	S	S	.	.	H	α-helix	trans	-74.7	-35.4	177.5	-69.9	178.8	-14.5	0	0	111.8	L63 S64 E65 E71	L63-Q67 HydrophobicContact CB-CB 3.96Å; L63-Q67 HydrophobicContact CD1-CB 4.29Å; L63-Q67 HydrophobicContact CD2-CB 4.08Å; L63-Q67 VanDerWaalsContact CD2-OE1 3.28Å; L63-Q67 HydrophobicContact CG-CB 4.35Å; S64-Q67 CarbonylContact O-C 3.58Å; S64-Q67 WeakPolarHBondContact O-CA 3.4Å; S64-Q67 WeakPolarHBondContact O-CB 3.5Å; S64-Q67 PolarHBondContact O-N 2.81Å; S64-Q67 WeakPolarHBondContact OG-CG 3.16Å; E65-Q67 VanDerWaalsContact C-N 3.31Å; E65-Q67 PolarHBondContact O-N 3.17Å; Q67-E71 WeakPolarHBondContact O-CB 3.48Å; Q67-E71 PolarHBondContact O-N 3.43Å
68	V	82	Confident	83	Confident	37 Å²	37	74.6 Å²	74.6	22%	0.224	38%	0.383	C	S	.	.	H	α-helix	trans	-62.4	-45.3	177.4	173.1	0	0	0	0	110.6	E60 L63 S64 E65 Q70 E71 V72	E60-V68 HydrophobicContact CB-CG1 4.5Å; E60-V68 HydrophobicContact CG-CG1 4.41Å; E60-V68 WeakPolarHBondContact O-CG2 3.15Å; L63-V68 HydrophobicContact CB-CG2 3.61Å; S64-V68 WeakPolarHBondContact O-CG2 3.24Å; S64-V68 PolarHBondContact O-N 3.02Å; E65-V68 PolarHBondContact O-N 3.14Å; V68-Q70 PolarHBondContact O-N 3.27Å; V68-E71 PolarHBondContact O-N 3.18Å; V68-E71 VanDerWaalsContact O-N 3.17Å; V68-V72 HydrophobicContact CG1-CG2 3.92Å; V68-V72 WeakPolarHBondContact O-CB 3.48Å; V68-V72 VanDerWaalsContact O-CG2 3.28Å; V68-V72 WeakPolarHBondContact O-CG2 3.36Å; V68-V72 PolarHBondContact O-N 3.1Å
69	E	80.6	Confident	82.9	Confident	136 Å²	136	71.4 Å²	71.4	64%	0.636	37%	0.368	S	S	*	.	H	α-helix	trans	-61.1	-44.8	-178.7	-174.6	173.4	-172.6	0	0	112.2	E65 E71 N73	E65-E69 PolarHBondContact O-N 3.29Å; E69-E71 VanDerWaalsContact C-N 3.33Å; E69-E71 PolarHBondContact O-N 3.25Å; E69-N73 WeakPolarHBondContact O-CB 3.41Å; E69-N73 PolarHBondContact O-N 3.36Å; E69-N73 VanDerWaalsContact O-N 3.12Å; E69-N73 PolarHBondContact O-ND2 3.49Å
70	Q	79.2	Confident	82.9	Confident	141 Å²	141	79.1 Å²	79.1	66%	0.659	40%	0.397	S	S	*	.	H	α-helix	trans	-62.3	-42.1	175.2	-67.5	-179.4	0.3	0	0	111.6	V68 N73 V74	V68-Q70 PolarHBondContact O-N 3.27Å; Q70-N73 PolarHBondContact O-N 3.48Å; Q70-V74 WeakPolarHBondContact O-CG2 3.27Å; Q70-V74 PolarHBondContact O-N 2.93Å
71	E	82.5	Confident	82.9	Confident	24 Å²	24	79.9 Å²	79.9	11%	0.112	40%	0.404	C	S	.	.	H	α-helix	trans	-69.9	-43	-176.9	-178.7	56.4	-132.8	0	0	112.4	R11 Q56 L59 L63 Q67 V68 E69 N73 V74 Y75	R11-E71 IonicContact CZ-OE1 3.58Å; R11-E71 IonicContact CZ-OE2 3.84Å; R11-E71 IonicContact NE-OE1 3.97Å; R11-E71 IonicContact NH1-OE1 2.86Å; R11-E71 PolarHBondContact NH1-OE1 3.48Å; R11-E71 IonicContact NH1-OE2 3.26Å; R11-E71 PolarHBondContact NH1-OE2 2.97Å; Q56-E71 PolarHBondContact NE2-OE1 3.44Å; Q56-E71 PolarHBondContact OE1-OE1 2.9Å; L59-E71 HydrophobicContact CD2-CG 3.53Å; L63-E71 HydrophobicContact CD1-CB 3.83Å; L63-E71 HydrophobicContact CD1-CG 3.73Å; Q67-E71 WeakPolarHBondContact O-CB 3.48Å; Q67-E71 PolarHBondContact O-N 3.43Å; V68-E71 PolarHBondContact O-N 3.18Å; V68-E71 VanDerWaalsContact O-N 3.17Å; E69-E71 VanDerWaalsContact C-N 3.33Å; E69-E71 PolarHBondContact O-N 3.25Å; E71-N73 PolarHBondContact O-N 3.12Å; E71-V74 PolarHBondContact O-N 3.25Å; E71-Y75 PolarHBondContact O-N 3.37Å
72	V	82.1	Confident	82.9	Confident	38 Å²	38	76.2 Å²	76.2	23%	0.23	38%	0.376	C	S	.	.	H	α-helix	trans	-60.9	-44.4	173.8	170.1	0	0	0	0	110.7	E60 V68 V74 Y75 M76	E60-V72 HydrophobicContact CG-CG2 4.17Å; E60-V72 WeakPolarHBondContact OE1-CG2 3.47Å; V68-V72 HydrophobicContact CG1-CG2 3.92Å; V68-V72 WeakPolarHBondContact O-CB 3.48Å; V68-V72 VanDerWaalsContact O-CG2 3.28Å; V68-V72 WeakPolarHBondContact O-CG2 3.36Å; V68-V72 PolarHBondContact O-N 3.1Å; V72-V74 VanDerWaalsContact C-N 3.29Å; V72-V74 PolarHBondContact O-N 2.93Å; V72-Y75 PolarHBondContact O-N 2.93Å; V72-Y75 VanDerWaalsContact O-N 3.14Å; V72-M76 HydrophobicContact CG1-CE 4.3Å; V72-M76 HydrophobicContact CG1-CG 4.02Å; V72-M76 WeakPolarHBondContact O-CB 3.39Å; V72-M76 VanDerWaalsContact O-CG 3.27Å; V72-M76 WeakPolarHBondContact O-CG 3.48Å; V72-M76 PolarHBondContact O-N 3.27Å
73	N	82.3	Confident	83	Confident	94 Å²	94	79.6 Å²	79.6	50%	0.503	39%	0.385	S	S	.	.	H	α-helix	trans	-59.2	-41.6	177.9	-82.6	-31.3	0	0	0	111.8	E69 Q70 E71 I77	E69-N73 WeakPolarHBondContact O-CB 3.41Å; E69-N73 PolarHBondContact O-N 3.36Å; E69-N73 VanDerWaalsContact O-N 3.12Å; E69-N73 PolarHBondContact O-ND2 3.49Å; Q70-N73 PolarHBondContact O-N 3.48Å; E71-N73 PolarHBondContact O-N 3.12Å; N73-I77 WeakPolarHBondContact O-CG1 3.39Å; N73-I77 PolarHBondContact O-N 2.95Å
74	V	80.4	Confident	83.1	Confident	64 Å²	64	81.4 Å²	81.4	39%	0.388	40%	0.403	S	S	.	.	H	α-helix	trans	-65.2	-39.5	175.9	172.5	0	0	0	0	111.8	Q70 E71 V72	Q70-V74 WeakPolarHBondContact O-CG2 3.27Å; Q70-V74 PolarHBondContact O-N 2.93Å; E71-V74 PolarHBondContact O-N 3.25Å; V72-V74 VanDerWaalsContact C-N 3.29Å; V72-V74 PolarHBondContact O-N 2.93Å
75	Y	85.1	Confident	83.3	Confident	15 Å²	15	79.3 Å²	79.3	6%	0.059	39%	0.387	C	S	.	.	H	α-helix	trans	-73.2	-36.4	179.6	-166.9	-96.4	0	0	0	112.8	A52 R53 Q56 E71 V72 I77 L78 E79	A52-Y75 VanDerWaalsContact C-OH 3.25Å; A52-Y75 HydrophobicContact CB-CE2 4.35Å; A52-Y75 WeakPolarHBondContact CB-OH 3.38Å; R53-Y75 VanDerWaalsContact CA-OH 3.27Å; R53-Y75 WeakPolarHBondContact CA-OH 3.45Å; R53-Y75 PolarHBondContact N-OH 2.92Å; Q56-Y75 HydrophobicContact CB-CD1 4.48Å; Q56-Y75 HydrophobicContact CB-CD2 4.03Å; Q56-Y75 HydrophobicContact CB-CE1 4.34Å; Q56-Y75 HydrophobicContact CB-CE2 3.89Å; Q56-Y75 HydrophobicContact CB-CG 4.35Å; Q56-Y75 HydrophobicContact CG-CD1 3.82Å; Q56-Y75 HydrophobicContact CG-CD2 3.69Å; Q56-Y75 HydrophobicContact CG-CE1 4.15Å; Q56-Y75 HydrophobicContact CG-CE2 4.04Å; Q56-Y75 HydrophobicContact CG-CG 3.59Å; E71-Y75 PolarHBondContact O-N 3.37Å; V72-Y75 PolarHBondContact O-N 2.93Å; V72-Y75 VanDerWaalsContact O-N 3.14Å; Y75-I77 VanDerWaalsContact C-N 3.27Å; Y75-I77 PolarHBondContact O-N 3.01Å; Y75-L78 HydrophobicContact CD2-CD2 4.43Å; Y75-L78 HydrophobicContact CE2-CD2 4.15Å; Y75-L78 WeakPolarHBondContact O-CB 3.26Å; Y75-L78 PolarHBondContact O-N 3.45Å; Y75-E79 HydrophobicContact CD1-CG 4.03Å; Y75-E79 HydrophobicContact CE1-CG 3.7Å; Y75-E79 PolarHBondContact O-N 2.87Å
76	M	85.1	Confident	83.8	Confident	90 Å²	90	72.5 Å²	72.5	44%	0.443	36%	0.355	S	S	.	.	H	α-helix	trans	-64.2	-31	177.8	-74.4	-67.2	163.2	0	0	113	V72 E79 R80	V72-M76 HydrophobicContact CG1-CE 4.3Å; V72-M76 HydrophobicContact CG1-CG 4.02Å; V72-M76 WeakPolarHBondContact O-CB 3.39Å; V72-M76 VanDerWaalsContact O-CG 3.27Å; V72-M76 WeakPolarHBondContact O-CG 3.48Å; V72-M76 PolarHBondContact O-N 3.27Å; M76-E79 PolarHBondContact O-N 2.96Å; M76-R80 WeakPolarHBondContact O-CB 3.25Å; M76-R80 PolarHBondContact O-N 3.42Å
77	I	83.4	Confident	84.2	Confident	96 Å²	96	68.9 Å²	68.9	49%	0.492	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-45.7	171.2	-66.3	166.6	0	0	0	110.2	N73 Y75 E79 R80 D81	N73-I77 WeakPolarHBondContact O-CG1 3.39Å; N73-I77 PolarHBondContact O-N 2.95Å; Y75-I77 VanDerWaalsContact C-N 3.27Å; Y75-I77 PolarHBondContact O-N 3.01Å; I77-E79 PolarHBondContact O-N 3.19Å; I77-R80 WeakPolarHBondContact O-CB 3.42Å; I77-R80 PolarHBondContact O-N 3.49Å; I77-D81 VanDerWaalsContact O-CG 3.3Å; I77-D81 PolarHBondContact O-N 2.77Å; I77-D81 VanDerWaalsContact O-N 3.09Å
78	L	82.8	Confident	84.4	Confident	20 Å²	20	68.1 Å²	68.1	11%	0.105	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-43.8	177.3	-180	67.4	0	0	0	111.8	K15 L18 Y75 R80 D81 I82	K15-L78 HydrophobicContact CD-CD2 4.48Å; K15-L78 HydrophobicContact CG-CD2 4.1Å; L18-L78 HydrophobicContact CD1-CD2 4.11Å; Y75-L78 HydrophobicContact CD2-CD2 4.43Å; Y75-L78 HydrophobicContact CE2-CD2 4.15Å; Y75-L78 WeakPolarHBondContact O-CB 3.26Å; Y75-L78 PolarHBondContact O-N 3.45Å; L78-R80 VanDerWaalsContact C-N 3.31Å; L78-R80 PolarHBondContact O-N 3.23Å; L78-D81 PolarHBondContact O-N 2.63Å; L78-I82 HydrophobicContact CG-CD1 4.18Å; L78-I82 WeakPolarHBondContact O-CG1 3.33Å; L78-I82 PolarHBondContact O-N 3.07Å
79	E	85.3	Confident	84.7	Confident	23 Å²	23	66.4 Å²	66.4	11%	0.107	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-36.5	177.2	-71.4	-151	149.6	0	0	113.1	R53 Y75 M76 I77 D81 I82 R83	R53-E79 IonicContact CZ-OE1 2.91Å; R53-E79 IonicContact NE-OE1 3.78Å; R53-E79 PolarHBondContact NE-OE1 3.48Å; R53-E79 IonicContact NH2-OE1 3.18Å; R53-E79 PolarHBondContact NH2-OE1 3.16Å; R53-E79 IonicContact NH2-OE2 3.32Å; Y75-E79 HydrophobicContact CD1-CG 4.03Å; Y75-E79 HydrophobicContact CE1-CG 3.7Å; Y75-E79 PolarHBondContact O-N 2.87Å; M76-E79 PolarHBondContact O-N 2.96Å; I77-E79 PolarHBondContact O-N 3.19Å; E79-D81 VanDerWaalsContact C-N 3.3Å; E79-I82 PolarHBondContact O-N 2.9Å; E79-R83 WeakPolarHBondContact O-CG 3.44Å; E79-R83 PolarHBondContact O-N 2.99Å; E79-R83 IonicContact OE2-NH1 3.3Å; E79-R83 PolarHBondContact OE2-NH1 3.27Å
80	R	86	Confident	85	Confident	162 Å²	162	68.8 Å²	68.8	61%	0.611	33%	0.333	S	S	*	.	H	α-helix	trans	-61.3	-43.6	175.4	-171.6	-173.3	72.8	167.4	2.5	110.6	M76 I77 L78 R83 A84	M76-R80 WeakPolarHBondContact O-CB 3.25Å; M76-R80 PolarHBondContact O-N 3.42Å; I77-R80 WeakPolarHBondContact O-CB 3.42Å; I77-R80 PolarHBondContact O-N 3.49Å; L78-R80 VanDerWaalsContact C-N 3.31Å; L78-R80 PolarHBondContact O-N 3.23Å; R80-R83 PolarHBondContact O-N 2.94Å; R80-A84 PolarHBondContact O-N 2.9Å
81	D	84.4	Confident	85.3	Confident	74 Å²	74	67.3 Å²	67.3	40%	0.396	33%	0.326	S	S	.	.	H	α-helix	trans	-66.8	-39.6	-179.8	-64	-12.9	0	0	0	111.6	I77 L78 E79 A84 L85	I77-D81 VanDerWaalsContact O-CG 3.3Å; I77-D81 PolarHBondContact O-N 2.77Å; I77-D81 VanDerWaalsContact O-N 3.09Å; L78-D81 PolarHBondContact O-N 2.63Å; E79-D81 VanDerWaalsContact C-N 3.3Å; D81-A84 PolarHBondContact O-N 2.98Å; D81-L85 PolarHBondContact O-N 2.64Å
82	I	87	Confident	85.4	Confident	17 Å²	17	67.9 Å²	67.9	9%	0.087	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-43.9	174	-67.1	167.8	0	0	0	111.1	L18 V45 A49 L78 E79 A84 L85 H86	L18-I82 HydrophobicContact CD1-CD1 4.23Å; L18-I82 HydrophobicContact CD2-CD1 4.11Å; V45-I82 HydrophobicContact CG1-CG2 4.11Å; A49-I82 HydrophobicContact CB-CD1 4.23Å; L78-I82 HydrophobicContact CG-CD1 4.18Å; L78-I82 WeakPolarHBondContact O-CG1 3.33Å; L78-I82 PolarHBondContact O-N 3.07Å; E79-I82 PolarHBondContact O-N 2.9Å; I82-A84 VanDerWaalsContact C-N 3.35Å; I82-A84 PolarHBondContact O-N 2.98Å; I82-L85 PolarHBondContact O-N 3.01Å; I82-H86 PolarHBondContact O-N 2.75Å; I82-H86 PolarHBondContact O-ND1 3.33Å
83	R	87.3	Confident	85.5	Confident	130 Å²	130	67 Å²	67	49%	0.491	32%	0.322	S	S	.	.	H	α-helix	trans	-61.6	-42.4	176.9	-76.9	-173.4	-69.1	-94.2	-0.3	112	E79 R80 L85 H86 V87	E79-R83 WeakPolarHBondContact O-CG 3.44Å; E79-R83 PolarHBondContact O-N 2.99Å; E79-R83 IonicContact OE2-NH1 3.3Å; E79-R83 PolarHBondContact OE2-NH1 3.27Å; R80-R83 PolarHBondContact O-N 2.94Å; R83-L85 VanDerWaalsContact C-N 3.32Å; R83-L85 PolarHBondContact O-N 3.27Å; R83-H86 PolarHBondContact O-N 3.48Å; R83-V87 WeakPolarHBondContact O-CG2 3.28Å; R83-V87 PolarHBondContact O-N 3.21Å
84	A	88.1	Confident	85.4	Confident	61 Å²	61	68.5 Å²	68.5	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-42.4	176.7	0	0	0	0	0	111.5	R80 D81 I82 H86 V87 E88	R80-A84 PolarHBondContact O-N 2.9Å; D81-A84 PolarHBondContact O-N 2.98Å; I82-A84 VanDerWaalsContact C-N 3.35Å; I82-A84 PolarHBondContact O-N 2.98Å; A84-H86 PolarHBondContact O-N 2.82Å; A84-V87 PolarHBondContact O-N 2.98Å; A84-E88 PolarHBondContact O-N 3.31Å
85	L	86	Confident	85.4	Confident	17 Å²	17	72 Å²	72	9%	0.089	34%	0.336	C	S	.	.	H	α-helix	trans	-65.2	-37.8	178.1	-132.3	92.8	0	0	0	113.2	T22 L25 K26 D81 I82 R83 V87 E88 A89	T22-L85 HydrophobicContact CG2-CD1 3.51Å; T22-L85 HydrophobicContact CG2-CD2 3.54Å; T22-L85 HydrophobicContact CG2-CG 4.04Å; T22-L85 WeakPolarHBondContact O-CD2 3.44Å; L25-L85 HydrophobicContact CB-CD2 3.8Å; L25-L85 HydrophobicContact CD2-CD2 3.6Å; L25-L85 HydrophobicContact CG-CD2 3.72Å; K26-L85 HydrophobicContact CB-CD1 4.42Å; K26-L85 HydrophobicContact CD-CD1 4.31Å; D81-L85 PolarHBondContact O-N 2.64Å; I82-L85 PolarHBondContact O-N 3.01Å; R83-L85 VanDerWaalsContact C-N 3.32Å; R83-L85 PolarHBondContact O-N 3.27Å; L85-V87 VanDerWaalsContact C-N 3.28Å; L85-V87 PolarHBondContact O-N 2.89Å; L85-E88 PolarHBondContact O-N 2.91Å; L85-A89 PolarHBondContact O-N 2.82Å
86	H	88.5	Confident	84.9	Confident	33 Å²	33	72.2 Å²	72.2	15%	0.153	34%	0.339	C	S	.	.	H	α-helix	trans	-62.1	-36	175.5	-82.1	136.5	0	0	0	113	D46 I82 R83 A84 R90	D46-H86 IonicContact OD1-CE1 2.65Å; D46-H86 PolarHBondContact OD1-CE1 3.01Å; D46-H86 IonicContact OD1-NE2 2.71Å; D46-H86 PolarHBondContact OD1-NE2 2.86Å; D46-H86 IonicContact OD2-NE2 3.44Å; I82-H86 PolarHBondContact O-N 2.75Å; I82-H86 PolarHBondContact O-ND1 3.33Å; R83-H86 PolarHBondContact O-N 3.48Å; A84-H86 PolarHBondContact O-N 2.82Å; H86-R90 WeakPolarHBondContact O-CB 3.37Å; H86-R90 WeakPolarHBondContact O-CG 3.2Å; H86-R90 PolarHBondContact O-N 3.06Å
87	V	87.3	Confident	84.2	Confident	82 Å²	82	73.5 Å²	73.5	50%	0.497	34%	0.342	S	S	.	.	H	α-helix	trans	-65.7	-45.5	175.2	175.4	0	0	0	0	110	R83 A84 L85 A89 R90 Q91	R83-V87 WeakPolarHBondContact O-CG2 3.28Å; R83-V87 PolarHBondContact O-N 3.21Å; A84-V87 PolarHBondContact O-N 2.98Å; L85-V87 VanDerWaalsContact C-N 3.28Å; L85-V87 PolarHBondContact O-N 2.89Å; V87-A89 PolarHBondContact O-N 3.07Å; V87-R90 PolarHBondContact O-N 3.11Å; V87-Q91 WeakPolarHBondContact O-CG 3.45Å; V87-Q91 PolarHBondContact O-N 2.99Å
88	E	86.5	Confident	83.5	Confident	76 Å²	76	75 Å²	75	36%	0.355	35%	0.347	S	S	.	.	H	α-helix	trans	-60.1	-46	177.4	-167.2	175.1	-179.2	0	0	111.7	A84 L85 Q91 Y92	A84-E88 PolarHBondContact O-N 3.31Å; L85-E88 PolarHBondContact O-N 2.91Å; E88-Q91 PolarHBondContact O-N 3.22Å; E88-Y92 PolarHBondContact O-N 3.29Å
89	A	88.2	Confident	82.2	Confident	1 Å²	1	80 Å²	80	1%	0.008	37%	0.37	C	S	.	.	H	α-helix	trans	-63.5	-42.3	177.5	0	0	0	0	0	112.7	L25 V38 V42 L85 V87 Y92 I93	L25-A89 HydrophobicContact CD1-CB 4.26Å; L25-A89 HydrophobicContact CD2-CB 4.45Å; V38-A89 HydrophobicContact CG1-CB 4.13Å; V42-A89 HydrophobicContact CG2-CB 3.75Å; L85-A89 PolarHBondContact O-N 2.82Å; V87-A89 PolarHBondContact O-N 3.07Å; A89-Y92 PolarHBondContact O-N 3.36Å; A89-I93 WeakPolarHBondContact O-CD1 3.48Å; A89-I93 VanDerWaalsContact O-CG1 3.28Å; A89-I93 WeakPolarHBondContact O-CG1 3.48Å; A89-I93 PolarHBondContact O-N 3.24Å
90	R	86.5	Confident	80.6	Confident	186 Å²	186	83.3 Å²	83.3	70%	0.702	39%	0.392	S	S	*	.	H	α-helix	trans	-64	-43.6	176.3	-79.2	-175.9	-173.6	170.8	3.6	112.2	H86 V87 Y92 I93 E94	H86-R90 WeakPolarHBondContact O-CB 3.37Å; H86-R90 WeakPolarHBondContact O-CG 3.2Å; H86-R90 PolarHBondContact O-N 3.06Å; V87-R90 PolarHBondContact O-N 3.11Å; R90-Y92 VanDerWaalsContact C-N 3.28Å; R90-Y92 PolarHBondContact O-N 3.38Å; R90-I93 PolarHBondContact O-N 2.86Å; R90-E94 WeakPolarHBondContact O-CB 3.3Å; R90-E94 PolarHBondContact O-N 3.24Å
91	Q	86.3	Confident	78.5	Confident	110 Å²	110	82.8 Å²	82.8	51%	0.514	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-38.8	176.4	-74.4	178.5	-6.5	0	0	111.7	V87 E88 K95	V87-Q91 WeakPolarHBondContact O-CG 3.45Å; V87-Q91 PolarHBondContact O-N 2.99Å; E88-Q91 PolarHBondContact O-N 3.22Å; Q91-K95 WeakPolarHBondContact O-CB 2.99Å; Q91-K95 WeakPolarHBondContact O-CG 3.41Å; Q91-K95 PolarHBondContact O-N 3.42Å
92	Y	85.4	Confident	76.4	Confident	36 Å²	36	84.3 Å²	84.3	14%	0.141	42%	0.416	C	S	.	.	H	α-helix	trans	-63.1	-48.4	173.9	-178.8	-93.7	0	0	0	112	C29 M32 Q33 V38 E88 A89 R90 E94 K95 S96	C29-Y92 WeakPolarHBondContact O-CD2 3.32Å; M32-Y92 VanDerWaalsContact CA-OH 3.24Å; M32-Y92 WeakPolarHBondContact CA-OH 3.14Å; M32-Y92 HydrophobicContact CE-CE2 4.32Å; M32-Y92 HydrophobicContact CG-CE2 4.18Å; M32-Y92 HydrophobicContact SD-CE2 4.41Å; Q33-Y92 PolarHBondContact O-OH 3.32Å; V38-Y92 HydrophobicContact CG1-CD1 4.38Å; V38-Y92 HydrophobicContact CG2-CD1 3.96Å; V38-Y92 HydrophobicContact CG2-CE1 3.9Å; E88-Y92 PolarHBondContact O-N 3.29Å; A89-Y92 PolarHBondContact O-N 3.36Å; R90-Y92 VanDerWaalsContact C-N 3.28Å; R90-Y92 PolarHBondContact O-N 3.38Å; Y92-E94 VanDerWaalsContact C-N 3.31Å; Y92-E94 PolarHBondContact O-N 3.21Å; Y92-K95 PolarHBondContact O-N 3.42Å; Y92-S96 PolarHBondContact O-N 2.91Å
93	I	82.9	Confident	73.8	Confident	21 Å²	21	88.4 Å²	88.4	11%	0.108	44%	0.443	C	S	.	.	H	α-helix	trans	-59.7	-43.4	179.3	-67.6	161.8	0	0	0	110.9	T35 V38 E39 A89 R90 S96 K97	T35-I93 HydrophobicContact CG2-CB 4.14Å; T35-I93 HydrophobicContact CG2-CG1 3.89Å; T35-I93 HydrophobicContact CG2-CG2 3.93Å; V38-I93 HydrophobicContact CG1-CD1 4.26Å; V38-I93 HydrophobicContact CG1-CG1 4.23Å; E39-I93 HydrophobicContact CG-CD1 3.69Å; E39-I93 HydrophobicContact CG-CG1 4.3Å; A89-I93 WeakPolarHBondContact O-CD1 3.48Å; A89-I93 VanDerWaalsContact O-CG1 3.28Å; A89-I93 WeakPolarHBondContact O-CG1 3.48Å; A89-I93 PolarHBondContact O-N 3.24Å; R90-I93 PolarHBondContact O-N 2.86Å; I93-S96 PolarHBondContact O-N 2.82Å; I93-S96 PolarHBondContact O-OG 3.32Å; I93-K97 HydrophobicContact CG2-CD 4.42Å; I93-K97 WeakPolarHBondContact O-CG 3.4Å; I93-K97 PolarHBondContact O-N 3.12Å; I93-K97 VanDerWaalsContact O-N 3.15Å
94	E	81.9	Confident	71.1	Confident	125 Å²	125	91 Å²	91	58%	0.584	46%	0.457	S	S	*	.	H	α-helix	trans	-66.7	-44.7	-179.4	-161	154.7	-150.2	0	0	111.9	R90 Y92 S96 K97 E98	R90-E94 WeakPolarHBondContact O-CB 3.3Å; R90-E94 PolarHBondContact O-N 3.24Å; Y92-E94 VanDerWaalsContact C-N 3.31Å; Y92-E94 PolarHBondContact O-N 3.21Å; E94-S96 VanDerWaalsContact C-N 3.31Å; E94-S96 PolarHBondContact O-N 2.83Å; E94-K97 WeakPolarHBondContact O-CB 3.48Å; E94-K97 PolarHBondContact O-N 3.06Å; E94-K97 VanDerWaalsContact O-N 3.14Å; E94-E98 PolarHBondContact O-N 3.43Å; E94-E98 VanDerWaalsContact O-N 3.11Å
95	K	78.8	Confident	68.2	Low	138 Å²	138	97 Å²	97	60%	0.6	48%	0.475	S	S	*	.	H	α-helix	trans	-60	-38.3	172.6	-77.6	-178.3	179.1	-180	0	113	Q91 Y92 K97 E98 Q99	Q91-K95 WeakPolarHBondContact O-CB 2.99Å; Q91-K95 WeakPolarHBondContact O-CG 3.41Å; Q91-K95 PolarHBondContact O-N 3.42Å; Y92-K95 PolarHBondContact O-N 3.42Å; K95-K97 VanDerWaalsContact C-N 3.31Å; K95-K97 PolarHBondContact O-N 3.48Å; K95-E98 PolarHBondContact O-N 3.47Å; K95-Q99 PolarHBondContact O-N 3.34Å; K95-Q99 VanDerWaalsContact O-N 3.09Å
96	S	74.4	Confident	65.6	Low	19 Å²	19	101.7 Å²	101.7	13%	0.133	50%	0.504	C	S	.	.	H	α-helix	trans	-64.2	-38.2	177.3	82	0	0	0	0	111.7	T35 Y92 I93 E94 Q99 T100	T35-S96 WeakPolarHBondContact CG2-OG 3.46Å; T35-S96 PolarHBondContact OG1-OG 3.2Å; T35-S96 VanDerWaalsContact OG1-OG 3.09Å; Y92-S96 PolarHBondContact O-N 2.91Å; I93-S96 PolarHBondContact O-N 2.82Å; I93-S96 PolarHBondContact O-OG 3.32Å; E94-S96 VanDerWaalsContact C-N 3.31Å; E94-S96 PolarHBondContact O-N 2.83Å; S96-Q99 PolarHBondContact O-N 3.41Å; S96-T100 PolarHBondContact O-N 3.36Å; S96-T100 PolarHBondContact O-OG1 2.91Å
97	K	71.4	Confident	62.8	Low	117 Å²	117	108.7 Å²	108.7	51%	0.509	54%	0.536	S	S	.	.	H	α-helix	trans	-65.1	-41.7	177.5	-72.4	174.6	-178.3	175	0	111.2	I93 E94 K95 T100 L101	I93-K97 HydrophobicContact CG2-CD 4.42Å; I93-K97 WeakPolarHBondContact O-CG 3.4Å; I93-K97 PolarHBondContact O-N 3.12Å; I93-K97 VanDerWaalsContact O-N 3.15Å; E94-K97 WeakPolarHBondContact O-CB 3.48Å; E94-K97 PolarHBondContact O-N 3.06Å; E94-K97 VanDerWaalsContact O-N 3.14Å; K95-K97 VanDerWaalsContact C-N 3.31Å; K95-K97 PolarHBondContact O-N 3.48Å; K97-T100 WeakPolarHBondContact CA-OG1 3.48Å; K97-T100 PolarHBondContact O-N 3.05Å; K97-T100 PolarHBondContact O-OG1 3.41Å; K97-L101 WeakPolarHBondContact O-CD1 3.42Å; K97-L101 PolarHBondContact O-N 2.91Å
98	E	67.9	Low	60.2	Low	127 Å²	127	113.4 Å²	113.4	59%	0.593	56%	0.559	S	S	*	*	H	α-helix	trans	-63.9	-40	176.1	-69.4	178.5	169.9	0	0	112.7	E94 K95 L101	E94-E98 PolarHBondContact O-N 3.43Å; E94-E98 VanDerWaalsContact O-N 3.11Å; K95-E98 PolarHBondContact O-N 3.47Å; E98-L101 WeakPolarHBondContact O-CB 3.45Å; E98-L101 PolarHBondContact O-N 2.94Å; E98-L101 VanDerWaalsContact O-N 3.15Å
99	Q	56.4	Low	57.5	Low	126 Å²	126	113 Å²	113	59%	0.589	58%	0.575	S	S	*	*	H	α-helix	trans	-67	-37.4	178.3	-74.7	-177.5	-10.4	0	0	113	K95 S96 L101 S102 T103	K95-Q99 PolarHBondContact O-N 3.34Å; K95-Q99 VanDerWaalsContact O-N 3.09Å; S96-Q99 PolarHBondContact O-N 3.41Å; Q99-L101 PolarHBondContact O-N 2.99Å; Q99-S102 PolarHBondContact O-N 3.05Å; Q99-T103 PolarHBondContact O-OG1 2.84Å
100	T	51.8	Low	54.8	Low	92 Å²	92	125.1 Å²	125.1	56%	0.564	62%	0.621	S	S	*	*	H	α-helix	trans	-64.4	-21.6	172.9	24.7	0	0	0	0	113.9	S96 K97	S96-T100 PolarHBondContact O-N 3.36Å; S96-T100 PolarHBondContact O-OG1 2.91Å; K97-T100 WeakPolarHBondContact CA-OG1 3.48Å; K97-T100 PolarHBondContact O-N 3.05Å; K97-T100 PolarHBondContact O-OG1 3.41Å
101	L	41.6	Very low	52.3	Low	151 Å²	151	121.2 Å²	121.2	79%	0.791	63%	0.628	S	S	*	*	H	α-helix	trans	-80.2	-20.7	176.9	-82.5	151.2	0	0	0	113	K97 E98 Q99	K97-L101 WeakPolarHBondContact O-CD1 3.42Å; K97-L101 PolarHBondContact O-N 2.91Å; E98-L101 WeakPolarHBondContact O-CB 3.45Å; E98-L101 PolarHBondContact O-N 2.94Å; E98-L101 VanDerWaalsContact O-N 3.15Å; Q99-L101 PolarHBondContact O-N 2.99Å
102	S	40.1	Very low	49.9	Very low	105 Å²	105	122.2 Å²	122.2	73%	0.734	65%	0.646	S	S	*	*	H	α-helix	trans	-87.1	-27.8	-179.4	-178.1	0	0	0	0	113.5	Q99	Q99-S102 PolarHBondContact O-N 3.05Å
103	T	33.7	Very low	47.4	Very low	104 Å²	104	123.9 Å²	123.9	64%	0.638	67%	0.667	S	S	*	*	S	Bend	trans	-120.5	81.2	-176.7	43	0	0	0	0	111.2	Q99	Q99-T103 PolarHBondContact O-OG1 2.84Å
104	K	29.3	Very low	45.3	Very low	184 Å²	184	128.2 Å²	128.2	80%	0.8	70%	0.697	S	S	*	*			trans	-173.1	76.3	152.4	-100.9	154	-166.9	-173.7	0	110.1
105	E	28.4	Very low	43.2	Very low	187 Å²	187	128.8 Å²	128.8	87%	0.874	71%	0.708	S	S	*	*			trans	-64.9	134.9	144	-73.9	-169.9	148.7	0	0	108.8
106	V	31.2	Very low	41.4	Very low	116 Å²	116	128.9 Å²	128.9	70%	0.703	72%	0.715	S	S	*	*	S	Bend	trans	62.5	89.3	165.4	-161.7	0	0	0	0	117.1
107	H	29.1	Very low	40.3	Very low	179 Å²	179	133.3 Å²	133.3	83%	0.829	74%	0.743	S	S	*	*				175.9	97.4	117.1	-94.1	-62.2	0	0	0	110.2	G109	H107-G109 PolarHBondContact O-N 2.84Å
108	N	33.7	Very low	39.3	Very low	181 Å²	181	136.5 Å²	136.5	97%	0.968	76%	0.757	S	S	*	*			trans	-76.9	112.5	-177.2	-84.5	-22.9	0	0	0	112.1
109	G	29	Very low	38.9	Very low	68 Å²	68	138.9 Å²	138.9	70%	0.701	76%	0.761	S	S	*	*			trans	-145.1	105.9	165.6	0	0	0	0	0	111.2	H107	H107-G109 PolarHBondContact O-N 2.84Å
110	R	31.4	Very low	39.5	Very low	256 Å²	256	139.2 Å²	139.2	97%	0.966	77%	0.766	S	S	*	*			trans	79.7	102.5	163.5	-64.9	179.4	170	177.2	-3	119.7
111	A	34.6	Very low	40.5	Very low	103 Å²	103	135.9 Å²	135.9	85%	0.851	75%	0.745	S	S	*	*				-158.3	115.3	105.2	0	0	0	0	0	108.4	A113	A111-A113 PolarHBondContact O-N 3.36Å; A111-A113 VanDerWaalsContact O-N 3.13Å
112	C	34.7	Very low	42.4	Very low	131 Å²	131	131.4 Å²	131.4	89%	0.885	73%	0.725	S	S	*	*			trans	-88.6	77	-165.2	-158.8	0	0	0	0	111
113	A	33.2	Very low	44.7	Very low	71 Å²	71	132.1 Å²	132.1	59%	0.587	72%	0.715	S	S	*	*	S	Bend	trans	-68.8	141.3	145.5	0	0	0	0	0	106.5	A111 V115	A111-A113 PolarHBondContact O-N 3.36Å; A111-A113 VanDerWaalsContact O-N 3.13Å; A113-V115 PolarHBondContact O-N 3.29Å
114	P	38.2	Very low	47.6	Very low	113 Å²	113	127.2 Å²	127.2	73%	0.734	69%	0.685	S	S	*	*			trans	-57.1	109.9	178.4	23.6	-30.8	0	0	0	107.4	L116	P114-L116 PolarHBondContact O-N 2.74Å
115	V	38	Very low	50.6	Low	136 Å²	136	121.7 Å²	121.7	82%	0.824	66%	0.664	S	S	*	*			trans	-66.8	91.1	171.3	179.3	0	0	0	0	104.2	A113	A113-V115 PolarHBondContact O-N 3.29Å
116	L	41	Very low	53.5	Low	140 Å²	140	113.3 Å²	113.3	73%	0.733	63%	0.628	S	S	*	*			trans	-53.2	136.7	163.5	-70.7	170.5	0	0	0	105.9	P114 K118	P114-L116 PolarHBondContact O-N 2.74Å; L116-K118 PolarHBondContact O-N 3.04Å
117	P	51.1	Low	56.4	Low	112 Å²	112	110.9 Å²	110.9	73%	0.727	61%	0.611	S	S	*	*			trans	-45.1	135	171.9	-24.1	31.5	0	0	0	108.3	W119	P117-W119 PolarHBondContact O-N 3.23Å
118	K	52.2	Low	59.3	Low	184 Å²	184	103.2 Å²	103.2	80%	0.8	58%	0.576	S	S	*	*			trans	-48.1	119.6	175	-78.6	-175.8	176.9	-179.1	0	106.9	L116 D120	L116-K118 PolarHBondContact O-N 3.04Å; K118-D120 VanDerWaalsContact C-N 3.26Å; K118-D120 PolarHBondContact O-N 3.33Å
119	W	57.8	Low	61.9	Low	178 Å²	178	95.7 Å²	95.7	67%	0.674	54%	0.536	S	S	*	.			trans	-74.3	90.7	-177.1	-172.8	7.9	0	0	0	107.5	P117	P117-W119 PolarHBondContact O-N 3.23Å
120	D	69.3	Low	64.8	Low	132 Å²	132	96.3 Å²	96.3	71%	0.706	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-78.7	125.1	175.6	-68.5	-32.1	0	0	0	108.4	K118	K118-D120 VanDerWaalsContact C-N 3.26Å; K118-D120 PolarHBondContact O-N 3.33Å
121	L	73.3	Confident	67.6	Low	23 Å²	23	84.7 Å²	84.7	12%	0.12	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-65.3	139.5	173.1	-78.9	163.2	0	0	0	109.2	N137 W138 R141 C156	L121-N137 HydrophobicContact CD2-CB 4.44Å; L121-W138 HydrophobicContact CD1-CE3 3.8Å; L121-W138 HydrophobicContact CD1-CZ3 3.76Å; L121-R141 VanDerWaalsContact CD1-NH1 3.3Å; L121-C156 WeakPolarHBondContact CB-SG 3.49Å; L121-C156 WeakPolarHBondContact CD1-SG 3.43Å
122	P	81.3	Confident	70.2	Confident	57 Å²	57	82 Å²	82	37%	0.37	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-61.1	141.5	177.2	24.1	-31.4	0	0	0	110.7	N137	P122-N137 HydrophobicContact CG-CB 4.39Å
123	K	88.9	Confident	72.6	Confident	120 Å²	120	78.5 Å²	78.5	52%	0.522	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-72.4	141.2	173.9	-64.1	-72.6	-174.9	161.3	0	110	T155 C156 E158	K123-T155 WeakPolarHBondContact CE-O 3.41Å; K123-T155 PolarHBondContact NZ-O 3.37Å; K123-C156 CarbonylContact C-O 3.42Å; K123-C156 VanDerWaalsContact CA-O 3.28Å; K123-C156 WeakPolarHBondContact CA-O 3.4Å; K123-E158 HydrophobicContact CB-CG 4.48Å
124	F	93.5	Very high	75.3	Confident	1 Å²	1	75.5 Å²	75.5	0%	0.004	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-121.6	118.7	175.7	177.5	-106.3	0	0	0	110.7	G126 D127 L130 F131 F134 C156 L157 E158 A161 F186	F124-G126 VanDerWaalsContact CZ-CA 3.42Å; F124-D127 VanDerWaalsContact CE2-O 3.23Å; F124-D127 WeakPolarHBondContact CE2-O 3.35Å; F124-L130 HydrophobicContact CD2-CB 4.42Å; F124-L130 HydrophobicContact CE2-CB 4.45Å; F124-F131 AromaticContact CE1-CD2 3.91Å; F124-F131 HydrophobicContact CE1-CD2 3.91Å; F124-F131 HydrophobicContact CE2-CB 3.95Å; F124-F131 HydrophobicContact CE2-CD2 4.12Å; F124-F131 HydrophobicContact CZ-CB 4.05Å; F124-F131 AromaticContact CZ-CD2 3.57Å; F124-F131 HydrophobicContact CZ-CD2 3.57Å; F124-F131 HydrophobicContact CZ-CG 4.31Å; F124-F134 HydrophobicContact CB-CB 4.19Å; F124-F134 HydrophobicContact CB-CD1 3.77Å; F124-F134 HydrophobicContact CB-CD2 3.49Å; F124-F134 VanDerWaalsContact CB-CD2 3.49Å; F124-F134 HydrophobicContact CB-CE1 3.96Å; F124-F134 HydrophobicContact CB-CE2 3.69Å; F124-F134 HydrophobicContact CB-CG 3.52Å; F124-F134 HydrophobicContact CB-CZ 3.92Å; F124-F134 HydrophobicContact CD1-CD1 4.06Å; F124-F134 HydrophobicContact CD1-CE1 4.11Å; F124-F134 HydrophobicContact CD2-CB 4Å; F124-F134 HydrophobicContact CD2-CD1 4.15Å; F124-F134 HydrophobicContact CD2-CG 4.08Å; F124-F134 HydrophobicContact CG-CB 4.28Å; F124-F134 AromaticContact CG-CD1 3.72Å; F124-F134 HydrophobicContact CG-CD1 3.72Å; F124-F134 HydrophobicContact CG-CD2 4.31Å; F124-F134 HydrophobicContact CG-CE1 4.1Å; F124-F134 AromaticContact CG-CG 3.83Å; F124-F134 HydrophobicContact CG-CG 3.83Å; F124-C156 PolarHBondContact N-O 3.11Å; F124-L157 HydrophobicContact CB-CD2 4.18Å; F124-L157 HydrophobicContact CD1-CD2 3.72Å; F124-L157 HydrophobicContact CG-CD2 4.43Å; F124-L157 WeakPolarHBondContact O-CA 3.4Å; F124-E158 PolarHBondContact O-N 2.83Å; F124-A161 HydrophobicContact CD1-CB 3.5Å; F124-A161 HydrophobicContact CE1-CB 3.56Å; F124-F186 HydrophobicContact CE1-CB 4.31Å; F124-F186 HydrophobicContact CE1-CD2 4.02Å; F124-F186 HydrophobicContact CE1-CG 4.07Å; F124-F186 HydrophobicContact CZ-CB 4Å; F124-F186 HydrophobicContact CZ-CD1 4.44Å; F124-F186 HydrophobicContact CZ-CD2 4.48Å; F124-F186 HydrophobicContact CZ-CG 4.07Å
125	N	92.3	Very high	77.7	Confident	68 Å²	68	71.3 Å²	71.3	36%	0.364	38%	0.376	S	S	.	.			trans	-97.5	-7.1	-174.1	65.8	-2.4	0	0	0	114.3	D127 E158 V160	N125-D127 WeakPolarHBondContact OD1-CB 3.45Å; N125-D127 PolarHBondContact OD1-N 3.48Å; N125-E158 CarbonylContact C-O 3.33Å; N125-E158 WeakPolarHBondContact CA-O 3.26Å; N125-E158 HydrophobicContact CB-CG 3.57Å; N125-V160 VanDerWaalsContact O-CG2 3.25Å; N125-V160 WeakPolarHBondContact O-CG2 3.3Å
126	G	89.4	Confident	79.9	Confident	11 Å²	11	69.7 Å²	69.7	11%	0.113	36%	0.363	C	S	.	.	S	Bend	trans	107.8	0.5	-174.4	0	0	0	0	0	115.2	F124 V128 F186	F124-G126 VanDerWaalsContact CZ-CA 3.42Å; G126-V128 PolarHBondContact O-N 2.79Å; G126-F186 WeakPolarHBondContact O-CD1 3.44Å
127	D	91.8	Very high	81.8	Confident	64 Å²	64	65.9 Å²	65.9	34%	0.342	34%	0.343	S	S	.	.			trans	-67	112.7	172.3	-175.9	1.6	0	0	0	111	F124 N125 L129 L130 F131	F124-D127 VanDerWaalsContact CE2-O 3.23Å; F124-D127 WeakPolarHBondContact CE2-O 3.35Å; N125-D127 WeakPolarHBondContact OD1-CB 3.45Å; N125-D127 PolarHBondContact OD1-N 3.48Å; D127-L129 PolarHBondContact O-N 2.98Å; D127-L129 VanDerWaalsContact O-N 3.15Å; D127-L129 PolarHBondContact OD1-N 3.36Å; D127-L130 HydrophobicContact CB-CD1 4.15Å; D127-L130 HydrophobicContact CB-CG 4.23Å; D127-L130 PolarHBondContact O-N 2.64Å; D127-F131 PolarHBondContact O-N 3.23Å
128	V	90.5	Very high	83.3	Confident	18 Å²	18	61 Å²	61	11%	0.109	31%	0.31	C	S	.	.	H	α-helix	trans	-56.2	-32.5	-177.8	-179.2	0	0	0	0	112.2	G126 L130 F131 L191 I192	G126-V128 PolarHBondContact O-N 2.79Å; V128-L130 PolarHBondContact O-N 2.88Å; V128-F131 WeakPolarHBondContact O-CB 3.22Å; V128-F131 PolarHBondContact O-N 2.98Å; V128-L191 HydrophobicContact CG1-CD2 4.32Å; V128-L191 HydrophobicContact CG1-CG 4.21Å; V128-L191 HydrophobicContact CG2-CD2 4.06Å; V128-I192 HydrophobicContact CG1-CB 4.1Å; V128-I192 HydrophobicContact CG1-CD1 4.44Å; V128-I192 HydrophobicContact CG1-CG1 3.6Å; V128-I192 HydrophobicContact CG1-CG2 4.44Å
129	L	89.2	Confident	84.4	Confident	24 Å²	24	55.3 Å²	55.3	13%	0.126	29%	0.293	C	S	.	.	H	α-helix	trans	-66.4	-22.1	178.1	-65.8	173	0	0	0	113.1	D127 K195 H196	D127-L129 PolarHBondContact O-N 2.98Å; D127-L129 VanDerWaalsContact O-N 3.15Å; D127-L129 PolarHBondContact OD1-N 3.36Å; L129-K195 HydrophobicContact CD2-CB 3.76Å; L129-K195 HydrophobicContact CG-CB 4.3Å; L129-H196 WeakPolarHBondContact CD2-CE1 3.32Å; L129-H196 WeakPolarHBondContact CD2-ND1 3.47Å
130	L	89.6	Confident	84.8	Confident	81 Å²	81	50 Å²	50	42%	0.424	28%	0.284	S	S	.	.	H	α-helix	trans	-98.5	-9.3	179.5	-59.6	179.2	0	0	0	112.6	F124 D127 V128 T132 A133 F134	F124-L130 HydrophobicContact CD2-CB 4.42Å; F124-L130 HydrophobicContact CE2-CB 4.45Å; D127-L130 HydrophobicContact CB-CD1 4.15Å; D127-L130 HydrophobicContact CB-CG 4.23Å; D127-L130 PolarHBondContact O-N 2.64Å; V128-L130 PolarHBondContact O-N 2.88Å; L130-T132 PolarHBondContact O-N 2.95Å; L130-A133 PolarHBondContact O-N 2.87Å; L130-F134 WeakPolarHBondContact O-CB 3.5Å; L130-F134 PolarHBondContact O-N 2.86Å
131	F	90.6	Very high	84.7	Confident	12 Å²	12	47.2 Å²	47.2	5%	0.053	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-47.4	-171.5	-177.5	-91.7	0	0	0	112.2	F124 D127 V128 A133 F134 W135 K183 F186 I192	F124-F131 AromaticContact CE1-CD2 3.91Å; F124-F131 HydrophobicContact CE1-CD2 3.91Å; F124-F131 HydrophobicContact CE2-CB 3.95Å; F124-F131 HydrophobicContact CE2-CD2 4.12Å; F124-F131 HydrophobicContact CZ-CB 4.05Å; F124-F131 AromaticContact CZ-CD2 3.57Å; F124-F131 HydrophobicContact CZ-CD2 3.57Å; F124-F131 HydrophobicContact CZ-CG 4.31Å; D127-F131 PolarHBondContact O-N 3.23Å; V128-F131 WeakPolarHBondContact O-CB 3.22Å; V128-F131 PolarHBondContact O-N 2.98Å; F131-A133 PolarHBondContact O-N 2.84Å; F131-F134 PolarHBondContact O-N 2.82Å; F131-W135 HydrophobicContact CD1-CB 4.33Å; F131-W135 HydrophobicContact CE1-CB 4Å; F131-W135 HydrophobicContact CE1-CD2 4.16Å; F131-W135 HydrophobicContact CE1-CE3 4.23Å; F131-W135 HydrophobicContact CE1-CG 4.03Å; F131-W135 AromaticContact CE2-CE3 3.81Å; F131-W135 HydrophobicContact CE2-CE3 3.81Å; F131-W135 HydrophobicContact CE2-CZ3 4.37Å; F131-W135 HydrophobicContact CZ-CB 4.33Å; F131-W135 AromaticContact CZ-CD2 3.79Å; F131-W135 HydrophobicContact CZ-CD2 3.79Å; F131-W135 AromaticContact CZ-CE3 3.46Å; F131-W135 HydrophobicContact CZ-CE3 3.46Å; F131-W135 VanDerWaalsContact CZ-CE3 3.46Å; F131-W135 HydrophobicContact CZ-CG 4.15Å; F131-W135 HydrophobicContact CZ-CZ3 4.13Å; F131-W135 WeakPolarHBondContact O-CB 3.28Å; F131-W135 PolarHBondContact O-N 2.9Å; F131-K183 HydrophobicContact CZ-CG 4.24Å; F131-F186 HydrophobicContact CD2-CB 3.54Å; F131-F186 HydrophobicContact CE2-CB 3.92Å; F131-F186 HydrophobicContact CG-CB 4.19Å; F131-I192 HydrophobicContact CB-CD1 4.43Å; F131-I192 HydrophobicContact CD1-CD1 4.23Å
132	T	87.6	Confident	83.9	Confident	47 Å²	47	53.1 Å²	53.1	29%	0.288	29%	0.294	S	S	.	.	H	α-helix	trans	-58.9	-50.2	-178.8	-47.2	0	0	0	0	111.2	L130 F134 W135 D136	L130-T132 PolarHBondContact O-N 2.95Å; T132-F134 PolarHBondContact O-N 2.9Å; T132-W135 PolarHBondContact O-N 3.01Å; T132-D136 WeakPolarHBondContact O-CB 3.3Å; T132-D136 VanDerWaalsContact O-CG 3.23Å; T132-D136 PolarHBondContact O-N 2.88Å
133	A	85.7	Confident	83.1	Confident	57 Å²	57	56.5 Å²	56.5	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-63.1	-39.4	178.7	0	0	0	0	0	112.8	L130 F131 N137	L130-A133 PolarHBondContact O-N 2.87Å; F131-A133 PolarHBondContact O-N 2.84Å; A133-N137 WeakPolarHBondContact O-CB 3.49Å; A133-N137 PolarHBondContact O-N 3.08Å; A133-N137 PolarHBondContact O-ND2 3.18Å
134	F	89.3	Confident	81.9	Confident	8 Å²	8	52.6 Å²	52.6	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-46.7	173.6	165.8	-105.3	0	0	0	111.4	F124 L130 F131 T132 N137 W138 L153 C156 L157	F124-F134 HydrophobicContact CB-CB 4.19Å; F124-F134 HydrophobicContact CB-CD1 3.77Å; F124-F134 HydrophobicContact CB-CD2 3.49Å; F124-F134 VanDerWaalsContact CB-CD2 3.49Å; F124-F134 HydrophobicContact CB-CE1 3.96Å; F124-F134 HydrophobicContact CB-CE2 3.69Å; F124-F134 HydrophobicContact CB-CG 3.52Å; F124-F134 HydrophobicContact CB-CZ 3.92Å; F124-F134 HydrophobicContact CD1-CD1 4.06Å; F124-F134 HydrophobicContact CD1-CE1 4.11Å; F124-F134 HydrophobicContact CD2-CB 4Å; F124-F134 HydrophobicContact CD2-CD1 4.15Å; F124-F134 HydrophobicContact CD2-CG 4.08Å; F124-F134 HydrophobicContact CG-CB 4.28Å; F124-F134 AromaticContact CG-CD1 3.72Å; F124-F134 HydrophobicContact CG-CD1 3.72Å; F124-F134 HydrophobicContact CG-CD2 4.31Å; F124-F134 HydrophobicContact CG-CE1 4.1Å; F124-F134 AromaticContact CG-CG 3.83Å; F124-F134 HydrophobicContact CG-CG 3.83Å; L130-F134 WeakPolarHBondContact O-CB 3.5Å; L130-F134 PolarHBondContact O-N 2.86Å; F131-F134 PolarHBondContact O-N 2.82Å; T132-F134 PolarHBondContact O-N 2.9Å; F134-N137 PolarHBondContact O-N 2.81Å; F134-W138 WeakPolarHBondContact O-CB 3.42Å; F134-W138 PolarHBondContact O-N 2.73Å; F134-L153 HydrophobicContact CZ-CD1 4.03Å; F134-C156 HydrophobicContact CE2-CB 3.87Å; F134-C156 HydrophobicContact CZ-CB 4.34Å; F134-L157 HydrophobicContact CE1-CD2 4.05Å; F134-L157 HydrophobicContact CZ-CD2 3.8Å
135	W	89.3	Confident	80.8	Confident	24 Å²	24	55.5 Å²	55.5	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-67.1	-40.3	-174.7	-161.7	-94.6	0	0	0	111.9	F131 T132 W138 C139 V179 L182 K183	F131-W135 HydrophobicContact CD1-CB 4.33Å; F131-W135 HydrophobicContact CE1-CB 4Å; F131-W135 HydrophobicContact CE1-CD2 4.16Å; F131-W135 HydrophobicContact CE1-CE3 4.23Å; F131-W135 HydrophobicContact CE1-CG 4.03Å; F131-W135 AromaticContact CE2-CE3 3.81Å; F131-W135 HydrophobicContact CE2-CE3 3.81Å; F131-W135 HydrophobicContact CE2-CZ3 4.37Å; F131-W135 HydrophobicContact CZ-CB 4.33Å; F131-W135 AromaticContact CZ-CD2 3.79Å; F131-W135 HydrophobicContact CZ-CD2 3.79Å; F131-W135 AromaticContact CZ-CE3 3.46Å; F131-W135 HydrophobicContact CZ-CE3 3.46Å; F131-W135 VanDerWaalsContact CZ-CE3 3.46Å; F131-W135 HydrophobicContact CZ-CG 4.15Å; F131-W135 HydrophobicContact CZ-CZ3 4.13Å; F131-W135 WeakPolarHBondContact O-CB 3.28Å; F131-W135 PolarHBondContact O-N 2.9Å; T132-W135 PolarHBondContact O-N 3.01Å; W135-W138 PolarHBondContact O-N 3.36Å; W135-C139 PolarHBondContact NE1-SG 3.14Å; W135-C139 WeakPolarHBondContact O-CB 3.45Å; W135-C139 PolarHBondContact O-N 2.97Å; W135-V179 HydrophobicContact CH2-CB 4.15Å; W135-V179 HydrophobicContact CH2-CG1 3.6Å; W135-V179 HydrophobicContact CH2-CG2 4.02Å; W135-V179 HydrophobicContact CZ2-CG1 3.69Å; W135-L182 HydrophobicContact CZ3-CB 4.23Å; W135-L182 HydrophobicContact CZ3-CD1 4.29Å; W135-K183 HydrophobicContact CH2-CG 4.2Å; W135-K183 HydrophobicContact CZ2-CD 4.18Å; W135-K183 HydrophobicContact CZ2-CG 4.02Å
136	D	83.8	Confident	79.8	Confident	102 Å²	102	53.7 Å²	53.7	55%	0.545	31%	0.311	S	S	.	.	H	α-helix	trans	-64.3	-43.4	175.6	-68	-20.2	0	0	0	111.4	T132 W138 C139 S140	T132-D136 WeakPolarHBondContact O-CB 3.3Å; T132-D136 VanDerWaalsContact O-CG 3.23Å; T132-D136 PolarHBondContact O-N 2.88Å; D136-W138 VanDerWaalsContact C-N 3.33Å; D136-W138 PolarHBondContact O-N 2.88Å; D136-C139 PolarHBondContact O-N 2.74Å; D136-S140 PolarHBondContact O-N 2.95Å
137	N	80.8	Confident	79.2	Confident	61 Å²	61	56.3 Å²	56.3	33%	0.326	33%	0.325	S	S	.	.	H	α-helix	trans	-60.9	-42.6	173.1	-83.4	-59.9	0	0	0	111.6	L121 P122 A133 F134 S140	L121-N137 HydrophobicContact CD2-CB 4.44Å; P122-N137 HydrophobicContact CG-CB 4.39Å; A133-N137 WeakPolarHBondContact O-CB 3.49Å; A133-N137 PolarHBondContact O-N 3.08Å; A133-N137 PolarHBondContact O-ND2 3.18Å; F134-N137 PolarHBondContact O-N 2.81Å; N137-S140 PolarHBondContact O-N 2.81Å; N137-S140 PolarHBondContact O-OG 2.89Å
138	W	82.1	Confident	78.5	Confident	8 Å²	8	56 Å²	56	3%	0.03	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-46.6	177.3	178.3	-107.8	0	0	0	112.5	L121 F134 W135 D136 S140 R141 K149 H152 L153 Y175	L121-W138 HydrophobicContact CD1-CE3 3.8Å; L121-W138 HydrophobicContact CD1-CZ3 3.76Å; F134-W138 WeakPolarHBondContact O-CB 3.42Å; F134-W138 PolarHBondContact O-N 2.73Å; W135-W138 PolarHBondContact O-N 3.36Å; D136-W138 VanDerWaalsContact C-N 3.33Å; D136-W138 PolarHBondContact O-N 2.88Å; W138-S140 PolarHBondContact O-N 3.07Å; W138-R141 PolarHBondContact O-N 2.89Å; W138-K149 WeakPolarHBondContact CH2-O 3.49Å; W138-K149 HydrophobicContact CZ2-CB 4.24Å; W138-K149 WeakPolarHBondContact CZ2-O 3.3Å; W138-H152 HydrophobicContact CH2-CB 3.92Å; W138-H152 HydrophobicContact CZ3-CB 4.08Å; W138-L153 HydrophobicContact CD2-CD1 3.94Å; W138-L153 HydrophobicContact CE3-CD1 4.26Å; W138-L153 HydrophobicContact CG-CD1 4.4Å; W138-L153 HydrophobicContact CH2-CB 3.67Å; W138-L153 VanDerWaalsContact CH2-N 3.3Å; W138-L153 HydrophobicContact CZ2-CB 3.64Å; W138-L153 HydrophobicContact CZ2-CD1 4.19Å; W138-L153 HydrophobicContact CZ2-CG 4.35Å; W138-L153 HydrophobicContact CZ3-CB 4.23Å; W138-Y175 AromaticContact CZ2-CE2 3.98Å; W138-Y175 HydrophobicContact CZ2-CE2 3.98Å; W138-Y175 PolarHBondContact NE1-OH 2.92Å
139	C	76	Confident	78.1	Confident	66 Å²	66	56.9 Å²	56.9	45%	0.446	33%	0.328	S	S	.	.	H	α-helix	trans	-64.3	-23.7	-178.6	-81.6	0	0	0	0	113.5	W135 D136 R141	W135-C139 PolarHBondContact NE1-SG 3.14Å; W135-C139 WeakPolarHBondContact O-CB 3.45Å; W135-C139 PolarHBondContact O-N 2.97Å; D136-C139 PolarHBondContact O-N 2.74Å; C139-R141 PolarHBondContact O-N 3.1Å
140	S	66.8	Low	78	Confident	67 Å²	67	55.8 Å²	55.8	47%	0.469	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.2	176.4	76	0	0	0	0	114.4	D136 N137 W138 L142	D136-S140 PolarHBondContact O-N 2.95Å; N137-S140 PolarHBondContact O-N 2.81Å; N137-S140 PolarHBondContact O-OG 2.89Å; W138-S140 PolarHBondContact O-N 3.07Å; S140-L142 PolarHBondContact O-N 3.15Å
141	R	66.2	Low	77.8	Confident	73 Å²	73	55 Å²	55	28%	0.275	32%	0.321	S	S	.	.			trans	-86.4	87.3	175.3	-89.4	-173.7	159.6	178.9	-9.4	112.7	L121 W138 C139 H152	L121-R141 VanDerWaalsContact CD1-NH1 3.3Å; W138-R141 PolarHBondContact O-N 2.89Å; C139-R141 PolarHBondContact O-N 3.1Å; R141-H152 PolarHBondContact NH1-CD2 3.47Å; R141-H152 PolarHBondContact NH1-NE2 3.37Å
142	L	56.3	Low	77.5	Confident	147 Å²	147	57.4 Å²	57.4	77%	0.77	33%	0.332	S	S	*	.			trans	-85.5	-7.8	179.7	-69.7	170.3	0	0	0	114.8	S140	S140-L142 PolarHBondContact O-N 3.15Å
143	D	64.4	Low	77.6	Confident	127 Å²	127	55.1 Å²	55.1	68%	0.679	32%	0.318	S	S	*	.	S	Bend	trans	-97.1	-4.4	-160.9	60.5	-29.3	0	0	0	116.4
144	L	65	Low	77.7	Confident	39 Å²	39	55 Å²	55	20%	0.204	31%	0.305	C	S	.	.	S	Bend	trans	-102.8	146.1	-171.1	-61	175.6	0	0	0	114.1	T148 K149	L144-T148 HydrophobicContact CB-CG2 4.45Å; L144-T148 HydrophobicContact CD1-CG2 4.47Å; L144-T148 HydrophobicContact CD2-CG2 4.07Å; L144-K149 HydrophobicContact CB-CG 3.64Å; L144-K149 WeakPolarHBondContact O-CD 3.45Å; L144-K149 WeakPolarHBondContact O-CE 3.32Å
145	S	70	Confident	77.7	Confident	62 Å²	62	58 Å²	58	43%	0.434	32%	0.324	S	S	.	.			trans	-61.7	155.1	171.6	86.8	0	0	0	0	111.4	V147 T148 K149	S145-V147 VanDerWaalsContact C-N 3.3Å; S145-V147 PolarHBondContact O-N 2.91Å; S145-T148 PolarHBondContact O-N 3.34Å; S145-T148 VanDerWaalsContact O-N 3.12Å; S145-T148 WeakPolarHBondContact OG-CB 3.39Å; S145-T148 PolarHBondContact OG-N 2.94Å; S145-T148 PolarHBondContact OG-OG1 3.47Å; S145-K149 WeakPolarHBondContact O-CG 3.36Å; S145-K149 PolarHBondContact O-N 3.31Å
146	G	70.8	Confident	77.7	Confident	29 Å²	29	57.1 Å²	57.1	30%	0.299	32%	0.322	S	S	.	.	H	α-helix	trans	-56.4	-38.9	-176.5	0	0	0	0	0	114.3	F150	G146-F150 PolarHBondContact O-N 3.19Å; G146-F150 VanDerWaalsContact O-N 3.15Å
147	V	77.2	Confident	78.2	Confident	67 Å²	67	52.6 Å²	52.6	41%	0.406	30%	0.298	S	S	.	.	H	α-helix	trans	-69.3	-45.9	176.2	-175.8	0	0	0	0	110.8	S145 K149 F150 V151 V170 A172	S145-V147 VanDerWaalsContact C-N 3.3Å; S145-V147 PolarHBondContact O-N 2.91Å; V147-K149 VanDerWaalsContact C-N 3.3Å; V147-K149 PolarHBondContact O-N 3.01Å; V147-F150 PolarHBondContact O-N 3.29Å; V147-V151 WeakPolarHBondContact O-CG2 3.43Å; V147-V151 PolarHBondContact O-N 3.21Å; V147-V170 HydrophobicContact CG1-CG1 4.34Å; V147-A172 HydrophobicContact CG2-CB 3.89Å
148	T	76.7	Confident	78.7	Confident	58 Å²	58	53.9 Å²	53.9	36%	0.356	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-39.2	178.7	-46.1	0	0	0	0	111.4	L144 S145 F150 V151 H152	L144-T148 HydrophobicContact CB-CG2 4.45Å; L144-T148 HydrophobicContact CD1-CG2 4.47Å; L144-T148 HydrophobicContact CD2-CG2 4.07Å; S145-T148 PolarHBondContact O-N 3.34Å; S145-T148 VanDerWaalsContact O-N 3.12Å; S145-T148 WeakPolarHBondContact OG-CB 3.39Å; S145-T148 PolarHBondContact OG-N 2.94Å; S145-T148 PolarHBondContact OG-OG1 3.47Å; T148-F150 VanDerWaalsContact C-N 3.29Å; T148-F150 PolarHBondContact O-N 3.1Å; T148-V151 PolarHBondContact O-N 3.14Å; T148-H152 WeakPolarHBondContact O-CB 3.4Å; T148-H152 PolarHBondContact O-N 3.34Å
149	K	83.1	Confident	79.3	Confident	36 Å²	36	55.6 Å²	55.6	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-57.1	-44.5	171.6	-77.9	-177.6	172.4	168.1	0	110.7	W138 L144 S145 V147 H152 L153 Y175	W138-K149 WeakPolarHBondContact CH2-O 3.49Å; W138-K149 HydrophobicContact CZ2-CB 4.24Å; W138-K149 WeakPolarHBondContact CZ2-O 3.3Å; L144-K149 HydrophobicContact CB-CG 3.64Å; L144-K149 WeakPolarHBondContact O-CD 3.45Å; L144-K149 WeakPolarHBondContact O-CE 3.32Å; S145-K149 WeakPolarHBondContact O-CG 3.36Å; S145-K149 PolarHBondContact O-N 3.31Å; V147-K149 VanDerWaalsContact C-N 3.3Å; V147-K149 PolarHBondContact O-N 3.01Å; K149-H152 PolarHBondContact O-N 3.02Å; K149-L153 VanDerWaalsContact O-CB 3.3Å; K149-L153 WeakPolarHBondContact O-CB 3.47Å; K149-L153 PolarHBondContact O-N 2.98Å; K149-Y175 HydrophobicContact CB-CD2 4.24Å; K149-Y175 HydrophobicContact CB-CE2 3.89Å; K149-Y175 HydrophobicContact CD-CE1 4.45Å
150	F	87.2	Confident	80.1	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-70.8	-40.3	-178	-162.3	-164.8	0	0	0	113.3	G146 V147 T148 H152 L153 R154 I165 S169 V170 T171 N174 Y175 A178	G146-F150 PolarHBondContact O-N 3.19Å; G146-F150 VanDerWaalsContact O-N 3.15Å; V147-F150 PolarHBondContact O-N 3.29Å; T148-F150 VanDerWaalsContact C-N 3.29Å; T148-F150 PolarHBondContact O-N 3.1Å; F150-H152 VanDerWaalsContact C-N 3.34Å; F150-H152 PolarHBondContact O-N 2.98Å; F150-L153 HydrophobicContact CD2-CD2 4.43Å; F150-L153 PolarHBondContact O-N 2.82Å; F150-R154 HydrophobicContact CD2-CG 4.2Å; F150-R154 HydrophobicContact CE2-CG 4.02Å; F150-R154 WeakPolarHBondContact O-CG 3.43Å; F150-R154 PolarHBondContact O-N 3.26Å; F150-I165 HydrophobicContact CE2-CD1 3.87Å; F150-S169 WeakPolarHBondContact CE1-O 3.47Å; F150-V170 HydrophobicContact CB-CG1 4.35Å; F150-V170 HydrophobicContact CD1-CB 4.44Å; F150-V170 HydrophobicContact CD1-CG1 4.23Å; F150-V170 HydrophobicContact CG-CG1 4.49Å; F150-T171 WeakPolarHBondContact CD1-O 3.18Å; F150-N174 HydrophobicContact CD1-CB 4.45Å; F150-N174 HydrophobicContact CE1-CB 3.85Å; F150-Y175 HydrophobicContact CB-CD2 3.87Å; F150-Y175 HydrophobicContact CB-CG 4.42Å; F150-Y175 HydrophobicContact CD2-CD2 4.16Å; F150-Y175 HydrophobicContact CG-CD2 4.2Å; F150-A178 HydrophobicContact CD2-CB 4.37Å; F150-A178 HydrophobicContact CE2-CB 3.45Å; F150-A178 VanDerWaalsContact CE2-CB 3.45Å; F150-A178 HydrophobicContact CZ-CB 3.57Å
151	V	84.8	Confident	81.4	Confident	66 Å²	66	52.9 Å²	52.9	40%	0.4	30%	0.3	S	S	.	.	H	α-helix	trans	-56.3	-51.2	172.5	174.8	0	0	0	0	110.1	V147 T148 L153 R154 T155 V170	V147-V151 WeakPolarHBondContact O-CG2 3.43Å; V147-V151 PolarHBondContact O-N 3.21Å; T148-V151 PolarHBondContact O-N 3.14Å; V151-L153 PolarHBondContact O-N 2.78Å; V151-R154 PolarHBondContact O-N 2.99Å; V151-T155 WeakPolarHBondContact O-CG2 3.45Å; V151-T155 PolarHBondContact O-N 2.98Å; V151-T155 VanDerWaalsContact O-N 3.12Å; V151-V170 HydrophobicContact CG2-CG1 3.51Å
152	H	85.5	Confident	82.7	Confident	61 Å²	61	52.5 Å²	52.5	28%	0.282	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-40.5	-179.7	-94	3.6	0	0	0	112.9	W138 R141 T148 K149 F150 R154 T155 C156	W138-H152 HydrophobicContact CH2-CB 3.92Å; W138-H152 HydrophobicContact CZ3-CB 4.08Å; R141-H152 PolarHBondContact NH1-CD2 3.47Å; R141-H152 PolarHBondContact NH1-NE2 3.37Å; T148-H152 WeakPolarHBondContact O-CB 3.4Å; T148-H152 PolarHBondContact O-N 3.34Å; K149-H152 PolarHBondContact O-N 3.02Å; F150-H152 VanDerWaalsContact C-N 3.34Å; F150-H152 PolarHBondContact O-N 2.98Å; H152-R154 VanDerWaalsContact C-N 3.31Å; H152-R154 PolarHBondContact O-N 3.13Å; H152-T155 WeakPolarHBondContact CA-OG1 3.27Å; H152-T155 PolarHBondContact O-N 2.95Å; H152-T155 VanDerWaalsContact O-N 3.08Å; H152-T155 PolarHBondContact O-OG1 2.98Å; H152-C156 PolarHBondContact O-N 2.69Å; H152-C156 VanDerWaalsContact O-N 3.15Å; H152-C156 PolarHBondContact O-SG 3.44Å
153	L	88.6	Confident	84.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.4	-47.3	175.9	-178.8	59.6	0	0	0	110.3	F134 W138 K149 F150 V151 T155 C156 L157 Y175 V179 L182	F134-L153 HydrophobicContact CZ-CD1 4.03Å; W138-L153 HydrophobicContact CD2-CD1 3.94Å; W138-L153 HydrophobicContact CE3-CD1 4.26Å; W138-L153 HydrophobicContact CG-CD1 4.4Å; W138-L153 HydrophobicContact CH2-CB 3.67Å; W138-L153 VanDerWaalsContact CH2-N 3.3Å; W138-L153 HydrophobicContact CZ2-CB 3.64Å; W138-L153 HydrophobicContact CZ2-CD1 4.19Å; W138-L153 HydrophobicContact CZ2-CG 4.35Å; W138-L153 HydrophobicContact CZ3-CB 4.23Å; K149-L153 VanDerWaalsContact O-CB 3.3Å; K149-L153 WeakPolarHBondContact O-CB 3.47Å; K149-L153 PolarHBondContact O-N 2.98Å; F150-L153 HydrophobicContact CD2-CD2 4.43Å; F150-L153 PolarHBondContact O-N 2.82Å; V151-L153 PolarHBondContact O-N 2.78Å; L153-T155 VanDerWaalsContact C-N 3.27Å; L153-T155 PolarHBondContact O-N 3.25Å; L153-C156 PolarHBondContact O-N 2.99Å; L153-L157 HydrophobicContact CD1-CD1 4.11Å; L153-L157 HydrophobicContact CD1-CG 4.38Å; L153-L157 HydrophobicContact CG-CD1 3.89Å; L153-L157 VanDerWaalsContact O-CG 3.3Å; L153-L157 WeakPolarHBondContact O-CG 3.34Å; L153-L157 PolarHBondContact O-N 3Å; L153-Y175 HydrophobicContact CD2-CD2 4.29Å; L153-Y175 HydrophobicContact CD2-CE2 3.85Å; L153-V179 HydrophobicContact CD2-CG2 4.2Å; L153-L182 HydrophobicContact CD1-CD1 4.26Å; L153-L182 HydrophobicContact CD2-CD1 3.94Å; L153-L182 HydrophobicContact CG-CD1 4.37Å
154	R	88.5	Confident	85.7	Confident	53 Å²	53	45.3 Å²	45.3	20%	0.2	27%	0.266	C	S	.	.	H	α-helix	trans	-58.5	-38.3	176.2	-73.1	-176.4	74.1	119.5	3.7	112.5	F150 V151 H152 C156 L157 F162 I165 A166 Y168	F150-R154 HydrophobicContact CD2-CG 4.2Å; F150-R154 HydrophobicContact CE2-CG 4.02Å; F150-R154 WeakPolarHBondContact O-CG 3.43Å; F150-R154 PolarHBondContact O-N 3.26Å; V151-R154 PolarHBondContact O-N 2.99Å; H152-R154 VanDerWaalsContact C-N 3.31Å; H152-R154 PolarHBondContact O-N 3.13Å; R154-C156 PolarHBondContact O-N 3.25Å; R154-L157 PolarHBondContact O-N 3.44Å; R154-F162 HydrophobicContact CB-CE2 4.36Å; R154-I165 HydrophobicContact CG-CD1 3.82Å; R154-A166 PolarHBondContact NH1-O 2.88Å; R154-Y168 PolarHBondContact NH1-O 3.01Å
155	T	87.7	Confident	87	Confident	72 Å²	72	43.5 Å²	43.5	44%	0.442	26%	0.256	S	S	.	.	H	α-helix	trans	-69	-19.3	176.4	61.4	0	0	0	0	113.6	K123 V151 H152 L153	K123-T155 WeakPolarHBondContact CE-O 3.41Å; K123-T155 PolarHBondContact NZ-O 3.37Å; V151-T155 WeakPolarHBondContact O-CG2 3.45Å; V151-T155 PolarHBondContact O-N 2.98Å; V151-T155 VanDerWaalsContact O-N 3.12Å; H152-T155 WeakPolarHBondContact CA-OG1 3.27Å; H152-T155 PolarHBondContact O-N 2.95Å; H152-T155 VanDerWaalsContact O-N 3.08Å; H152-T155 PolarHBondContact O-OG1 2.98Å; L153-T155 VanDerWaalsContact C-N 3.27Å; L153-T155 PolarHBondContact O-N 3.25Å
156	C	90.8	Very high	87.9	Confident	6 Å²	6	42.4 Å²	42.4	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-92.5	-7.6	178.3	-53.6	0	0	0	0	113	L121 K123 F124 F134 H152 L153 R154	L121-C156 WeakPolarHBondContact CB-SG 3.49Å; L121-C156 WeakPolarHBondContact CD1-SG 3.43Å; K123-C156 CarbonylContact C-O 3.42Å; K123-C156 VanDerWaalsContact CA-O 3.28Å; K123-C156 WeakPolarHBondContact CA-O 3.4Å; F124-C156 PolarHBondContact N-O 3.11Å; F134-C156 HydrophobicContact CE2-CB 3.87Å; F134-C156 HydrophobicContact CZ-CB 4.34Å; H152-C156 PolarHBondContact O-N 2.69Å; H152-C156 VanDerWaalsContact O-N 3.15Å; H152-C156 PolarHBondContact O-SG 3.44Å; L153-C156 PolarHBondContact O-N 2.99Å; R154-C156 PolarHBondContact O-N 3.25Å
157	L	92.9	Very high	88.8	Confident	7 Å²	7	45 Å²	45	4%	0.037	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-101.9	143.2	-177.1	-61.9	166.8	0	0	0	110.4	F124 F134 L153 R154 A161 F162 I165 L182	F124-L157 HydrophobicContact CB-CD2 4.18Å; F124-L157 HydrophobicContact CD1-CD2 3.72Å; F124-L157 HydrophobicContact CG-CD2 4.43Å; F124-L157 WeakPolarHBondContact O-CA 3.4Å; F134-L157 HydrophobicContact CE1-CD2 4.05Å; F134-L157 HydrophobicContact CZ-CD2 3.8Å; L153-L157 HydrophobicContact CD1-CD1 4.11Å; L153-L157 HydrophobicContact CD1-CG 4.38Å; L153-L157 HydrophobicContact CG-CD1 3.89Å; L153-L157 VanDerWaalsContact O-CG 3.3Å; L153-L157 WeakPolarHBondContact O-CG 3.34Å; L153-L157 PolarHBondContact O-N 3Å; R154-L157 PolarHBondContact O-N 3.44Å; L157-A161 HydrophobicContact CD2-CB 4.04Å; L157-F162 HydrophobicContact CB-CB 4.06Å; L157-F162 HydrophobicContact CB-CD2 4.33Å; L157-I165 HydrophobicContact CD1-CD1 3.33Å; L157-I165 HydrophobicContact CD1-CG1 3.93Å; L157-L182 HydrophobicContact CD1-CD1 3.83Å; L157-L182 HydrophobicContact CD1-CD2 4.27Å; L157-L182 HydrophobicContact CD2-CD1 4.34Å; L157-L182 HydrophobicContact CD2-CD2 4.22Å
158	E	93.1	Very high	89.4	Confident	87 Å²	87	45 Å²	45	41%	0.407	27%	0.27	S	S	.	.			trans	-140.5	168.4	173.8	66.9	-174.1	-174.5	0	0	110.8	K123 F124 N125 V160 A161 F162	K123-E158 HydrophobicContact CB-CG 4.48Å; F124-E158 PolarHBondContact O-N 2.83Å; N125-E158 CarbonylContact C-O 3.33Å; N125-E158 WeakPolarHBondContact CA-O 3.26Å; N125-E158 HydrophobicContact CB-CG 3.57Å; E158-V160 PolarHBondContact O-N 3.33Å; E158-A161 PolarHBondContact O-N 3.04Å; E158-F162 PolarHBondContact O-N 3.09Å
159	G	93.3	Very high	90	Very high	45 Å²	45	45.8 Å²	45.8	46%	0.464	28%	0.278	S	S	.	.	H	α-helix	trans	51.4	-138	178.4	0	0	0	0	0	113.9	A161 F162 D163	G159-A161 PolarHBondContact O-N 3.26Å; G159-A161 VanDerWaalsContact O-N 3.13Å; G159-F162 PolarHBondContact O-N 3.01Å; G159-D163 PolarHBondContact O-N 3.35Å
160	V	93.4	Very high	90.1	Very high	75 Å²	75	47 Å²	47	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-22.4	-175	-63.9	0	0	0	0	113.5	N125 E158 A164 F186	N125-V160 VanDerWaalsContact O-CG2 3.25Å; N125-V160 WeakPolarHBondContact O-CG2 3.3Å; E158-V160 PolarHBondContact O-N 3.33Å; V160-A164 WeakPolarHBondContact O-CB 3.24Å; V160-A164 PolarHBondContact O-N 3.04Å; V160-A164 VanDerWaalsContact O-N 3.1Å; V160-F186 HydrophobicContact CG2-CE1 4.12Å; V160-F186 HydrophobicContact CG2-CZ 4.26Å
161	A	93.6	Very high	89.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-75.6	-37.1	175.5	0	0	0	0	0	112.4	F124 L157 E158 G159 L182 F186	F124-A161 HydrophobicContact CD1-CB 3.5Å; F124-A161 HydrophobicContact CE1-CB 3.56Å; L157-A161 HydrophobicContact CD2-CB 4.04Å; E158-A161 PolarHBondContact O-N 3.04Å; G159-A161 PolarHBondContact O-N 3.26Å; G159-A161 VanDerWaalsContact O-N 3.13Å; A161-L182 HydrophobicContact CB-CD2 4.46Å; A161-F186 HydrophobicContact CB-CE2 4Å; A161-F186 HydrophobicContact CB-CZ 4.13Å
162	F	93.8	Very high	89.7	Confident	65 Å²	65	48.9 Å²	48.9	29%	0.285	31%	0.306	S	S	.	.	H	α-helix	trans	-67.9	-46.2	171.5	-179.1	-93.2	0	0	0	110.9	R154 L157 E158 G159 A164 I165 A166	R154-F162 HydrophobicContact CB-CE2 4.36Å; L157-F162 HydrophobicContact CB-CB 4.06Å; L157-F162 HydrophobicContact CB-CD2 4.33Å; E158-F162 PolarHBondContact O-N 3.09Å; G159-F162 PolarHBondContact O-N 3.01Å; F162-A164 PolarHBondContact O-N 3.45Å; F162-I165 CarbonylContact O-C 3.58Å; F162-I165 WeakPolarHBondContact O-CG1 3.28Å; F162-I165 PolarHBondContact O-N 2.71Å; F162-A166 HydrophobicContact CD1-CB 4.44Å; F162-A166 HydrophobicContact CE1-CB 4.29Å; F162-A166 PolarHBondContact O-N 3.45Å
163	D	92	Very high	89.5	Confident	108 Å²	108	49.9 Å²	49.9	58%	0.578	32%	0.324	S	S	*	.	H	α-helix	trans	-59.5	-35.5	179.9	-64.7	-23.9	0	0	0	112	G159 I165 A166	G159-D163 PolarHBondContact O-N 3.35Å; D163-I165 PolarHBondContact O-N 3.44Å; D163-I165 VanDerWaalsContact O-N 3.14Å; D163-A166 PolarHBondContact O-N 2.86Å
164	A	91	Very high	89.5	Confident	16 Å²	16	51.8 Å²	51.8	13%	0.132	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.7	177.3	0	0	0	0	0	113.8	V160 F162 T181 F186	V160-A164 WeakPolarHBondContact O-CB 3.24Å; V160-A164 PolarHBondContact O-N 3.04Å; V160-A164 VanDerWaalsContact O-N 3.1Å; F162-A164 PolarHBondContact O-N 3.45Å; A164-T181 HydrophobicContact CB-CG2 4.46Å; A164-T181 WeakPolarHBondContact O-CG2 3.31Å; A164-F186 HydrophobicContact CB-CE2 4.05Å; A164-F186 HydrophobicContact CB-CZ 4.35Å
165	I	93	Very high	89.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	2.4	-179.6	64.9	149.8	0	0	0	113.2	F150 R154 L157 F162 D163 G167 Y168 A178 T181 L182	F150-I165 HydrophobicContact CE2-CD1 3.87Å; R154-I165 HydrophobicContact CG-CD1 3.82Å; L157-I165 HydrophobicContact CD1-CD1 3.33Å; L157-I165 HydrophobicContact CD1-CG1 3.93Å; F162-I165 CarbonylContact O-C 3.58Å; F162-I165 WeakPolarHBondContact O-CG1 3.28Å; F162-I165 PolarHBondContact O-N 2.71Å; D163-I165 PolarHBondContact O-N 3.44Å; D163-I165 VanDerWaalsContact O-N 3.14Å; I165-G167 PolarHBondContact O-N 3.03Å; I165-G167 VanDerWaalsContact O-N 3.17Å; I165-Y168 HydrophobicContact CB-CD2 3.93Å; I165-Y168 HydrophobicContact CB-CE2 4.46Å; I165-Y168 HydrophobicContact CG2-CD2 4.35Å; I165-Y168 HydrophobicContact CG2-CE2 4.44Å; I165-Y168 WeakPolarHBondContact O-CD2 3.46Å; I165-Y168 PolarHBondContact O-N 3.16Å; I165-A178 HydrophobicContact CB-CB 4.22Å; I165-A178 HydrophobicContact CG2-CB 3.94Å; I165-T181 HydrophobicContact CG2-CG2 4.49Å; I165-L182 HydrophobicContact CG2-CD1 4.27Å; I165-L182 HydrophobicContact CG2-CD2 4.04Å; I165-L182 HydrophobicContact CG2-CG 3.81Å
166	A	89.5	Confident	89.5	Confident	40 Å²	40	51.2 Å²	51.2	33%	0.331	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-34.5	-171.1	0	0	0	0	0	112.6	R154 F162 D163 Y168	R154-A166 PolarHBondContact NH1-O 2.88Å; F162-A166 HydrophobicContact CD1-CB 4.44Å; F162-A166 HydrophobicContact CE1-CB 4.29Å; F162-A166 PolarHBondContact O-N 3.45Å; D163-A166 PolarHBondContact O-N 2.86Å; A166-Y168 VanDerWaalsContact C-N 3.3Å; A166-Y168 PolarHBondContact O-N 2.89Å
167	G	88.2	Confident	89.4	Confident	82 Å²	82	52.8 Å²	52.8	85%	0.845	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-11.3	179.6	0	0	0	0	0	115.7	I165	I165-G167 PolarHBondContact O-N 3.03Å; I165-G167 VanDerWaalsContact O-N 3.17Å
168	Y	91.3	Very high	89.3	Confident	67 Å²	67	52.4 Å²	52.4	26%	0.263	35%	0.35	S	S	.	.	S	Bend	trans	-81.2	123.6	174.5	-67.1	-70.2	0	0	0	110.5	R154 I165 A166 N174 A177 A178 T181	R154-Y168 PolarHBondContact NH1-O 3.01Å; I165-Y168 HydrophobicContact CB-CD2 3.93Å; I165-Y168 HydrophobicContact CB-CE2 4.46Å; I165-Y168 HydrophobicContact CG2-CD2 4.35Å; I165-Y168 HydrophobicContact CG2-CE2 4.44Å; I165-Y168 WeakPolarHBondContact O-CD2 3.46Å; I165-Y168 PolarHBondContact O-N 3.16Å; A166-Y168 VanDerWaalsContact C-N 3.3Å; A166-Y168 PolarHBondContact O-N 2.89Å; Y168-N174 HydrophobicContact CD1-CB 4.29Å; Y168-A177 HydrophobicContact CD1-CB 4.29Å; Y168-A177 HydrophobicContact CE1-CB 3.63Å; Y168-A178 HydrophobicContact CD2-CB 3.94Å; Y168-A178 HydrophobicContact CE2-CB 4.32Å; Y168-A178 HydrophobicContact CG-CB 4.4Å; Y168-T181 PolarHBondContact OH-OG1 2.88Å
169	S	88.1	Confident	89.2	Confident	75 Å²	75	49.3 Å²	49.3	52%	0.524	34%	0.337	S	S	.	.			trans	-67.7	145.5	169.9	59.6	0	0	0	0	110.6	F150 T171 N174	F150-S169 WeakPolarHBondContact CE1-O 3.47Å; S169-T171 PolarHBondContact O-N 2.75Å; S169-N174 WeakPolarHBondContact O-CB 3.37Å; S169-N174 PolarHBondContact O-ND2 3.45Å; S169-N174 PolarHBondContact OG-ND2 2.98Å
170	V	85.4	Confident	89.1	Confident	61 Å²	61	49.9 Å²	49.9	37%	0.37	34%	0.337	S	S	.	.	S	Bend	trans	-73.4	87	-173.5	-174.5	0	0	0	0	110.9	V147 F150 V151	V147-V170 HydrophobicContact CG1-CG1 4.34Å; F150-V170 HydrophobicContact CB-CG1 4.35Å; F150-V170 HydrophobicContact CD1-CB 4.44Å; F150-V170 HydrophobicContact CD1-CG1 4.23Å; F150-V170 HydrophobicContact CG-CG1 4.49Å; V151-V170 HydrophobicContact CG2-CG1 3.51Å
171	T	83.8	Confident	89	Confident	53 Å²	53	48.1 Å²	48.1	33%	0.325	33%	0.327	S	S	.	.			trans	-133	156.7	177	69.9	0	0	0	0	110.3	F150 S169 A173 N174 Y175	F150-T171 WeakPolarHBondContact CD1-O 3.18Å; S169-T171 PolarHBondContact O-N 2.75Å; T171-A173 VanDerWaalsContact C-N 3.26Å; T171-A173 PolarHBondContact O-N 3.37Å; T171-N174 PolarHBondContact O-N 2.88Å; T171-N174 WeakPolarHBondContact OG1-CB 3.41Å; T171-N174 VanDerWaalsContact OG1-CG 3.22Å; T171-N174 PolarHBondContact OG1-N 2.9Å; T171-N174 PolarHBondContact OG1-ND2 2.77Å; T171-N174 VanDerWaalsContact OG1-ND2 3.14Å; T171-Y175 PolarHBondContact O-N 2.73Å
172	A	79.5	Confident	89	Confident	53 Å²	53	48.1 Å²	48.1	44%	0.438	33%	0.327	S	S	.	.	H	α-helix	trans	-62.6	-34.4	178	0	0	0	0	0	112.4	V147 Y175	V147-A172 HydrophobicContact CG2-CB 3.89Å; A172-Y175 WeakPolarHBondContact O-CB 3.18Å; A172-Y175 PolarHBondContact O-N 3.06Å
173	A	81.9	Confident	88.9	Confident	82 Å²	82	49.8 Å²	49.8	68%	0.678	33%	0.334	S	S	*	.	H	α-helix	trans	-65.9	-42.9	177.4	0	0	0	0	0	111.9	T171 Y175	T171-A173 VanDerWaalsContact C-N 3.26Å; T171-A173 PolarHBondContact O-N 3.37Å; A173-Y175 VanDerWaalsContact C-N 3.26Å; A173-Y175 PolarHBondContact O-N 2.9Å
174	N	88.9	Confident	88.6	Confident	41 Å²	41	48.5 Å²	48.5	22%	0.219	33%	0.333	C	S	.	.	H	α-helix	trans	-72.2	-18.5	-178.7	-71.6	-19.7	0	0	0	113.6	F150 Y168 S169 T171 A176 A177 A178	F150-N174 HydrophobicContact CD1-CB 4.45Å; F150-N174 HydrophobicContact CE1-CB 3.85Å; Y168-N174 HydrophobicContact CD1-CB 4.29Å; S169-N174 WeakPolarHBondContact O-CB 3.37Å; S169-N174 PolarHBondContact O-ND2 3.45Å; S169-N174 PolarHBondContact OG-ND2 2.98Å; T171-N174 PolarHBondContact O-N 2.88Å; T171-N174 WeakPolarHBondContact OG1-CB 3.41Å; T171-N174 VanDerWaalsContact OG1-CG 3.22Å; T171-N174 PolarHBondContact OG1-N 2.9Å; T171-N174 PolarHBondContact OG1-ND2 2.77Å; T171-N174 VanDerWaalsContact OG1-ND2 3.14Å; N174-A176 VanDerWaalsContact C-N 3.3Å; N174-A176 PolarHBondContact O-N 2.81Å; N174-A177 PolarHBondContact O-N 2.73Å; N174-A178 WeakPolarHBondContact O-CB 3.39Å; N174-A178 PolarHBondContact O-N 3.37Å
175	Y	89.2	Confident	88.6	Confident	47 Å²	47	53.2 Å²	53.2	18%	0.184	35%	0.348	C	S	.	.	H	α-helix	trans	-55.9	-45.3	177	175.6	-107.2	0	0	0	111.9	W138 K149 F150 L153 T171 A172 A173 A177 A178 V179	W138-Y175 AromaticContact CZ2-CE2 3.98Å; W138-Y175 HydrophobicContact CZ2-CE2 3.98Å; W138-Y175 PolarHBondContact NE1-OH 2.92Å; K149-Y175 HydrophobicContact CB-CD2 4.24Å; K149-Y175 HydrophobicContact CB-CE2 3.89Å; K149-Y175 HydrophobicContact CD-CE1 4.45Å; F150-Y175 HydrophobicContact CB-CD2 3.87Å; F150-Y175 HydrophobicContact CB-CG 4.42Å; F150-Y175 HydrophobicContact CD2-CD2 4.16Å; F150-Y175 HydrophobicContact CG-CD2 4.2Å; L153-Y175 HydrophobicContact CD2-CD2 4.29Å; L153-Y175 HydrophobicContact CD2-CE2 3.85Å; T171-Y175 PolarHBondContact O-N 2.73Å; A172-Y175 WeakPolarHBondContact O-CB 3.18Å; A172-Y175 PolarHBondContact O-N 3.06Å; A173-Y175 VanDerWaalsContact C-N 3.26Å; A173-Y175 PolarHBondContact O-N 2.9Å; Y175-A177 VanDerWaalsContact C-N 3.35Å; Y175-A177 PolarHBondContact O-N 3.2Å; Y175-A178 PolarHBondContact O-N 2.9Å; Y175-V179 HydrophobicContact CD1-CG2 4.35Å; Y175-V179 HydrophobicContact CD2-CG2 4.17Å; Y175-V179 HydrophobicContact CE1-CG2 3.9Å; Y175-V179 HydrophobicContact CE2-CG2 3.7Å; Y175-V179 HydrophobicContact CG-CG2 4.48Å; Y175-V179 WeakPolarHBondContact O-CB 3.48Å; Y175-V179 VanDerWaalsContact O-CG2 3.3Å; Y175-V179 WeakPolarHBondContact O-CG2 3.39Å; Y175-V179 PolarHBondContact O-N 3.2Å
176	A	86.9	Confident	88.6	Confident	66 Å²	66	53.7 Å²	53.7	55%	0.545	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-42.2	179.6	0	0	0	0	0	111.7	N174 V179 A180	N174-A176 VanDerWaalsContact C-N 3.3Å; N174-A176 PolarHBondContact O-N 2.81Å; A176-V179 PolarHBondContact O-N 3.44Å; A176-A180 WeakPolarHBondContact O-CB 3.34Å; A176-A180 PolarHBondContact O-N 3.03Å
177	A	89	Confident	88.5	Confident	38 Å²	38	52.8 Å²	52.8	31%	0.314	34%	0.344	S	S	.	.	H	α-helix	trans	-65.3	-43.3	176.4	0	0	0	0	0	112	Y168 N174 Y175 V179 A180 T181	Y168-A177 HydrophobicContact CD1-CB 4.29Å; Y168-A177 HydrophobicContact CE1-CB 3.63Å; N174-A177 PolarHBondContact O-N 2.73Å; Y175-A177 VanDerWaalsContact C-N 3.35Å; Y175-A177 PolarHBondContact O-N 3.2Å; A177-V179 PolarHBondContact O-N 3.41Å; A177-A180 PolarHBondContact O-N 3.06Å; A177-T181 PolarHBondContact O-N 3.41Å; A177-T181 PolarHBondContact O-OG1 3.36Å; A177-T181 VanDerWaalsContact O-OG1 3.07Å
178	A	90.8	Very high	88.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-62.5	-42.7	176.7	0	0	0	0	0	112.1	F150 I165 Y168 N174 Y175 T181 L182	F150-A178 HydrophobicContact CD2-CB 4.37Å; F150-A178 HydrophobicContact CE2-CB 3.45Å; F150-A178 VanDerWaalsContact CE2-CB 3.45Å; F150-A178 HydrophobicContact CZ-CB 3.57Å; I165-A178 HydrophobicContact CB-CB 4.22Å; I165-A178 HydrophobicContact CG2-CB 3.94Å; Y168-A178 HydrophobicContact CD2-CB 3.94Å; Y168-A178 HydrophobicContact CE2-CB 4.32Å; Y168-A178 HydrophobicContact CG-CB 4.4Å; N174-A178 WeakPolarHBondContact O-CB 3.39Å; N174-A178 PolarHBondContact O-N 3.37Å; Y175-A178 PolarHBondContact O-N 2.9Å; A178-T181 PolarHBondContact O-N 3.29Å; A178-L182 WeakPolarHBondContact O-CG 3.27Å; A178-L182 PolarHBondContact O-N 3.47Å
179	V	90.7	Very high	88.2	Confident	22 Å²	22	54.3 Å²	54.3	13%	0.133	33%	0.334	C	S	.	.	H	α-helix	trans	-61.2	-45.4	174.3	162.1	0	0	0	0	111.3	W135 L153 Y175 A176 A177 T181 L182 K183	W135-V179 HydrophobicContact CH2-CB 4.15Å; W135-V179 HydrophobicContact CH2-CG1 3.6Å; W135-V179 HydrophobicContact CH2-CG2 4.02Å; W135-V179 HydrophobicContact CZ2-CG1 3.69Å; L153-V179 HydrophobicContact CD2-CG2 4.2Å; Y175-V179 HydrophobicContact CD1-CG2 4.35Å; Y175-V179 HydrophobicContact CD2-CG2 4.17Å; Y175-V179 HydrophobicContact CE1-CG2 3.9Å; Y175-V179 HydrophobicContact CE2-CG2 3.7Å; Y175-V179 HydrophobicContact CG-CG2 4.48Å; Y175-V179 WeakPolarHBondContact O-CB 3.48Å; Y175-V179 VanDerWaalsContact O-CG2 3.3Å; Y175-V179 WeakPolarHBondContact O-CG2 3.39Å; Y175-V179 PolarHBondContact O-N 3.2Å; A176-V179 PolarHBondContact O-N 3.44Å; A177-V179 PolarHBondContact O-N 3.41Å; V179-T181 VanDerWaalsContact C-N 3.32Å; V179-T181 PolarHBondContact O-N 3.31Å; V179-L182 PolarHBondContact O-N 3.11Å; V179-K183 HydrophobicContact CG1-CD 4.46Å; V179-K183 PolarHBondContact O-N 3.28Å
180	A	90.2	Very high	88	Confident	56 Å²	56	54 Å²	54	46%	0.463	33%	0.325	S	S	.	.	H	α-helix	trans	-60.5	-42.4	176.8	0	0	0	0	0	111.4	A176 A177 K183 S184	A176-A180 WeakPolarHBondContact O-CB 3.34Å; A176-A180 PolarHBondContact O-N 3.03Å; A177-A180 PolarHBondContact O-N 3.06Å; A180-K183 PolarHBondContact O-N 2.7Å; A180-S184 WeakPolarHBondContact O-CB 3.47Å; A180-S184 PolarHBondContact O-N 3.45Å
181	T	92.6	Very high	88.1	Confident	38 Å²	38	53.4 Å²	53.4	23%	0.233	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-42.7	176.4	-63.9	0	0	0	0	112.3	A164 I165 Y168 A177 A178 V179 R185	A164-T181 HydrophobicContact CB-CG2 4.46Å; A164-T181 WeakPolarHBondContact O-CG2 3.31Å; I165-T181 HydrophobicContact CG2-CG2 4.49Å; Y168-T181 PolarHBondContact OH-OG1 2.88Å; A177-T181 PolarHBondContact O-N 3.41Å; A177-T181 PolarHBondContact O-OG1 3.36Å; A177-T181 VanDerWaalsContact O-OG1 3.07Å; A178-T181 PolarHBondContact O-N 3.29Å; V179-T181 VanDerWaalsContact C-N 3.32Å; V179-T181 PolarHBondContact O-N 3.31Å; T181-R185 WeakPolarHBondContact O-CB 3.32Å; T181-R185 PolarHBondContact O-N 3.03Å
182	L	93.2	Very high	88.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-47.2	176.6	-71.1	168.7	0	0	0	112.2	W135 L153 L157 A161 I165 A178 V179 R185 F186	W135-L182 HydrophobicContact CZ3-CB 4.23Å; W135-L182 HydrophobicContact CZ3-CD1 4.29Å; L153-L182 HydrophobicContact CD1-CD1 4.26Å; L153-L182 HydrophobicContact CD2-CD1 3.94Å; L153-L182 HydrophobicContact CG-CD1 4.37Å; L157-L182 HydrophobicContact CD1-CD1 3.83Å; L157-L182 HydrophobicContact CD1-CD2 4.27Å; L157-L182 HydrophobicContact CD2-CD1 4.34Å; L157-L182 HydrophobicContact CD2-CD2 4.22Å; A161-L182 HydrophobicContact CB-CD2 4.46Å; I165-L182 HydrophobicContact CG2-CD1 4.27Å; I165-L182 HydrophobicContact CG2-CD2 4.04Å; I165-L182 HydrophobicContact CG2-CG 3.81Å; A178-L182 WeakPolarHBondContact O-CG 3.27Å; A178-L182 PolarHBondContact O-N 3.47Å; V179-L182 PolarHBondContact O-N 3.11Å; L182-R185 PolarHBondContact O-N 3.37Å; L182-F186 HydrophobicContact CD2-CD2 4.05Å; L182-F186 HydrophobicContact CD2-CE2 3.95Å; L182-F186 WeakPolarHBondContact O-CD2 3.39Å; L182-F186 PolarHBondContact O-N 3.47Å
183	K	90.9	Very high	89	Confident	100 Å²	100	49.1 Å²	49.1	44%	0.435	29%	0.29	S	S	.	.	H	α-helix	trans	-62.2	-45.6	177.4	-75.2	-170.9	175.7	-168.6	0	111.8	F131 W135 V179 A180 R185 G187	F131-K183 HydrophobicContact CZ-CG 4.24Å; W135-K183 HydrophobicContact CH2-CG 4.2Å; W135-K183 HydrophobicContact CZ2-CD 4.18Å; W135-K183 HydrophobicContact CZ2-CG 4.02Å; V179-K183 HydrophobicContact CG1-CD 4.46Å; V179-K183 PolarHBondContact O-N 3.28Å; A180-K183 PolarHBondContact O-N 2.7Å; K183-R185 VanDerWaalsContact C-N 3.34Å; K183-R185 PolarHBondContact O-N 3.42Å; K183-G187 CarbonylContact O-C 3.59Å; K183-G187 WeakPolarHBondContact O-CA 3.22Å; K183-G187 PolarHBondContact O-N 3.47Å
184	S	87.5	Confident	89.4	Confident	81 Å²	81	46.6 Å²	46.6	57%	0.566	26%	0.264	S	S	*	.	H	α-helix	trans	-62	-42.4	177.7	176.8	0	0	0	0	111.5	A180 R188	A180-S184 WeakPolarHBondContact O-CB 3.47Å; A180-S184 PolarHBondContact O-N 3.45Å; S184-R188 WeakPolarHBondContact O-CD 3.32Å; S184-R188 WeakPolarHBondContact O-CG 3.3Å; S184-R188 PolarHBondContact O-NE 3.42Å
185	R	89.5	Confident	89.5	Confident	115 Å²	115	49.6 Å²	49.6	43%	0.434	28%	0.275	S	S	.	.	H	α-helix	trans	-77.1	-44.4	-175.3	-167.3	167.1	-179.8	167	-2	113.3	T181 L182 K183 R188	T181-R185 WeakPolarHBondContact O-CB 3.32Å; T181-R185 PolarHBondContact O-N 3.03Å; L182-R185 PolarHBondContact O-N 3.37Å; K183-R185 VanDerWaalsContact C-N 3.34Å; K183-R185 PolarHBondContact O-N 3.42Å; R185-R188 PolarHBondContact O-NH2 3.4Å
186	F	92.7	Very high	89.8	Confident	11 Å²	11	47.6 Å²	47.6	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-118.7	-25	-169	-52	-73	0	0	0	114.3	F124 G126 F131 V160 A161 A164 L182 R188	F124-F186 HydrophobicContact CE1-CB 4.31Å; F124-F186 HydrophobicContact CE1-CD2 4.02Å; F124-F186 HydrophobicContact CE1-CG 4.07Å; F124-F186 HydrophobicContact CZ-CB 4Å; F124-F186 HydrophobicContact CZ-CD1 4.44Å; F124-F186 HydrophobicContact CZ-CD2 4.48Å; F124-F186 HydrophobicContact CZ-CG 4.07Å; G126-F186 WeakPolarHBondContact O-CD1 3.44Å; F131-F186 HydrophobicContact CD2-CB 3.54Å; F131-F186 HydrophobicContact CE2-CB 3.92Å; F131-F186 HydrophobicContact CG-CB 4.19Å; V160-F186 HydrophobicContact CG2-CE1 4.12Å; V160-F186 HydrophobicContact CG2-CZ 4.26Å; A161-F186 HydrophobicContact CB-CE2 4Å; A161-F186 HydrophobicContact CB-CZ 4.13Å; A164-F186 HydrophobicContact CB-CE2 4.05Å; A164-F186 HydrophobicContact CB-CZ 4.35Å; L182-F186 HydrophobicContact CD2-CD2 4.05Å; L182-F186 HydrophobicContact CD2-CE2 3.95Å; L182-F186 WeakPolarHBondContact O-CD2 3.39Å; L182-F186 PolarHBondContact O-N 3.47Å; F186-R188 PolarHBondContact O-N 3.27Å
187	G	89.2	Confident	90.1	Very high	20 Å²	20	44.9 Å²	44.9	21%	0.206	24%	0.244	C	C	.	.			trans	-93.6	34	-174	0	0	0	0	0	115.4	K183 P189	K183-G187 CarbonylContact O-C 3.59Å; K183-G187 WeakPolarHBondContact O-CA 3.22Å; K183-G187 PolarHBondContact O-N 3.47Å; G187-P189 WeakPolarHBondContact O-CD 3.42Å
188	R	87.1	Confident	90.3	Very high	104 Å²	104	43.8 Å²	43.8	39%	0.392	23%	0.232	S	C	.	.			trans	-87.4	107	-178.9	-78.3	-179.6	-95.8	178	-4.3	110.4	S184 R185 F186 I190 L191 I192	S184-R188 WeakPolarHBondContact O-CD 3.32Å; S184-R188 WeakPolarHBondContact O-CG 3.3Å; S184-R188 PolarHBondContact O-NE 3.42Å; R185-R188 PolarHBondContact O-NH2 3.4Å; F186-R188 PolarHBondContact O-N 3.27Å; R188-I190 VanDerWaalsContact C-N 3.29Å; R188-I190 PolarHBondContact O-N 2.9Å; R188-I190 VanDerWaalsContact O-N 3.13Å; R188-L191 HydrophobicContact CB-CB 3.98Å; R188-L191 WeakPolarHBondContact O-CB 3.38Å; R188-L191 PolarHBondContact O-N 3.23Å; R188-I192 WeakPolarHBondContact O-CG1 3.48Å; R188-I192 PolarHBondContact O-N 3.28Å
189	P	85.1	Confident	90.4	Very high	78 Å²	78	47.1 Å²	47.1	51%	0.506	25%	0.248	S	C	.	.	H	α-helix	trans	-53.3	-41	-169.4	-28.6	36.2	0	0	0	114.5	G187 I192 A193 L231	G187-P189 WeakPolarHBondContact O-CD 3.42Å; P189-I192 PolarHBondContact O-N 2.93Å; P189-A193 WeakPolarHBondContact O-CB 3.35Å; P189-A193 PolarHBondContact O-N 3.47Å; P189-L231 HydrophobicContact CB-CD2 4.48Å
190	I	84.6	Confident	90.5	Very high	67 Å²	67	48.2 Å²	48.2	34%	0.344	25%	0.253	S	S	.	.	H	α-helix	trans	-60.1	-48.5	176.1	-64.6	178.3	0	0	0	111	R188 I192 A193 E194 Q271	R188-I190 VanDerWaalsContact C-N 3.29Å; R188-I190 PolarHBondContact O-N 2.9Å; R188-I190 VanDerWaalsContact O-N 3.13Å; I190-I192 VanDerWaalsContact C-N 3.28Å; I190-I192 PolarHBondContact O-N 3.49Å; I190-A193 PolarHBondContact O-N 3.29Å; I190-E194 HydrophobicContact CG2-CG 4.15Å; I190-E194 WeakPolarHBondContact O-CB 3.44Å; I190-E194 VanDerWaalsContact O-CG 3.23Å; I190-E194 WeakPolarHBondContact O-CG 3.36Å; I190-E194 PolarHBondContact O-N 2.87Å; I190-Q271 HydrophobicContact CD1-CB 4.14Å; I190-Q271 VanDerWaalsContact CD1-CD 3.44Å; I190-Q271 HydrophobicContact CD1-CG 3.57Å; I190-Q271 VanDerWaalsContact CD1-NE2 3.3Å
191	L	87	Confident	90.5	Very high	50 Å²	50	51.1 Å²	51.1	26%	0.262	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-37.7	179.1	-177	67.4	0	0	0	111.6	V128 R188 K195	V128-L191 HydrophobicContact CG1-CD2 4.32Å; V128-L191 HydrophobicContact CG1-CG 4.21Å; V128-L191 HydrophobicContact CG2-CD2 4.06Å; R188-L191 HydrophobicContact CB-CB 3.98Å; R188-L191 WeakPolarHBondContact O-CB 3.38Å; R188-L191 PolarHBondContact O-N 3.23Å; L191-K195 WeakPolarHBondContact O-CB 3.43Å; L191-K195 WeakPolarHBondContact O-CG 3.47Å; L191-K195 PolarHBondContact O-N 3.17Å
192	I	90.9	Very high	90.3	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-48.9	175.7	-44.9	-164	0	0	0	110	V128 F131 R188 P189 I190 K195 H196 L231	V128-I192 HydrophobicContact CG1-CB 4.1Å; V128-I192 HydrophobicContact CG1-CD1 4.44Å; V128-I192 HydrophobicContact CG1-CG1 3.6Å; V128-I192 HydrophobicContact CG1-CG2 4.44Å; F131-I192 HydrophobicContact CB-CD1 4.43Å; F131-I192 HydrophobicContact CD1-CD1 4.23Å; R188-I192 WeakPolarHBondContact O-CG1 3.48Å; R188-I192 PolarHBondContact O-N 3.28Å; P189-I192 PolarHBondContact O-N 2.93Å; I190-I192 VanDerWaalsContact C-N 3.28Å; I190-I192 PolarHBondContact O-N 3.49Å; I192-K195 PolarHBondContact O-N 3.01Å; I192-H196 PolarHBondContact O-CD2 3.32Å; I192-H196 PolarHBondContact O-N 3.27Å; I192-L231 HydrophobicContact CB-CD1 4.02Å; I192-L231 HydrophobicContact CG2-CD1 3.9Å
193	A	90.2	Very high	90.2	Very high	12 Å²	12	57.6 Å²	57.6	10%	0.099	29%	0.289	C	S	.	.	H	α-helix	trans	-60.1	-49	178.8	0	0	0	0	0	111.5	P189 I190 K195 H196 I197 L228 L231	P189-A193 WeakPolarHBondContact O-CB 3.35Å; P189-A193 PolarHBondContact O-N 3.47Å; I190-A193 PolarHBondContact O-N 3.29Å; A193-K195 VanDerWaalsContact C-N 3.29Å; A193-K195 PolarHBondContact O-N 2.82Å; A193-H196 PolarHBondContact O-N 3.11Å; A193-H196 VanDerWaalsContact O-N 3.14Å; A193-I197 VanDerWaalsContact O-CG1 3.29Å; A193-I197 WeakPolarHBondContact O-CG1 3.26Å; A193-I197 PolarHBondContact O-N 2.74Å; A193-L228 HydrophobicContact CB-CD2 4.05Å; A193-L231 HydrophobicContact CB-CD1 4.1Å
194	E	90.6	Very high	89.9	Confident	29 Å²	29	61.2 Å²	61.2	14%	0.136	31%	0.307	C	S	.	.	H	α-helix	trans	-57.2	-41.1	176.2	-73.9	178.2	149.7	0	0	112.4	I190 I197 L198 A248 K251	I190-E194 HydrophobicContact CG2-CG 4.15Å; I190-E194 WeakPolarHBondContact O-CB 3.44Å; I190-E194 VanDerWaalsContact O-CG 3.23Å; I190-E194 WeakPolarHBondContact O-CG 3.36Å; I190-E194 PolarHBondContact O-N 2.87Å; E194-I197 PolarHBondContact O-N 3.19Å; E194-L198 WeakPolarHBondContact O-CB 3.45Å; E194-L198 WeakPolarHBondContact O-CD1 3.44Å; E194-L198 WeakPolarHBondContact O-CG 3.33Å; E194-L198 PolarHBondContact O-N 3.2Å; E194-A248 HydrophobicContact CB-CB 4.37Å; E194-A248 HydrophobicContact CG-CB 4.17Å; E194-K251 VanDerWaalsContact OE1-CE 3.27Å; E194-K251 WeakPolarHBondContact OE1-CE 3.3Å; E194-K251 IonicContact OE1-NZ 2.68Å; E194-K251 PolarHBondContact OE1-NZ 3.37Å; E194-K251 WeakPolarHBondContact OE2-CE 3.48Å; E194-K251 IonicContact OE2-NZ 3.45Å; E194-K251 PolarHBondContact OE2-NZ 3.04Å
195	K	92.3	Very high	89.8	Confident	103 Å²	103	65.5 Å²	65.5	45%	0.448	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-42.1	176.8	-84.3	-74.4	-173.1	172.5	0	112	L129 L191 I192 A193 L198 E199	L129-K195 HydrophobicContact CD2-CB 3.76Å; L129-K195 HydrophobicContact CG-CB 4.3Å; L191-K195 WeakPolarHBondContact O-CB 3.43Å; L191-K195 WeakPolarHBondContact O-CG 3.47Å; L191-K195 PolarHBondContact O-N 3.17Å; I192-K195 PolarHBondContact O-N 3.01Å; A193-K195 VanDerWaalsContact C-N 3.29Å; A193-K195 PolarHBondContact O-N 2.82Å; K195-L198 PolarHBondContact O-N 3.49Å; K195-E199 WeakPolarHBondContact O-CB 3.41Å; K195-E199 PolarHBondContact O-N 3.37Å
196	H	94.5	Very high	89.5	Confident	5 Å²	5	62 Å²	62	2%	0.023	31%	0.308	C	S	.	.	H	α-helix	trans	-65.5	-40.3	174.1	-76.3	-62.8	0	0	0	112.6	L129 I192 A193 E199 L200 N224 A227 L228	L129-H196 WeakPolarHBondContact CD2-CE1 3.32Å; L129-H196 WeakPolarHBondContact CD2-ND1 3.47Å; I192-H196 PolarHBondContact O-CD2 3.32Å; I192-H196 PolarHBondContact O-N 3.27Å; A193-H196 PolarHBondContact O-N 3.11Å; A193-H196 VanDerWaalsContact O-N 3.14Å; H196-E199 PolarHBondContact O-N 2.72Å; H196-L200 WeakPolarHBondContact O-CG 3.4Å; H196-L200 PolarHBondContact O-N 3.09Å; H196-N224 HydrophobicContact CB-CB 4.45Å; H196-N224 PolarHBondContact ND1-OD1 3.37Å; H196-A227 WeakPolarHBondContact CE1-CB 3.18Å; H196-A227 WeakPolarHBondContact NE2-CB 3.43Å; H196-L228 HydrophobicContact CB-CD1 4.22Å; H196-L228 HydrophobicContact CB-CD2 3.88Å; H196-L228 HydrophobicContact CB-CG 3.77Å
197	I	93.6	Very high	89.1	Confident	10 Å²	10	67.4 Å²	67.4	5%	0.051	34%	0.338	C	S	.	.	H	α-helix	trans	-59.9	-48	174.6	-68.6	164.1	0	0	0	109.8	A193 E194 E199 L200 M201 L228 L240 V245 A248	A193-I197 VanDerWaalsContact O-CG1 3.29Å; A193-I197 WeakPolarHBondContact O-CG1 3.26Å; A193-I197 PolarHBondContact O-N 2.74Å; E194-I197 PolarHBondContact O-N 3.19Å; I197-E199 PolarHBondContact O-N 3.47Å; I197-L200 WeakPolarHBondContact O-CB 3.42Å; I197-L200 PolarHBondContact O-N 3.41Å; I197-M201 HydrophobicContact CG2-CG 4.37Å; I197-M201 VanDerWaalsContact O-CG 3.29Å; I197-M201 WeakPolarHBondContact O-CG 3.49Å; I197-M201 PolarHBondContact O-N 3.35Å; I197-L228 HydrophobicContact CG1-CD1 4.27Å; I197-L228 HydrophobicContact CG1-CD2 4.11Å; I197-L240 HydrophobicContact CD1-CD1 3.85Å; I197-L240 HydrophobicContact CG1-CD2 4.45Å; I197-V245 HydrophobicContact CG2-CB 4.47Å; I197-V245 HydrophobicContact CG2-CG1 4.1Å; I197-V245 HydrophobicContact CG2-CG2 4.49Å; I197-A248 HydrophobicContact CB-CB 4.3Å; I197-A248 HydrophobicContact CD1-CB 4.41Å; I197-A248 HydrophobicContact CG2-CB 3.85Å
198	L	93.2	Very high	88.8	Confident	14 Å²	14	73.3 Å²	73.3	7%	0.073	35%	0.354	C	S	.	.	H	α-helix	trans	-64.3	-39.6	179.7	-72.6	166	0	0	0	112.7	E194 K195 L200 M201 Q202 Q252	E194-L198 WeakPolarHBondContact O-CB 3.45Å; E194-L198 WeakPolarHBondContact O-CD1 3.44Å; E194-L198 WeakPolarHBondContact O-CG 3.33Å; E194-L198 PolarHBondContact O-N 3.2Å; K195-L198 PolarHBondContact O-N 3.49Å; L198-L200 VanDerWaalsContact C-N 3.32Å; L198-L200 PolarHBondContact O-N 3.41Å; L198-M201 PolarHBondContact O-N 3.29Å; L198-Q202 VanDerWaalsContact O-CB 3.28Å; L198-Q202 WeakPolarHBondContact O-CB 3.32Å; L198-Q202 VanDerWaalsContact O-CG 3.25Å; L198-Q202 WeakPolarHBondContact O-CG 3.32Å; L198-Q202 PolarHBondContact O-N 2.77Å; L198-Q252 HydrophobicContact CD1-CG 4.34Å; L198-Q252 HydrophobicContact CD2-CG 3.57Å
199	E	92.9	Very high	88.6	Confident	71 Å²	71	74.2 Å²	74.2	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-61.5	-41.1	175.2	-168.5	84.8	163.8	0	0	111.3	K195 H196 I197 Q202 T203 R223 N224	K195-E199 WeakPolarHBondContact O-CB 3.41Å; K195-E199 PolarHBondContact O-N 3.37Å; H196-E199 PolarHBondContact O-N 2.72Å; I197-E199 PolarHBondContact O-N 3.47Å; E199-Q202 PolarHBondContact O-N 3.47Å; E199-T203 PolarHBondContact O-N 2.95Å; E199-T203 VanDerWaalsContact O-N 3.09Å; E199-T203 PolarHBondContact O-OG1 3.13Å; E199-R223 IonicContact OE1-NH2 3.73Å; E199-R223 PolarHBondContact OE1-NH2 3.5Å; E199-N224 WeakPolarHBondContact CG-ND2 3.36Å
200	L	91.9	Very high	88.6	Confident	45 Å²	45	76.4 Å²	76.4	24%	0.236	37%	0.371	C	S	.	.	H	α-helix	trans	-63.8	-45.9	173.3	-75.7	168.9	0	0	0	111.6	H196 I197 L198 Q202 T203 V221 N224 V225 L228	H196-L200 WeakPolarHBondContact O-CG 3.4Å; H196-L200 PolarHBondContact O-N 3.09Å; I197-L200 WeakPolarHBondContact O-CB 3.42Å; I197-L200 PolarHBondContact O-N 3.41Å; L198-L200 VanDerWaalsContact C-N 3.32Å; L198-L200 PolarHBondContact O-N 3.41Å; L200-Q202 VanDerWaalsContact C-N 3.27Å; L200-Q202 PolarHBondContact O-N 3.47Å; L200-T203 WeakPolarHBondContact O-CB 3.47Å; L200-T203 PolarHBondContact O-N 2.97Å; L200-T203 PolarHBondContact O-OG1 2.89Å; L200-T203 VanDerWaalsContact O-OG1 3.14Å; L200-V221 HydrophobicContact CD2-CB 4.43Å; L200-V221 HydrophobicContact CD2-CG1 4.25Å; L200-V221 HydrophobicContact CD2-CG2 4.48Å; L200-N224 HydrophobicContact CD1-CB 3.93Å; L200-N224 HydrophobicContact CD2-CB 3.76Å; L200-N224 HydrophobicContact CG-CB 3.57Å; L200-V225 HydrophobicContact CD1-CG2 4.32Å; L200-V225 HydrophobicContact CD2-CG2 4.41Å; L200-L228 HydrophobicContact CD1-CD1 3.7Å
201	M	90.4	Very high	88.7	Confident	117 Å²	117	76.4 Å²	76.4	58%	0.576	38%	0.382	S	S	*	.	H	α-helix	trans	-68.6	-24.5	-179.8	-67.1	-56.3	-63.2	0	0	113.5	I197 L198 V249	I197-M201 HydrophobicContact CG2-CG 4.37Å; I197-M201 VanDerWaalsContact O-CG 3.29Å; I197-M201 WeakPolarHBondContact O-CG 3.49Å; I197-M201 PolarHBondContact O-N 3.35Å; L198-M201 PolarHBondContact O-N 3.29Å; M201-V249 HydrophobicContact CB-CG2 4.49Å; M201-V249 HydrophobicContact CE-CG2 4.41Å; M201-V249 HydrophobicContact CG-CG2 3.9Å
202	Q	89.8	Confident	88.6	Confident	132 Å²	132	82.9 Å²	82.9	62%	0.617	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	7.8	179.2	-64.8	174.5	23.1	0	0	112.8	L198 E199 L200 E204	L198-Q202 VanDerWaalsContact O-CB 3.28Å; L198-Q202 WeakPolarHBondContact O-CB 3.32Å; L198-Q202 VanDerWaalsContact O-CG 3.25Å; L198-Q202 WeakPolarHBondContact O-CG 3.32Å; L198-Q202 PolarHBondContact O-N 2.77Å; E199-Q202 PolarHBondContact O-N 3.47Å; L200-Q202 VanDerWaalsContact C-N 3.27Å; L200-Q202 PolarHBondContact O-N 3.47Å; Q202-E204 PolarHBondContact O-N 3.13Å
203	T	89.5	Confident	88.4	Confident	42 Å²	42	84.8 Å²	84.8	26%	0.258	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-59.4	127.9	179.2	-66.5	0	0	0	0	110.5	E199 L200 L217 T220	E199-T203 PolarHBondContact O-N 2.95Å; E199-T203 VanDerWaalsContact O-N 3.09Å; E199-T203 PolarHBondContact O-OG1 3.13Å; L200-T203 WeakPolarHBondContact O-CB 3.47Å; L200-T203 PolarHBondContact O-N 2.97Å; L200-T203 PolarHBondContact O-OG1 2.89Å; L200-T203 VanDerWaalsContact O-OG1 3.14Å; T203-L217 HydrophobicContact CG2-CD1 3.39Å; T203-T220 HydrophobicContact CG2-CG2 4.45Å
204	E	85	Confident	88.3	Confident	175 Å²	175	88.1 Å²	88.1	82%	0.818	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-64.2	144.2	-176.5	-69.5	-172.4	171.8	0	0	112.6	Q202 C206	Q202-E204 PolarHBondContact O-N 3.13Å; E204-C206 PolarHBondContact O-N 3.33Å
205	K	85.2	Confident	88.1	Confident	171 Å²	171	95.7 Å²	95.7	74%	0.743	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-65.5	121.6	175.9	-176.2	177.5	177.9	175.9	0	110.7	N207	K205-N207 PolarHBondContact O-N 3.06Å; K205-N207 PolarHBondContact O-ND2 2.74Å
206	C	84.3	Confident	87.9	Confident	42 Å²	42	95.8 Å²	95.8	28%	0.284	46%	0.456	S	S	.	.			trans	-70.7	96.2	171.8	-171.9	0	0	0	0	110.4	E204 R208 L217	E204-C206 PolarHBondContact O-N 3.33Å; C206-R208 VanDerWaalsContact C-N 3.34Å; C206-R208 PolarHBondContact SG-O 2.96Å; C206-R208 VanDerWaalsContact SG-O 3.37Å; C206-L217 HydrophobicContact CB-CD2 3.81Å
207	N	84.5	Confident	87.7	Confident	125 Å²	125	98.2 Å²	98.2	67%	0.668	47%	0.469	S	S	*	.			trans	-81.5	-11.4	-176.1	-67.4	-48.3	0	0	0	113.9	K205	K205-N207 PolarHBondContact O-N 3.06Å; K205-N207 PolarHBondContact O-ND2 2.74Å
208	R	81.1	Confident	87.7	Confident	143 Å²	143	102.8 Å²	102.8	54%	0.54	49%	0.49	S	S	.	.	S	Bend	trans	-129.8	120.4	-174	-64.8	-176.5	-178.2	168	1.8	109.8	C206 R210 E213	C206-R208 VanDerWaalsContact C-N 3.34Å; C206-R208 PolarHBondContact SG-O 2.96Å; C206-R208 VanDerWaalsContact SG-O 3.37Å; R208-R210 HydrophobicContact CB-CG 4.46Å; R208-R210 PolarHBondContact O-N 3.15Å; R208-E213 HydrophobicContact CB-CG 4.37Å
209	P	84.7	Confident	87.6	Confident	123 Å²	123	106.8 Å²	106.8	80%	0.799	51%	0.512	S	S	*	.			trans	-80.6	49.2	-177.6	35.4	-37.6	0	0	0	111.6
210	R	85.3	Confident	87.5	Confident	124 Å²	124	105.5 Å²	105.5	47%	0.468	51%	0.509	S	S	.	.			trans	-98.5	148	175.4	-61	-179	-174.5	161.2	-11.9	108.7	R208 R212 E213 L214	R208-R210 HydrophobicContact CB-CG 4.46Å; R208-R210 PolarHBondContact O-N 3.15Å; R210-R212 PolarHBondContact O-N 3.14Å; R210-R212 VanDerWaalsContact O-N 3.16Å; R210-E213 WeakPolarHBondContact CB-OE2 3.4Å; R210-E213 WeakPolarHBondContact CD-OE1 3.27Å; R210-E213 IonicContact NH1-OE1 3.96Å; R210-E213 PolarHBondContact NH1-OE1 2.93Å; R210-E213 PolarHBondContact O-N 3.02Å; R210-L214 WeakPolarHBondContact O-CG 3.15Å; R210-L214 PolarHBondContact O-N 3.45Å
211	A	85.5	Confident	87.5	Confident	68 Å²	68	106 Å²	106	56%	0.562	51%	0.514	S	S	*	.	H	α-helix	trans	-53.8	-39.3	-176	0	0	0	0	0	113.3	W215	A211-W215 VanDerWaalsContact O-CB 3.24Å; A211-W215 WeakPolarHBondContact O-CB 3.48Å; A211-W215 VanDerWaalsContact O-CG 3.26Å; A211-W215 PolarHBondContact O-N 3.41Å
212	R	84.7	Confident	87.6	Confident	185 Å²	185	101.8 Å²	101.8	70%	0.698	49%	0.494	S	S	*	.	H	α-helix	trans	-65.7	-50	179.6	-175.6	-179.4	179.5	177.5	2.4	112.3	R210 L214 W215 Q216	R210-R212 PolarHBondContact O-N 3.14Å; R210-R212 VanDerWaalsContact O-N 3.16Å; R212-L214 VanDerWaalsContact C-N 3.34Å; R212-W215 PolarHBondContact O-N 2.99Å; R212-Q216 WeakPolarHBondContact O-CG 3.44Å; R212-Q216 PolarHBondContact O-N 3.42Å
213	E	86.6	Confident	87.7	Confident	44 Å²	44	100.4 Å²	100.4	21%	0.206	48%	0.483	C	S	.	.	H	α-helix	trans	-63.9	-38.3	177.7	-70.4	91.3	141.4	0	0	111.8	R208 R210 Q216 L217	R208-E213 HydrophobicContact CB-CG 4.37Å; R210-E213 WeakPolarHBondContact CB-OE2 3.4Å; R210-E213 WeakPolarHBondContact CD-OE1 3.27Å; R210-E213 IonicContact NH1-OE1 3.96Å; R210-E213 PolarHBondContact NH1-OE1 2.93Å; R210-E213 PolarHBondContact O-N 3.02Å; E213-Q216 PolarHBondContact O-N 3.09Å; E213-L217 PolarHBondContact O-N 3.37Å; E213-L217 VanDerWaalsContact O-N 3.12Å
214	L	88.3	Confident	87.8	Confident	83 Å²	83	98.4 Å²	98.4	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-67.9	-38.5	174.2	-70.2	172.6	0	0	0	112.3	R210 R212 L217 H218	R210-L214 WeakPolarHBondContact O-CG 3.15Å; R210-L214 PolarHBondContact O-N 3.45Å; R212-L214 VanDerWaalsContact C-N 3.34Å; L214-L217 PolarHBondContact O-N 3.32Å; L214-H218 WeakPolarHBondContact O-CB 3.44Å; L214-H218 PolarHBondContact O-N 2.99Å
215	W	86.4	Confident	88.2	Confident	188 Å²	188	92.2 Å²	92.2	71%	0.712	45%	0.445	S	S	*	.	H	α-helix	trans	-64.1	-43	173.9	-84.5	13.1	0	0	0	112.2	A211 R212 L217 H218 D219	A211-W215 VanDerWaalsContact O-CB 3.24Å; A211-W215 WeakPolarHBondContact O-CB 3.48Å; A211-W215 VanDerWaalsContact O-CG 3.26Å; A211-W215 PolarHBondContact O-N 3.41Å; R212-W215 PolarHBondContact O-N 2.99Å; W215-L217 VanDerWaalsContact C-N 3.34Å; W215-L217 PolarHBondContact O-N 3.23Å; W215-H218 PolarHBondContact O-N 3.01Å; W215-D219 WeakPolarHBondContact O-CB 3.24Å; W215-D219 PolarHBondContact O-N 3.29Å
216	Q	88.5	Confident	88.4	Confident	104 Å²	104	92.1 Å²	92.1	49%	0.486	44%	0.44	S	S	.	.	H	α-helix	trans	-62.4	-41.6	176.7	-74.6	176.5	-27	0	0	112.1	R212 E213 T220	R212-Q216 WeakPolarHBondContact O-CG 3.44Å; R212-Q216 PolarHBondContact O-N 3.42Å; E213-Q216 PolarHBondContact O-N 3.09Å; Q216-T220 WeakPolarHBondContact O-CB 3.45Å; Q216-T220 PolarHBondContact O-N 3.26Å; Q216-T220 PolarHBondContact O-OG1 3.01Å
217	L	91.2	Very high	88.7	Confident	56 Å²	56	91.4 Å²	91.4	29%	0.293	44%	0.437	S	S	.	.	H	α-helix	trans	-61.8	-49.8	172.8	177.1	63.7	0	0	0	111	T203 C206 E213 L214 W215 D219 T220 V221	T203-L217 HydrophobicContact CG2-CD1 3.39Å; C206-L217 HydrophobicContact CB-CD2 3.81Å; E213-L217 PolarHBondContact O-N 3.37Å; E213-L217 VanDerWaalsContact O-N 3.12Å; L214-L217 PolarHBondContact O-N 3.32Å; W215-L217 VanDerWaalsContact C-N 3.34Å; W215-L217 PolarHBondContact O-N 3.23Å; L217-D219 PolarHBondContact O-N 3.18Å; L217-T220 PolarHBondContact O-N 3.38Å; L217-V221 HydrophobicContact CD1-CG2 4.06Å; L217-V221 HydrophobicContact CG-CG2 4.5Å; L217-V221 WeakPolarHBondContact O-CG2 3.39Å; L217-V221 PolarHBondContact O-N 3.02Å
218	H	92.6	Very high	89	Confident	107 Å²	107	85.4 Å²	85.4	50%	0.495	41%	0.405	S	S	.	.	H	α-helix	trans	-56.1	-49	178.9	171.2	-83.7	0	0	0	112	L214 W215 T220 V221 T222	L214-H218 WeakPolarHBondContact O-CB 3.44Å; L214-H218 PolarHBondContact O-N 2.99Å; W215-H218 PolarHBondContact O-N 3.01Å; H218-T220 VanDerWaalsContact C-N 3.33Å; H218-T220 PolarHBondContact O-N 3.35Å; H218-V221 PolarHBondContact O-N 3.5Å; H218-T222 PolarHBondContact CE1-OG1 3.2Å; H218-T222 WeakPolarHBondContact O-CB 3.49Å; H218-T222 PolarHBondContact O-N 3.01Å; H218-T222 PolarHBondContact O-OG1 3.17Å
219	D	91.2	Very high	89.4	Confident	98 Å²	98	81.4 Å²	81.4	52%	0.524	40%	0.397	S	S	.	.	H	α-helix	trans	-66.6	-37	-178.4	-72.3	-7.7	0	0	0	111.5	W215 L217 R223	W215-D219 WeakPolarHBondContact O-CB 3.24Å; W215-D219 PolarHBondContact O-N 3.29Å; L217-D219 PolarHBondContact O-N 3.18Å; D219-R223 WeakPolarHBondContact O-CB 3.25Å; D219-R223 PolarHBondContact O-N 2.86Å
220	T	91.3	Very high	89.4	Confident	44 Å²	44	79.2 Å²	79.2	27%	0.27	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-48.5	176.3	-58.2	0	0	0	0	111.3	T203 Q216 L217 H218 N224	T203-T220 HydrophobicContact CG2-CG2 4.45Å; Q216-T220 WeakPolarHBondContact O-CB 3.45Å; Q216-T220 PolarHBondContact O-N 3.26Å; Q216-T220 PolarHBondContact O-OG1 3.01Å; L217-T220 PolarHBondContact O-N 3.38Å; H218-T220 VanDerWaalsContact C-N 3.33Å; H218-T220 PolarHBondContact O-N 3.35Å; T220-N224 PolarHBondContact O-N 3.22Å; T220-N224 PolarHBondContact O-ND2 2.97Å
221	V	92.1	Very high	89.4	Confident	56 Å²	56	75.2 Å²	75.2	34%	0.339	38%	0.376	S	S	.	.	H	α-helix	trans	-63.4	-50	177.5	173	0	0	0	0	110.1	L200 L217 H218 R223 N224 V225	L200-V221 HydrophobicContact CD2-CB 4.43Å; L200-V221 HydrophobicContact CD2-CG1 4.25Å; L200-V221 HydrophobicContact CD2-CG2 4.48Å; L217-V221 HydrophobicContact CD1-CG2 4.06Å; L217-V221 HydrophobicContact CG-CG2 4.5Å; L217-V221 WeakPolarHBondContact O-CG2 3.39Å; L217-V221 PolarHBondContact O-N 3.02Å; H218-V221 PolarHBondContact O-N 3.5Å; V221-R223 PolarHBondContact O-N 2.97Å; V221-N224 PolarHBondContact O-N 2.98Å; V221-V225 HydrophobicContact CG1-CG2 4.14Å; V221-V225 WeakPolarHBondContact O-CG2 3.29Å; V221-V225 PolarHBondContact O-N 3.49Å
222	T	92.8	Very high	89.5	Confident	27 Å²	27	78.4 Å²	78.4	17%	0.166	38%	0.384	C	S	.	.	H	α-helix	trans	-62.1	-40.8	-177.1	-59.9	0	0	0	0	112.2	H218 R226	H218-T222 PolarHBondContact CE1-OG1 3.2Å; H218-T222 WeakPolarHBondContact O-CB 3.49Å; H218-T222 PolarHBondContact O-N 3.01Å; H218-T222 PolarHBondContact O-OG1 3.17Å; T222-R226 HydrophobicContact CG2-CG 4.3Å; T222-R226 VanDerWaalsContact CG2-NE 3.31Å; T222-R226 WeakPolarHBondContact O-CB 3.36Å; T222-R226 VanDerWaalsContact O-CG 3.23Å; T222-R226 WeakPolarHBondContact O-CG 3.2Å; T222-R226 PolarHBondContact O-N 3.09Å
223	R	90.6	Very high	89.6	Confident	103 Å²	103	72.3 Å²	72.3	39%	0.389	36%	0.363	S	S	.	.	H	α-helix	trans	-57.1	-51.2	175.9	174.7	-177.1	64.6	118.6	-3.3	111.3	E199 D219 V221 A227	E199-R223 IonicContact OE1-NH2 3.73Å; E199-R223 PolarHBondContact OE1-NH2 3.5Å; D219-R223 WeakPolarHBondContact O-CB 3.25Å; D219-R223 PolarHBondContact O-N 2.86Å; V221-R223 PolarHBondContact O-N 2.97Å; R223-A227 WeakPolarHBondContact O-CB 3.24Å; R223-A227 PolarHBondContact O-N 3.1Å; R223-A227 VanDerWaalsContact O-N 3.1Å
224	N	92.9	Very high	89.6	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-71.7	-40.7	-176	-70.7	-63.6	0	0	0	112.1	H196 E199 L200 T220 V221 R226 A227 L228	H196-N224 HydrophobicContact CB-CB 4.45Å; H196-N224 PolarHBondContact ND1-OD1 3.37Å; E199-N224 WeakPolarHBondContact CG-ND2 3.36Å; L200-N224 HydrophobicContact CD1-CB 3.93Å; L200-N224 HydrophobicContact CD2-CB 3.76Å; L200-N224 HydrophobicContact CG-CB 3.57Å; T220-N224 PolarHBondContact O-N 3.22Å; T220-N224 PolarHBondContact O-ND2 2.97Å; V221-N224 PolarHBondContact O-N 2.98Å; N224-R226 PolarHBondContact O-N 3.31Å; N224-A227 PolarHBondContact O-N 3.04Å; N224-L228 WeakPolarHBondContact O-CG 3.42Å; N224-L228 PolarHBondContact O-N 3.44Å
225	V	91.6	Very high	89.3	Confident	46 Å²	46	70.4 Å²	70.4	28%	0.279	36%	0.357	S	S	.	.	H	α-helix	trans	-60.2	-46.8	175.1	172.1	0	0	0	0	110.7	L200 V221 A227 L228 V229 P235	L200-V225 HydrophobicContact CD1-CG2 4.32Å; L200-V225 HydrophobicContact CD2-CG2 4.41Å; V221-V225 HydrophobicContact CG1-CG2 4.14Å; V221-V225 WeakPolarHBondContact O-CG2 3.29Å; V221-V225 PolarHBondContact O-N 3.49Å; V225-A227 VanDerWaalsContact C-N 3.33Å; V225-A227 PolarHBondContact O-N 3.09Å; V225-L228 PolarHBondContact O-N 3.32Å; V225-V229 HydrophobicContact CG1-CG2 4.35Å; V225-V229 WeakPolarHBondContact O-CG2 3.23Å; V225-V229 PolarHBondContact O-N 3.02Å; V225-P235 HydrophobicContact CG1-CG 4.48Å
226	R	90.3	Very high	88.9	Confident	169 Å²	169	65.1 Å²	65.1	64%	0.638	35%	0.349	S	S	*	.	H	α-helix	trans	-62.6	-38.7	178.1	-74.2	175.3	-179.8	163.6	4	112.9	T222 N224 L228 V229 A230	T222-R226 HydrophobicContact CG2-CG 4.3Å; T222-R226 VanDerWaalsContact CG2-NE 3.31Å; T222-R226 WeakPolarHBondContact O-CB 3.36Å; T222-R226 VanDerWaalsContact O-CG 3.23Å; T222-R226 WeakPolarHBondContact O-CG 3.2Å; T222-R226 PolarHBondContact O-N 3.09Å; N224-R226 PolarHBondContact O-N 3.31Å; R226-L228 VanDerWaalsContact C-N 3.34Å; R226-V229 PolarHBondContact O-N 3.28Å; R226-A230 PolarHBondContact O-N 3.36Å
227	A	89.5	Confident	88.3	Confident	26 Å²	26	62.8 Å²	62.8	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-66.6	-38.3	177.4	0	0	0	0	0	111.9	H196 R223 N224 V225 A230 L231	H196-A227 WeakPolarHBondContact CE1-CB 3.18Å; H196-A227 WeakPolarHBondContact NE2-CB 3.43Å; R223-A227 WeakPolarHBondContact O-CB 3.24Å; R223-A227 PolarHBondContact O-N 3.1Å; R223-A227 VanDerWaalsContact O-N 3.1Å; N224-A227 PolarHBondContact O-N 3.04Å; V225-A227 VanDerWaalsContact C-N 3.33Å; V225-A227 PolarHBondContact O-N 3.09Å; A227-A230 PolarHBondContact O-N 3.07Å; A227-L231 WeakPolarHBondContact O-CG 3.28Å; A227-L231 PolarHBondContact O-N 2.77Å
228	L	91.2	Very high	87.5	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-65.4	-43.2	173.1	-74.9	171	0	0	0	112.2	A193 H196 I197 L200 N224 V225 R226 A230 L231 N232 K233 P235 L240	A193-L228 HydrophobicContact CB-CD2 4.05Å; H196-L228 HydrophobicContact CB-CD1 4.22Å; H196-L228 HydrophobicContact CB-CD2 3.88Å; H196-L228 HydrophobicContact CB-CG 3.77Å; I197-L228 HydrophobicContact CG1-CD1 4.27Å; I197-L228 HydrophobicContact CG1-CD2 4.11Å; L200-L228 HydrophobicContact CD1-CD1 3.7Å; N224-L228 WeakPolarHBondContact O-CG 3.42Å; N224-L228 PolarHBondContact O-N 3.44Å; V225-L228 PolarHBondContact O-N 3.32Å; R226-L228 VanDerWaalsContact C-N 3.34Å; L228-A230 VanDerWaalsContact C-N 3.3Å; L228-A230 PolarHBondContact O-N 2.86Å; L228-L231 CarbonylContact O-C 3.57Å; L228-L231 WeakPolarHBondContact O-CA 3.4Å; L228-L231 WeakPolarHBondContact O-CB 3.14Å; L228-L231 PolarHBondContact O-N 2.88Å; L228-N232 PolarHBondContact O-N 3.5Å; L228-K233 CarbonylContact C-O 3.5Å; L228-K233 WeakPolarHBondContact CB-O 3.31Å; L228-K233 HydrophobicContact CD2-CB 4.28Å; L228-K233 CarbonylContact O-C 3.56Å; L228-K233 WeakPolarHBondContact O-CA 3.44Å; L228-K233 PolarHBondContact O-N 3.45Å; L228-P235 HydrophobicContact CD1-CG 4.21Å; L228-L240 HydrophobicContact CD1-CD2 4.41Å
229	V	89.2	Confident	87	Confident	59 Å²	59	64.2 Å²	64.2	36%	0.358	35%	0.35	S	S	.	.	H	α-helix	trans	-57.2	-43.5	173.2	174.6	0	0	0	0	111	V225 R226 L231 N232 D234	V225-V229 HydrophobicContact CG1-CG2 4.35Å; V225-V229 WeakPolarHBondContact O-CG2 3.23Å; V225-V229 PolarHBondContact O-N 3.02Å; R226-V229 PolarHBondContact O-N 3.28Å; V229-L231 PolarHBondContact O-N 3.04Å; V229-N232 PolarHBondContact O-N 2.98Å; V229-D234 HydrophobicContact CB-CB 4.33Å; V229-D234 HydrophobicContact CG1-CB 4.46Å; V229-D234 HydrophobicContact CG2-CB 3.74Å
230	A	85.5	Confident	86.7	Confident	76 Å²	76	60.7 Å²	60.7	63%	0.628	33%	0.331	S	S	*	.	H	α-helix	trans	-66.1	-20.2	177.2	0	0	0	0	0	113.7	R226 A227 L228 N232	R226-A230 PolarHBondContact O-N 3.36Å; A227-A230 PolarHBondContact O-N 3.07Å; L228-A230 VanDerWaalsContact C-N 3.3Å; L228-A230 PolarHBondContact O-N 2.86Å; A230-N232 VanDerWaalsContact C-N 3.32Å
231	L	85.7	Confident	86.5	Confident	41 Å²	41	60.8 Å²	60.8	22%	0.215	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	11.6	172.9	-67.8	169.3	0	0	0	112.7	P189 I192 A193 A227 L228 V229 K233	P189-L231 HydrophobicContact CB-CD2 4.48Å; I192-L231 HydrophobicContact CB-CD1 4.02Å; I192-L231 HydrophobicContact CG2-CD1 3.9Å; A193-L231 HydrophobicContact CB-CD1 4.1Å; A227-L231 WeakPolarHBondContact O-CG 3.28Å; A227-L231 PolarHBondContact O-N 2.77Å; L228-L231 CarbonylContact O-C 3.57Å; L228-L231 WeakPolarHBondContact O-CA 3.4Å; L228-L231 WeakPolarHBondContact O-CB 3.14Å; L228-L231 PolarHBondContact O-N 2.88Å; V229-L231 PolarHBondContact O-N 3.04Å; L231-K233 PolarHBondContact O-N 3.28Å
232	N	86.7	Confident	86.2	Confident	134 Å²	134	61.7 Å²	61.7	72%	0.717	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	34.2	-172	-63.9	-24.3	0	0	0	113.3	L228 V229 A230	L228-N232 PolarHBondContact O-N 3.5Å; V229-N232 PolarHBondContact O-N 2.98Å; A230-N232 VanDerWaalsContact C-N 3.32Å
233	K	86.9	Confident	85.9	Confident	58 Å²	58	62 Å²	62	25%	0.252	35%	0.352	S	S	.	.			trans	-124.2	51.7	177.2	-65.4	-66.5	170.7	-174.8	0	110	L228 L231 P235 L240 E244	L228-K233 CarbonylContact C-O 3.5Å; L228-K233 WeakPolarHBondContact CB-O 3.31Å; L228-K233 HydrophobicContact CD2-CB 4.28Å; L228-K233 CarbonylContact O-C 3.56Å; L228-K233 WeakPolarHBondContact O-CA 3.44Å; L228-K233 PolarHBondContact O-N 3.45Å; L231-K233 PolarHBondContact O-N 3.28Å; K233-P235 VanDerWaalsContact O-CD 3.29Å; K233-P235 WeakPolarHBondContact O-CD 3.48Å; K233-L240 HydrophobicContact CB-CB 4.28Å; K233-L240 HydrophobicContact CB-CD1 4.25Å; K233-L240 HydrophobicContact CD-CD1 4.29Å; K233-E244 WeakPolarHBondContact CE-OE1 3.17Å; K233-E244 VanDerWaalsContact NZ-CD 3.31Å; K233-E244 IonicContact NZ-OE1 3.72Å; K233-E244 PolarHBondContact NZ-OE1 2.98Å; K233-E244 IonicContact NZ-OE2 3.97Å; K233-E244 PolarHBondContact NZ-OE2 3.47Å
234	D	87.1	Confident	85.8	Confident	24 Å²	24	59.9 Å²	59.9	13%	0.128	35%	0.346	C	S	.	.			trans	-68.1	118.6	-179.5	179	-4.9	0	0	0	110.8	V229 S236 N237 T239 L240	V229-D234 HydrophobicContact CB-CB 4.33Å; V229-D234 HydrophobicContact CG1-CB 4.46Å; V229-D234 HydrophobicContact CG2-CB 3.74Å; D234-S236 PolarHBondContact O-N 3.22Å; D234-S236 VanDerWaalsContact O-N 3.12Å; D234-S236 VanDerWaalsContact OD1-CB 3.31Å; D234-S236 WeakPolarHBondContact OD1-CB 3.4Å; D234-S236 PolarHBondContact OD1-N 3.37Å; D234-S236 PolarHBondContact OD1-OG 2.92Å; D234-S236 PolarHBondContact OD2-OG 2.82Å; D234-N237 VanDerWaalsContact CB-OD1 3.29Å; D234-N237 WeakPolarHBondContact CB-OD1 3.36Å; D234-N237 PolarHBondContact O-OD1 3.3Å; D234-N237 PolarHBondContact OD2-ND2 3.13Å; D234-T239 WeakPolarHBondContact CA-OG1 3.4Å; D234-T239 WeakPolarHBondContact CB-OG1 3.17Å; D234-T239 PolarHBondContact N-OG1 3.16Å; D234-T239 PolarHBondContact O-OG1 2.9Å; D234-T239 VanDerWaalsContact O-OG1 3.09Å; D234-L240 PolarHBondContact O-N 3.39Å
235	P	81.2	Confident	85.7	Confident	62 Å²	62	61.9 Å²	61.9	40%	0.403	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.7	178.2	-19.6	32	0	0	0	114.5	V225 L228 K233 L240	V225-P235 HydrophobicContact CG1-CG 4.48Å; L228-P235 HydrophobicContact CD1-CG 4.21Å; K233-P235 VanDerWaalsContact O-CD 3.29Å; K233-P235 WeakPolarHBondContact O-CD 3.48Å; P235-L240 HydrophobicContact CB-CD2 4.27Å; P235-L240 HydrophobicContact CG-CD2 4.02Å
236	S	79.6	Confident	85.6	Confident	77 Å²	77	63.6 Å²	63.6	54%	0.538	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-7.7	-171.4	72.6	0	0	0	0	115.4	D234	D234-S236 PolarHBondContact O-N 3.22Å; D234-S236 VanDerWaalsContact O-N 3.12Å; D234-S236 VanDerWaalsContact OD1-CB 3.31Å; D234-S236 WeakPolarHBondContact OD1-CB 3.4Å; D234-S236 PolarHBondContact OD1-N 3.37Å; D234-S236 PolarHBondContact OD1-OG 2.92Å; D234-S236 PolarHBondContact OD2-OG 2.82Å
237	N	75.6	Confident	85.5	Confident	56 Å²	56	56.6 Å²	56.6	30%	0.299	34%	0.341	S	S	.	.	S	Bend	trans	-138.2	29.3	-171.7	69.9	4	0	0	0	114.2	D234 T239	D234-N237 VanDerWaalsContact CB-OD1 3.29Å; D234-N237 WeakPolarHBondContact CB-OD1 3.36Å; D234-N237 PolarHBondContact O-OD1 3.3Å; D234-N237 PolarHBondContact OD2-ND2 3.13Å; N237-T239 PolarHBondContact O-N 3.33Å; N237-T239 VanDerWaalsContact O-N 3.08Å; N237-T239 WeakPolarHBondContact OD1-CB 3.43Å; N237-T239 VanDerWaalsContact OD1-CG2 3.25Å; N237-T239 WeakPolarHBondContact OD1-CG2 3.44Å; N237-T239 PolarHBondContact OD1-N 2.73Å; N237-T239 PolarHBondContact OD1-OG1 3.42Å
238	E	74.3	Confident	85.6	Confident	132 Å²	132	55.4 Å²	55.4	62%	0.617	33%	0.331	S	S	*	.	S	Bend	trans	69	-5.8	177	-50.8	179.5	160.6	0	0	116.3	L240	E238-L240 VanDerWaalsContact C-N 3.28Å; E238-L240 PolarHBondContact O-N 3.49Å
239	T	82.4	Confident	85.7	Confident	61 Å²	61	57.2 Å²	57.2	37%	0.374	34%	0.342	S	S	.	.	S	Bend	trans	-67.6	-27.3	179	56.9	0	0	0	0	113.6	D234 N237	D234-T239 WeakPolarHBondContact CA-OG1 3.4Å; D234-T239 WeakPolarHBondContact CB-OG1 3.17Å; D234-T239 PolarHBondContact N-OG1 3.16Å; D234-T239 PolarHBondContact O-OG1 2.9Å; D234-T239 VanDerWaalsContact O-OG1 3.09Å; N237-T239 PolarHBondContact O-N 3.33Å; N237-T239 VanDerWaalsContact O-N 3.08Å; N237-T239 WeakPolarHBondContact OD1-CB 3.43Å; N237-T239 VanDerWaalsContact OD1-CG2 3.25Å; N237-T239 WeakPolarHBondContact OD1-CG2 3.44Å; N237-T239 PolarHBondContact OD1-N 2.73Å; N237-T239 PolarHBondContact OD1-OG1 3.42Å
240	L	85.1	Confident	85.8	Confident	23 Å²	23	57.5 Å²	57.5	12%	0.12	34%	0.341	C	S	.	.	S	Bend	trans	-93.6	107.7	164.7	178.5	64	0	0	0	109.2	I197 L228 K233 D234 P235 E238 E244 V245	I197-L240 HydrophobicContact CD1-CD1 3.85Å; I197-L240 HydrophobicContact CG1-CD2 4.45Å; L228-L240 HydrophobicContact CD1-CD2 4.41Å; K233-L240 HydrophobicContact CB-CB 4.28Å; K233-L240 HydrophobicContact CB-CD1 4.25Å; K233-L240 HydrophobicContact CD-CD1 4.29Å; D234-L240 PolarHBondContact O-N 3.39Å; P235-L240 HydrophobicContact CB-CD2 4.27Å; P235-L240 HydrophobicContact CG-CD2 4.02Å; E238-L240 VanDerWaalsContact C-N 3.28Å; E238-L240 PolarHBondContact O-N 3.49Å; L240-E244 HydrophobicContact CD1-CB 3.88Å; L240-V245 HydrophobicContact CD1-CG2 4.19Å; L240-V245 HydrophobicContact CD2-CG2 3.83Å; L240-V245 HydrophobicContact CG-CG2 3.9Å
241	S	85.9	Confident	86.1	Confident	46 Å²	46	54.2 Å²	54.2	32%	0.322	31%	0.313	S	S	.	.			trans	-73.5	151	179.8	67.4	0	0	0	0	111.5	A243 E244 V245	S241-A243 PolarHBondContact O-N 2.76Å; S241-E244 PolarHBondContact N-OE2 3.25Å; S241-E244 PolarHBondContact O-N 2.91Å; S241-E244 VanDerWaalsContact OG-CG 3.25Å; S241-E244 WeakPolarHBondContact OG-CG 3.39Å; S241-E244 PolarHBondContact OG-N 3.36Å; S241-E244 PolarHBondContact OG-OE2 3.47Å; S241-V245 PolarHBondContact O-N 3.36Å
242	A	85.5	Confident	86.3	Confident	75 Å²	75	56 Å²	56	62%	0.62	32%	0.32	S	S	*	.	H	α-helix	trans	-58	-32.2	170.8	0	0	0	0	0	111.7	E244 V245 L246	A242-E244 PolarHBondContact O-N 3.47Å; A242-V245 PolarHBondContact O-N 3.14Å; A242-L246 WeakPolarHBondContact O-CB 3.49Å; A242-L246 VanDerWaalsContact O-CG 3.26Å; A242-L246 WeakPolarHBondContact O-CG 3.31Å; A242-L246 PolarHBondContact O-N 3.15Å
243	A	86.3	Confident	86.5	Confident	34 Å²	34	57.4 Å²	57.4	28%	0.281	32%	0.32	S	S	.	.	H	α-helix	trans	-58.9	-44.6	176	0	0	0	0	0	112.3	S241 L246 L247 L276	S241-A243 PolarHBondContact O-N 2.76Å; A243-L246 PolarHBondContact O-N 2.7Å; A243-L247 WeakPolarHBondContact O-CB 3.23Å; A243-L247 WeakPolarHBondContact O-CG 3.5Å; A243-L247 PolarHBondContact O-N 2.97Å; A243-L276 HydrophobicContact CB-CB 4.04Å
244	E	88.7	Confident	86.8	Confident	58 Å²	58	55.8 Å²	55.8	27%	0.271	31%	0.314	S	S	.	.	H	α-helix	trans	-65.7	-41.1	178.3	-72.5	169	116.1	0	0	112.4	K233 L240 S241 A242 L247 A248	K233-E244 WeakPolarHBondContact CE-OE1 3.17Å; K233-E244 VanDerWaalsContact NZ-CD 3.31Å; K233-E244 IonicContact NZ-OE1 3.72Å; K233-E244 PolarHBondContact NZ-OE1 2.98Å; K233-E244 IonicContact NZ-OE2 3.97Å; K233-E244 PolarHBondContact NZ-OE2 3.47Å; L240-E244 HydrophobicContact CD1-CB 3.88Å; S241-E244 PolarHBondContact N-OE2 3.25Å; S241-E244 PolarHBondContact O-N 2.91Å; S241-E244 VanDerWaalsContact OG-CG 3.25Å; S241-E244 WeakPolarHBondContact OG-CG 3.39Å; S241-E244 PolarHBondContact OG-N 3.36Å; S241-E244 PolarHBondContact OG-OE2 3.47Å; A242-E244 PolarHBondContact O-N 3.47Å; E244-L247 PolarHBondContact O-N 3.21Å; E244-A248 WeakPolarHBondContact O-CB 3.38Å; E244-A248 PolarHBondContact O-N 3.4Å
245	V	90.4	Very high	86.9	Confident	42 Å²	42	58.8 Å²	58.8	26%	0.255	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-45.7	175.7	178.8	0	0	0	0	110.4	I197 L240 S241 A242 A248 V249	I197-V245 HydrophobicContact CG2-CB 4.47Å; I197-V245 HydrophobicContact CG2-CG1 4.1Å; I197-V245 HydrophobicContact CG2-CG2 4.49Å; L240-V245 HydrophobicContact CD1-CG2 4.19Å; L240-V245 HydrophobicContact CD2-CG2 3.83Å; L240-V245 HydrophobicContact CG-CG2 3.9Å; S241-V245 PolarHBondContact O-N 3.36Å; A242-V245 PolarHBondContact O-N 3.14Å; V245-A248 PolarHBondContact O-N 3.13Å; V245-V249 WeakPolarHBondContact O-CG2 3.04Å; V245-V249 PolarHBondContact O-N 3.29Å
246	L	89.8	Confident	87.3	Confident	83 Å²	83	59.8 Å²	59.8	44%	0.435	34%	0.343	S	S	.	.	H	α-helix	trans	-62.6	-46.6	177.4	-73.5	171.6	0	0	0	111.4	A242 A243 A248 V249 L250 L276	A242-L246 WeakPolarHBondContact O-CB 3.49Å; A242-L246 VanDerWaalsContact O-CG 3.26Å; A242-L246 WeakPolarHBondContact O-CG 3.31Å; A242-L246 PolarHBondContact O-N 3.15Å; A243-L246 PolarHBondContact O-N 2.7Å; L246-A248 VanDerWaalsContact C-N 3.35Å; L246-A248 PolarHBondContact O-N 3.12Å; L246-V249 PolarHBondContact O-N 3.19Å; L246-V249 VanDerWaalsContact O-N 3.17Å; L246-L250 HydrophobicContact CB-CD1 4.19Å; L246-L250 VanDerWaalsContact O-CB 3.26Å; L246-L250 WeakPolarHBondContact O-CB 3.25Å; L246-L250 WeakPolarHBondContact O-CG 3.47Å; L246-L250 PolarHBondContact O-N 2.93Å; L246-L276 HydrophobicContact CB-CD1 4.4Å; L246-L276 HydrophobicContact CD1-CD2 4.08Å
247	L	90	Very high	87.7	Confident	22 Å²	22	61.4 Å²	61.4	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-57	-47.2	177.4	-81	169.5	0	0	0	111.9	A243 E244 V249 K251 W262 L276 F279	A243-L247 WeakPolarHBondContact O-CB 3.23Å; A243-L247 WeakPolarHBondContact O-CG 3.5Å; A243-L247 PolarHBondContact O-N 2.97Å; E244-L247 PolarHBondContact O-N 3.21Å; L247-V249 VanDerWaalsContact C-N 3.27Å; L247-V249 PolarHBondContact O-N 3.33Å; L247-K251 VanDerWaalsContact O-CG 3.26Å; L247-K251 WeakPolarHBondContact O-CG 3.36Å; L247-K251 PolarHBondContact O-N 3.39Å; L247-K251 VanDerWaalsContact O-N 3.17Å; L247-W262 HydrophobicContact CD2-CZ2 4.25Å; L247-L276 HydrophobicContact CD2-CD1 4.15Å; L247-L276 HydrophobicContact CG-CD1 4.16Å; L247-F279 HydrophobicContact CD2-CB 3.36Å; L247-F279 HydrophobicContact CD2-CD1 4.19Å; L247-F279 HydrophobicContact CD2-CD2 4.06Å; L247-F279 HydrophobicContact CD2-CG 3.61Å
248	A	91.5	Very high	88.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-59.1	-38.6	178.7	0	0	0	0	0	112.2	E194 I197 E244 V245 L246 K251	E194-A248 HydrophobicContact CB-CB 4.37Å; E194-A248 HydrophobicContact CG-CB 4.17Å; I197-A248 HydrophobicContact CB-CB 4.3Å; I197-A248 HydrophobicContact CD1-CB 4.41Å; I197-A248 HydrophobicContact CG2-CB 3.85Å; E244-A248 WeakPolarHBondContact O-CB 3.38Å; E244-A248 PolarHBondContact O-N 3.4Å; V245-A248 PolarHBondContact O-N 3.13Å; L246-A248 VanDerWaalsContact C-N 3.35Å; L246-A248 PolarHBondContact O-N 3.12Å; A248-K251 WeakPolarHBondContact O-CG 3.41Å
249	V	92.9	Very high	89.4	Confident	39 Å²	39	55.8 Å²	55.8	24%	0.236	32%	0.315	C	S	.	.	H	α-helix	trans	-79.7	-47.3	-180	175	0	0	0	0	112.3	M201 V245 L246 L247 K251 Q252	M201-V249 HydrophobicContact CB-CG2 4.49Å; M201-V249 HydrophobicContact CE-CG2 4.41Å; M201-V249 HydrophobicContact CG-CG2 3.9Å; V245-V249 WeakPolarHBondContact O-CG2 3.04Å; V245-V249 PolarHBondContact O-N 3.29Å; L246-V249 PolarHBondContact O-N 3.19Å; L246-V249 VanDerWaalsContact O-N 3.17Å; L247-V249 VanDerWaalsContact C-N 3.27Å; L247-V249 PolarHBondContact O-N 3.33Å; V249-K251 PolarHBondContact O-N 2.97Å; V249-Q252 VanDerWaalsContact O-CB 3.25Å; V249-Q252 WeakPolarHBondContact O-CB 3.27Å; V249-Q252 PolarHBondContact O-N 3.36Å
250	L	91.8	Very high	89.7	Confident	64 Å²	64	59.9 Å²	59.9	34%	0.335	33%	0.328	S	S	.	.	H	α-helix	trans	-65.6	-38.5	-173.7	-72.4	172.5	0	0	0	111.9	L246 Q252 K253 L276 F279	L246-L250 HydrophobicContact CB-CD1 4.19Å; L246-L250 VanDerWaalsContact O-CB 3.26Å; L246-L250 WeakPolarHBondContact O-CB 3.25Å; L246-L250 WeakPolarHBondContact O-CG 3.47Å; L246-L250 PolarHBondContact O-N 2.93Å; L250-Q252 PolarHBondContact O-N 2.74Å; L250-Q252 VanDerWaalsContact O-N 3.15Å; L250-K253 WeakPolarHBondContact O-CA 3.2Å; L250-K253 WeakPolarHBondContact O-CB 3.49Å; L250-K253 PolarHBondContact O-N 3.25Å; L250-L276 HydrophobicContact CD1-CD1 4.12Å; L250-F279 HydrophobicContact CB-CE1 3.8Å; L250-F279 HydrophobicContact CB-CZ 3.9Å; L250-F279 HydrophobicContact CD1-CD1 4.5Å; L250-F279 HydrophobicContact CD1-CE1 4.06Å
251	K	90.4	Very high	89.9	Confident	7 Å²	7	63.6 Å²	63.6	3%	0.03	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-61.5	-25.3	174.3	71.9	178.6	-165.9	165.4	0	112.9	E194 L247 A248 V249 K253 L254 R259 E263	E194-K251 VanDerWaalsContact OE1-CE 3.27Å; E194-K251 WeakPolarHBondContact OE1-CE 3.3Å; E194-K251 IonicContact OE1-NZ 2.68Å; E194-K251 PolarHBondContact OE1-NZ 3.37Å; E194-K251 WeakPolarHBondContact OE2-CE 3.48Å; E194-K251 IonicContact OE2-NZ 3.45Å; E194-K251 PolarHBondContact OE2-NZ 3.04Å; L247-K251 VanDerWaalsContact O-CG 3.26Å; L247-K251 WeakPolarHBondContact O-CG 3.36Å; L247-K251 PolarHBondContact O-N 3.39Å; L247-K251 VanDerWaalsContact O-N 3.17Å; A248-K251 WeakPolarHBondContact O-CG 3.41Å; V249-K251 PolarHBondContact O-N 2.97Å; K251-K253 PolarHBondContact O-N 2.81Å; K251-L254 PolarHBondContact O-N 3.47Å; K251-R259 WeakPolarHBondContact O-CD 3.48Å; K251-R259 PolarHBondContact O-NE 3.37Å; K251-R259 PolarHBondContact O-NH1 2.99Å; K251-R259 PolarHBondContact O-NH2 3.15Å; K251-E263 IonicContact NZ-OE1 2.71Å; K251-E263 PolarHBondContact NZ-OE1 3.35Å; K251-E263 IonicContact NZ-OE2 3.4Å
252	Q	90.6	Very high	90.2	Very high	78 Å²	78	61.8 Å²	61.8	36%	0.364	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-67.8	-18.4	172.8	-59.2	-69.9	-11.6	0	0	113.6	L198 V249 L250 R259	L198-Q252 HydrophobicContact CD1-CG 4.34Å; L198-Q252 HydrophobicContact CD2-CG 3.57Å; V249-Q252 VanDerWaalsContact O-CB 3.25Å; V249-Q252 WeakPolarHBondContact O-CB 3.27Å; V249-Q252 PolarHBondContact O-N 3.36Å; L250-Q252 PolarHBondContact O-N 2.74Å; L250-Q252 VanDerWaalsContact O-N 3.15Å; Q252-R259 VanDerWaalsContact OE1-CZ 3.27Å
253	K	91.3	Very high	90.3	Very high	165 Å²	165	61 Å²	61	72%	0.717	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-91.3	-11.1	-179.9	-54.2	-58	-176.5	176.8	0	113	L250 K251	L250-K253 WeakPolarHBondContact O-CA 3.2Å; L250-K253 WeakPolarHBondContact O-CB 3.49Å; L250-K253 PolarHBondContact O-N 3.25Å; K251-K253 PolarHBondContact O-N 2.81Å
254	L	92	Very high	90.3	Very high	24 Å²	24	62.9 Å²	62.9	13%	0.126	32%	0.321	C	S	.	.	S	Bend	trans	-71.5	139.8	176.4	-73.2	178.5	0	0	0	111.9	K251 V258 R259 W262 F279 F282 L283	K251-L254 PolarHBondContact O-N 3.47Å; L254-V258 HydrophobicContact CD1-CG1 4.23Å; L254-V258 HydrophobicContact CD2-CB 4.49Å; L254-V258 HydrophobicContact CD2-CG1 3.8Å; L254-V258 HydrophobicContact CG-CG1 4.46Å; L254-R259 HydrophobicContact CB-CB 3.89Å; L254-R259 HydrophobicContact CB-CG 4.4Å; L254-W262 HydrophobicContact CD1-CB 4.33Å; L254-F279 HydrophobicContact CD1-CE2 3.82Å; L254-F279 HydrophobicContact CD1-CZ 4.2Å; L254-F279 HydrophobicContact CG-CZ 4.45Å; L254-F282 HydrophobicContact CD1-CE1 4.38Å; L254-L283 HydrophobicContact CD2-CD1 3.6Å
255	P	90.7	Very high	90.1	Very high	86 Å²	86	62.7 Å²	62.7	56%	0.558	32%	0.319	S	S	*	.			trans	-53.2	146.4	165.8	-24.4	33.7	0	0	0	111.1	I257 V258 R259	P255-I257 PolarHBondContact O-N 3.29Å; P255-V258 HydrophobicContact CB-CG2 4.41Å; P255-V258 HydrophobicContact CG-CG2 4.46Å; P255-V258 PolarHBondContact O-N 3.03Å; P255-V258 VanDerWaalsContact O-N 3.09Å; P255-R259 WeakPolarHBondContact O-CB 3.17Å; P255-R259 PolarHBondContact O-N 3Å
256	S	88.7	Confident	89.8	Confident	83 Å²	83	62.6 Å²	62.6	58%	0.58	32%	0.319	S	S	*	.	H	α-helix	trans	-55.7	-32.4	-173	57.7	0	0	0	0	114	K260	S256-K260 VanDerWaalsContact O-CG 3.22Å; S256-K260 WeakPolarHBondContact O-CG 3.24Å; S256-K260 PolarHBondContact O-N 3.15Å; S256-K260 VanDerWaalsContact O-N 3.15Å
257	I	88.9	Confident	89.3	Confident	111 Å²	111	64.5 Å²	64.5	57%	0.569	33%	0.329	S	S	*	.	H	α-helix	trans	-70.5	-51.2	179.1	-64.2	167.5	0	0	0	110.4	P255 R259 K260 R261	P255-I257 PolarHBondContact O-N 3.29Å; I257-R259 VanDerWaalsContact C-N 3.29Å; I257-R259 PolarHBondContact O-N 3.45Å; I257-K260 WeakPolarHBondContact O-CB 3.28Å; I257-K260 PolarHBondContact O-N 3.41Å; I257-R261 PolarHBondContact O-N 2.85Å
258	V	91.9	Very high	88.8	Confident	22 Å²	22	67.5 Å²	67.5	13%	0.133	36%	0.357	C	S	.	.	H	α-helix	trans	-62.4	-41.2	178.6	179.2	0	0	0	0	110.8	L254 P255 K260 R261 W262 F282 Q286	L254-V258 HydrophobicContact CD1-CG1 4.23Å; L254-V258 HydrophobicContact CD2-CB 4.49Å; L254-V258 HydrophobicContact CD2-CG1 3.8Å; L254-V258 HydrophobicContact CG-CG1 4.46Å; P255-V258 HydrophobicContact CB-CG2 4.41Å; P255-V258 HydrophobicContact CG-CG2 4.46Å; P255-V258 PolarHBondContact O-N 3.03Å; P255-V258 VanDerWaalsContact O-N 3.09Å; V258-K260 VanDerWaalsContact C-N 3.35Å; V258-K260 PolarHBondContact O-N 3.28Å; V258-R261 WeakPolarHBondContact O-CB 3.2Å; V258-R261 PolarHBondContact O-N 2.94Å; V258-R261 VanDerWaalsContact O-N 3.11Å; V258-W262 PolarHBondContact O-N 2.94Å; V258-F282 HydrophobicContact CG1-CE1 3.9Å; V258-F282 HydrophobicContact CG1-CZ 4.08Å; V258-Q286 HydrophobicContact CG1-CB 4.36Å; V258-Q286 HydrophobicContact CG1-CG 3.88Å
259	R	92.3	Very high	88.1	Confident	48 Å²	48	71.5 Å²	71.5	18%	0.181	38%	0.376	C	S	.	.	H	α-helix	trans	-61.3	-40.4	176.7	-167.2	177.1	-166.8	165.7	7.6	113.3	K251 Q252 L254 P255 I257 R261 W262 E263	K251-R259 WeakPolarHBondContact O-CD 3.48Å; K251-R259 PolarHBondContact O-NE 3.37Å; K251-R259 PolarHBondContact O-NH1 2.99Å; K251-R259 PolarHBondContact O-NH2 3.15Å; Q252-R259 VanDerWaalsContact OE1-CZ 3.27Å; L254-R259 HydrophobicContact CB-CB 3.89Å; L254-R259 HydrophobicContact CB-CG 4.4Å; P255-R259 WeakPolarHBondContact O-CB 3.17Å; P255-R259 PolarHBondContact O-N 3Å; I257-R259 VanDerWaalsContact C-N 3.29Å; I257-R259 PolarHBondContact O-N 3.45Å; R259-R261 VanDerWaalsContact C-N 3.27Å; R259-R261 PolarHBondContact O-N 2.95Å; R259-W262 WeakPolarHBondContact O-CB 3.41Å; R259-W262 PolarHBondContact O-N 3.23Å; R259-E263 HydrophobicContact CG-CG 4.4Å; R259-E263 VanDerWaalsContact O-CG 3.29Å; R259-E263 WeakPolarHBondContact O-CG 3.34Å; R259-E263 PolarHBondContact O-N 3.21Å
260	K	89.3	Confident	86.9	Confident	147 Å²	147	72.3 Å²	72.3	64%	0.639	38%	0.383	S	S	*	.	H	α-helix	trans	-61.9	-36	174.7	-76.7	169.8	-178	-175.8	0	112	S256 I257 V258 S264	S256-K260 VanDerWaalsContact O-CG 3.22Å; S256-K260 WeakPolarHBondContact O-CG 3.24Å; S256-K260 PolarHBondContact O-N 3.15Å; S256-K260 VanDerWaalsContact O-N 3.15Å; I257-K260 WeakPolarHBondContact O-CB 3.28Å; I257-K260 PolarHBondContact O-N 3.41Å; V258-K260 VanDerWaalsContact C-N 3.35Å; V258-K260 PolarHBondContact O-N 3.28Å; K260-S264 WeakPolarHBondContact O-CB 3.48Å; K260-S264 PolarHBondContact O-N 3.21Å; K260-S264 PolarHBondContact O-OG 3.31Å
261	R	90.1	Very high	85.6	Confident	102 Å²	102	75.7 Å²	75.7	39%	0.385	40%	0.397	S	S	.	.	H	α-helix	trans	-65.7	-44.8	174.2	-66	177.1	178	163.1	1.5	110.9	I257 V258 R259 S264 K265 F282 E290	I257-R261 PolarHBondContact O-N 2.85Å; V258-R261 WeakPolarHBondContact O-CB 3.2Å; V258-R261 PolarHBondContact O-N 2.94Å; V258-R261 VanDerWaalsContact O-N 3.11Å; R259-R261 VanDerWaalsContact C-N 3.27Å; R259-R261 PolarHBondContact O-N 2.95Å; R261-S264 WeakPolarHBondContact O-CB 3.47Å; R261-S264 PolarHBondContact O-N 3.43Å; R261-K265 PolarHBondContact O-N 3.21Å; R261-F282 HydrophobicContact CB-CE2 4.11Å; R261-F282 HydrophobicContact CB-CZ 3.95Å; R261-E290 IonicContact NH1-OE1 2.79Å
262	W	90.7	Very high	84.3	Confident	8 Å²	8	84 Å²	84	3%	0.03	44%	0.436	C	S	.	.	H	α-helix	trans	-58	-52.7	174.2	176.1	-108.8	0	0	0	112.1	L247 L254 V258 R259 S264 K265 V266 M274 F279 F282	L247-W262 HydrophobicContact CD2-CZ2 4.25Å; L254-W262 HydrophobicContact CD1-CB 4.33Å; V258-W262 PolarHBondContact O-N 2.94Å; R259-W262 WeakPolarHBondContact O-CB 3.41Å; R259-W262 PolarHBondContact O-N 3.23Å; W262-S264 PolarHBondContact O-N 3.46Å; W262-K265 HydrophobicContact CZ3-CD 4.39Å; W262-K265 WeakPolarHBondContact O-CA 3.24Å; W262-K265 WeakPolarHBondContact O-CB 3.13Å; W262-K265 PolarHBondContact O-N 3.09Å; W262-V266 HydrophobicContact CD2-CG2 4.14Å; W262-V266 HydrophobicContact CG-CG2 4.29Å; W262-V266 HydrophobicContact CZ2-CG2 4.18Å; W262-V266 WeakPolarHBondContact O-CG2 3.34Å; W262-V266 PolarHBondContact O-N 3.37Å; W262-M274 HydrophobicContact CH2-CE 3.15Å; W262-M274 HydrophobicContact CZ2-CE 3.13Å; W262-M274 HydrophobicContact CZ3-CE 3.88Å; W262-F279 AromaticContact CD2-CD2 3.86Å; W262-F279 HydrophobicContact CD2-CD2 3.86Å; W262-F279 HydrophobicContact CD2-CE2 4.38Å; W262-F279 AromaticContact CE2-CD2 3.65Å; W262-F279 HydrophobicContact CE3-CD2 4.07Å; W262-F279 HydrophobicContact CH2-CB 3.48Å; W262-F279 VanDerWaalsContact CH2-CB 3.48Å; W262-F279 AromaticContact CH2-CD2 3.83Å; W262-F279 HydrophobicContact CH2-CD2 3.83Å; W262-F279 HydrophobicContact CH2-CG 4.17Å; W262-F279 HydrophobicContact CZ2-CB 3.85Å; W262-F279 AromaticContact CZ2-CD2 3.63Å; W262-F279 HydrophobicContact CZ2-CD2 3.63Å; W262-F279 HydrophobicContact CZ2-CG 4.22Å; W262-F279 HydrophobicContact CZ3-CB 4.09Å; W262-F279 HydrophobicContact CZ3-CD2 4.06Å; W262-F282 HydrophobicContact CB-CD1 4.29Å; W262-F282 HydrophobicContact CB-CE1 3.66Å; W262-F282 HydrophobicContact CB-CE2 4.48Å; W262-F282 HydrophobicContact CB-CZ 3.77Å; W262-F282 HydrophobicContact CD2-CD1 4.22Å; W262-F282 HydrophobicContact CD2-CE1 4.47Å; W262-F282 HydrophobicContact CE3-CB 3.76Å; W262-F282 AromaticContact CE3-CD1 3.45Å; W262-F282 HydrophobicContact CE3-CD1 3.45Å; W262-F282 VanDerWaalsContact CE3-CD1 3.45Å; W262-F282 AromaticContact CE3-CD2 3.98Å; W262-F282 HydrophobicContact CE3-CD2 3.98Å; W262-F282 HydrophobicContact CE3-CE1 4.02Å; W262-F282 HydrophobicContact CE3-CE2 4.47Å; W262-F282 AromaticContact CE3-CG 3.43Å; W262-F282 HydrophobicContact CE3-CG 3.43Å; W262-F282 VanDerWaalsContact CE3-CG 3.43Å; W262-F282 HydrophobicContact CE3-CZ 4.49Å; W262-F282 HydrophobicContact CG-CE1 4.39Å; W262-F282 HydrophobicContact CZ3-CB 3.59Å; W262-F282 HydrophobicContact CZ3-CD1 4.13Å; W262-F282 AromaticContact CZ3-CG 3.84Å; W262-F282 HydrophobicContact CZ3-CG 3.84Å
263	E	88.8	Confident	83.2	Confident	57 Å²	57	85.7 Å²	85.7	27%	0.266	44%	0.444	S	S	.	.	H	α-helix	trans	-63.7	-26.7	-179.9	-62.2	-74.3	175.3	0	0	111.9	K251 R259 L267	K251-E263 IonicContact NZ-OE1 2.71Å; K251-E263 PolarHBondContact NZ-OE1 3.35Å; K251-E263 IonicContact NZ-OE2 3.4Å; R259-E263 HydrophobicContact CG-CG 4.4Å; R259-E263 VanDerWaalsContact O-CG 3.29Å; R259-E263 WeakPolarHBondContact O-CG 3.34Å; R259-E263 PolarHBondContact O-N 3.21Å; E263-L267 WeakPolarHBondContact O-CD1 3.4Å; E263-L267 WeakPolarHBondContact O-CG 3.24Å; E263-L267 PolarHBondContact O-N 3.11Å; E263-L267 VanDerWaalsContact O-N 3.17Å
264	S	86.3	Confident	82.3	Confident	74 Å²	74	79.3 Å²	79.3	52%	0.517	42%	0.417	S	S	.	.	H	α-helix	trans	-69.8	-40.1	170.7	-64.3	0	0	0	0	112.4	K260 R261 W262 L267 A268	K260-S264 WeakPolarHBondContact O-CB 3.48Å; K260-S264 PolarHBondContact O-N 3.21Å; K260-S264 PolarHBondContact O-OG 3.31Å; R261-S264 WeakPolarHBondContact O-CB 3.47Å; R261-S264 PolarHBondContact O-N 3.43Å; W262-S264 PolarHBondContact O-N 3.46Å; S264-L267 PolarHBondContact O-N 2.85Å; S264-A268 PolarHBondContact O-N 3.43Å
265	K	84.4	Confident	82	Confident	54 Å²	54	81.2 Å²	81.2	24%	0.235	43%	0.43	C	S	.	.	H	α-helix	trans	-62.4	-46.7	174.2	-172.2	177.5	176.9	-178.5	0	110.7	R261 W262 L267 A268 E269 F282	R261-K265 PolarHBondContact O-N 3.21Å; W262-K265 HydrophobicContact CZ3-CD 4.39Å; W262-K265 WeakPolarHBondContact O-CA 3.24Å; W262-K265 WeakPolarHBondContact O-CB 3.13Å; W262-K265 PolarHBondContact O-N 3.09Å; K265-L267 PolarHBondContact O-N 3.16Å; K265-A268 PolarHBondContact O-N 3.45Å; K265-E269 WeakPolarHBondContact CE-OE1 3.41Å; K265-E269 WeakPolarHBondContact CE-OE2 3.27Å; K265-E269 IonicContact NZ-OE2 3.87Å; K265-E269 PolarHBondContact O-N 2.78Å; K265-F282 HydrophobicContact CD-CD2 4.29Å
266	V	83.9	Confident	81.7	Confident	40 Å²	40	79 Å²	79	24%	0.242	41%	0.413	C	S	.	.	H	α-helix	trans	-56.9	-34.1	176.2	179.9	0	0	0	0	112.4	W262 M274	W262-V266 HydrophobicContact CD2-CG2 4.14Å; W262-V266 HydrophobicContact CG-CG2 4.29Å; W262-V266 HydrophobicContact CZ2-CG2 4.18Å; W262-V266 WeakPolarHBondContact O-CG2 3.34Å; W262-V266 PolarHBondContact O-N 3.37Å; V266-M274 HydrophobicContact CB-CE 4.14Å; V266-M274 HydrophobicContact CG2-CE 3.36Å; V266-M274 HydrophobicContact CG2-SD 4.37Å
267	L	78.5	Confident	81.8	Confident	124 Å²	124	80 Å²	80	65%	0.649	41%	0.412	S	S	*	.	H	α-helix	trans	-79.3	-21.1	178.4	-79.9	165.6	0	0	0	113.6	E263 S264 K265	E263-L267 WeakPolarHBondContact O-CD1 3.4Å; E263-L267 WeakPolarHBondContact O-CG 3.24Å; E263-L267 PolarHBondContact O-N 3.11Å; E263-L267 VanDerWaalsContact O-N 3.17Å; S264-L267 PolarHBondContact O-N 2.85Å; K265-L267 PolarHBondContact O-N 3.16Å
268	A	79.7	Confident	81.7	Confident	85 Å²	85	75.3 Å²	75.3	70%	0.702	39%	0.389	S	S	*	.	H	α-helix	trans	-94.2	-32.4	-176.9	0	0	0	0	0	112.8	S264 K265	S264-A268 PolarHBondContact O-N 3.43Å; K265-A268 PolarHBondContact O-N 3.45Å
269	E	77.2	Confident	81.8	Confident	83 Å²	83	74.5 Å²	74.5	39%	0.388	38%	0.384	S	S	.	.	S	Bend	trans	-99.3	164.1	-175.5	-69.6	174.2	-168.2	0	0	112.4	K265 M274	K265-E269 WeakPolarHBondContact CE-OE1 3.41Å; K265-E269 WeakPolarHBondContact CE-OE2 3.27Å; K265-E269 IonicContact NZ-OE2 3.87Å; K265-E269 PolarHBondContact O-N 2.78Å; E269-M274 HydrophobicContact CB-SD 4.4Å
270	S	67.1	Low	81.8	Confident	56 Å²	56	76.6 Å²	76.6	39%	0.392	40%	0.398	S	S	.	.			trans	-74.7	155.2	-177.9	73.1	0	0	0	0	111.8	E272 E273	S270-E272 PolarHBondContact O-N 3.11Å; S270-E273 PolarHBondContact N-OE2 2.9Å; S270-E273 PolarHBondContact O-N 2.7Å; S270-E273 WeakPolarHBondContact OG-CG 3.46Å; S270-E273 PolarHBondContact OG-OE2 2.73Å
271	Q	64.6	Low	81.9	Confident	135 Å²	135	75.7 Å²	75.7	63%	0.631	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-62	-30.6	-178.5	-68.7	-172.2	-21.6	0	0	113.2	I190 E273 M274	I190-Q271 HydrophobicContact CD1-CB 4.14Å; I190-Q271 VanDerWaalsContact CD1-CD 3.44Å; I190-Q271 HydrophobicContact CD1-CG 3.57Å; I190-Q271 VanDerWaalsContact CD1-NE2 3.3Å; Q271-E273 VanDerWaalsContact C-N 3.29Å; Q271-E273 PolarHBondContact O-N 2.59Å; Q271-M274 PolarHBondContact O-N 2.79Å
272	E	64	Low	82.1	Confident	183 Å²	183	71.4 Å²	71.4	86%	0.855	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-73	-21.6	-176.3	-68.2	173.1	178.9	0	0	112.5	S270	S270-E272 PolarHBondContact O-N 3.11Å
273	E	66.3	Low	82.1	Confident	113 Å²	113	74.1 Å²	74.1	53%	0.528	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-87.7	-10.2	-179.8	-70.1	167.9	144.1	0	0	113.3	S270 Q271 T275 A278	S270-E273 PolarHBondContact N-OE2 2.9Å; S270-E273 PolarHBondContact O-N 2.7Å; S270-E273 WeakPolarHBondContact OG-CG 3.46Å; S270-E273 PolarHBondContact OG-OE2 2.73Å; Q271-E273 VanDerWaalsContact C-N 3.29Å; Q271-E273 PolarHBondContact O-N 2.59Å; E273-T275 VanDerWaalsContact C-N 3.28Å; E273-T275 PolarHBondContact O-N 2.86Å; E273-A278 WeakPolarHBondContact O-CB 3.45Å
274	M	73.7	Confident	82.3	Confident	30 Å²	30	77.1 Å²	77.1	15%	0.148	41%	0.409	C	S	.	.			trans	-87.3	59.8	-171.7	-65.5	-60	-47.5	0	0	112.8	W262 V266 E269 Q271	W262-M274 HydrophobicContact CH2-CE 3.15Å; W262-M274 HydrophobicContact CZ2-CE 3.13Å; W262-M274 HydrophobicContact CZ3-CE 3.88Å; V266-M274 HydrophobicContact CB-CE 4.14Å; V266-M274 HydrophobicContact CG2-CE 3.36Å; V266-M274 HydrophobicContact CG2-SD 4.37Å; E269-M274 HydrophobicContact CB-SD 4.4Å; Q271-M274 PolarHBondContact O-N 2.79Å
275	T	84.4	Confident	82.5	Confident	64 Å²	64	75.6 Å²	75.6	39%	0.393	40%	0.399	S	S	.	.			trans	-82	168.8	179.7	66.9	0	0	0	0	112.7	E273 D277 A278 F279	E273-T275 VanDerWaalsContact C-N 3.28Å; E273-T275 PolarHBondContact O-N 2.86Å; T275-D277 PolarHBondContact O-N 2.86Å; T275-D277 PolarHBondContact OG1-N 3.23Å; T275-A278 PolarHBondContact O-N 3.13Å; T275-A278 PolarHBondContact OG1-N 2.88Å; T275-A278 VanDerWaalsContact OG1-N 3.14Å; T275-F279 PolarHBondContact O-N 2.87Å
276	L	85.8	Confident	82.9	Confident	40 Å²	40	73.9 Å²	73.9	21%	0.209	39%	0.392	C	S	.	.	H	α-helix	trans	-60.3	-35.1	170.7	-177.9	63.2	0	0	0	111.3	A243 L246 L247 L250 F279 L280	A243-L276 HydrophobicContact CB-CB 4.04Å; L246-L276 HydrophobicContact CB-CD1 4.4Å; L246-L276 HydrophobicContact CD1-CD2 4.08Å; L247-L276 HydrophobicContact CD2-CD1 4.15Å; L247-L276 HydrophobicContact CG-CD1 4.16Å; L250-L276 HydrophobicContact CD1-CD1 4.12Å; L276-F279 HydrophobicContact CD1-CD1 4.42Å; L276-F279 WeakPolarHBondContact O-CB 3.28Å; L276-F279 PolarHBondContact O-N 3.18Å; L276-L280 WeakPolarHBondContact O-CG 3.31Å; L276-L280 PolarHBondContact O-N 2.71Å
277	D	89	Confident	83.1	Confident	105 Å²	105	76.4 Å²	76.4	56%	0.561	41%	0.407	S	S	*	.	H	α-helix	trans	-65.9	-44.3	177.1	-58.2	-45.4	0	0	0	111.2	T275 F279 L280 E281	T275-D277 PolarHBondContact O-N 2.86Å; T275-D277 PolarHBondContact OG1-N 3.23Å; D277-F279 PolarHBondContact O-N 3.49Å; D277-L280 PolarHBondContact O-N 3.4Å; D277-E281 WeakPolarHBondContact O-CG 3.5Å; D277-E281 PolarHBondContact O-N 2.86Å
278	A	88.1	Confident	83.6	Confident	11 Å²	11	75.8 Å²	75.8	9%	0.091	40%	0.401	C	S	.	.	H	α-helix	trans	-59.9	-31.4	174.7	0	0	0	0	0	112.7	E273 T275 F282	E273-A278 WeakPolarHBondContact O-CB 3.45Å; T275-A278 PolarHBondContact O-N 3.13Å; T275-A278 PolarHBondContact OG1-N 2.88Å; T275-A278 VanDerWaalsContact OG1-N 3.14Å; A278-F282 WeakPolarHBondContact O-CB 3.17Å; A278-F282 PolarHBondContact O-N 2.91Å
279	F	92.6	Very high	83.9	Confident	6 Å²	6	75.6 Å²	75.6	3%	0.026	39%	0.387	C	S	.	.	H	α-helix	trans	-71	-41.7	172.6	175.1	-98.7	0	0	0	112.9	L247 L250 L254 W262 T275 L276 D277 F282 L283	L247-F279 HydrophobicContact CD2-CB 3.36Å; L247-F279 HydrophobicContact CD2-CD1 4.19Å; L247-F279 HydrophobicContact CD2-CD2 4.06Å; L247-F279 HydrophobicContact CD2-CG 3.61Å; L250-F279 HydrophobicContact CB-CE1 3.8Å; L250-F279 HydrophobicContact CB-CZ 3.9Å; L250-F279 HydrophobicContact CD1-CD1 4.5Å; L250-F279 HydrophobicContact CD1-CE1 4.06Å; L254-F279 HydrophobicContact CD1-CE2 3.82Å; L254-F279 HydrophobicContact CD1-CZ 4.2Å; L254-F279 HydrophobicContact CG-CZ 4.45Å; W262-F279 AromaticContact CD2-CD2 3.86Å; W262-F279 HydrophobicContact CD2-CD2 3.86Å; W262-F279 HydrophobicContact CD2-CE2 4.38Å; W262-F279 AromaticContact CE2-CD2 3.65Å; W262-F279 HydrophobicContact CE3-CD2 4.07Å; W262-F279 HydrophobicContact CH2-CB 3.48Å; W262-F279 VanDerWaalsContact CH2-CB 3.48Å; W262-F279 AromaticContact CH2-CD2 3.83Å; W262-F279 HydrophobicContact CH2-CD2 3.83Å; W262-F279 HydrophobicContact CH2-CG 4.17Å; W262-F279 HydrophobicContact CZ2-CB 3.85Å; W262-F279 AromaticContact CZ2-CD2 3.63Å; W262-F279 HydrophobicContact CZ2-CD2 3.63Å; W262-F279 HydrophobicContact CZ2-CG 4.22Å; W262-F279 HydrophobicContact CZ3-CB 4.09Å; W262-F279 HydrophobicContact CZ3-CD2 4.06Å; T275-F279 PolarHBondContact O-N 2.87Å; L276-F279 HydrophobicContact CD1-CD1 4.42Å; L276-F279 WeakPolarHBondContact O-CB 3.28Å; L276-F279 PolarHBondContact O-N 3.18Å; D277-F279 PolarHBondContact O-N 3.49Å; F279-F282 PolarHBondContact O-N 3.45Å; F279-L283 HydrophobicContact CE1-CD1 3.79Å; F279-L283 HydrophobicContact CE2-CD1 4.23Å; F279-L283 HydrophobicContact CZ-CD1 3.58Å; F279-L283 WeakPolarHBondContact O-CB 3.47Å; F279-L283 PolarHBondContact O-N 2.68Å
280	L	92.3	Very high	84.3	Confident	91 Å²	91	76 Å²	76	48%	0.476	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-43.2	176.9	-67.6	174.2	0	0	0	111.4	L276 D277 F282 L283 Q284	L276-L280 WeakPolarHBondContact O-CG 3.31Å; L276-L280 PolarHBondContact O-N 2.71Å; D277-L280 PolarHBondContact O-N 3.4Å; L280-F282 VanDerWaalsContact C-N 3.34Å; L280-F282 PolarHBondContact O-N 2.81Å; L280-L283 WeakPolarHBondContact O-CB 3.39Å; L280-L283 PolarHBondContact O-N 2.83Å; L280-L283 VanDerWaalsContact O-N 3.14Å; L280-Q284 PolarHBondContact O-N 2.75Å
281	E	92.2	Very high	85	Confident	129 Å²	129	78 Å²	78	60%	0.603	40%	0.395	S	S	*	.	H	α-helix	trans	-58.9	-44.4	172.7	-73.3	179.8	179.7	0	0	111.6	D277 L283 Q284 S285	D277-E281 WeakPolarHBondContact O-CG 3.5Å; D277-E281 PolarHBondContact O-N 2.86Å; E281-L283 VanDerWaalsContact C-N 3.34Å; E281-L283 PolarHBondContact O-N 2.81Å; E281-Q284 PolarHBondContact O-N 3.13Å; E281-S285 WeakPolarHBondContact O-CB 3.38Å; E281-S285 PolarHBondContact O-N 3Å
282	F	93.6	Very high	85.7	Confident	12 Å²	12	74.5 Å²	74.5	5%	0.053	39%	0.389	C	S	.	.	H	α-helix	trans	-59.5	-46.1	173.4	167.2	-95.3	0	0	0	111.4	L254 V258 R261 W262 K265 A278 F279 L280 Q284 S285 Q286	L254-F282 HydrophobicContact CD1-CE1 4.38Å; V258-F282 HydrophobicContact CG1-CE1 3.9Å; V258-F282 HydrophobicContact CG1-CZ 4.08Å; R261-F282 HydrophobicContact CB-CE2 4.11Å; R261-F282 HydrophobicContact CB-CZ 3.95Å; W262-F282 HydrophobicContact CB-CD1 4.29Å; W262-F282 HydrophobicContact CB-CE1 3.66Å; W262-F282 HydrophobicContact CB-CE2 4.48Å; W262-F282 HydrophobicContact CB-CZ 3.77Å; W262-F282 HydrophobicContact CD2-CD1 4.22Å; W262-F282 HydrophobicContact CD2-CE1 4.47Å; W262-F282 HydrophobicContact CE3-CB 3.76Å; W262-F282 AromaticContact CE3-CD1 3.45Å; W262-F282 HydrophobicContact CE3-CD1 3.45Å; W262-F282 VanDerWaalsContact CE3-CD1 3.45Å; W262-F282 AromaticContact CE3-CD2 3.98Å; W262-F282 HydrophobicContact CE3-CD2 3.98Å; W262-F282 HydrophobicContact CE3-CE1 4.02Å; W262-F282 HydrophobicContact CE3-CE2 4.47Å; W262-F282 AromaticContact CE3-CG 3.43Å; W262-F282 HydrophobicContact CE3-CG 3.43Å; W262-F282 VanDerWaalsContact CE3-CG 3.43Å; W262-F282 HydrophobicContact CE3-CZ 4.49Å; W262-F282 HydrophobicContact CG-CE1 4.39Å; W262-F282 HydrophobicContact CZ3-CB 3.59Å; W262-F282 HydrophobicContact CZ3-CD1 4.13Å; W262-F282 AromaticContact CZ3-CG 3.84Å; W262-F282 HydrophobicContact CZ3-CG 3.84Å; K265-F282 HydrophobicContact CD-CD2 4.29Å; A278-F282 WeakPolarHBondContact O-CB 3.17Å; A278-F282 PolarHBondContact O-N 2.91Å; F279-F282 PolarHBondContact O-N 3.45Å; L280-F282 VanDerWaalsContact C-N 3.34Å; L280-F282 PolarHBondContact O-N 2.81Å; F282-Q284 VanDerWaalsContact C-N 3.3Å; F282-Q284 PolarHBondContact O-N 3.36Å; F282-S285 WeakPolarHBondContact O-CB 3.29Å; F282-S285 PolarHBondContact O-N 3.45Å; F282-S285 PolarHBondContact O-OG 3.47Å; F282-Q286 HydrophobicContact CD1-CG 4.3Å; F282-Q286 HydrophobicContact CD2-CG 4.4Å; F282-Q286 HydrophobicContact CE1-CG 3.79Å; F282-Q286 HydrophobicContact CE2-CG 3.92Å; F282-Q286 HydrophobicContact CZ-CG 3.58Å; F282-Q286 WeakPolarHBondContact O-CG 3.32Å; F282-Q286 PolarHBondContact O-N 3.08Å
283	L	92.6	Very high	86.4	Confident	64 Å²	64	67.6 Å²	67.6	34%	0.335	36%	0.364	S	S	.	.	H	α-helix	trans	-60.3	-43.5	-179.5	-143.7	106.1	0	0	0	111.1	L254 F279 L280 E281 Q286 V287	L254-L283 HydrophobicContact CD2-CD1 3.6Å; F279-L283 HydrophobicContact CE1-CD1 3.79Å; F279-L283 HydrophobicContact CE2-CD1 4.23Å; F279-L283 HydrophobicContact CZ-CD1 3.58Å; F279-L283 WeakPolarHBondContact O-CB 3.47Å; F279-L283 PolarHBondContact O-N 2.68Å; L280-L283 WeakPolarHBondContact O-CB 3.39Å; L280-L283 PolarHBondContact O-N 2.83Å; L280-L283 VanDerWaalsContact O-N 3.14Å; E281-L283 VanDerWaalsContact C-N 3.34Å; E281-L283 PolarHBondContact O-N 2.81Å; L283-Q286 PolarHBondContact O-N 3.17Å; L283-V287 WeakPolarHBondContact O-CG2 3.44Å; L283-V287 PolarHBondContact O-N 2.83Å; L283-V287 VanDerWaalsContact O-N 3.08Å
284	Q	91.6	Very high	86.7	Confident	120 Å²	120	65.4 Å²	65.4	56%	0.561	36%	0.358	S	S	*	.	H	α-helix	trans	-60.8	-45.8	175	180	176	-14.7	0	0	111.3	L280 E281 F282 Q286 V287 E288	L280-Q284 PolarHBondContact O-N 2.75Å; E281-Q284 PolarHBondContact O-N 3.13Å; F282-Q284 VanDerWaalsContact C-N 3.3Å; F282-Q284 PolarHBondContact O-N 3.36Å; Q284-Q286 PolarHBondContact O-N 3.3Å; Q284-V287 WeakPolarHBondContact O-CB 3.45Å; Q284-V287 PolarHBondContact O-N 3.49Å; Q284-E288 WeakPolarHBondContact CG-OE1 3.5Å; Q284-E288 PolarHBondContact NE2-OE1 2.95Å; Q284-E288 PolarHBondContact O-N 3.45Å
285	S	91.2	Very high	86.2	Confident	42 Å²	42	67.7 Å²	67.7	29%	0.294	37%	0.371	S	S	.	.	H	α-helix	trans	-57.9	-36.7	176.3	109.3	0	0	0	0	111.8	E281 F282 I289	E281-S285 WeakPolarHBondContact O-CB 3.38Å; E281-S285 PolarHBondContact O-N 3Å; F282-S285 WeakPolarHBondContact O-CB 3.29Å; F282-S285 PolarHBondContact O-N 3.45Å; F282-S285 PolarHBondContact O-OG 3.47Å; S285-I289 WeakPolarHBondContact O-CD1 3.41Å; S285-I289 WeakPolarHBondContact O-CG1 3.45Å; S285-I289 PolarHBondContact O-N 3.27Å
286	Q	92.1	Very high	84.9	Confident	18 Å²	18	68.2 Å²	68.2	8%	0.084	38%	0.377	C	S	.	.	H	α-helix	trans	-70.6	-36.1	176.7	-61.2	-53.9	-68.5	0	0	112.2	V258 F282 L283 Q284 I289 E290	V258-Q286 HydrophobicContact CG1-CB 4.36Å; V258-Q286 HydrophobicContact CG1-CG 3.88Å; F282-Q286 HydrophobicContact CD1-CG 4.3Å; F282-Q286 HydrophobicContact CD2-CG 4.4Å; F282-Q286 HydrophobicContact CE1-CG 3.79Å; F282-Q286 HydrophobicContact CE2-CG 3.92Å; F282-Q286 HydrophobicContact CZ-CG 3.58Å; F282-Q286 WeakPolarHBondContact O-CG 3.32Å; F282-Q286 PolarHBondContact O-N 3.08Å; L283-Q286 PolarHBondContact O-N 3.17Å; Q284-Q286 PolarHBondContact O-N 3.3Å; Q286-I289 PolarHBondContact O-N 3.22Å; Q286-E290 WeakPolarHBondContact O-CG 3.4Å; Q286-E290 PolarHBondContact O-N 2.88Å; Q286-E290 VanDerWaalsContact O-N 3.08Å
287	V	87.6	Confident	83.1	Confident	94 Å²	94	73.3 Å²	73.3	57%	0.57	40%	0.4	S	S	*	.	H	α-helix	trans	-62.5	-46.9	173.9	173.3	0	0	0	0	110.4	L283 Q284 I289 E290 D291	L283-V287 WeakPolarHBondContact O-CG2 3.44Å; L283-V287 PolarHBondContact O-N 2.83Å; L283-V287 VanDerWaalsContact O-N 3.08Å; Q284-V287 WeakPolarHBondContact O-CB 3.45Å; Q284-V287 PolarHBondContact O-N 3.49Å; V287-I289 VanDerWaalsContact C-N 3.34Å; V287-I289 PolarHBondContact O-N 3.27Å; V287-E290 PolarHBondContact O-N 2.88Å; V287-D291 WeakPolarHBondContact O-CB 3.48Å; V287-D291 PolarHBondContact O-N 3.45Å
288	E	89.2	Confident	81.2	Confident	111 Å²	111	76 Å²	76	52%	0.519	41%	0.406	S	S	.	.	H	α-helix	trans	-61.4	-40.4	178.6	-69	170.4	-171.4	0	0	112.2	Q284 A292	Q284-E288 WeakPolarHBondContact CG-OE1 3.5Å; Q284-E288 PolarHBondContact NE2-OE1 2.95Å; Q284-E288 PolarHBondContact O-N 3.45Å; E288-A292 VanDerWaalsContact O-CB 3.29Å; E288-A292 WeakPolarHBondContact O-CB 3.41Å; E288-A292 PolarHBondContact O-N 2.88Å
289	I	87.3	Confident	79.2	Confident	81 Å²	81	83.8 Å²	83.8	42%	0.415	44%	0.441	S	S	.	.	H	α-helix	trans	-62.3	-47.8	175.7	-71.5	163.3	0	0	0	111.4	S285 Q286 V287 A292 A293	S285-I289 WeakPolarHBondContact O-CD1 3.41Å; S285-I289 WeakPolarHBondContact O-CG1 3.45Å; S285-I289 PolarHBondContact O-N 3.27Å; Q286-I289 PolarHBondContact O-N 3.22Å; V287-I289 VanDerWaalsContact C-N 3.34Å; V287-I289 PolarHBondContact O-N 3.27Å; I289-A292 PolarHBondContact O-N 3.15Å; I289-A293 WeakPolarHBondContact O-CB 3.45Å; I289-A293 PolarHBondContact O-N 3.16Å
290	E	84.6	Confident	76.8	Confident	91 Å²	91	86.5 Å²	86.5	43%	0.425	47%	0.47	S	S	.	.	H	α-helix	trans	-69.4	-36.7	-178.3	-65.5	-62.3	152.8	0	0	111.5	R261 Q286 V287 A293 V294	R261-E290 IonicContact NH1-OE1 2.79Å; Q286-E290 WeakPolarHBondContact O-CG 3.4Å; Q286-E290 PolarHBondContact O-N 2.88Å; Q286-E290 VanDerWaalsContact O-N 3.08Å; V287-E290 PolarHBondContact O-N 2.88Å; E290-A293 PolarHBondContact O-N 3.38Å; E290-V294 WeakPolarHBondContact O-CG2 3.39Å; E290-V294 PolarHBondContact O-N 3.34Å
291	D	81.4	Confident	73.8	Confident	98 Å²	98	87.2 Å²	87.2	52%	0.524	48%	0.482	S	S	.	.	H	α-helix	trans	-67	-41	176	-157.6	41.7	0	0	0	111.4	V287 V294 N295	V287-D291 WeakPolarHBondContact O-CB 3.48Å; V287-D291 PolarHBondContact O-N 3.45Å; D291-V294 PolarHBondContact O-N 2.92Å; D291-N295 WeakPolarHBondContact O-CB 3.33Å; D291-N295 VanDerWaalsContact O-CG 3.26Å; D291-N295 PolarHBondContact O-N 3.39Å; D291-N295 PolarHBondContact O-ND2 3.46Å
292	A	80.1	Confident	70.9	Confident	61 Å²	61	90.2 Å²	90.2	50%	0.504	49%	0.493	S	S	.	.	H	α-helix	trans	-63.1	-41	173.1	0	0	0	0	0	112.5	E288 I289 N295 S296	E288-A292 VanDerWaalsContact O-CB 3.29Å; E288-A292 WeakPolarHBondContact O-CB 3.41Å; E288-A292 PolarHBondContact O-N 2.88Å; I289-A292 PolarHBondContact O-N 3.15Å; A292-N295 PolarHBondContact O-N 3.24Å; A292-S296 WeakPolarHBondContact O-CB 3.47Å; A292-S296 PolarHBondContact O-N 3.34Å; A292-S296 PolarHBondContact O-OG 3.3Å
293	A	78.5	Confident	68	Low	39 Å²	39	96.6 Å²	96.6	32%	0.322	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-48.4	177.1	0	0	0	0	0	111.3	I289 E290 N295 S296 E297	I289-A293 WeakPolarHBondContact O-CB 3.45Å; I289-A293 PolarHBondContact O-N 3.16Å; E290-A293 PolarHBondContact O-N 3.38Å; A293-N295 PolarHBondContact O-N 3.26Å; A293-S296 PolarHBondContact O-N 3.06Å; A293-S296 PolarHBondContact O-OG 3.48Å; A293-E297 PolarHBondContact O-N 3.47Å; A293-E297 VanDerWaalsContact O-N 3.08Å
294	V	72.9	Confident	65	Low	66 Å²	66	103.2 Å²	103.2	40%	0.4	55%	0.554	S	S	.	*	H	α-helix	trans	-64.4	-38.7	178.7	173.2	0	0	0	0	112.1	E290 D291 E297 K298	E290-V294 WeakPolarHBondContact O-CG2 3.39Å; E290-V294 PolarHBondContact O-N 3.34Å; D291-V294 PolarHBondContact O-N 2.92Å; V294-E297 PolarHBondContact O-N 3.44Å; V294-K298 PolarHBondContact O-N 2.61Å
295	N	63.2	Low	61.9	Low	79 Å²	79	108.9 Å²	108.9	42%	0.422	57%	0.57	S	S	.	*	H	α-helix	trans	-69	-36.1	177.3	-72.4	-35.9	0	0	0	111.9	D291 A292 A293 K298	D291-N295 WeakPolarHBondContact O-CB 3.33Å; D291-N295 VanDerWaalsContact O-CG 3.26Å; D291-N295 PolarHBondContact O-N 3.39Å; D291-N295 PolarHBondContact O-ND2 3.46Å; A292-N295 PolarHBondContact O-N 3.24Å; A293-N295 PolarHBondContact O-N 3.26Å; N295-K298 PolarHBondContact O-N 3.07Å
296	S	56.2	Low	58.8	Low	75 Å²	75	117.9 Å²	117.9	52%	0.524	60%	0.597	S	S	.	*	H	α-helix	trans	-67.4	-34.2	174.7	75	0	0	0	0	113.2	A292 A293 K298 E299 G300	A292-S296 WeakPolarHBondContact O-CB 3.47Å; A292-S296 PolarHBondContact O-N 3.34Å; A292-S296 PolarHBondContact O-OG 3.3Å; A293-S296 PolarHBondContact O-N 3.06Å; A293-S296 PolarHBondContact O-OG 3.48Å; S296-K298 VanDerWaalsContact C-N 3.33Å; S296-K298 PolarHBondContact O-N 3.07Å; S296-E299 PolarHBondContact O-N 3.02Å; S296-G300 PolarHBondContact O-N 3.28Å
297	E	48.2	Very low	55.8	Low	146 Å²	146	122.9 Å²	122.9	68%	0.682	63%	0.629	S	S	*	*	H	α-helix	trans	-70.2	-28.7	176.9	-73.8	-173.5	172.2	0	0	112.8	A293 V294	A293-E297 PolarHBondContact O-N 3.47Å; A293-E297 VanDerWaalsContact O-N 3.08Å; V294-E297 PolarHBondContact O-N 3.44Å
298	K	49.1	Very low	52.9	Low	162 Å²	162	127.4 Å²	127.4	70%	0.704	64%	0.644	S	S	*	*	H	α-helix	trans	-73.9	-24.7	176.8	-75	-179.7	-177.9	170.5	0	113.5	V294 N295 S296	V294-K298 PolarHBondContact O-N 2.61Å; N295-K298 PolarHBondContact O-N 3.07Å; S296-K298 VanDerWaalsContact C-N 3.33Å; S296-K298 PolarHBondContact O-N 3.07Å
299	E	47.6	Very low	49.9	Very low	175 Å²	175	128.2 Å²	128.2	82%	0.818	66%	0.659	S	S	*	*	H	α-helix	trans	-89.1	-23.3	176	-66.9	-166.6	151.9	0	0	112.9	S296	S296-E299 PolarHBondContact O-N 3.02Å
300	G	41.1	Very low	47.1	Very low	62 Å²	62	129.7 Å²	129.7	64%	0.639	68%	0.677	S	S	*	*	S	Bend	trans	-100.3	29.1	-168.9	0	0	0	0	0	117.8	S296	S296-G300 PolarHBondContact O-N 3.28Å
301	C	30	Very low	44.6	Very low	106 Å²	106	134.5 Å²	134.5	72%	0.716	70%	0.699	S	S	*	*			trans	-156.2	50	170.4	-140.9	0	0	0	0	115.7	N303	C301-N303 VanDerWaalsContact C-N 3.3Å; C301-N303 PolarHBondContact O-N 2.82Å
302	K	31.8	Very low	42.1	Very low	192 Å²	192	136.8 Å²	136.8	84%	0.835	71%	0.71	S	S	*	*			trans	-76.2	80.8	161.9	-71.3	-176.1	-176.8	173.4	0	110.3
303	N	32.4	Very low	39.5	Very low	146 Å²	146	143 Å²	143	78%	0.781	73%	0.729	S	S	*	*			trans	154.8	95.7	148.5	-86.1	-26.3	0	0	0	110.3	C301	C301-N303 VanDerWaalsContact C-N 3.3Å; C301-N303 PolarHBondContact O-N 2.82Å
304	K	27.9	Very low	37.1	Very low	204 Å²	204	150.7 Å²	150.7	89%	0.887	76%	0.759	S	S	*	*			trans	-165.9	103.7	133	-103.9	160.9	-170.2	-179	0	108.6
305	R	27.6	Very low	35	Very low	239 Å²	239	158.6 Å²	158.6	90%	0.902	78%	0.781	S	S	*	*			trans	-49.6	132.8	160.8	-62.1	171.1	173.7	179.9	-4	108.4
306	R	26.1	Very low	33.3	Very low	230 Å²	230	166.2 Å²	166.2	87%	0.868	80%	0.804	S	S	*	*				167.7	128.3	112.8	-100.4	177.8	161.2	174	-6.1	113.8
307	T	29.5	Very low	32	Very low	124 Å²	124	174.6 Å²	174.6	76%	0.761	82%	0.824	S	S	*	*			trans	60.9	112.1	141.4	38.8	0	0	0	0	119.9
308	E	25.4	Very low	31	Very low	189 Å²	189	176.4 Å²	176.4	88%	0.883	83%	0.83	S	S	*	*			trans	-33.2	124	153.8	-62.5	174.6	162.5	0	0	112.9
309	P	27.9	Very low	30	Very low	127 Å²	127	174.5 Å²	174.5	83%	0.825	83%	0.827	S	S	*	*			trans	-82.5	121.2	167.4	-1	19.3	0	0	0	109
310	S	27.4	Very low	28.9	Very low	112 Å²	112	176.9 Å²	176.9	78%	0.783	83%	0.829	S	S	*	*			trans	-64	147.9	175.8	65.4	0	0	0	0	112.2	L312	S310-L312 PolarHBondContact O-N 3.42Å
311	E	32	Very low	28.2	Very low	192 Å²	192	183.9 Å²	183.9	90%	0.897	84%	0.842	S	S	*	*	S	Bend	trans	-62.2	86.2	179	-62.6	175.1	128.9	0	0	112.3
312	L	28.8	Very low	28.2	Very low	146 Å²	146	182.8 Å²	182.8	76%	0.764	83%	0.834	S	S	*	*			trans	-162.7	49.8	163.5	-122.7	142	0	0	0	115.9	S310	S310-L312 PolarHBondContact O-N 3.42Å
313	E	27.1	Very low	28.1	Very low	193 Å²	193	178.2 Å²	178.2	90%	0.902	83%	0.826	S	S	*	*			trans	-152.7	23.2	167.6	-118.9	157.1	-164.3	0	0	117.5	R315	E313-R315 VanDerWaalsContact C-N 3.32Å
314	Q	27.1	Very low	28.2	Very low	200 Å²	200	175.4 Å²	175.4	94%	0.935	82%	0.823	S	S	*	*			trans	-95.9	30.8	166.1	-78.1	-178.2	-8.4	0	0	113.6
315	R	28	Very low	28.6	Very low	232 Å²	232	169.6 Å²	169.6	88%	0.875	81%	0.813	S	S	*	*			trans	-98.5	53.6	170.6	-85.5	-172.2	172.9	-176.4	1.1	112.7	E313	E313-R315 VanDerWaalsContact C-N 3.32Å
316	R	29.3	Very low	28.9	Very low	239 Å²	239	161 Å²	161	90%	0.902	79%	0.793	S	S	*	*	S	Bend	trans	-152.5	71.4	156.1	-71.9	-160.4	-176.1	-159.7	1.2	111.8
317	R	26.8	Very low	29.2	Very low	250 Å²	250	157 Å²	157	94%	0.943	79%	0.788	S	S	*	*			trans	-171.8	64.5	148.1	-100.8	170.1	-162.2	-160.3	6.5	109.1
318	K	27.5	Very low	29.3	Very low	184 Å²	184	159.8 Å²	159.8	80%	0.8	79%	0.792	S	S	*	*			trans	-72.8	146.7	157.9	-83.7	-170.3	156.3	-168.8	0	108.1
319	D	28.1	Very low	29.7	Very low	123 Å²	123	154.9 Å²	154.9	66%	0.658	79%	0.785	S	S	*	*			cis	-167.2	132.6	-4.1	-87.2	-36.8	0	0	0	102.1
320	W	25.5	Very low	29.8	Very low	225 Å²	225	154.8 Å²	154.8	85%	0.852	78%	0.782	S	S	*	*			trans	178.6	78.7	140.6	-156.9	-88	0	0	0	110.5
321	F	25.8	Very low	29.9	Very low	208 Å²	208	154.4 Å²	154.4	91%	0.912	77%	0.774	S	S	*	*			trans	-102.4	106.3	158.1	-72.5	-78.8	0	0	0	107.3	S323	F321-S323 PolarHBondContact O-N 3.41Å
322	P	30.4	Very low	29.8	Very low	84 Å²	84	152 Å²	152	55%	0.545	76%	0.763	S	S	.	*			trans	-77	108.8	173.9	26.4	-21.6	0	0	0	108.1	A326	P322-A326 HydrophobicContact CB-CB 4.37Å
323	S	29	Very low	30.1	Very low	96 Å²	96	157 Å²	157	67%	0.671	77%	0.772	S	S	*	*			trans	-58.4	157.9	168.5	56.4	0	0	0	0	111	F321 A325 A326	F321-S323 PolarHBondContact O-N 3.41Å; S323-A325 PolarHBondContact O-N 2.9Å; S323-A326 PolarHBondContact O-N 2.83Å
324	A	36.3	Very low	30.8	Very low	87 Å²	87	157.7 Å²	157.7	72%	0.719	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-55.4	-0.2	-165.5	0	0	0	0	0	117.6	A326 L327	A324-A326 VanDerWaalsContact C-N 3.3Å; A324-A326 PolarHBondContact O-N 3.05Å; A324-L327 PolarHBondContact O-N 2.94Å
325	A	34.6	Very low	32.2	Very low	81 Å²	81	154.2 Å²	154.2	67%	0.669	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-71.7	-20.2	171.1	0	0	0	0	0	113.4	S323 L327	S323-A325 PolarHBondContact O-N 2.9Å; A325-L327 PolarHBondContact O-N 2.79Å
326	A	35.4	Very low	34.2	Very low	59 Å²	59	148.8 Å²	148.8	49%	0.488	74%	0.74	S	S	.	*	G	3₁₀ helix	trans	-73.1	-14.8	174.3	0	0	0	0	0	113.5	P322 S323 A324 Q328	P322-A326 HydrophobicContact CB-CB 4.37Å; S323-A326 PolarHBondContact O-N 2.83Å; A324-A326 VanDerWaalsContact C-N 3.3Å; A324-A326 PolarHBondContact O-N 3.05Å; A326-Q328 VanDerWaalsContact C-N 3.3Å; A326-Q328 PolarHBondContact O-N 2.86Å
327	L	32.5	Very low	36.8	Very low	146 Å²	146	137.5 Å²	137.5	76%	0.764	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-80.1	-10.7	-179.7	-133.5	120.7	0	0	0	113.3	A324 A325	A324-L327 PolarHBondContact O-N 2.94Å; A325-L327 PolarHBondContact O-N 2.79Å
328	Q	30.7	Very low	39.4	Very low	182 Å²	182	126.8 Å²	126.8	85%	0.85	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-105.8	-1	177.8	-80.6	-173.1	-21.5	0	0	115.2	A326	A326-Q328 VanDerWaalsContact C-N 3.3Å; A326-Q328 PolarHBondContact O-N 2.86Å
329	A	33.8	Very low	42.2	Very low	87 Å²	87	119 Å²	119	72%	0.719	63%	0.627	S	S	*	*	S	Bend	trans	-107.5	1.3	179.3	0	0	0	0	0	115.4
330	T	29.5	Very low	44.9	Very low	125 Å²	125	115.4 Å²	115.4	77%	0.767	61%	0.611	S	S	*	*			trans	-116.7	47.6	177.3	38.3	0	0	0	0	112.7
331	V	29.8	Very low	47.7	Very low	103 Å²	103	108.5 Å²	108.5	62%	0.624	60%	0.597	S	S	*	*	S	Bend	trans	-110.2	107.5	169.1	-179.8	0	0	0	0	107.6
332	H	30	Very low	50.2	Low	143 Å²	143	99.7 Å²	99.7	66%	0.662	57%	0.565	S	S	*	*			trans	80.2	70.4	167.9	-49.9	-53.9	0	0	0	119.9
333	R	34.1	Very low	52.7	Low	251 Å²	251	104.6 Å²	104.6	95%	0.947	58%	0.581	S	S	*	*			trans	-111.6	45.6	135.8	-75.4	-164.2	-177.6	-173.4	3.1	111.1	N335	R333-N335 PolarHBondContact O-N 3.06Å; R333-N335 VanDerWaalsContact O-N 3.11Å
334	R	43.7	Very low	55.2	Low	207 Å²	207	102.9 Å²	102.9	78%	0.781	56%	0.562	S	S	*	*			trans	-68.4	109.2	172.7	-89.1	-176.7	174.4	157.7	-0.3	108.6	M336	R334-M336 PolarHBondContact O-N 3.45Å; R334-M336 VanDerWaalsContact O-N 3.08Å
335	N	56.2	Low	57.4	Low	126 Å²	126	104.4 Å²	104.4	67%	0.674	55%	0.554	S	S	*	*			trans	37.8	55.8	154.6	-67.1	-7.7	0	0	0	117.1	R333	R333-N335 PolarHBondContact O-N 3.06Å; R333-N335 VanDerWaalsContact O-N 3.11Å
336	M	69.7	Low	59.7	Low	118 Å²	118	101.2 Å²	101.2	58%	0.581	53%	0.526	S	S	*	.			trans	-74.8	135.3	163	-64.5	176.8	75.5	0	0	109.3	R334 S338 S341 G342	R334-M336 PolarHBondContact O-N 3.45Å; R334-M336 VanDerWaalsContact O-N 3.08Å; M336-S338 PolarHBondContact O-N 3.36Å; M336-S341 WeakPolarHBondContact CE-O 3.49Å; M336-G342 CarbonylContact C-O 3.6Å
337	C	82.7	Confident	61.9	Low	2 Å²	2	99.8 Å²	99.8	1%	0.014	51%	0.514	C	S	.	.			trans	-60.2	126.2	174.6	177.5	0	0	0	0	110.2	F339 S341 G342 H344 N346 C349	C337-F339 PolarHBondContact O-N 3.29Å; C337-F339 PolarHBondContact SG-N 3.17Å; C337-F339 VanDerWaalsContact SG-N 3.37Å; C337-S341 WeakPolarHBondContact O-CA 3.41Å; C337-S341 PolarHBondContact O-N 2.99Å; C337-G342 WeakPolarHBondContact CB-O 3.33Å; C337-G342 PolarHBondContact N-O 3.27Å; C337-H344 WeakPolarHBondContact CB-CE1 3.18Å; C337-H344 WeakPolarHBondContact CB-O 3.47Å; C337-H344 PolarHBondContact N-O 2.97Å; C337-H344 PolarHBondContact SG-CE1 2.85Å; C337-N346 VanDerWaalsContact CA-OD1 3.31Å; C337-N346 WeakPolarHBondContact CA-OD1 3.48Å; C337-N346 PolarHBondContact SG-OD1 3.04Å; C337-C349 VanDerWaalsContact SG-SG 3.67Å
338	S	81.5	Confident	64.4	Low	26 Å²	26	96.4 Å²	96.4	18%	0.182	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-14.1	-179.9	64.4	0	0	0	0	113.6	M336 N346 K367	M336-S338 PolarHBondContact O-N 3.36Å; S338-N346 PolarHBondContact N-OD1 2.82Å; S338-N346 PolarHBondContact OG-ND2 3.42Å; S338-N346 PolarHBondContact OG-OD1 2.97Å; S338-K367 VanDerWaalsContact O-CD 3.26Å; S338-K367 WeakPolarHBondContact O-CD 3.29Å; S338-K367 VanDerWaalsContact O-CE 3.27Å; S338-K367 WeakPolarHBondContact O-CE 3.47Å; S338-K367 WeakPolarHBondContact O-CG 3.22Å
339	F	87.1	Confident	67.1	Low	19 Å²	19	87.7 Å²	87.7	8%	0.083	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-39.5	-178.6	-57.3	-49.9	0	0	0	113.8	C337 N346 C349 F352 M363 V364 K367 A369	C337-F339 PolarHBondContact O-N 3.29Å; C337-F339 PolarHBondContact SG-N 3.17Å; C337-F339 VanDerWaalsContact SG-N 3.37Å; F339-N346 HydrophobicContact CD2-CB 4.04Å; F339-N346 HydrophobicContact CE2-CB 3.57Å; F339-N346 HydrophobicContact CZ-CB 4.36Å; F339-C349 HydrophobicContact CD2-CB 4.07Å; F339-F352 HydrophobicContact CD1-CD2 4.21Å; F339-F352 HydrophobicContact CD2-CB 3.76Å; F339-F352 AromaticContact CD2-CD2 3.91Å; F339-F352 HydrophobicContact CD2-CD2 3.91Å; F339-F352 AromaticContact CD2-CG 3.86Å; F339-F352 HydrophobicContact CD2-CG 3.86Å; F339-F352 HydrophobicContact CE1-CD2 4.11Å; F339-F352 HydrophobicContact CE1-CE2 4.23Å; F339-F352 HydrophobicContact CE2-CB 4.21Å; F339-F352 HydrophobicContact CE2-CD1 4.26Å; F339-F352 AromaticContact CE2-CD2 3.74Å; F339-F352 HydrophobicContact CE2-CD2 3.74Å; F339-F352 HydrophobicContact CE2-CE2 4.15Å; F339-F352 AromaticContact CE2-CG 3.8Å; F339-F352 HydrophobicContact CE2-CG 3.8Å; F339-F352 HydrophobicContact CG-CB 4.25Å; F339-F352 HydrophobicContact CG-CD2 4.14Å; F339-F352 HydrophobicContact CG-CG 4.44Å; F339-F352 AromaticContact CZ-CD2 3.88Å; F339-F352 HydrophobicContact CZ-CD2 3.88Å; F339-F352 AromaticContact CZ-CE2 3.92Å; F339-F352 HydrophobicContact CZ-CE2 3.92Å; F339-F352 HydrophobicContact CZ-CG 4.39Å; F339-F352 HydrophobicContact CZ-CZ 4.44Å; F339-M363 HydrophobicContact CB-CE 3.75Å; F339-M363 HydrophobicContact CD1-CB 4.16Å; F339-M363 HydrophobicContact CD1-CE 4.16Å; F339-M363 HydrophobicContact CE1-CB 4.29Å; F339-M363 HydrophobicContact CG-CE 4.21Å; F339-V364 HydrophobicContact CE1-CG2 4.22Å; F339-V364 HydrophobicContact CZ-CG2 4.01Å; F339-K367 HydrophobicContact CD1-CB 4.47Å; F339-K367 HydrophobicContact CD1-CG 4.22Å; F339-K367 HydrophobicContact CE1-CB 4.4Å; F339-A369 HydrophobicContact CE1-CB 4.38Å; F339-A369 HydrophobicContact CZ-CB 4.2Å
340	C	85.7	Confident	69.5	Low	48 Å²	48	88.7 Å²	88.7	32%	0.324	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.6	4	-176.1	70.1	0	0	0	0	114.2	G342 H344 C349 C351	C340-G342 PolarHBondContact O-N 3.25Å; C340-G342 VanDerWaalsContact O-N 3.13Å; C340-H344 VanDerWaalsContact SG-CE1 3.52Å; C340-H344 PolarHBondContact SG-NE2 2.87Å; C340-C349 VanDerWaalsContact SG-SG 3.61Å; C340-C351 HydrophobicContact CB-CB 3.96Å
341	S	82.2	Confident	72.2	Confident	80 Å²	80	86.1 Å²	86.1	56%	0.559	44%	0.435	S	S	*	.			trans	61	16.2	-177.7	-52.9	0	0	0	0	114.8	M336 C337	M336-S341 WeakPolarHBondContact CE-O 3.49Å; C337-S341 WeakPolarHBondContact O-CA 3.41Å; C337-S341 PolarHBondContact O-N 2.99Å
342	G	80.1	Confident	75.1	Confident	23 Å²	23	81.2 Å²	81.2	24%	0.237	41%	0.405	C	S	.	.			trans	-83.3	161.1	176.3	0	0	0	0	0	113.1	M336 C337 C340 H344	M336-G342 CarbonylContact C-O 3.6Å; C337-G342 WeakPolarHBondContact CB-O 3.33Å; C337-G342 PolarHBondContact N-O 3.27Å; C340-G342 PolarHBondContact O-N 3.25Å; C340-G342 VanDerWaalsContact O-N 3.13Å; G342-H344 VanDerWaalsContact C-N 3.26Å; G342-H344 PolarHBondContact O-N 3.02Å
343	E	82.5	Confident	77.7	Confident	188 Å²	188	80.3 Å²	80.3	88%	0.879	40%	0.396	S	S	*	.	S	Bend	trans	-80.1	65.7	179.8	-63.9	-170.2	162.6	0	0	112.6
344	H	81.9	Confident	80.1	Confident	60 Å²	60	74.1 Å²	74.1	28%	0.278	38%	0.382	S	S	.	.	S	Bend	trans	-153	166.4	173.7	59.9	68.5	0	0	0	111.5	C337 C340 G342 C349	C337-H344 WeakPolarHBondContact CB-CE1 3.18Å; C337-H344 WeakPolarHBondContact CB-O 3.47Å; C337-H344 PolarHBondContact N-O 2.97Å; C337-H344 PolarHBondContact SG-CE1 2.85Å; C340-H344 VanDerWaalsContact SG-CE1 3.52Å; C340-H344 PolarHBondContact SG-NE2 2.87Å; G342-H344 VanDerWaalsContact C-N 3.26Å; G342-H344 PolarHBondContact O-N 3.02Å; H344-C349 WeakPolarHBondContact CE1-CA 3.46Å; H344-C349 WeakPolarHBondContact CE1-CB 3.46Å
345	E	81.3	Confident	82.2	Confident	118 Å²	118	66.8 Å²	66.8	55%	0.551	36%	0.36	S	S	*	.			trans	-67.8	152	174.5	-64.5	-176.2	-179.8	0	0	111.8	A347 T348 C349	E345-A347 PolarHBondContact O-N 2.73Å; E345-T348 PolarHBondContact O-N 3.11Å; E345-T348 VanDerWaalsContact O-N 3.14Å; E345-T348 PolarHBondContact O-OG1 2.93Å; E345-C349 PolarHBondContact O-N 2.84Å
346	N	83.6	Confident	83.6	Confident	15 Å²	15	65.5 Å²	65.5	8%	0.08	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-58.8	-33.8	179.5	-79.1	-5.5	0	0	0	113.4	C337 S338 F339 T348 C349 L374	C337-N346 VanDerWaalsContact CA-OD1 3.31Å; C337-N346 WeakPolarHBondContact CA-OD1 3.48Å; C337-N346 PolarHBondContact SG-OD1 3.04Å; S338-N346 PolarHBondContact N-OD1 2.82Å; S338-N346 PolarHBondContact OG-ND2 3.42Å; S338-N346 PolarHBondContact OG-OD1 2.97Å; F339-N346 HydrophobicContact CD2-CB 4.04Å; F339-N346 HydrophobicContact CE2-CB 3.57Å; F339-N346 HydrophobicContact CZ-CB 4.36Å; N346-T348 VanDerWaalsContact C-N 3.28Å; N346-T348 PolarHBondContact O-N 3.16Å; N346-C349 WeakPolarHBondContact O-CB 3.44Å; N346-C349 PolarHBondContact O-N 2.82Å; N346-L374 HydrophobicContact CB-CB 4.09Å; N346-L374 VanDerWaalsContact CB-O 3.25Å; N346-L374 WeakPolarHBondContact CB-O 3.49Å; N346-L374 PolarHBondContact ND2-O 2.87Å
347	A	82.1	Confident	84.2	Confident	28 Å²	28	60.3 Å²	60.3	23%	0.231	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-71.4	-20.6	-180	0	0	0	0	0	113.9	E345 L374	E345-A347 PolarHBondContact O-N 2.73Å; A347-L374 HydrophobicContact CB-CD1 4.46Å
348	T	84.3	Confident	84.3	Confident	75 Å²	75	68.4 Å²	68.4	46%	0.46	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-101.8	1.5	178	56	0	0	0	0	112.9	E345 N346 Q350	E345-T348 PolarHBondContact O-N 3.11Å; E345-T348 VanDerWaalsContact O-N 3.14Å; E345-T348 PolarHBondContact O-OG1 2.93Å; N346-T348 VanDerWaalsContact C-N 3.28Å; N346-T348 PolarHBondContact O-N 3.16Å; T348-Q350 PolarHBondContact O-N 3.13Å
349	C	86.4	Confident	84.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.363	C	S	.	.			trans	-62.8	118.9	179.6	-177.7	0	0	0	0	112.6	C337 F339 C340 H344 E345 N346 F352 R353	C337-C349 VanDerWaalsContact SG-SG 3.67Å; F339-C349 HydrophobicContact CD2-CB 4.07Å; C340-C349 VanDerWaalsContact SG-SG 3.61Å; H344-C349 WeakPolarHBondContact CE1-CA 3.46Å; H344-C349 WeakPolarHBondContact CE1-CB 3.46Å; E345-C349 PolarHBondContact O-N 2.84Å; N346-C349 WeakPolarHBondContact O-CB 3.44Å; N346-C349 PolarHBondContact O-N 2.82Å; C349-F352 HydrophobicContact CB-CB 3.79Å; C349-F352 PolarHBondContact O-N 2.82Å; C349-F352 PolarHBondContact SG-N 2.73Å; C349-F352 VanDerWaalsContact SG-N 3.41Å; C349-R353 PolarHBondContact O-N 3.49Å
350	Q	85.5	Confident	84.8	Confident	107 Å²	107	69 Å²	69	50%	0.5	37%	0.366	S	S	.	.	H	α-helix	trans	-70.2	-37.1	178.3	-157.7	68.2	16.9	0	0	111.9	T348 F352 R353 N354	T348-Q350 PolarHBondContact O-N 3.13Å; Q350-F352 PolarHBondContact O-N 3.37Å; Q350-R353 PolarHBondContact O-N 3.21Å; Q350-R353 VanDerWaalsContact O-N 3.09Å; Q350-N354 PolarHBondContact NE2-OD1 3.3Å; Q350-N354 WeakPolarHBondContact O-CB 3.5Å; Q350-N354 PolarHBondContact O-N 3.45Å; Q350-N354 PolarHBondContact O-OD1 2.79Å
351	C	86.8	Confident	85.1	Confident	71 Å²	71	69.2 Å²	69.2	48%	0.48	36%	0.36	S	S	.	.	H	α-helix	trans	-58.7	-34.8	173.9	-56.1	0	0	0	0	111.8	C340 V355	C340-C351 HydrophobicContact CB-CB 3.96Å; C351-V355 WeakPolarHBondContact O-CG2 3.49Å
352	F	89.6	Confident	85.4	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-76	-35.5	175	-175.3	-106.3	0	0	0	112.8	F339 C349 Q350 N354 V355 R360 M363 V364 L374 M395 L396	F339-F352 HydrophobicContact CD1-CD2 4.21Å; F339-F352 HydrophobicContact CD2-CB 3.76Å; F339-F352 AromaticContact CD2-CD2 3.91Å; F339-F352 HydrophobicContact CD2-CD2 3.91Å; F339-F352 AromaticContact CD2-CG 3.86Å; F339-F352 HydrophobicContact CD2-CG 3.86Å; F339-F352 HydrophobicContact CE1-CD2 4.11Å; F339-F352 HydrophobicContact CE1-CE2 4.23Å; F339-F352 HydrophobicContact CE2-CB 4.21Å; F339-F352 HydrophobicContact CE2-CD1 4.26Å; F339-F352 AromaticContact CE2-CD2 3.74Å; F339-F352 HydrophobicContact CE2-CD2 3.74Å; F339-F352 HydrophobicContact CE2-CE2 4.15Å; F339-F352 AromaticContact CE2-CG 3.8Å; F339-F352 HydrophobicContact CE2-CG 3.8Å; F339-F352 HydrophobicContact CG-CB 4.25Å; F339-F352 HydrophobicContact CG-CD2 4.14Å; F339-F352 HydrophobicContact CG-CG 4.44Å; F339-F352 AromaticContact CZ-CD2 3.88Å; F339-F352 HydrophobicContact CZ-CD2 3.88Å; F339-F352 AromaticContact CZ-CE2 3.92Å; F339-F352 HydrophobicContact CZ-CE2 3.92Å; F339-F352 HydrophobicContact CZ-CG 4.39Å; F339-F352 HydrophobicContact CZ-CZ 4.44Å; C349-F352 HydrophobicContact CB-CB 3.79Å; C349-F352 PolarHBondContact O-N 2.82Å; C349-F352 PolarHBondContact SG-N 2.73Å; C349-F352 VanDerWaalsContact SG-N 3.41Å; Q350-F352 PolarHBondContact O-N 3.37Å; F352-N354 VanDerWaalsContact C-N 3.35Å; F352-V355 WeakPolarHBondContact O-CG2 3.14Å; F352-R360 HydrophobicContact CD1-CG 4.37Å; F352-R360 HydrophobicContact CD2-CB 4.4Å; F352-R360 HydrophobicContact CD2-CG 3.98Å; F352-R360 HydrophobicContact CE1-CB 4.43Å; F352-R360 HydrophobicContact CE1-CG 4.08Å; F352-R360 HydrophobicContact CE2-CB 3.62Å; F352-R360 HydrophobicContact CE2-CG 3.65Å; F352-R360 HydrophobicContact CG-CG 4.33Å; F352-R360 HydrophobicContact CZ-CB 3.64Å; F352-R360 HydrophobicContact CZ-CG 3.71Å; F352-R360 WeakPolarHBondContact O-CD 3.26Å; F352-R360 WeakPolarHBondContact O-CG 3.45Å; F352-M363 HydrophobicContact CD2-CB 4.28Å; F352-M363 HydrophobicContact CD2-SD 4.02Å; F352-M363 HydrophobicContact CE2-CB 4.3Å; F352-V364 HydrophobicContact CE2-CG2 3.6Å; F352-V364 HydrophobicContact CZ-CG2 3.69Å; F352-L374 HydrophobicContact CD1-CD1 4.37Å; F352-L374 HydrophobicContact CE1-CD1 3.72Å; F352-L374 HydrophobicContact CE1-CD2 4.38Å; F352-L374 HydrophobicContact CZ-CD1 4.31Å; F352-L374 HydrophobicContact CZ-CD2 4.14Å; F352-M395 HydrophobicContact CD1-CE 4.36Å; F352-M395 HydrophobicContact CE1-CB 4.26Å; F352-L396 HydrophobicContact CZ-CD2 4.07Å
353	R	84.8	Confident	85.9	Confident	124 Å²	124	72.6 Å²	72.6	47%	0.468	36%	0.359	S	S	.	.	H	α-helix	trans	-69	-32	177.6	-83.7	178.3	179	-177.2	-1.1	113.8	C349 Q350 V355 M395	C349-R353 PolarHBondContact O-N 3.49Å; Q350-R353 PolarHBondContact O-N 3.21Å; Q350-R353 VanDerWaalsContact O-N 3.09Å; R353-V355 VanDerWaalsContact C-N 3.31Å; R353-V355 PolarHBondContact O-N 2.99Å; R353-M395 HydrophobicContact CB-CE 4.48Å; R353-M395 HydrophobicContact CG-CE 3.2Å; R353-M395 VanDerWaalsContact NE-CE 3.35Å
354	N	85.4	Confident	86.2	Confident	122 Å²	122	63.6 Å²	63.6	65%	0.652	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-6.5	-172.2	-69.1	-5.8	0	0	0	113.7	Q350 F352	Q350-N354 PolarHBondContact NE2-OD1 3.3Å; Q350-N354 WeakPolarHBondContact O-CB 3.5Å; Q350-N354 PolarHBondContact O-N 3.45Å; Q350-N354 PolarHBondContact O-OD1 2.79Å; F352-N354 VanDerWaalsContact C-N 3.35Å
355	V	86.4	Confident	86.4	Confident	53 Å²	53	68.5 Å²	68.5	32%	0.321	33%	0.334	S	S	.	.	S	Bend	trans	-92.7	151.9	170.4	-108.4	0	0	0	0	111.6	C351 F352 R353 R360 M363	C351-V355 WeakPolarHBondContact O-CG2 3.49Å; F352-V355 WeakPolarHBondContact O-CG2 3.14Å; R353-V355 VanDerWaalsContact C-N 3.31Å; R353-V355 PolarHBondContact O-N 2.99Å; V355-R360 HydrophobicContact CB-CG 4.44Å; V355-R360 HydrophobicContact CG2-CG 4.11Å; V355-R360 PolarHBondContact O-NE 3.4Å; V355-R360 VanDerWaalsContact O-NE 3.15Å; V355-M363 HydrophobicContact CG2-SD 3.59Å; V355-M363 VanDerWaalsContact CG2-SD 3.59Å
356	D	85.6	Confident	86.6	Confident	98 Å²	98	68.8 Å²	68.8	52%	0.524	34%	0.335	S	S	.	.			trans	-63	172.5	174.8	69.5	-11.6	0	0	0	112.2	K358 G359 R360	D356-K358 PolarHBondContact O-N 3.06Å; D356-G359 PolarHBondContact O-N 3.14Å; D356-G359 WeakPolarHBondContact OD1-CA 3.44Å; D356-G359 PolarHBondContact OD1-N 2.92Å; D356-R360 WeakPolarHBondContact O-CG 2.93Å; D356-R360 PolarHBondContact O-N 2.81Å; D356-R360 PolarHBondContact O-NE 3.06Å
357	A	82.2	Confident	86.5	Confident	9 Å²	9	73.2 Å²	73.2	7%	0.074	35%	0.354	C	S	.	.	H	α-helix	trans	-58.7	-39.7	-178.9	0	0	0	0	0	111.6	R360 W361 E398	A357-R360 PolarHBondContact O-N 2.92Å; A357-W361 PolarHBondContact O-N 2.76Å; A357-E398 HydrophobicContact CB-CB 4.36Å; A357-E398 HydrophobicContact CB-CG 4.48Å
358	K	84.7	Confident	86.5	Confident	172 Å²	172	81.8 Å²	81.8	75%	0.748	38%	0.38	S	S	*	.	H	α-helix	trans	-64.2	-45	178.5	-169	178.1	-179.9	-179	0	112.2	D356 W361 K362	D356-K358 PolarHBondContact O-N 3.06Å; K358-W361 PolarHBondContact O-N 2.94Å; K358-K362 PolarHBondContact O-N 3.47Å; K358-K362 VanDerWaalsContact O-N 3.16Å
359	G	88.3	Confident	86.6	Confident	16 Å²	16	78.3 Å²	78.3	17%	0.165	36%	0.359	C	S	.	.	H	α-helix	trans	-63.7	-41.6	175.5	0	0	0	0	0	112.4	D356 W361 K362 M363	D356-G359 PolarHBondContact O-N 3.14Å; D356-G359 WeakPolarHBondContact OD1-CA 3.44Å; D356-G359 PolarHBondContact OD1-N 2.92Å; G359-W361 PolarHBondContact O-N 3.5Å; G359-K362 WeakPolarHBondContact O-CB 3.41Å; G359-K362 PolarHBondContact O-N 2.97Å; G359-K362 VanDerWaalsContact O-N 3.15Å; G359-M363 WeakPolarHBondContact O-CG 3.44Å; G359-M363 PolarHBondContact O-N 3.43Å
360	R	91.9	Very high	86.5	Confident	43 Å²	43	78.4 Å²	78.4	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-60.5	-44.2	174.7	-76.6	-178.4	-80	-179.4	3.6	112.3	F352 V355 D356 A357 K362 M363 V364 M395 L396	F352-R360 HydrophobicContact CD1-CG 4.37Å; F352-R360 HydrophobicContact CD2-CB 4.4Å; F352-R360 HydrophobicContact CD2-CG 3.98Å; F352-R360 HydrophobicContact CE1-CB 4.43Å; F352-R360 HydrophobicContact CE1-CG 4.08Å; F352-R360 HydrophobicContact CE2-CB 3.62Å; F352-R360 HydrophobicContact CE2-CG 3.65Å; F352-R360 HydrophobicContact CG-CG 4.33Å; F352-R360 HydrophobicContact CZ-CB 3.64Å; F352-R360 HydrophobicContact CZ-CG 3.71Å; F352-R360 WeakPolarHBondContact O-CD 3.26Å; F352-R360 WeakPolarHBondContact O-CG 3.45Å; V355-R360 HydrophobicContact CB-CG 4.44Å; V355-R360 HydrophobicContact CG2-CG 4.11Å; V355-R360 PolarHBondContact O-NE 3.4Å; V355-R360 VanDerWaalsContact O-NE 3.15Å; D356-R360 WeakPolarHBondContact O-CG 2.93Å; D356-R360 PolarHBondContact O-N 2.81Å; D356-R360 PolarHBondContact O-NE 3.06Å; A357-R360 PolarHBondContact O-N 2.92Å; R360-K362 VanDerWaalsContact C-N 3.3Å; R360-K362 PolarHBondContact O-N 3.31Å; R360-M363 PolarHBondContact O-N 3.44Å; R360-V364 WeakPolarHBondContact O-CG2 3.44Å; R360-V364 PolarHBondContact O-N 3.25Å; R360-M395 WeakPolarHBondContact CD-O 3.35Å; R360-M395 PolarHBondContact NE-O 3.48Å; R360-M395 PolarHBondContact NH1-O 3.42Å; R360-L396 HydrophobicContact CB-CD2 4.01Å
361	W	90.8	Very high	86.7	Confident	51 Å²	51	76.4 Å²	76.4	19%	0.193	35%	0.349	C	S	.	.	H	α-helix	trans	-58.9	-39.9	173.9	-86.8	107.5	0	0	0	112.9	A357 K358 G359 R365 F371 Y392 L396	A357-W361 PolarHBondContact O-N 2.76Å; K358-W361 PolarHBondContact O-N 2.94Å; G359-W361 PolarHBondContact O-N 3.5Å; W361-R365 WeakPolarHBondContact O-CG 3.48Å; W361-R365 PolarHBondContact O-N 2.95Å; W361-F371 HydrophobicContact CZ3-CD1 4.41Å; W361-F371 HydrophobicContact CZ3-CD2 4.23Å; W361-F371 HydrophobicContact CZ3-CE2 4.47Å; W361-F371 HydrophobicContact CZ3-CG 4.2Å; W361-Y392 AromaticContact CH2-CD1 3.58Å; W361-Y392 HydrophobicContact CH2-CD1 3.58Å; W361-Y392 HydrophobicContact CH2-CD2 4.43Å; W361-Y392 AromaticContact CH2-CE1 3.91Å; W361-Y392 HydrophobicContact CH2-CE1 3.91Å; W361-Y392 AromaticContact CH2-CG 3.86Å; W361-Y392 HydrophobicContact CH2-CG 3.86Å; W361-Y392 HydrophobicContact CZ2-CD1 4.24Å; W361-Y392 HydrophobicContact CZ2-CD2 4.36Å; W361-Y392 HydrophobicContact CZ2-CG 4.06Å; W361-L396 HydrophobicContact CD2-CB 4.46Å; W361-L396 HydrophobicContact CD2-CD1 4.46Å; W361-L396 HydrophobicContact CD2-CD2 4.12Å; W361-L396 HydrophobicContact CE3-CD1 4.36Å; W361-L396 HydrophobicContact CG-CD2 4.22Å; W361-L396 HydrophobicContact CH2-CD1 4.03Å; W361-L396 HydrophobicContact CZ2-CB 3.82Å; W361-L396 HydrophobicContact CZ2-CD1 4.09Å; W361-L396 HydrophobicContact CZ2-CG 4.46Å; W361-L396 HydrophobicContact CZ3-CD1 4.15Å; W361-L396 PolarHBondContact NE1-O 3.47Å
362	K	88.9	Confident	86.7	Confident	132 Å²	132	73.8 Å²	73.8	57%	0.574	33%	0.33	S	S	*	.	H	α-helix	trans	-62.5	-48.9	175.6	-175	177.4	173.7	-179.6	0	111.4	K358 G359 R360 V364 R365 E366	K358-K362 PolarHBondContact O-N 3.47Å; K358-K362 VanDerWaalsContact O-N 3.16Å; G359-K362 WeakPolarHBondContact O-CB 3.41Å; G359-K362 PolarHBondContact O-N 2.97Å; G359-K362 VanDerWaalsContact O-N 3.15Å; R360-K362 VanDerWaalsContact C-N 3.3Å; R360-K362 PolarHBondContact O-N 3.31Å; K362-V364 PolarHBondContact O-N 3.12Å; K362-R365 PolarHBondContact O-N 3.19Å; K362-E366 WeakPolarHBondContact CE-OE1 3.25Å; K362-E366 HydrophobicContact CG-CG 4.48Å; K362-E366 WeakPolarHBondContact CG-OE1 3.42Å; K362-E366 IonicContact NZ-OE1 3.08Å; K362-E366 WeakPolarHBondContact O-CG 3.27Å; K362-E366 PolarHBondContact O-N 2.8Å
363	M	90.5	Very high	86.5	Confident	42 Å²	42	74.8 Å²	74.8	21%	0.207	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-43.2	-179.9	-68.1	-176.6	82.8	0	0	113.1	F339 F352 V355 G359 R360 R365 E366 K367	F339-M363 HydrophobicContact CB-CE 3.75Å; F339-M363 HydrophobicContact CD1-CB 4.16Å; F339-M363 HydrophobicContact CD1-CE 4.16Å; F339-M363 HydrophobicContact CE1-CB 4.29Å; F339-M363 HydrophobicContact CG-CE 4.21Å; F352-M363 HydrophobicContact CD2-CB 4.28Å; F352-M363 HydrophobicContact CD2-SD 4.02Å; F352-M363 HydrophobicContact CE2-CB 4.3Å; V355-M363 HydrophobicContact CG2-SD 3.59Å; V355-M363 VanDerWaalsContact CG2-SD 3.59Å; G359-M363 WeakPolarHBondContact O-CG 3.44Å; G359-M363 PolarHBondContact O-N 3.43Å; R360-M363 PolarHBondContact O-N 3.44Å; M363-R365 VanDerWaalsContact C-N 3.32Å; M363-R365 PolarHBondContact O-N 3.14Å; M363-E366 PolarHBondContact O-N 3.3Å; M363-K367 WeakPolarHBondContact O-CB 3.34Å; M363-K367 WeakPolarHBondContact O-CG 3.38Å; M363-K367 PolarHBondContact O-N 3Å
364	V	89.7	Confident	86.6	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64	-38.8	179.4	175.9	0	0	0	0	111.4	F339 F352 R360 K362 R368 A369 F371 L374 L396	F339-V364 HydrophobicContact CE1-CG2 4.22Å; F339-V364 HydrophobicContact CZ-CG2 4.01Å; F352-V364 HydrophobicContact CE2-CG2 3.6Å; F352-V364 HydrophobicContact CZ-CG2 3.69Å; R360-V364 WeakPolarHBondContact O-CG2 3.44Å; R360-V364 PolarHBondContact O-N 3.25Å; K362-V364 PolarHBondContact O-N 3.12Å; V364-R368 PolarHBondContact O-N 3.23Å; V364-R368 VanDerWaalsContact O-N 3.13Å; V364-A369 HydrophobicContact CG1-CB 4Å; V364-A369 VanDerWaalsContact CG1-O 3.23Å; V364-A369 WeakPolarHBondContact CG1-O 3.32Å; V364-A369 PolarHBondContact O-N 2.9Å; V364-F371 HydrophobicContact CG1-CD1 3.39Å; V364-F371 HydrophobicContact CG1-CE1 3.68Å; V364-L374 HydrophobicContact CG2-CD2 3.74Å; V364-L396 HydrophobicContact CG2-CD2 3.98Å
365	R	86.1	Confident	86.3	Confident	163 Å²	163	64 Å²	64	62%	0.615	29%	0.293	S	S	*	.	H	α-helix	trans	-69.5	-47	177.3	-71.3	175.9	-175.9	173.4	2.8	112.3	W361 K362 M363 K367 R368 F371	W361-R365 WeakPolarHBondContact O-CG 3.48Å; W361-R365 PolarHBondContact O-N 2.95Å; K362-R365 PolarHBondContact O-N 3.19Å; M363-R365 VanDerWaalsContact C-N 3.32Å; M363-R365 PolarHBondContact O-N 3.14Å; R365-K367 VanDerWaalsContact C-N 3.32Å; R365-K367 PolarHBondContact O-N 3.4Å; R365-R368 PolarHBondContact O-N 2.88Å; R365-F371 HydrophobicContact CG-CE1 4.31Å; R365-F371 HydrophobicContact CG-CZ 4.25Å
366	E	84.7	Confident	85.9	Confident	123 Å²	123	64.7 Å²	64.7	58%	0.575	30%	0.3	S	S	*	.	H	α-helix	trans	-61.4	-40.2	179.7	-76.2	175.5	176.9	0	0	112.2	K362 M363 R368	K362-E366 WeakPolarHBondContact CE-OE1 3.25Å; K362-E366 HydrophobicContact CG-CG 4.48Å; K362-E366 WeakPolarHBondContact CG-OE1 3.42Å; K362-E366 IonicContact NZ-OE1 3.08Å; K362-E366 WeakPolarHBondContact O-CG 3.27Å; K362-E366 PolarHBondContact O-N 2.8Å; M363-E366 PolarHBondContact O-N 3.3Å; E366-R368 VanDerWaalsContact C-N 3.33Å
367	K	82.1	Confident	85.5	Confident	109 Å²	109	64 Å²	64	47%	0.474	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	5.6	-179.8	-59.6	-61.7	-172.7	177.7	0	113.8	S338 F339 M363 R365 A369	S338-K367 VanDerWaalsContact O-CD 3.26Å; S338-K367 WeakPolarHBondContact O-CD 3.29Å; S338-K367 VanDerWaalsContact O-CE 3.27Å; S338-K367 WeakPolarHBondContact O-CE 3.47Å; S338-K367 WeakPolarHBondContact O-CG 3.22Å; F339-K367 HydrophobicContact CD1-CB 4.47Å; F339-K367 HydrophobicContact CD1-CG 4.22Å; F339-K367 HydrophobicContact CE1-CB 4.4Å; M363-K367 WeakPolarHBondContact O-CB 3.34Å; M363-K367 WeakPolarHBondContact O-CG 3.38Å; M363-K367 PolarHBondContact O-N 3Å; R365-K367 VanDerWaalsContact C-N 3.32Å; R365-K367 PolarHBondContact O-N 3.4Å; K367-A369 PolarHBondContact O-N 3.21Å
368	R	82.6	Confident	85.5	Confident	207 Å²	207	67 Å²	67	78%	0.781	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	41.8	-178.2	-59.5	-176.6	179.2	-172.7	-0.4	113.1	V364 R365 E366	V364-R368 PolarHBondContact O-N 3.23Å; V364-R368 VanDerWaalsContact O-N 3.13Å; R365-R368 PolarHBondContact O-N 2.88Å; E366-R368 VanDerWaalsContact C-N 3.33Å
369	A	85.8	Confident	85	Confident	3 Å²	3	64.5 Å²	64.5	3%	0.025	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-82.6	147.1	177	0	0	0	0	0	110.6	F339 V364 K367 F371 G375	F339-A369 HydrophobicContact CE1-CB 4.38Å; F339-A369 HydrophobicContact CZ-CB 4.2Å; V364-A369 HydrophobicContact CG1-CB 4Å; V364-A369 VanDerWaalsContact CG1-O 3.23Å; V364-A369 WeakPolarHBondContact CG1-O 3.32Å; V364-A369 PolarHBondContact O-N 2.9Å; K367-A369 PolarHBondContact O-N 3.21Å; A369-F371 WeakPolarHBondContact O-CD1 3.26Å; A369-F371 PolarHBondContact O-N 3.44Å; A369-G375 CarbonylContact C-O 3.5Å; A369-G375 WeakPolarHBondContact CA-O 3.37Å
370	C	85	Confident	84.4	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.007	32%	0.323	C	S	.	.			trans	-62.4	128.2	178.8	173.5	0	0	0	0	111.2	L372 L374 G375 Y378	C370-L372 PolarHBondContact O-N 3.31Å; C370-L374 WeakPolarHBondContact O-CA 3.49Å; C370-L374 PolarHBondContact O-N 3.02Å; C370-G375 PolarHBondContact N-O 3.41Å; C370-Y378 HydrophobicContact CB-CD2 4Å; C370-Y378 HydrophobicContact CB-CE2 3.58Å
371	F	89.7	Confident	83.6	Confident	66 Å²	66	70.5 Å²	70.5	29%	0.289	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.8	-176.4	-56.8	-17.9	0	0	0	113.8	W361 V364 R365 A369 M380 Y392 H393	W361-F371 HydrophobicContact CZ3-CD1 4.41Å; W361-F371 HydrophobicContact CZ3-CD2 4.23Å; W361-F371 HydrophobicContact CZ3-CE2 4.47Å; W361-F371 HydrophobicContact CZ3-CG 4.2Å; V364-F371 HydrophobicContact CG1-CD1 3.39Å; V364-F371 HydrophobicContact CG1-CE1 3.68Å; R365-F371 HydrophobicContact CG-CE1 4.31Å; R365-F371 HydrophobicContact CG-CZ 4.25Å; A369-F371 WeakPolarHBondContact O-CD1 3.26Å; A369-F371 PolarHBondContact O-N 3.44Å; F371-M380 HydrophobicContact CB-SD 4.08Å; F371-M380 HydrophobicContact CD2-SD 4.45Å; F371-Y392 HydrophobicContact CB-CD1 4.22Å; F371-H393 WeakPolarHBondContact O-CB 3.29Å; F371-H393 PolarHBondContact O-N 3.4Å
372	L	85.8	Confident	82.8	Confident	15 Å²	15	73.6 Å²	73.6	8%	0.079	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-38.9	-177.6	-114.3	156.7	0	0	0	112.6	C370 M380 K386 V390 H393	C370-L372 PolarHBondContact O-N 3.31Å; L372-M380 HydrophobicContact CB-CG 4.18Å; L372-M380 HydrophobicContact CD1-CE 4.09Å; L372-M380 HydrophobicContact CD1-CG 3.57Å; L372-M380 HydrophobicContact CD1-SD 4.17Å; L372-M380 HydrophobicContact CG-CG 4.17Å; L372-K386 HydrophobicContact CD1-CB 4.39Å; L372-K386 HydrophobicContact CD1-CG 4.21Å; L372-V390 HydrophobicContact CD2-CB 4.27Å; L372-V390 HydrophobicContact CD2-CG1 3.8Å; L372-H393 WeakPolarHBondContact O-CB 3.32Å; L372-H393 PolarHBondContact O-CD2 3.2Å; L372-H393 VanDerWaalsContact O-CD2 3.28Å
373	C	84.7	Confident	82.4	Confident	21 Å²	21	67.7 Å²	67.7	14%	0.142	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	1.8	-173.1	64.5	0	0	0	0	115.1	G375 Y378 C383 K385	C373-G375 PolarHBondContact O-N 2.83Å; C373-G375 VanDerWaalsContact O-N 3.14Å; C373-Y378 PolarHBondContact SG-OH 3.06Å; C373-C383 PolarHBondContact SG-SG 2.85Å; C373-K385 HydrophobicContact CB-CD 3.94Å
374	L	86.7	Confident	81.8	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	37%	0.365	C	S	.	.			trans	63.1	9.6	-179.2	-50.4	174.7	0	0	0	115.3	N346 A347 F352 V364 C370 H393 M395 L396	N346-L374 HydrophobicContact CB-CB 4.09Å; N346-L374 VanDerWaalsContact CB-O 3.25Å; N346-L374 WeakPolarHBondContact CB-O 3.49Å; N346-L374 PolarHBondContact ND2-O 2.87Å; A347-L374 HydrophobicContact CB-CD1 4.46Å; F352-L374 HydrophobicContact CD1-CD1 4.37Å; F352-L374 HydrophobicContact CE1-CD1 3.72Å; F352-L374 HydrophobicContact CE1-CD2 4.38Å; F352-L374 HydrophobicContact CZ-CD1 4.31Å; F352-L374 HydrophobicContact CZ-CD2 4.14Å; V364-L374 HydrophobicContact CG2-CD2 3.74Å; C370-L374 WeakPolarHBondContact O-CA 3.49Å; C370-L374 PolarHBondContact O-N 3.02Å; L374-H393 HydrophobicContact CD2-CB 4.3Å; L374-H393 HydrophobicContact CG-CB 4.28Å; L374-M395 HydrophobicContact CD1-SD 4.47Å; L374-L396 HydrophobicContact CD2-CD1 4.42Å
375	G	80.3	Confident	81.1	Confident	18 Å²	18	78.1 Å²	78.1	19%	0.186	39%	0.394	C	S	.	.			trans	-70.7	150.4	175.9	0	0	0	0	0	113.3	A369 C370 C373	A369-G375 CarbonylContact C-O 3.5Å; A369-G375 WeakPolarHBondContact CA-O 3.37Å; C370-G375 PolarHBondContact N-O 3.41Å; C373-G375 PolarHBondContact O-N 2.83Å; C373-G375 VanDerWaalsContact O-N 3.14Å
376	S	78.6	Confident	80.2	Confident	68 Å²	68	76.9 Å²	76.9	48%	0.476	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-98.8	148.5	178.4	51.5	0	0	0	0	112
377	G	77.1	Confident	79.3	Confident	83 Å²	83	77.8 Å²	77.8	86%	0.856	40%	0.397	S	S	*	.	S	Bend	trans	99.5	-2.8	173.3	0	0	0	0	0	115.5
378	Y	81	Confident	78	Confident	73 Å²	73	82.2 Å²	82.2	29%	0.286	42%	0.42	S	S	.	.	S	Bend	trans	-149.2	155.5	176.2	58.9	-88.1	0	0	0	110.4	C370 C373 E382 C383	C370-Y378 HydrophobicContact CB-CD2 4Å; C370-Y378 HydrophobicContact CB-CE2 3.58Å; C373-Y378 PolarHBondContact SG-OH 3.06Å; Y378-E382 WeakPolarHBondContact CA-OE2 3.38Å; Y378-C383 HydrophobicContact CD2-CB 4.18Å; Y378-C383 HydrophobicContact CE2-CB 3.9Å
379	Q	75.6	Confident	77	Confident	120 Å²	120	76.2 Å²	76.2	56%	0.561	42%	0.422	S	S	*	.			trans	-93	169.8	176.7	-67.1	-166.2	2.5	0	0	112.4	H381 E382 C383	Q379-H381 PolarHBondContact O-N 2.92Å; Q379-H381 VanDerWaalsContact O-N 3.14Å; Q379-H381 PolarHBondContact OE1-CE1 3.24Å; Q379-E382 PolarHBondContact N-OE2 3.06Å; Q379-E382 PolarHBondContact O-N 3.16Å; Q379-C383 PolarHBondContact O-N 2.91Å
380	M	74.3	Confident	75.9	Confident	58 Å²	58	79.3 Å²	79.3	29%	0.286	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-54.7	-33.5	-178.2	-170.9	179.9	126.9	0	0	113.7	F371 L372 E382 C383	F371-M380 HydrophobicContact CB-SD 4.08Å; F371-M380 HydrophobicContact CD2-SD 4.45Å; L372-M380 HydrophobicContact CB-CG 4.18Å; L372-M380 HydrophobicContact CD1-CE 4.09Å; L372-M380 HydrophobicContact CD1-CG 3.57Å; L372-M380 HydrophobicContact CD1-SD 4.17Å; L372-M380 HydrophobicContact CG-CG 4.17Å; M380-E382 VanDerWaalsContact C-N 3.3Å; M380-E382 PolarHBondContact O-N 3.06Å; M380-C383 WeakPolarHBondContact O-CB 3.33Å; M380-C383 PolarHBondContact O-N 3.4Å
381	H	75.3	Confident	75.2	Confident	127 Å²	127	85.6 Å²	85.6	59%	0.588	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-74.6	-19.8	-179.8	66.8	-88.5	0	0	0	113.6	Q379	Q379-H381 PolarHBondContact O-N 2.92Å; Q379-H381 VanDerWaalsContact O-N 3.14Å; Q379-H381 PolarHBondContact OE1-CE1 3.24Å
382	E	75.3	Confident	74.8	Confident	116 Å²	116	86.7 Å²	86.7	54%	0.542	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-98.3	2.3	177.9	-55.9	170.8	124.3	0	0	111.7	Y378 Q379 M380 S384	Y378-E382 WeakPolarHBondContact CA-OE2 3.38Å; Q379-E382 PolarHBondContact N-OE2 3.06Å; Q379-E382 PolarHBondContact O-N 3.16Å; M380-E382 VanDerWaalsContact C-N 3.3Å; M380-E382 PolarHBondContact O-N 3.06Å; E382-S384 PolarHBondContact O-N 3.25Å
383	C	79.7	Confident	74.6	Confident	8 Å²	8	87.6 Å²	87.6	5%	0.054	48%	0.476	C	S	.	.			trans	-77.1	119.2	-173.6	-172.3	0	0	0	0	111.3	C373 Y378 Q379 M380 K385 K386	C373-C383 PolarHBondContact SG-SG 2.85Å; Y378-C383 HydrophobicContact CD2-CB 4.18Å; Y378-C383 HydrophobicContact CE2-CB 3.9Å; Q379-C383 PolarHBondContact O-N 2.91Å; M380-C383 WeakPolarHBondContact O-CB 3.33Å; M380-C383 PolarHBondContact O-N 3.4Å; C383-K385 PolarHBondContact O-N 2.81Å; C383-K385 PolarHBondContact SG-N 2.95Å; C383-K386 WeakPolarHBondContact O-CB 3.43Å; C383-K386 PolarHBondContact O-N 2.68Å
384	S	77.6	Confident	74.4	Confident	119 Å²	119	91.2 Å²	91.2	83%	0.832	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-9.6	174.4	55.5	0	0	0	0	114.8	E382	E382-S384 PolarHBondContact O-N 3.25Å
385	K	75.7	Confident	74	Confident	141 Å²	141	92.6 Å²	92.6	61%	0.613	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	19.1	177.8	-58.5	-175.7	178.7	-179.7	0	113.3	C373 C383 E387	C373-K385 HydrophobicContact CB-CD 3.94Å; C383-K385 PolarHBondContact O-N 2.81Å; C383-K385 PolarHBondContact SG-N 2.95Å; K385-E387 PolarHBondContact O-N 2.54Å
386	K	67	Low	74.1	Confident	137 Å²	137	91.9 Å²	91.9	60%	0.596	50%	0.498	S	S	*	.			trans	-76.7	114.8	-179.6	-171.7	-179.4	177.6	-171.6	0	109.7	L372 C383	L372-K386 HydrophobicContact CD1-CB 4.39Å; L372-K386 HydrophobicContact CD1-CG 4.21Å; C383-K386 WeakPolarHBondContact O-CB 3.43Å; C383-K386 PolarHBondContact O-N 2.68Å
387	E	65.9	Low	73.6	Confident	142 Å²	142	93.8 Å²	93.8	66%	0.664	50%	0.501	S	S	*	.			trans	-115.4	150.3	174	-69.1	176.8	179.2	0	0	109.8	K385 G389	K385-E387 PolarHBondContact O-N 2.54Å; E387-G389 PolarHBondContact O-N 2.68Å
388	E	55.2	Low	72.3	Confident	203 Å²	203	97.8 Å²	97.8	95%	0.949	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	130.1	177.9	-73.6	-170.3	154.9	0	0	111.2
389	G	61.4	Low	70.5	Confident	81 Å²	81	103.8 Å²	103.8	84%	0.835	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.6	-13.2	176.3	0	0	0	0	0	116.2	E387	E387-G389 PolarHBondContact O-N 2.68Å
390	V	62.7	Low	68.4	Low	67 Å²	67	109.8 Å²	109.8	41%	0.406	54%	0.543	S	S	.	.			trans	-96.8	102.9	176.5	-174.2	0	0	0	0	110.1	L372	L372-V390 HydrophobicContact CD2-CB 4.27Å; L372-V390 HydrophobicContact CD2-CG1 3.8Å
391	Q	69	Low	66.1	Low	133 Å²	133	118.7 Å²	118.7	62%	0.621	57%	0.573	S	S	*	*			trans	-80.9	-41.8	-178.8	-72.4	-174.4	-14.4	0	0	113.5
392	Y	82.8	Confident	63.7	Low	89 Å²	89	124.2 Å²	124.2	35%	0.349	59%	0.589	S	S	.	*	S	Bend	trans	-144.1	155.6	-172.6	-48.6	-64	0	0	0	111.6	W361 F371 M397	W361-Y392 AromaticContact CH2-CD1 3.58Å; W361-Y392 HydrophobicContact CH2-CD1 3.58Å; W361-Y392 HydrophobicContact CH2-CD2 4.43Å; W361-Y392 AromaticContact CH2-CE1 3.91Å; W361-Y392 HydrophobicContact CH2-CE1 3.91Å; W361-Y392 AromaticContact CH2-CG 3.86Å; W361-Y392 HydrophobicContact CH2-CG 3.86Å; W361-Y392 HydrophobicContact CZ2-CD1 4.24Å; W361-Y392 HydrophobicContact CZ2-CD2 4.36Å; W361-Y392 HydrophobicContact CZ2-CG 4.06Å; F371-Y392 HydrophobicContact CB-CD1 4.22Å; Y392-M397 HydrophobicContact CD2-SD 4.26Å
393	H	81.4	Confident	61.3	Low	34 Å²	34	128 Å²	128	16%	0.157	61%	0.607	C	S	.	*			trans	-60.1	136.8	177	-168.8	-94.9	0	0	0	110.7	F371 L372 L374 M395 L396	F371-H393 WeakPolarHBondContact O-CB 3.29Å; F371-H393 PolarHBondContact O-N 3.4Å; L372-H393 WeakPolarHBondContact O-CB 3.32Å; L372-H393 PolarHBondContact O-CD2 3.2Å; L372-H393 VanDerWaalsContact O-CD2 3.28Å; L374-H393 HydrophobicContact CD2-CB 4.3Å; L374-H393 HydrophobicContact CG-CB 4.28Å; H393-M395 VanDerWaalsContact CE1-SD 3.58Å; H393-M395 PolarHBondContact ND1-N 2.94Å; H393-M395 PolarHBondContact O-N 2.83Å; H393-L396 HydrophobicContact CB-CD1 4.43Å; H393-L396 WeakPolarHBondContact O-CB 3.4Å; H393-L396 PolarHBondContact O-N 3.48Å
394	P	79.8	Confident	58.6	Low	97 Å²	97	137.6 Å²	137.6	63%	0.63	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-55.6	-26.4	-175	-27.5	33.8	0	0	0	115	L396 M397	P394-L396 VanDerWaalsContact C-N 3.25Å; P394-L396 PolarHBondContact O-N 3.28Å; P394-M397 PolarHBondContact O-N 3.4Å
395	M	78.9	Confident	56.1	Low	31 Å²	31	135.6 Å²	135.6	15%	0.153	65%	0.645	C	S	.	*	G	3₁₀ helix	trans	-74.1	-12.9	177.4	-60.6	179	81.1	0	0	113.8	F352 R353 R360 L374 H393 M397	F352-M395 HydrophobicContact CD1-CE 4.36Å; F352-M395 HydrophobicContact CE1-CB 4.26Å; R353-M395 HydrophobicContact CB-CE 4.48Å; R353-M395 HydrophobicContact CG-CE 3.2Å; R353-M395 VanDerWaalsContact NE-CE 3.35Å; R360-M395 WeakPolarHBondContact CD-O 3.35Å; R360-M395 PolarHBondContact NE-O 3.48Å; R360-M395 PolarHBondContact NH1-O 3.42Å; L374-M395 HydrophobicContact CD1-SD 4.47Å; H393-M395 VanDerWaalsContact CE1-SD 3.58Å; H393-M395 PolarHBondContact ND1-N 2.94Å; H393-M395 PolarHBondContact O-N 2.83Å; M395-M397 VanDerWaalsContact C-N 3.32Å
396	L	81	Confident	53.5	Low	3 Å²	3	138.5 Å²	138.5	2%	0.016	66%	0.661	C	S	.	*	G	3₁₀ helix	trans	-88.3	-3.8	172.9	-66.6	175.2	0	0	0	112.5	F352 R360 W361 V364 L374 H393 P394	F352-L396 HydrophobicContact CZ-CD2 4.07Å; R360-L396 HydrophobicContact CB-CD2 4.01Å; W361-L396 HydrophobicContact CD2-CB 4.46Å; W361-L396 HydrophobicContact CD2-CD1 4.46Å; W361-L396 HydrophobicContact CD2-CD2 4.12Å; W361-L396 HydrophobicContact CE3-CD1 4.36Å; W361-L396 HydrophobicContact CG-CD2 4.22Å; W361-L396 HydrophobicContact CH2-CD1 4.03Å; W361-L396 HydrophobicContact CZ2-CB 3.82Å; W361-L396 HydrophobicContact CZ2-CD1 4.09Å; W361-L396 HydrophobicContact CZ2-CG 4.46Å; W361-L396 HydrophobicContact CZ3-CD1 4.15Å; W361-L396 PolarHBondContact NE1-O 3.47Å; V364-L396 HydrophobicContact CG2-CD2 3.98Å; L374-L396 HydrophobicContact CD2-CD1 4.42Å; H393-L396 HydrophobicContact CB-CD1 4.43Å; H393-L396 WeakPolarHBondContact O-CB 3.4Å; H393-L396 PolarHBondContact O-N 3.48Å; P394-L396 VanDerWaalsContact C-N 3.25Å; P394-L396 PolarHBondContact O-N 3.28Å
397	M	68.3	Low	51.4	Low	107 Å²	107	136.8 Å²	136.8	53%	0.527	67%	0.672	S	S	.	*	S	Bend	trans	-100.8	138.7	-175.3	-55.5	-67.6	-88.9	0	0	111.2	Y392 P394 M395	Y392-M397 HydrophobicContact CD2-SD 4.26Å; P394-M397 PolarHBondContact O-N 3.4Å; M395-M397 VanDerWaalsContact C-N 3.32Å
398	E	51	Low	49.4	Very low	168 Å²	168	135.9 Å²	135.9	79%	0.785	68%	0.682	S	S	*	*			trans	-84.5	116.8	-175.3	-161.1	159.7	-144.7	0	0	111.4	A357 R400	A357-E398 HydrophobicContact CB-CB 4.36Å; A357-E398 HydrophobicContact CB-CG 4.48Å; E398-R400 PolarHBondContact O-N 3.19Å
399	K	43.4	Very low	47.9	Very low	198 Å²	198	134 Å²	134	86%	0.861	67%	0.673	S	S	*	*			trans	-78.1	109.8	-180	-77.5	-173.7	176.5	-178.4	0	110.6	R401	K399-R401 PolarHBondContact O-N 3.35Å
400	R	30.5	Very low	46	Very low	247 Å²	247	137.6 Å²	137.6	93%	0.932	67%	0.673	S	S	*	*			trans	-66.3	111.7	166.9	-78.5	-177.5	163.9	-176.3	-5.1	110.2	E398 R402	E398-R400 PolarHBondContact O-N 3.19Å; R400-R402 PolarHBondContact O-N 3.48Å
401	R	26.9	Very low	44.3	Very low	244 Å²	244	145.9 Å²	145.9	92%	0.921	70%	0.697	S	S	*	*			trans	-65.1	122.8	172.3	-81.7	179.4	164.8	179.6	-4.3	109.7	K399	K399-R401 PolarHBondContact O-N 3.35Å
402	R	24.9	Very low	42.4	Very low	243 Å²	243	148.8 Å²	148.8	92%	0.917	71%	0.707	S	S	*	*			trans	-113.8	121.7	162	-89.5	-176.4	167	177.8	-3.7	107.9	R400	R400-R402 PolarHBondContact O-N 3.48Å
403	E	25.2	Very low	40.1	Very low	197 Å²	197	146 Å²	146	92%	0.921	70%	0.699	S	S	*	*			trans	-68.6	135.6	179.8	-69.9	171.6	160.4	0	0	110.7	G405	E403-G405 PolarHBondContact O-N 2.94Å
404	K	22	Very low	38	Very low	208 Å²	208	148.3 Å²	148.3	90%	0.904	71%	0.711	S	S	*	*			trans	-85.5	104.1	-178.2	-75	-179.1	173.9	-177.7	0	109.3
405	G	24.3	Very low	36.3	Very low	77 Å²	77	144.5 Å²	144.5	79%	0.794	69%	0.685	S	S	*	*			trans	-84.5	118.8	162	0	0	0	0	0	110.3	E403	E403-G405 PolarHBondContact O-N 2.94Å
406	Q	21.6	Very low	34.5	Very low	203 Å²	203	144.4 Å²	144.4	95%	0.949	69%	0.692	S	S	*	*			trans	-69.1	129	170.4	-74.9	164.9	-41.8	0	0	109.7
407	A	23.4	Very low	32.5	Very low	100 Å²	100	147.8 Å²	147.8	83%	0.826	71%	0.71	S	S	*	*			trans	-124.2	119	171.9	0	0	0	0	0	109.6
408	S	23.6	Very low	30.9	Very low	123 Å²	123	145.4 Å²	145.4	86%	0.86	71%	0.707	S	S	*	*			trans	-59.6	137.3	-177.8	-172.9	0	0	0	0	113	N410	S408-N410 PolarHBondContact O-N 3.4Å
409	E	23.8	Very low	30	Very low	165 Å²	165	140 Å²	140	77%	0.771	70%	0.697	S	S	*	*			trans	-66.9	121.6	173.8	-73.8	175	133.8	0	0	111.7
410	N	22.4	Very low	29.4	Very low	155 Å²	155	137.5 Å²	137.5	83%	0.829	69%	0.69	S	S	*	*			trans	-164.1	86.4	148.7	-102.5	-27.4	0	0	0	107.8	S408 K412	S408-N410 PolarHBondContact O-N 3.4Å; N410-K412 PolarHBondContact O-N 3.36Å
411	R	27.1	Very low	29.7	Very low	242 Å²	242	131 Å²	131	91%	0.913	68%	0.68	S	S	*	*			trans	-71.7	91.9	-174.2	-74	-179.3	178	172.4	0.3	110.8
412	K	28.3	Very low	30.6	Very low	193 Å²	193	122.9 Å²	122.9	84%	0.839	66%	0.657	S	S	*	*			trans	-72.3	134	167.8	-74.3	-179.2	178	176.6	0	110.3	N410 Q414	N410-K412 PolarHBondContact O-N 3.36Å; K412-Q414 PolarHBondContact O-N 2.98Å
413	V	35.1	Very low	31.8	Very low	30 Å²	30	119.8 Å²	119.8	18%	0.182	65%	0.651	C	S	.	*			trans	-63.8	122.4	177.9	-177.3	0	0	0	0	109.6	Y486	V413-Y486 HydrophobicContact CG1-CE2 4.11Å; V413-Y486 WeakPolarHBondContact CG1-OH 3.27Å
414	Q	37.4	Very low	33.4	Very low	84 Å²	84	111.3 Å²	111.3	39%	0.393	62%	0.616	S	S	.	*			trans	-142.2	126.3	173.7	-175.2	168.2	-32.5	0	0	109.5	K412 G416 K521	K412-Q414 PolarHBondContact O-N 2.98Å; Q414-G416 PolarHBondContact O-N 3.39Å; Q414-K521 HydrophobicContact CG-CD 4.37Å
415	V	43.3	Very low	35.8	Very low	17 Å²	17	103.1 Å²	103.1	10%	0.103	58%	0.58	C	S	.	*			trans	-65	114.3	168.6	-171.9	0	0	0	0	107	T479 L519 I522	V415-T479 HydrophobicContact CG1-CG2 4.17Å; V415-L519 HydrophobicContact CG2-CD1 4.22Å; V415-I522 VanDerWaalsContact CB-O 3.29Å; V415-I522 WeakPolarHBondContact CB-O 3.43Å; V415-I522 VanDerWaalsContact CG2-O 3.23Å; V415-I522 WeakPolarHBondContact CG2-O 3.39Å
416	G	40.6	Very low	38.5	Very low	28 Å²	28	103.8 Å²	103.8	29%	0.289	57%	0.568	S	S	.	*			trans	-69.1	147.4	-164.5	0	0	0	0	0	114.6	Q414	Q414-G416 PolarHBondContact O-N 3.39Å
417	L	38.3	Very low	41.5	Very low	74 Å²	74	94.8 Å²	94.8	39%	0.387	53%	0.526	S	S	.	.			trans	-114.6	116.9	-176.6	-154	90.6	0	0	0	108.8	R605	L417-R605 HydrophobicContact CD1-CB 3.79Å; L417-R605 HydrophobicContact CD1-CG 3.84Å; L417-R605 HydrophobicContact CD2-CG 4.28Å; L417-R605 HydrophobicContact CG-CB 4.5Å; L417-R605 HydrophobicContact CG-CG 4.43Å
418	A	36	Very low	44.6	Very low	57 Å²	57	92.4 Å²	92.4	47%	0.471	50%	0.499	S	S	.	.			trans	-98.5	125.2	169.4	0	0	0	0	0	109.7
419	G	32.1	Very low	47.8	Very low	56 Å²	56	88.4 Å²	88.4	58%	0.577	47%	0.467	S	S	*	.			trans	-114.3	128.6	-176.6	0	0	0	0	0	112.8
420	M	31.1	Very low	51.2	Low	145 Å²	145	81 Å²	81	71%	0.714	43%	0.433	S	S	*	.			trans	-124	149.9	159.3	-71.2	-141.8	77.9	0	0	109.1	V604	M420-V604 WeakPolarHBondContact O-CB 3.27Å; M420-V604 WeakPolarHBondContact O-CG2 3.43Å
421	P	36.7	Very low	54.6	Low	110 Å²	110	73.6 Å²	73.6	71%	0.714	39%	0.393	S	S	*	.			trans	-72.4	131	-177.3	14.8	-9.8	0	0	0	111.7
422	T	46.4	Very low	57.8	Low	73 Å²	73	66 Å²	66	45%	0.448	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-133.1	161.7	170.9	61.8	0	0	0	0	110.9	G424 V604	T422-G424 VanDerWaalsContact C-N 3.31Å; T422-G424 PolarHBondContact O-N 2.98Å; T422-V604 HydrophobicContact CG2-CG2 3.93Å; T422-V604 VanDerWaalsContact OG1-CG2 3.25Å; T422-V604 WeakPolarHBondContact OG1-CG2 3.39Å
423	K	49.5	Very low	60.9	Low	179 Å²	179	56.8 Å²	56.8	78%	0.778	33%	0.325	S	S	*	.	S	Bend	trans	-80	5.1	-173.1	-81.9	-174.6	174.9	-178.7	0	115.4
424	G	59.2	Low	63.7	Low	19 Å²	19	56.2 Å²	56.2	20%	0.196	32%	0.321	C	S	.	.	S	Bend	trans	-148.2	152.9	-173	0	0	0	0	0	114.2	T422	T422-G424 VanDerWaalsContact C-N 3.31Å; T422-G424 PolarHBondContact O-N 2.98Å
425	R	72.3	Confident	66.5	Low	36 Å²	36	52.2 Å²	52.2	14%	0.136	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	136.3	175.8	-169.9	175	-179.9	-150.4	-17.9	109.4	A528 S594 I595 V601	R425-A528 PolarHBondContact NH1-O 2.8Å; R425-A528 PolarHBondContact NH2-O 3.17Å; R425-S594 CarbonylContact O-C 3.59Å; R425-S594 WeakPolarHBondContact O-CA 3.49Å; R425-I595 PolarHBondContact N-O 3.35Å; R425-I595 PolarHBondContact O-N 3.14Å; R425-V601 HydrophobicContact CB-CG2 4.13Å
426	V	79.3	Confident	68.8	Low	91 Å²	91	53.7 Å²	53.7	55%	0.552	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.3	178	-177.6	0	0	0	0	110.3	G593	V426-G593 WeakPolarHBondContact CA-O 3.11Å
427	L	84.9	Confident	71.2	Confident	14 Å²	14	52.9 Å²	52.9	7%	0.073	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	125.5	168.7	-66.6	-172.4	0	0	0	109.9	N529 F548 L580 V591 C592 G593 I595	L427-N529 HydrophobicContact CD2-CB 4.1Å; L427-F548 HydrophobicContact CD1-CE1 3.96Å; L427-F548 HydrophobicContact CD1-CZ 4.26Å; L427-L580 HydrophobicContact CB-CD2 4.37Å; L427-L580 HydrophobicContact CD1-CD1 3.74Å; L427-L580 HydrophobicContact CD1-CD2 3.88Å; L427-L580 HydrophobicContact CD1-CG 4.48Å; L427-L580 HydrophobicContact CG-CD2 4.22Å; L427-V591 HydrophobicContact CD1-CG1 4.48Å; L427-C592 WeakPolarHBondContact O-CA 3.5Å; L427-C592 WeakPolarHBondContact O-CB 3.5Å; L427-G593 PolarHBondContact N-O 2.91Å; L427-G593 PolarHBondContact O-N 2.85Å; L427-G593 VanDerWaalsContact O-N 3.08Å; L427-I595 HydrophobicContact CD1-CD1 3.82Å; L427-I595 HydrophobicContact CD1-CG1 4.46Å; L427-I595 HydrophobicContact CD2-CD1 4.03Å; L427-I595 HydrophobicContact CG-CD1 3.68Å; L427-I595 HydrophobicContact CG-CG1 4.24Å
428	L	89.2	Confident	73.3	Confident	49 Å²	49	56.3 Å²	56.3	26%	0.257	31%	0.312	S	S	.	.			trans	-82.2	162.4	173.2	-60	178.2	0	0	0	110.6	T430 L448 L607	L428-T430 HydrophobicContact CB-CG2 4.31Å; L428-T430 PolarHBondContact O-N 3.23Å; L428-L448 HydrophobicContact CB-CD1 3.76Å; L428-L448 HydrophobicContact CD1-CD1 4.11Å; L428-L607 HydrophobicContact CD1-CD1 4.09Å
429	Q	91.8	Very high	75.5	Confident	39 Å²	39	58 Å²	58	18%	0.182	31%	0.313	C	S	.	.			trans	-75.4	87.9	178.2	-68.3	-175.8	7.1	0	0	111.3	L449 Y564 I590 C592	Q429-L449 HydrophobicContact CB-CB 4.04Å; Q429-L449 PolarHBondContact O-N 3.49Å; Q429-Y564 PolarHBondContact NE2-OH 2.98Å; Q429-Y564 VanDerWaalsContact NE2-OH 3.1Å; Q429-Y564 VanDerWaalsContact OE1-CE2 3.27Å; Q429-Y564 PolarHBondContact OE1-OH 3.01Å; Q429-I590 HydrophobicContact CB-CD1 3.72Å; Q429-I590 HydrophobicContact CG-CD1 3.85Å; Q429-C592 HydrophobicContact CG-CB 3.72Å
430	T	93.7	Very high	77.9	Confident	9 Å²	9	57.5 Å²	57.5	6%	0.055	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	144.4	-176.6	56.1	0	0	0	0	111.9	L428 M446 C447 L448 I526 D546 R550 I555 I590	L428-T430 HydrophobicContact CB-CG2 4.31Å; L428-T430 PolarHBondContact O-N 3.23Å; T430-M446 HydrophobicContact CG2-CE 4.48Å; T430-C447 WeakPolarHBondContact CA-O 3.11Å; T430-L448 HydrophobicContact CG2-CD1 3.85Å; T430-I526 HydrophobicContact CG2-CD1 3.7Å; T430-D546 WeakPolarHBondContact CB-OD2 3.32Å; T430-D546 WeakPolarHBondContact O-CB 3.23Å; T430-D546 PolarHBondContact OG1-OD2 3.48Å; T430-R550 PolarHBondContact OG1-NH1 3.24Å; T430-I555 HydrophobicContact CG2-CD1 4.35Å; T430-I590 VanDerWaalsContact O-CG2 3.3Å; T430-I590 WeakPolarHBondContact O-CG2 3.16Å
431	A	93.9	Very high	80.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	148.6	-178.4	0	0	0	0	0	111.3	M446 C447 L449 A545 I585 F587 I590	A431-M446 WeakPolarHBondContact O-CE 3.42Å; A431-C447 PolarHBondContact N-O 3.18Å; A431-C447 WeakPolarHBondContact O-CA 3.28Å; A431-C447 WeakPolarHBondContact O-CB 3.44Å; A431-C447 PolarHBondContact O-N 2.82Å; A431-L449 HydrophobicContact CB-CD1 4.11Å; A431-A545 HydrophobicContact CB-CB 3.9Å; A431-I585 HydrophobicContact CB-CD1 3.7Å; A431-F587 HydrophobicContact CB-CD2 4.33Å; A431-I590 HydrophobicContact CB-CG2 3.82Å
432	R	94.9	Very high	83.3	Confident	82 Å²	82	56.7 Å²	56.7	31%	0.309	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.3	168.2	-66.8	177.9	68.4	177.4	0.4	109.2	V444 V445 M446 L500 A545	R432-V444 HydrophobicContact CB-CG1 4.47Å; R432-V445 WeakPolarHBondContact CA-O 3.1Å; R432-M446 HydrophobicContact CG-CE 4.25Å; R432-M446 HydrophobicContact CG-SD 3.59Å; R432-M446 VanDerWaalsContact CG-SD 3.59Å; R432-L500 HydrophobicContact CB-CD1 3.95Å; R432-L500 HydrophobicContact CB-CG 4.47Å; R432-A545 PolarHBondContact N-O 3.34Å
433	A	94.3	Very high	85.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	156.2	179.9	0	0	0	0	0	110.9	V444 V445 L497 S498 F587	A433-V444 CarbonylContact O-C 3.53Å; A433-V444 WeakPolarHBondContact O-CA 3.19Å; A433-V445 HydrophobicContact CB-CG2 4.31Å; A433-V445 PolarHBondContact N-O 3.49Å; A433-V445 WeakPolarHBondContact O-CG2 3.38Å; A433-V445 PolarHBondContact O-N 3.04Å; A433-L497 HydrophobicContact CB-CB 4.5Å; A433-L497 HydrophobicContact CB-CD2 4.28Å; A433-S498 WeakPolarHBondContact CA-O 3.47Å; A433-F587 HydrophobicContact CB-CD2 3.8Å; A433-F587 HydrophobicContact CB-CE1 4.48Å; A433-F587 HydrophobicContact CB-CE2 3.55Å; A433-F587 HydrophobicContact CB-CG 4.37Å; A433-F587 HydrophobicContact CB-CZ 3.92Å
434	V	93.8	Very high	87.8	Confident	19 Å²	19	49.4 Å²	49.4	12%	0.115	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	114.3	166.9	-178.3	0	0	0	0	108	R436 R442 L497 S498 L500	V434-R436 HydrophobicContact CG1-CG 4.28Å; V434-R442 HydrophobicContact CG1-CB 4.17Å; V434-L497 WeakPolarHBondContact O-CA 3.38Å; V434-S498 PolarHBondContact N-O 3.02Å; V434-S498 PolarHBondContact O-N 3.39Å; V434-S498 PolarHBondContact O-OG 3.04Å; V434-L500 HydrophobicContact CG2-CD2 3.97Å
435	M	95.2	Very high	89.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	135.5	169.8	-170.4	177.2	78.3	0	0	110.2	R442 T443 V445 I458 L462 M466 I468 F495 A496 L497	M435-R442 VanDerWaalsContact O-CA 3.28Å; M435-R442 WeakPolarHBondContact O-CA 3.3Å; M435-T443 HydrophobicContact CB-CG2 4.3Å; M435-T443 HydrophobicContact CE-CG2 3.99Å; M435-T443 PolarHBondContact N-O 3.33Å; M435-T443 PolarHBondContact O-N 2.97Å; M435-T443 VanDerWaalsContact O-N 3.08Å; M435-V445 HydrophobicContact CB-CG1 3.78Å; M435-V445 HydrophobicContact CB-CG2 3.99Å; M435-V445 HydrophobicContact SD-CG1 4.32Å; M435-I458 HydrophobicContact CE-CD1 4.42Å; M435-I458 HydrophobicContact SD-CD1 3.91Å; M435-L462 HydrophobicContact CE-CD1 4.05Å; M435-L462 HydrophobicContact CE-CD2 3.9Å; M435-L462 HydrophobicContact CE-CG 3.94Å; M435-L462 HydrophobicContact SD-CD2 4.06Å; M435-M466 HydrophobicContact CE-CB 4.05Å; M435-M466 HydrophobicContact CE-CE 4.12Å; M435-M466 HydrophobicContact CE-CG 3.5Å; M435-M466 VanDerWaalsContact CE-CG 3.5Å; M435-M466 HydrophobicContact CE-SD 4.37Å; M435-I468 HydrophobicContact CE-CD1 4.16Å; M435-F495 HydrophobicContact CG-CB 3.99Å; M435-F495 HydrophobicContact CG-CD2 3.63Å; M435-F495 HydrophobicContact CG-CE2 4.36Å; M435-F495 HydrophobicContact CG-CG 3.95Å; M435-F495 HydrophobicContact SD-CB 4.16Å; M435-F495 HydrophobicContact SD-CD1 4.17Å; M435-F495 HydrophobicContact SD-CD2 3.68Å; M435-F495 HydrophobicContact SD-CE2 4.07Å; M435-F495 HydrophobicContact SD-CG 3.74Å; M435-F495 HydrophobicContact SD-CZ 4.47Å; M435-A496 CarbonylContact C-O 3.52Å; M435-A496 WeakPolarHBondContact CA-O 3.47Å; M435-L497 HydrophobicContact CB-CD2 3.86Å; M435-L497 HydrophobicContact CG-CD2 4.02Å
436	R	92.5	Very high	90.6	Very high	48 Å²	48	47.5 Å²	47.5	18%	0.181	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130	178.7	-65.5	170.5	-179.6	-108.5	-5.6	109.8	V434 D441 R442 A496 S498	V434-R436 HydrophobicContact CG1-CG 4.28Å; R436-D441 WeakPolarHBondContact CA-O 3.47Å; R436-R442 HydrophobicContact CG-CG 4.11Å; R436-R442 VanDerWaalsContact CZ-CZ 3.45Å; R436-R442 VanDerWaalsContact NH2-NH1 3.15Å; R436-A496 HydrophobicContact CB-CB 4.46Å; R436-A496 PolarHBondContact N-O 3.19Å; R436-A496 PolarHBondContact O-N 3.35Å; R436-S498 PolarHBondContact NE-OG 3.5Å
437	T	90.8	Very high	91.4	Very high	11 Å²	11	43.2 Å²	43.2	7%	0.067	22%	0.22	C	C	.	.			trans	-90.2	167.9	173.8	64.4	0	0	0	0	110.8	N439 G440 D441 M466 I468	T437-N439 WeakPolarHBondContact CB-OD1 3.43Å; T437-N439 PolarHBondContact O-N 3.02Å; T437-N439 PolarHBondContact OG1-ND2 3.21Å; T437-N439 PolarHBondContact OG1-OD1 3.03Å; T437-G440 PolarHBondContact O-N 3.49Å; T437-D441 HydrophobicContact CG2-CB 4.47Å; T437-D441 PolarHBondContact N-O 3.07Å; T437-D441 WeakPolarHBondContact OG1-CB 3.32Å; T437-D441 PolarHBondContact OG1-N 2.97Å; T437-M466 HydrophobicContact CG2-CB 4Å; T437-M466 HydrophobicContact CG2-CE 3.61Å; T437-I468 HydrophobicContact CG2-CD1 3.71Å; T437-I468 HydrophobicContact CG2-CG1 3.73Å
438	M	82	Confident	91.9	Very high	146 Å²	146	42.6 Å²	42.6	72%	0.719	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.8	176.7	-64.6	-161.6	-178.9	0	0	112.6	G440 Q494	M438-G440 PolarHBondContact O-N 3.01Å; M438-Q494 HydrophobicContact CE-CB 4.24Å; M438-Q494 VanDerWaalsContact CE-CD 3.47Å; M438-Q494 HydrophobicContact CE-CG 3.88Å
439	N	81.8	Confident	92.1	Very high	93 Å²	93	40.6 Å²	40.6	50%	0.497	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-5.8	171.8	31.3	-39.5	0	0	0	113.4	T437 D441	T437-N439 WeakPolarHBondContact CB-OD1 3.43Å; T437-N439 PolarHBondContact O-N 3.02Å; T437-N439 PolarHBondContact OG1-ND2 3.21Å; T437-N439 PolarHBondContact OG1-OD1 3.03Å; N439-D441 PolarHBondContact ND2-OD2 3.17Å
440	G	83	Confident	92	Very high	44 Å²	44	39.8 Å²	39.8	45%	0.454	20%	0.203	S	C	.	.			trans	89.8	-6.6	176.2	0	0	0	0	0	115.1	T437 M438 R442	T437-G440 PolarHBondContact O-N 3.49Å; M438-G440 PolarHBondContact O-N 3.01Å; G440-R442 WeakPolarHBondContact O-CG 3.33Å
441	D	89.1	Confident	91.5	Very high	78 Å²	78	41.8 Å²	41.8	42%	0.417	22%	0.22	S	C	.	.			trans	-60.9	144.1	176	-64	-42.1	0	0	0	111	R436 T437 N439 M466	R436-D441 WeakPolarHBondContact CA-O 3.47Å; T437-D441 HydrophobicContact CG2-CB 4.47Å; T437-D441 PolarHBondContact N-O 3.07Å; T437-D441 WeakPolarHBondContact OG1-CB 3.32Å; T437-D441 PolarHBondContact OG1-N 2.97Å; N439-D441 PolarHBondContact ND2-OD2 3.17Å; D441-M466 HydrophobicContact CB-CE 3.68Å
442	R	91.9	Very high	90.9	Very high	161 Å²	161	43.2 Å²	43.2	61%	0.608	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.8	-175.7	-46	-170.6	-173.6	170.2	0.9	111.3	V434 M435 R436 G440	V434-R442 HydrophobicContact CG1-CB 4.17Å; M435-R442 VanDerWaalsContact O-CA 3.28Å; M435-R442 WeakPolarHBondContact O-CA 3.3Å; R436-R442 HydrophobicContact CG-CG 4.11Å; R436-R442 VanDerWaalsContact CZ-CZ 3.45Å; R436-R442 VanDerWaalsContact NH2-NH1 3.15Å; G440-R442 WeakPolarHBondContact O-CG 3.33Å
443	T	95	Very high	90.4	Very high	34 Å²	34	39.4 Å²	39.4	21%	0.209	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	151.1	170.5	-174.3	0	0	0	0	110.2	M435 V445 L462 M466	M435-T443 HydrophobicContact CB-CG2 4.3Å; M435-T443 HydrophobicContact CE-CG2 3.99Å; M435-T443 PolarHBondContact N-O 3.33Å; M435-T443 PolarHBondContact O-N 2.97Å; M435-T443 VanDerWaalsContact O-N 3.08Å; T443-V445 HydrophobicContact CG2-CG1 3.82Å; T443-L462 HydrophobicContact CG2-CD1 4.09Å; T443-M466 HydrophobicContact CG2-CE 3.83Å; T443-M466 HydrophobicContact CG2-CG 4.21Å; T443-M466 HydrophobicContact CG2-SD 3.52Å; T443-M466 VanDerWaalsContact CG2-SD 3.52Å
444	V	94.6	Very high	89.7	Confident	64 Å²	64	43 Å²	43	39%	0.388	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134.1	168.6	179.9	0	0	0	0	108.2	R432 A433 L500	R432-V444 HydrophobicContact CB-CG1 4.47Å; A433-V444 CarbonylContact O-C 3.53Å; A433-V444 WeakPolarHBondContact O-CA 3.19Å; V444-L500 HydrophobicContact CB-CD2 4.5Å; V444-L500 HydrophobicContact CG1-CD2 3.83Å; V444-L500 HydrophobicContact CG2-CD2 3.87Å
445	V	95.7	Very high	89.5	Confident	2 Å²	2	47 Å²	47	1%	0.012	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	150.5	-179.4	-61.9	0	0	0	0	110.5	R432 A433 M435 T443 L462 L497 D556 V557	R432-V445 WeakPolarHBondContact CA-O 3.1Å; A433-V445 HydrophobicContact CB-CG2 4.31Å; A433-V445 PolarHBondContact N-O 3.49Å; A433-V445 WeakPolarHBondContact O-CG2 3.38Å; A433-V445 PolarHBondContact O-N 3.04Å; M435-V445 HydrophobicContact CB-CG1 3.78Å; M435-V445 HydrophobicContact CB-CG2 3.99Å; M435-V445 HydrophobicContact SD-CG1 4.32Å; T443-V445 HydrophobicContact CG2-CG1 3.82Å; V445-L462 HydrophobicContact CB-CD2 4.49Å; V445-L462 HydrophobicContact CG1-CD1 4.38Å; V445-L462 HydrophobicContact CG1-CD2 3.6Å; V445-L497 HydrophobicContact CG2-CD2 3.96Å; V445-D556 WeakPolarHBondContact CA-OD2 3.1Å; V445-D556 HydrophobicContact CB-CB 3.98Å; V445-D556 HydrophobicContact CG1-CB 4.36Å; V445-V557 HydrophobicContact CB-CG2 4.49Å; V445-V557 HydrophobicContact CG2-CG2 4.33Å
446	M	95.5	Very high	89.5	Confident	13 Å²	13	47 Å²	47	6%	0.064	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	115.4	171.2	-162.3	67.6	-142.6	0	0	110.3	T430 A431 R432 D546 K554 I555 D556 V557	T430-M446 HydrophobicContact CG2-CE 4.48Å; A431-M446 WeakPolarHBondContact O-CE 3.42Å; R432-M446 HydrophobicContact CG-CE 4.25Å; R432-M446 HydrophobicContact CG-SD 3.59Å; R432-M446 VanDerWaalsContact CG-SD 3.59Å; M446-D546 HydrophobicContact CE-CB 4.46Å; M446-D546 WeakPolarHBondContact CE-OD1 3.32Å; M446-D546 WeakPolarHBondContact CE-OD2 3.46Å; M446-K554 WeakPolarHBondContact CB-O 3.5Å; M446-I555 HydrophobicContact CB-CD1 4.4Å; M446-I555 HydrophobicContact CG-CD1 3.72Å; M446-D556 PolarHBondContact N-OD2 2.99Å; M446-D556 PolarHBondContact O-N 2.91Å; M446-V557 PolarHBondContact O-N 3.49Å
447	C	95.8	Very high	89.6	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	143.4	179.6	-61.8	0	0	0	0	111.5	T430 A431 V557	T430-C447 WeakPolarHBondContact CA-O 3.11Å; A431-C447 PolarHBondContact N-O 3.18Å; A431-C447 WeakPolarHBondContact O-CA 3.28Å; A431-C447 WeakPolarHBondContact O-CB 3.44Å; A431-C447 PolarHBondContact O-N 2.82Å; C447-V557 CarbonylContact C-O 3.6Å; C447-V557 VanDerWaalsContact CA-O 3.26Å; C447-V557 WeakPolarHBondContact CA-O 3.38Å
448	L	94.5	Very high	89.8	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122	166.2	176.6	60.7	0	0	0	108.4	L428 T430 I555 V557 L558 I559 L607	L428-L448 HydrophobicContact CB-CD1 3.76Å; L428-L448 HydrophobicContact CD1-CD1 4.11Å; T430-L448 HydrophobicContact CG2-CD1 3.85Å; L448-I555 HydrophobicContact CB-CD1 3.88Å; L448-I555 HydrophobicContact CB-CG1 4.03Å; L448-I555 HydrophobicContact CB-CG2 3.78Å; L448-I555 HydrophobicContact CD2-CG1 4.42Å; L448-V557 PolarHBondContact N-O 3.35Å; L448-L558 HydrophobicContact CD2-CD1 4.28Å; L448-L558 CarbonylContact O-C 3.59Å; L448-L558 WeakPolarHBondContact O-CA 3.2Å; L448-I559 PolarHBondContact O-N 2.84Å; L448-L607 HydrophobicContact CD2-CD1 3.78Å
449	L	93.9	Very high	90.4	Very high	7 Å²	7	38 Å²	38	4%	0.037	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	122.1	172.2	-65.4	83.8	0	0	0	107.9	Q429 A431 I559 Y564 F567 V568 I585 I590	Q429-L449 HydrophobicContact CB-CB 4.04Å; Q429-L449 PolarHBondContact O-N 3.49Å; A431-L449 HydrophobicContact CB-CD1 4.11Å; L449-I559 HydrophobicContact CG-CB 4.45Å; L449-Y564 HydrophobicContact CB-CD2 4.13Å; L449-Y564 HydrophobicContact CB-CE2 3.92Å; L449-F567 HydrophobicContact CD2-CB 4.41Å; L449-V568 HydrophobicContact CD2-CG2 3.83Å; L449-I585 HydrophobicContact CD1-CD1 4.39Å; L449-I585 HydrophobicContact CD2-CG2 4.19Å; L449-I590 HydrophobicContact CD2-CD1 4.43Å
450	D	89.2	Confident	91	Very high	22 Å²	22	37 Å²	37	12%	0.118	20%	0.202	C	C	.	.			trans	-137.2	100.7	-174.1	-178.8	18.6	0	0	0	111.1	G452 S453 L558 I559 L607	D450-G452 PolarHBondContact O-N 2.88Å; D450-G452 WeakPolarHBondContact OD1-CA 3.47Å; D450-G452 PolarHBondContact OD1-N 3.22Å; D450-S453 PolarHBondContact O-N 3.36Å; D450-L558 HydrophobicContact CB-CD1 4.24Å; D450-L558 HydrophobicContact CB-CD2 4.17Å; D450-L558 HydrophobicContact CB-CG 4.19Å; D450-I559 PolarHBondContact N-O 3.49Å; D450-L607 WeakPolarHBondContact OD2-CB 3.41Å
451	A	84.1	Confident	91.5	Very high	50 Å²	50	40.8 Å²	40.8	41%	0.413	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.2	174.4	0	0	0	0	0	113.2	S453 L561 Y564	A451-S453 VanDerWaalsContact C-N 3.32Å; A451-L561 HydrophobicContact CB-CD1 3.82Å; A451-Y564 HydrophobicContact CB-CD2 4.27Å; A451-Y564 HydrophobicContact CB-CE2 4.07Å
452	G	81	Confident	91.8	Very high	30 Å²	30	37.1 Å²	37.1	31%	0.309	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-9.2	174.7	0	0	0	0	0	114.4	D450 H608	D450-G452 PolarHBondContact O-N 2.88Å; D450-G452 WeakPolarHBondContact OD1-CA 3.47Å; D450-G452 PolarHBondContact OD1-N 3.22Å; G452-H608 PolarHBondContact O-ND1 2.98Å; G452-H608 VanDerWaalsContact O-ND1 3.13Å
453	S	83.9	Confident	92	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.014	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-102.3	126.9	-179.8	-174.2	0	0	0	0	110.9	D450 A451 R455 F457 L558 G560 L561	D450-S453 PolarHBondContact O-N 3.36Å; A451-S453 VanDerWaalsContact C-N 3.32Å; S453-R455 VanDerWaalsContact C-N 3.29Å; S453-R455 PolarHBondContact O-N 3.26Å; S453-R455 PolarHBondContact OG-O 3.46Å; S453-F457 WeakPolarHBondContact OG-CE2 3.2Å; S453-L558 VanDerWaalsContact CB-CD2 3.48Å; S453-L558 WeakPolarHBondContact OG-CD2 3.15Å; S453-G560 CarbonylContact O-C 3.48Å; S453-G560 VanDerWaalsContact O-CA 3.26Å; S453-G560 WeakPolarHBondContact O-CA 3.49Å; S453-L561 PolarHBondContact O-N 3.48Å
454	Q	80.6	Confident	91.9	Very high	77 Å²	77	31.8 Å²	31.8	36%	0.36	17%	0.17	S	C	.	.	S	Bend	trans	-74	-21.2	179	-69.8	-177.7	-25.6	0	0	113.8	A609 Q610 V611	Q454-A609 PolarHBondContact N-O 2.75Å; Q454-Q610 VanDerWaalsContact OE1-CA 3.24Å; Q454-Q610 VanDerWaalsContact OE1-CG 3.3Å; Q454-V611 VanDerWaalsContact OE1-N 3.09Å
455	R	89.5	Confident	91.9	Very high	101 Å²	101	35.3 Å²	35.3	38%	0.381	18%	0.177	S	C	.	.	S	Bend	trans	-131.1	154.4	-175.4	-71.9	-69.2	-170.1	-102.5	-0.3	110.7	S453 F457 L517 D562 V611	S453-R455 VanDerWaalsContact C-N 3.29Å; S453-R455 PolarHBondContact O-N 3.26Å; S453-R455 PolarHBondContact OG-O 3.46Å; R455-F457 HydrophobicContact CB-CE2 4.1Å; R455-F457 HydrophobicContact CB-CZ 4.05Å; R455-F457 VanDerWaalsContact O-CD2 3.28Å; R455-F457 WeakPolarHBondContact O-CD2 3.48Å; R455-F457 WeakPolarHBondContact O-CE2 3.37Å; R455-L517 HydrophobicContact CB-CD1 4.44Å; R455-D562 WeakPolarHBondContact CA-OD2 3.45Å; R455-V611 HydrophobicContact CB-CG2 4.11Å; R455-V611 HydrophobicContact CG-CB 3.74Å; R455-V611 HydrophobicContact CG-CG1 4.05Å; R455-V611 HydrophobicContact CG-CG2 3.79Å
456	S	94.1	Very high	91.8	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.			trans	-87.5	144.3	171.7	-66.1	0	0	0	0	111.9	A516 L517 L558 G560 D562 Y563	S456-A516 VanDerWaalsContact O-CA 3.3Å; S456-A516 WeakPolarHBondContact O-CA 3.2Å; S456-L517 PolarHBondContact O-N 2.86Å; S456-L558 CarbonylContact C-O 3.59Å; S456-L558 VanDerWaalsContact CA-O 3.22Å; S456-L558 WeakPolarHBondContact CA-O 3.31Å; S456-L558 WeakPolarHBondContact CB-O 3.39Å; S456-G560 PolarHBondContact OG-N 2.98Å; S456-D562 PolarHBondContact N-OD1 3.02Å; S456-D562 VanDerWaalsContact N-OD1 3.14Å; S456-D562 PolarHBondContact N-OD2 3.42Å; S456-D562 PolarHBondContact OG-OD1 3.43Å; S456-Y563 WeakPolarHBondContact OG-CD2 3.33Å
457	F	94.9	Very high	91.6	Very high	3 Å²	3	45 Å²	45	1%	0.013	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	153.4	-175.4	-60.4	-87.2	0	0	0	111.9	S453 R455 I477 L517 L519 I522 V557 L558 A609 V611	S453-F457 WeakPolarHBondContact OG-CE2 3.2Å; R455-F457 HydrophobicContact CB-CE2 4.1Å; R455-F457 HydrophobicContact CB-CZ 4.05Å; R455-F457 VanDerWaalsContact O-CD2 3.28Å; R455-F457 WeakPolarHBondContact O-CD2 3.48Å; R455-F457 WeakPolarHBondContact O-CE2 3.37Å; F457-I477 HydrophobicContact CE1-CD1 4.06Å; F457-L517 VanDerWaalsContact CA-O 3.32Å; F457-L517 WeakPolarHBondContact CA-O 3.43Å; F457-L517 HydrophobicContact CD1-CB 3.61Å; F457-L517 HydrophobicContact CD1-CD1 4.42Å; F457-L517 HydrophobicContact CE1-CB 3.82Å; F457-L517 HydrophobicContact CE1-CD1 3.79Å; F457-L517 HydrophobicContact CE1-CG 4.42Å; F457-L517 HydrophobicContact CZ-CD1 4.42Å; F457-L519 HydrophobicContact CB-CD1 4.28Å; F457-L519 HydrophobicContact CD1-CD1 3.35Å; F457-L519 HydrophobicContact CD1-CG 3.7Å; F457-L519 HydrophobicContact CE1-CD1 3.78Å; F457-L519 HydrophobicContact CE1-CG 4.27Å; F457-L519 HydrophobicContact CG-CD1 3.88Å; F457-L519 HydrophobicContact CG-CG 4.48Å; F457-I522 HydrophobicContact CB-CD1 4.43Å; F457-I522 HydrophobicContact CB-CG1 4.38Å; F457-V557 CarbonylContact O-C 3.54Å; F457-V557 WeakPolarHBondContact O-CA 3.45Å; F457-L558 HydrophobicContact CB-CB 4.33Å; F457-L558 HydrophobicContact CD2-CD2 4.05Å; F457-L558 PolarHBondContact N-O 3.05Å; F457-L558 PolarHBondContact O-N 2.92Å; F457-A609 HydrophobicContact CE2-CB 3.92Å; F457-A609 HydrophobicContact CZ-CB 4.13Å; F457-V611 HydrophobicContact CZ-CG2 4.1Å
458	I	95.9	Very high	91.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146.9	174.3	-177.7	167.8	0	0	0	109.5	M435 E460 L462 A463 V493 F495 A516 L517 C518 L519 D556 V557	M435-I458 HydrophobicContact CE-CD1 4.42Å; M435-I458 HydrophobicContact SD-CD1 3.91Å; I458-E460 PolarHBondContact O-N 2.88Å; I458-L462 HydrophobicContact CD1-CD2 3.82Å; I458-L462 HydrophobicContact CD1-CG 4.08Å; I458-L462 HydrophobicContact CG1-CB 4.34Å; I458-L462 HydrophobicContact CG1-CD2 3.99Å; I458-L462 HydrophobicContact CG1-CG 4.36Å; I458-A463 HydrophobicContact CD1-CB 4.34Å; I458-A463 HydrophobicContact CG2-CB 4.41Å; I458-V493 HydrophobicContact CG2-CG2 3.49Å; I458-V493 VanDerWaalsContact CG2-CG2 3.49Å; I458-F495 HydrophobicContact CB-CE1 4.09Å; I458-F495 HydrophobicContact CB-CZ 4.42Å; I458-F495 HydrophobicContact CD1-CD1 4.01Å; I458-F495 HydrophobicContact CD1-CE1 3.57Å; I458-F495 HydrophobicContact CD1-CZ 4.11Å; I458-F495 HydrophobicContact CG1-CE1 4.38Å; I458-F495 HydrophobicContact CG2-CE1 4.29Å; I458-A516 HydrophobicContact CB-CB 4.24Å; I458-A516 HydrophobicContact CG2-CB 4.01Å; I458-L517 PolarHBondContact N-O 3.16Å; I458-C518 WeakPolarHBondContact O-CA 2.94Å; I458-L519 PolarHBondContact O-N 3.38Å; I458-D556 WeakPolarHBondContact CA-O 3.38Å; I458-V557 HydrophobicContact CD1-CG2 4.41Å; I458-V557 HydrophobicContact CG1-CG2 4.22Å
459	T	95	Very high	91.2	Very high	14 Å²	14	52 Å²	52	9%	0.086	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	135.7	174.3	59.1	0	0	0	0	111.1	E461 L462 A463 L519 I522 I555 D556	T459-E461 PolarHBondContact O-N 2.8Å; T459-L462 PolarHBondContact O-N 2.87Å; T459-L462 VanDerWaalsContact O-N 3.11Å; T459-L462 WeakPolarHBondContact OG1-CB 3.44Å; T459-L462 PolarHBondContact OG1-N 3.32Å; T459-A463 PolarHBondContact O-N 3.34Å; T459-L519 CarbonylContact C-O 3.53Å; T459-L519 VanDerWaalsContact CA-O 3.25Å; T459-L519 WeakPolarHBondContact CA-O 3.49Å; T459-I522 HydrophobicContact CG2-CD1 3.89Å; T459-I522 HydrophobicContact CG2-CG1 3.99Å; T459-I555 WeakPolarHBondContact CG2-O 3.38Å; T459-D556 PolarHBondContact N-O 3.22Å
460	E	93.3	Very high	91	Very high	73 Å²	73	53.2 Å²	53.2	34%	0.341	27%	0.265	S	S	.	.	H	α-helix	trans	-60.9	-35.8	177.9	-168	166.7	-160	0	0	111.1	I458 A463 N464 L519	I458-E460 PolarHBondContact O-N 2.88Å; E460-A463 PolarHBondContact O-N 3.33Å; E460-N464 VanDerWaalsContact O-CB 3.28Å; E460-N464 WeakPolarHBondContact O-CB 3.17Å; E460-N464 PolarHBondContact O-N 3.24Å; E460-N464 PolarHBondContact O-ND2 3.27Å; E460-L519 PolarHBondContact N-O 2.71Å
461	E	94.5	Very high	91.1	Very high	123 Å²	123	55.7 Å²	55.7	58%	0.575	28%	0.282	S	S	*	.	H	α-helix	trans	-54.9	-50.9	170.9	-173.1	-171.5	153.4	0	0	111.9	T459 R465	T459-E461 PolarHBondContact O-N 2.8Å; E461-R465 WeakPolarHBondContact O-CB 3.34Å; E461-R465 PolarHBondContact O-N 2.98Å
462	L	95.5	Very high	91.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68	-45.3	179.8	176	64	0	0	0	111.7	M435 T443 V445 I458 T459 N464 R465 M466 D556 V557	M435-L462 HydrophobicContact CE-CD1 4.05Å; M435-L462 HydrophobicContact CE-CD2 3.9Å; M435-L462 HydrophobicContact CE-CG 3.94Å; M435-L462 HydrophobicContact SD-CD2 4.06Å; T443-L462 HydrophobicContact CG2-CD1 4.09Å; V445-L462 HydrophobicContact CB-CD2 4.49Å; V445-L462 HydrophobicContact CG1-CD1 4.38Å; V445-L462 HydrophobicContact CG1-CD2 3.6Å; I458-L462 HydrophobicContact CD1-CD2 3.82Å; I458-L462 HydrophobicContact CD1-CG 4.08Å; I458-L462 HydrophobicContact CG1-CB 4.34Å; I458-L462 HydrophobicContact CG1-CD2 3.99Å; I458-L462 HydrophobicContact CG1-CG 4.36Å; T459-L462 PolarHBondContact O-N 2.87Å; T459-L462 VanDerWaalsContact O-N 3.11Å; T459-L462 WeakPolarHBondContact OG1-CB 3.44Å; T459-L462 PolarHBondContact OG1-N 3.32Å; L462-N464 VanDerWaalsContact C-N 3.27Å; L462-N464 PolarHBondContact O-N 3.21Å; L462-R465 PolarHBondContact O-N 3.5Å; L462-M466 HydrophobicContact CD1-CG 3.72Å; L462-M466 HydrophobicContact CG-CG 4.33Å; L462-M466 WeakPolarHBondContact O-CB 3.25Å; L462-M466 VanDerWaalsContact O-CG 3.29Å; L462-M466 WeakPolarHBondContact O-CG 3.26Å; L462-M466 PolarHBondContact O-N 3.38Å; L462-D556 HydrophobicContact CD2-CB 3.75Å; L462-V557 HydrophobicContact CD2-CG2 4.23Å
463	A	95	Very high	91.1	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.6	-40.5	179.6	0	0	0	0	0	111.6	I458 T459 E460 R467 I468	I458-A463 HydrophobicContact CD1-CB 4.34Å; I458-A463 HydrophobicContact CG2-CB 4.41Å; T459-A463 PolarHBondContact O-N 3.34Å; E460-A463 PolarHBondContact O-N 3.33Å; A463-R467 PolarHBondContact O-N 3.45Å; A463-R467 VanDerWaalsContact O-N 3.1Å; A463-I468 PolarHBondContact O-N 3.4Å
464	N	94.4	Very high	90.8	Very high	83 Å²	83	64.4 Å²	64.4	44%	0.444	30%	0.304	S	S	.	.	H	α-helix	trans	-68.7	-45.6	175.2	-70.7	-18	0	0	0	112	E460 L462 M466 R467 R491	E460-N464 VanDerWaalsContact O-CB 3.28Å; E460-N464 WeakPolarHBondContact O-CB 3.17Å; E460-N464 PolarHBondContact O-N 3.24Å; E460-N464 PolarHBondContact O-ND2 3.27Å; L462-N464 VanDerWaalsContact C-N 3.27Å; L462-N464 PolarHBondContact O-N 3.21Å; N464-M466 PolarHBondContact O-N 2.7Å; N464-R467 PolarHBondContact O-N 3.3Å; N464-R491 PolarHBondContact OD1-NH1 3.45Å; N464-R491 PolarHBondContact OD1-NH2 3.03Å
465	R	93.9	Very high	90.5	Very high	139 Å²	139	61 Å²	61	53%	0.525	29%	0.289	S	S	.	.	H	α-helix	trans	-57.4	-37.4	176.9	-176.4	169.9	68.7	-155.2	3.1	112.1	E461 L462 R467	E461-R465 WeakPolarHBondContact O-CB 3.34Å; E461-R465 PolarHBondContact O-N 2.98Å; L462-R465 PolarHBondContact O-N 3.5Å; R465-R467 VanDerWaalsContact C-N 3.31Å
466	M	94.1	Very high	89.8	Confident	15 Å²	15	58.1 Å²	58.1	7%	0.074	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	4.2	179.1	-62.1	-65.8	-59.6	0	0	113.4	M435 T437 D441 T443 L462 N464 I468	M435-M466 HydrophobicContact CE-CB 4.05Å; M435-M466 HydrophobicContact CE-CE 4.12Å; M435-M466 HydrophobicContact CE-CG 3.5Å; M435-M466 VanDerWaalsContact CE-CG 3.5Å; M435-M466 HydrophobicContact CE-SD 4.37Å; T437-M466 HydrophobicContact CG2-CB 4Å; T437-M466 HydrophobicContact CG2-CE 3.61Å; D441-M466 HydrophobicContact CB-CE 3.68Å; T443-M466 HydrophobicContact CG2-CE 3.83Å; T443-M466 HydrophobicContact CG2-CG 4.21Å; T443-M466 HydrophobicContact CG2-SD 3.52Å; T443-M466 VanDerWaalsContact CG2-SD 3.52Å; L462-M466 HydrophobicContact CD1-CG 3.72Å; L462-M466 HydrophobicContact CG-CG 4.33Å; L462-M466 WeakPolarHBondContact O-CB 3.25Å; L462-M466 VanDerWaalsContact O-CG 3.29Å; L462-M466 WeakPolarHBondContact O-CG 3.26Å; L462-M466 PolarHBondContact O-N 3.38Å; N464-M466 PolarHBondContact O-N 2.7Å; M466-I468 VanDerWaalsContact C-N 3.25Å; M466-I468 HydrophobicContact CB-CD1 3.97Å; M466-I468 HydrophobicContact CB-CG1 3.83Å; M466-I468 PolarHBondContact O-N 2.83Å
467	R	91	Very high	88.7	Confident	203 Å²	203	58.1 Å²	58.1	77%	0.766	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	37.6	175.9	-55.1	178.3	-178.4	179.6	-0.5	113.6	A463 N464 R465 N469	A463-R467 PolarHBondContact O-N 3.45Å; A463-R467 VanDerWaalsContact O-N 3.1Å; N464-R467 PolarHBondContact O-N 3.3Å; R465-R467 VanDerWaalsContact C-N 3.31Å; R467-N469 PolarHBondContact O-N 3.45Å
468	I	92.7	Very high	87.4	Confident	11 Å²	11	58.5 Å²	58.5	6%	0.056	28%	0.283	C	S	.	.			trans	-88.3	113.3	-178.4	-43.4	174.5	0	0	0	109.1	M435 T437 A463 M466 V493 F495	M435-I468 HydrophobicContact CE-CD1 4.16Å; T437-I468 HydrophobicContact CG2-CD1 3.71Å; T437-I468 HydrophobicContact CG2-CG1 3.73Å; A463-I468 PolarHBondContact O-N 3.4Å; M466-I468 VanDerWaalsContact C-N 3.25Å; M466-I468 HydrophobicContact CB-CD1 3.97Å; M466-I468 HydrophobicContact CB-CG1 3.83Å; M466-I468 PolarHBondContact O-N 2.83Å; I468-V493 HydrophobicContact CB-CB 4.28Å; I468-V493 HydrophobicContact CB-CG1 4.25Å; I468-V493 HydrophobicContact CG2-CB 3.72Å; I468-V493 HydrophobicContact CG2-CG1 4.05Å; I468-V493 WeakPolarHBondContact O-CG1 3.45Å; I468-F495 HydrophobicContact CD1-CB 4.25Å; I468-F495 HydrophobicContact CD1-CD1 4.42Å
469	N	89.8	Confident	86	Confident	138 Å²	138	58.9 Å²	58.9	74%	0.738	29%	0.285	S	S	*	.			trans	-91	163.2	174.1	-68.4	-34	0	0	0	111.3	R467	R467-N469 PolarHBondContact O-N 3.45Å
470	G	89.6	Confident	84.2	Confident	34 Å²	34	62.6 Å²	62.6	35%	0.351	30%	0.304	S	S	.	.			trans	175.8	174.1	174.2	0	0	0	0	0	112	R492	G470-R492 CarbonylContact C-O 3.49Å; G470-R492 VanDerWaalsContact CA-O 3.27Å; G470-R492 WeakPolarHBondContact CA-O 3.29Å
471	P	90.6	Very high	82.4	Confident	74 Å²	74	62.4 Å²	62.4	48%	0.481	32%	0.322	S	S	.	.			trans	-66.8	151.7	-174.4	28.3	-34.7	0	0	0	111.8	R491 R492	P471-R491 WeakPolarHBondContact O-CA 3.17Å; P471-R492 PolarHBondContact O-N 3.25Å
472	L	85.8	Confident	80.4	Confident	96 Å²	96	58.7 Å²	58.7	50%	0.503	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.7	170.4	-72.1	174.1	0	0	0	108.6	R489 R491	L472-R489 HydrophobicContact CB-CG 4Å; L472-R491 HydrophobicContact CD2-CB 3.86Å
473	E	79.7	Confident	78.3	Confident	54 Å²	54	67.6 Å²	67.6	25%	0.252	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.1	178.2	55.9	-166.9	-152.8	0	0	110.8	V475 R489 I490 R492 L517	E473-V475 HydrophobicContact CG-CG2 3.98Å; E473-R489 CarbonylContact O-C 3.59Å; E473-R489 WeakPolarHBondContact O-CA 3.48Å; E473-I490 PolarHBondContact N-O 3.24Å; E473-I490 PolarHBondContact O-N 3.12Å; E473-R492 HydrophobicContact CG-CB 4.4Å; E473-R492 WeakPolarHBondContact OE1-CD 3.29Å; E473-R492 IonicContact OE1-NE 3.72Å; E473-R492 PolarHBondContact OE1-NE 3.28Å; E473-R492 IonicContact OE2-CZ 3.68Å; E473-R492 IonicContact OE2-NE 3.06Å; E473-R492 PolarHBondContact OE2-NE 3.47Å; E473-R492 IonicContact OE2-NH2 2.63Å; E473-R492 PolarHBondContact OE2-NH2 2.95Å; E473-L517 HydrophobicContact CG-CD2 4.21Å; E473-L517 WeakPolarHBondContact OE1-CD2 3.21Å
474	Y	77.8	Confident	76.4	Confident	114 Å²	114	69.2 Å²	69.2	45%	0.447	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124.2	175.7	-77.4	-88.6	0	0	0	109.3	R489	Y474-R489 HydrophobicContact CD1-CB 4.09Å; Y474-R489 HydrophobicContact CD1-CG 4.37Å; Y474-R489 HydrophobicContact CD2-CG 4.03Å; Y474-R489 HydrophobicContact CE1-CB 3.85Å; Y474-R489 HydrophobicContact CE1-CG 4.19Å; Y474-R489 HydrophobicContact CE2-CB 4.4Å; Y474-R489 HydrophobicContact CE2-CG 3.82Å; Y474-R489 HydrophobicContact CG-CB 4.48Å; Y474-R489 HydrophobicContact CG-CG 4.3Å
475	V	73.5	Confident	74.6	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.03	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.8	-177.1	174.8	0	0	0	0	109.2	E473 I477 C487 K488 I490 L517 V611	E473-V475 HydrophobicContact CG-CG2 3.98Å; V475-I477 HydrophobicContact CG1-CG1 3.92Å; V475-C487 WeakPolarHBondContact O-CA 3.28Å; V475-K488 PolarHBondContact N-O 3.31Å; V475-K488 PolarHBondContact O-N 2.76Å; V475-I490 HydrophobicContact CB-CD1 4.31Å; V475-L517 HydrophobicContact CG1-CD1 4.04Å; V475-L517 HydrophobicContact CG2-CD1 4.13Å; V475-L517 HydrophobicContact CG2-CD2 4.15Å; V475-V611 HydrophobicContact CG1-CB 4.06Å; V475-V611 HydrophobicContact CG1-CG1 3.42Å; V475-V611 VanDerWaalsContact CG1-CG1 3.42Å; V475-V611 HydrophobicContact CG1-CG2 3.69Å
476	E	74.2	Confident	73.3	Confident	42 Å²	42	67.4 Å²	67.4	20%	0.196	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.9	166.9	-172.7	-176.9	175.7	0	0	109.5	V611 M612	E476-V611 VanDerWaalsContact O-CA 3.3Å; E476-V611 WeakPolarHBondContact O-CA 3.5Å; E476-M612 HydrophobicContact CB-CB 4.44Å; E476-M612 PolarHBondContact N-O 3.03Å; E476-M612 PolarHBondContact O-N 3.44Å; E476-M612 WeakPolarHBondContact OE2-CE 3.23Å
477	I	72.2	Confident	71.4	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.2	175.1	-57.8	-180	0	0	0	108.8	F457 V475 Y486 I490 L519 V611	F457-I477 HydrophobicContact CE1-CD1 4.06Å; V475-I477 HydrophobicContact CG1-CG1 3.92Å; I477-Y486 HydrophobicContact CB-CE2 4.45Å; I477-Y486 PolarHBondContact N-O 3.41Å; I477-Y486 VanDerWaalsContact N-O 3.1Å; I477-Y486 PolarHBondContact O-N 2.93Å; I477-I490 HydrophobicContact CD1-CD1 3.6Å; I477-I490 HydrophobicContact CG1-CD1 4.34Å; I477-L519 HydrophobicContact CD1-CD1 4.3Å; I477-L519 HydrophobicContact CD1-CD2 3.62Å; I477-V611 HydrophobicContact CG1-CG2 4.47Å
478	S	68.1	Low	70.4	Confident	10 Å²	10	65.3 Å²	65.3	7%	0.07	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.4	176.7	56.8	0	0	0	0	111.3	A609 Q610	S478-A609 WeakPolarHBondContact O-CA 3.5Å; S478-Q610 PolarHBondContact N-O 3.24Å; S478-Q610 PolarHBondContact O-N 3.36Å; S478-Q610 VanDerWaalsContact OG-CB 3.28Å; S478-Q610 WeakPolarHBondContact OG-CB 3.43Å; S478-Q610 PolarHBondContact OG-O 3.48Å
479	T	66.5	Low	69.7	Low	8 Å²	8	71 Å²	71	5%	0.049	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	165.6	-179	65.8	0	0	0	0	112.1	V415 G481 G482 S484 H608	V415-T479 HydrophobicContact CG1-CG2 4.17Å; T479-G481 PolarHBondContact O-N 2.98Å; T479-G482 PolarHBondContact O-N 3.37Å; T479-G482 VanDerWaalsContact O-N 3.09Å; T479-S484 WeakPolarHBondContact CG2-OG 3.04Å; T479-S484 PolarHBondContact N-O 3.03Å; T479-S484 PolarHBondContact OG1-OG 2.81Å; T479-H608 WeakPolarHBondContact CA-O 3.47Å
480	L	57.3	Low	69.5	Low	92 Å²	92	64.8 Å²	64.8	48%	0.482	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	131.9	176.4	-160.4	81.1	0	0	0	110.7	S606 H608	L480-S606 VanDerWaalsContact CD2-OG 3.27Å; L480-S606 WeakPolarHBondContact CD2-OG 3.4Å; L480-H608 HydrophobicContact CB-CB 3.88Å; L480-H608 HydrophobicContact CD1-CB 4.1Å
481	G	54.5	Low	69.7	Low	70 Å²	70	65.1 Å²	65.1	72%	0.722	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	1.5	-178.9	0	0	0	0	0	115.1	T479 Q483	T479-G481 PolarHBondContact O-N 2.98Å; G481-Q483 PolarHBondContact O-N 2.65Å
482	G	53.2	Low	69.8	Low	44 Å²	44	65.6 Å²	65.6	45%	0.454	34%	0.335	S	S	.	.	S	Bend	trans	67.9	3.8	174.4	0	0	0	0	0	115.2	T479 S484	T479-G482 PolarHBondContact O-N 3.37Å; T479-G482 VanDerWaalsContact O-N 3.09Å; G482-S484 VanDerWaalsContact C-N 3.27Å; G482-S484 PolarHBondContact O-N 3.3Å
483	Q	51.7	Low	70.2	Confident	187 Å²	187	61.2 Å²	61.2	87%	0.874	31%	0.312	S	S	*	.	S	Bend	trans	-72.3	-15.8	-171.4	-65.2	-144.2	-26.8	0	0	114.5	G481	G481-Q483 PolarHBondContact O-N 2.65Å
484	S	55	Low	71	Confident	34 Å²	34	61.8 Å²	61.8	24%	0.238	32%	0.315	C	S	.	.			trans	-138.2	101.4	169.3	60.5	0	0	0	0	110	T479 G482	T479-S484 WeakPolarHBondContact CG2-OG 3.04Å; T479-S484 PolarHBondContact N-O 3.03Å; T479-S484 PolarHBondContact OG1-OG 2.81Å; G482-S484 VanDerWaalsContact C-N 3.27Å; G482-S484 PolarHBondContact O-N 3.3Å
485	K	56.9	Low	71.9	Confident	125 Å²	125	56.5 Å²	56.5	54%	0.543	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.2	161.2	-66.8	-174.8	173.4	-165.1	0	107.3
486	Y	64.6	Low	72.9	Confident	60 Å²	60	56.9 Å²	56.9	24%	0.235	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	135	172.1	55.6	-84.8	0	0	0	109.9	V413 I477 K488	V413-Y486 HydrophobicContact CG1-CE2 4.11Å; V413-Y486 WeakPolarHBondContact CG1-OH 3.27Å; I477-Y486 HydrophobicContact CB-CE2 4.45Å; I477-Y486 PolarHBondContact N-O 3.41Å; I477-Y486 VanDerWaalsContact N-O 3.1Å; I477-Y486 PolarHBondContact O-N 2.93Å; Y486-K488 HydrophobicContact CD2-CB 4.44Å
487	C	55.6	Low	73.9	Confident	78 Å²	78	54.9 Å²	54.9	53%	0.527	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125.6	172.8	-174.6	0	0	0	0	108.6	V475	V475-C487 WeakPolarHBondContact O-CA 3.28Å
488	K	68.8	Low	74.8	Confident	95 Å²	95	55 Å²	55	41%	0.413	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	144.3	177.3	-168.6	178.3	-179.8	-174.4	0	109.9	V475 Y486 I490	V475-K488 PolarHBondContact N-O 3.31Å; V475-K488 PolarHBondContact O-N 2.76Å; Y486-K488 HydrophobicContact CD2-CB 4.44Å; K488-I490 HydrophobicContact CB-CD1 4.27Å; K488-I490 HydrophobicContact CB-CG1 4.06Å; K488-I490 HydrophobicContact CD-CG1 4.38Å; K488-I490 HydrophobicContact CG-CG1 4.19Å; K488-I490 PolarHBondContact O-N 3.24Å
489	R	78.9	Confident	75.8	Confident	132 Å²	132	55.5 Å²	55.5	50%	0.498	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	109.7	166.8	-152	175	73.4	-175.3	6.8	109	L472 E473 Y474	L472-R489 HydrophobicContact CB-CG 4Å; E473-R489 CarbonylContact O-C 3.59Å; E473-R489 WeakPolarHBondContact O-CA 3.48Å; Y474-R489 HydrophobicContact CD1-CB 4.09Å; Y474-R489 HydrophobicContact CD1-CG 4.37Å; Y474-R489 HydrophobicContact CD2-CG 4.03Å; Y474-R489 HydrophobicContact CE1-CB 3.85Å; Y474-R489 HydrophobicContact CE1-CG 4.19Å; Y474-R489 HydrophobicContact CE2-CB 4.4Å; Y474-R489 HydrophobicContact CE2-CG 3.82Å; Y474-R489 HydrophobicContact CG-CB 4.48Å; Y474-R489 HydrophobicContact CG-CG 4.3Å
490	I	85	Confident	76.7	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.036	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	139.8	-172.7	-68.4	173.2	0	0	0	109.6	E473 V475 I477 K488 L517 C518 L519	E473-I490 PolarHBondContact N-O 3.24Å; E473-I490 PolarHBondContact O-N 3.12Å; V475-I490 HydrophobicContact CB-CD1 4.31Å; I477-I490 HydrophobicContact CD1-CD1 3.6Å; I477-I490 HydrophobicContact CG1-CD1 4.34Å; K488-I490 HydrophobicContact CB-CD1 4.27Å; K488-I490 HydrophobicContact CB-CG1 4.06Å; K488-I490 HydrophobicContact CD-CG1 4.38Å; K488-I490 HydrophobicContact CG-CG1 4.19Å; K488-I490 PolarHBondContact O-N 3.24Å; I490-L517 HydrophobicContact CG2-CB 3.93Å; I490-L517 HydrophobicContact CG2-CD2 3.99Å; I490-C518 VanDerWaalsContact CG2-O 3.24Å; I490-C518 WeakPolarHBondContact CG2-O 3.43Å; I490-L519 HydrophobicContact CD1-CD2 3.95Å
491	R	93.1	Very high	77.5	Confident	41 Å²	41	59.3 Å²	59.3	16%	0.155	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	124.2	175.1	-172.7	177.8	62.5	-164.7	-6.1	110.1	N464 P471 L472 V493 C518	N464-R491 PolarHBondContact OD1-NH1 3.45Å; N464-R491 PolarHBondContact OD1-NH2 3.03Å; P471-R491 WeakPolarHBondContact O-CA 3.17Å; L472-R491 HydrophobicContact CD2-CB 3.86Å; R491-V493 HydrophobicContact CG-CG1 4.02Å; R491-C518 HydrophobicContact CB-CB 4.25Å; R491-C518 WeakPolarHBondContact O-CB 3.31Å; R491-C518 PolarHBondContact O-N 3.17Å; R491-C518 PolarHBondContact O-SG 3.1Å
492	R	93.6	Very high	77.9	Confident	84 Å²	84	58.8 Å²	58.8	32%	0.317	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	131.8	168.2	-178.9	167.3	50	119.4	3.6	109.7	G470 P471 E473 A516 L517	G470-R492 CarbonylContact C-O 3.49Å; G470-R492 VanDerWaalsContact CA-O 3.27Å; G470-R492 WeakPolarHBondContact CA-O 3.29Å; P471-R492 PolarHBondContact O-N 3.25Å; E473-R492 HydrophobicContact CG-CB 4.4Å; E473-R492 WeakPolarHBondContact OE1-CD 3.29Å; E473-R492 IonicContact OE1-NE 3.72Å; E473-R492 PolarHBondContact OE1-NE 3.28Å; E473-R492 IonicContact OE2-CZ 3.68Å; E473-R492 IonicContact OE2-NE 3.06Å; E473-R492 PolarHBondContact OE2-NE 3.47Å; E473-R492 IonicContact OE2-NH2 2.63Å; E473-R492 PolarHBondContact OE2-NH2 2.95Å; R492-A516 WeakPolarHBondContact CA-O 3.17Å; R492-L517 HydrophobicContact CB-CD2 4.15Å
493	V	95.1	Very high	77.8	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.018	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	160.2	179.9	-63.7	0	0	0	0	111	I458 I468 R491 F495 K515 A516	I458-V493 HydrophobicContact CG2-CG2 3.49Å; I458-V493 VanDerWaalsContact CG2-CG2 3.49Å; I468-V493 HydrophobicContact CB-CB 4.28Å; I468-V493 HydrophobicContact CB-CG1 4.25Å; I468-V493 HydrophobicContact CG2-CB 3.72Å; I468-V493 HydrophobicContact CG2-CG1 4.05Å; I468-V493 WeakPolarHBondContact O-CG1 3.45Å; R491-V493 HydrophobicContact CG-CG1 4.02Å; V493-F495 HydrophobicContact CG2-CD1 4.29Å; V493-F495 HydrophobicContact CG2-CE1 4.29Å; V493-K515 CarbonylContact O-C 3.53Å; V493-K515 VanDerWaalsContact O-CA 3.32Å; V493-K515 WeakPolarHBondContact O-CA 3.2Å; V493-A516 PolarHBondContact N-O 2.77Å; V493-A516 PolarHBondContact O-N 3.25Å
494	Q	95.8	Very high	77.3	Confident	67 Å²	67	67.3 Å²	67.3	31%	0.313	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	132.4	-179.4	-175.7	175.1	-36.7	0	0	110.8	M438 T513 V514 K515	M438-Q494 HydrophobicContact CE-CB 4.24Å; M438-Q494 VanDerWaalsContact CE-CD 3.47Å; M438-Q494 HydrophobicContact CE-CG 3.88Å; Q494-T513 HydrophobicContact CG-CG2 3.56Å; Q494-T513 VanDerWaalsContact NE2-CG2 3.3Å; Q494-V514 WeakPolarHBondContact CA-O 3.26Å; Q494-K515 HydrophobicContact CB-CG 4.27Å; Q494-K515 HydrophobicContact CG-CG 4.06Å
495	F	95.8	Very high	76.9	Confident	3 Å²	3	75.5 Å²	75.5	1%	0.013	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	171.2	178	54.1	-93.5	0	0	0	110.6	M435 I458 I468 V493 L497 T513 V514 A516 V557	M435-F495 HydrophobicContact CG-CB 3.99Å; M435-F495 HydrophobicContact CG-CD2 3.63Å; M435-F495 HydrophobicContact CG-CE2 4.36Å; M435-F495 HydrophobicContact CG-CG 3.95Å; M435-F495 HydrophobicContact SD-CB 4.16Å; M435-F495 HydrophobicContact SD-CD1 4.17Å; M435-F495 HydrophobicContact SD-CD2 3.68Å; M435-F495 HydrophobicContact SD-CE2 4.07Å; M435-F495 HydrophobicContact SD-CG 3.74Å; M435-F495 HydrophobicContact SD-CZ 4.47Å; I458-F495 HydrophobicContact CB-CE1 4.09Å; I458-F495 HydrophobicContact CB-CZ 4.42Å; I458-F495 HydrophobicContact CD1-CD1 4.01Å; I458-F495 HydrophobicContact CD1-CE1 3.57Å; I458-F495 HydrophobicContact CD1-CZ 4.11Å; I458-F495 HydrophobicContact CG1-CE1 4.38Å; I458-F495 HydrophobicContact CG2-CE1 4.29Å; I468-F495 HydrophobicContact CD1-CB 4.25Å; I468-F495 HydrophobicContact CD1-CD1 4.42Å; V493-F495 HydrophobicContact CG2-CD1 4.29Å; V493-F495 HydrophobicContact CG2-CE1 4.29Å; F495-L497 HydrophobicContact CD2-CD2 4.03Å; F495-L497 HydrophobicContact CD2-CG 4.07Å; F495-L497 HydrophobicContact CE2-CD1 4.12Å; F495-L497 HydrophobicContact CE2-CD2 3.88Å; F495-L497 HydrophobicContact CE2-CG 3.85Å; F495-T513 CarbonylContact O-C 3.58Å; F495-T513 WeakPolarHBondContact O-CA 3.33Å; F495-V514 HydrophobicContact CD2-CB 4.47Å; F495-V514 HydrophobicContact CE2-CB 4.02Å; F495-V514 HydrophobicContact CE2-CG1 4.41Å; F495-V514 HydrophobicContact CZ-CB 4.27Å; F495-V514 HydrophobicContact CZ-CG1 4.23Å; F495-V514 PolarHBondContact N-O 3.06Å; F495-V514 VanDerWaalsContact N-O 3.07Å; F495-V514 PolarHBondContact O-N 2.96Å; F495-A516 HydrophobicContact CE1-CB 3.77Å; F495-A516 HydrophobicContact CZ-CB 4Å; F495-V557 HydrophobicContact CE2-CG1 4.19Å; F495-V557 HydrophobicContact CE2-CG2 4.36Å; F495-V557 HydrophobicContact CZ-CG1 3.9Å; F495-V557 HydrophobicContact CZ-CG2 4.16Å
496	A	94.4	Very high	76.1	Confident	13 Å²	13	82.1 Å²	82.1	11%	0.107	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.4	176.3	0	0	0	0	0	111.8	M435 R436 W511 R512	M435-A496 CarbonylContact C-O 3.52Å; M435-A496 WeakPolarHBondContact CA-O 3.47Å; R436-A496 HydrophobicContact CB-CB 4.46Å; R436-A496 PolarHBondContact N-O 3.19Å; R436-A496 PolarHBondContact O-N 3.35Å; A496-W511 HydrophobicContact CB-CB 4.2Å; A496-W511 HydrophobicContact CB-CG 4.23Å; A496-R512 CarbonylContact C-O 3.48Å; A496-R512 VanDerWaalsContact CA-O 3.26Å; A496-R512 WeakPolarHBondContact CA-O 3.39Å
497	L	95.1	Very high	75.2	Confident	0 Å²	0	83.5 Å²	83.5	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	139.3	176.8	-63.1	176.4	0	0	0	111.3	A433 V434 M435 V445 F495 W511 R512 V514 V557 I559 F567 F587	A433-L497 HydrophobicContact CB-CB 4.5Å; A433-L497 HydrophobicContact CB-CD2 4.28Å; V434-L497 WeakPolarHBondContact O-CA 3.38Å; M435-L497 HydrophobicContact CB-CD2 3.86Å; M435-L497 HydrophobicContact CG-CD2 4.02Å; V445-L497 HydrophobicContact CG2-CD2 3.96Å; F495-L497 HydrophobicContact CD2-CD2 4.03Å; F495-L497 HydrophobicContact CD2-CG 4.07Å; F495-L497 HydrophobicContact CE2-CD1 4.12Å; F495-L497 HydrophobicContact CE2-CD2 3.88Å; F495-L497 HydrophobicContact CE2-CG 3.85Å; L497-W511 CarbonylContact O-C 3.5Å; L497-W511 WeakPolarHBondContact O-CA 3.32Å; L497-W511 WeakPolarHBondContact O-CB 3.35Å; L497-R512 PolarHBondContact N-O 3.3Å; L497-R512 PolarHBondContact O-N 3.17Å; L497-V514 HydrophobicContact CD1-CG2 4.19Å; L497-V557 HydrophobicContact CD1-CG1 4.49Å; L497-I559 HydrophobicContact CD1-CD1 3.81Å; L497-I559 HydrophobicContact CD1-CG1 4.49Å; L497-F567 HydrophobicContact CB-CE1 4.08Å; L497-F567 HydrophobicContact CB-CZ 4.25Å; L497-F567 HydrophobicContact CD1-CE1 4.41Å; L497-F567 HydrophobicContact CD1-CZ 4.01Å; L497-F587 HydrophobicContact CB-CE1 4.36Å; L497-F587 HydrophobicContact CB-CE2 4.39Å; L497-F587 HydrophobicContact CB-CZ 3.59Å
498	S	91.3	Very high	75	Confident	3 Å²	3	83.1 Å²	83.1	2%	0.021	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	163.2	-179.7	50.9	0	0	0	0	112.1	A433 V434 R436 F587	A433-S498 WeakPolarHBondContact CA-O 3.47Å; V434-S498 PolarHBondContact N-O 3.02Å; V434-S498 PolarHBondContact O-N 3.39Å; V434-S498 PolarHBondContact O-OG 3.04Å; R436-S498 PolarHBondContact NE-OG 3.5Å; S498-F587 VanDerWaalsContact C-CD1 3.48Å; S498-F587 VanDerWaalsContact C-CE1 3.43Å
499	A	89.3	Confident	74.4	Confident	20 Å²	20	86.3 Å²	86.3	17%	0.165	41%	0.414	C	S	.	.			trans	-64.5	156.1	175.4	0	0	0	0	0	112.1	F587	A499-F587 HydrophobicContact CB-CB 4.47Å; A499-F587 HydrophobicContact CB-CD1 4.19Å
500	L	86.2	Confident	74.2	Confident	72 Å²	72	83.5 Å²	83.5	38%	0.377	41%	0.406	S	S	.	.	S	Bend	trans	-61.9	-45.3	176.9	-65.9	174.6	0	0	0	112.5	R432 V434 V444 S502	R432-L500 HydrophobicContact CB-CD1 3.95Å; R432-L500 HydrophobicContact CB-CG 4.47Å; V434-L500 HydrophobicContact CG2-CD2 3.97Å; V444-L500 HydrophobicContact CB-CD2 4.5Å; V444-L500 HydrophobicContact CG1-CD2 3.83Å; V444-L500 HydrophobicContact CG2-CD2 3.87Å; L500-S502 PolarHBondContact O-N 3.36Å
501	D	74.2	Confident	74.2	Confident	107 Å²	107	88.8 Å²	88.8	57%	0.572	43%	0.426	S	S	*	.			trans	-99	76.8	-179.4	-57.7	-37.1	0	0	0	110.6	R503 K543	D501-R503 PolarHBondContact O-N 3Å; D501-R503 VanDerWaalsContact O-N 3.1Å; D501-K543 VanDerWaalsContact CB-NZ 3.32Å; D501-K543 WeakPolarHBondContact OD2-CE 3.44Å; D501-K543 IonicContact OD2-NZ 2.68Å; D501-K543 PolarHBondContact OD2-NZ 2.9Å
502	S	61.8	Low	74.1	Confident	59 Å²	59	91 Å²	91	41%	0.413	43%	0.434	S	S	.	.			trans	-82.8	41.1	175	72.5	0	0	0	0	112.6	L500 E504	L500-S502 PolarHBondContact O-N 3.36Å; S502-E504 PolarHBondContact O-N 3.24Å
503	R	52.6	Low	74.1	Confident	232 Å²	232	90.1 Å²	90.1	88%	0.875	44%	0.438	S	S	*	.			trans	-77.5	111.5	172.2	-78.8	-170.6	179	-175.5	-0.1	109.6	D501	D501-R503 PolarHBondContact O-N 3Å; D501-R503 VanDerWaalsContact O-N 3.1Å
504	E	39.7	Very low	74.1	Confident	179 Å²	179	90 Å²	90	84%	0.836	44%	0.437	S	S	*	.			trans	54.5	80.2	148.8	-62	-179.4	164.5	0	0	118.5	S502	S502-E504 PolarHBondContact O-N 3.24Å
505	R	46.7	Very low	74.1	Confident	206 Å²	206	91 Å²	91	78%	0.777	44%	0.441	S	S	*	.			trans	-130.1	104.9	137.5	-73.2	-168.5	-178.7	-176.2	-0.4	109.1	G507	R505-G507 PolarHBondContact O-N 3.17Å
506	R	41	Very low	74	Confident	263 Å²	263	90.9 Å²	90.9	99%	0.992	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	123.1	173.7	-73.6	-178	-177.7	-178	0.9	108.8
507	G	45.4	Very low	74	Confident	89 Å²	89	90.5 Å²	90.5	92%	0.918	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.8	-23.7	163.6	0	0	0	0	0	117.2	R505	R505-G507 PolarHBondContact O-N 3.17Å
508	A	50.8	Low	73.9	Confident	70 Å²	70	90.9 Å²	90.9	58%	0.579	44%	0.439	S	S	*	.	S	Bend	trans	-112.1	129.9	179.4	0	0	0	0	0	111.3	Q510	A508-Q510 VanDerWaalsContact C-N 3.32Å; A508-Q510 PolarHBondContact O-N 2.9Å
509	K	56.5	Low	73.9	Confident	163 Å²	163	91 Å²	91	71%	0.709	44%	0.44	S	S	*	.			trans	-60.1	94.3	167.2	-73.8	178.6	178.8	174.8	0	108.5	W511 R512	K509-W511 HydrophobicContact CG-CZ2 4.36Å; K509-W511 PolarHBondContact O-N 2.92Å; K509-W511 VanDerWaalsContact O-N 3.12Å; K509-R512 PolarHBondContact O-NH1 3.27Å
510	Q	74	Confident	73.7	Confident	72 Å²	72	92.9 Å²	92.9	34%	0.336	45%	0.451	S	S	.	.			trans	-80.5	22.7	-178.2	-75.9	-171.6	-16.7	0	0	113.4	A508	A508-Q510 VanDerWaalsContact C-N 3.32Å; A508-Q510 PolarHBondContact O-N 2.9Å
511	W	85.6	Confident	73.5	Confident	118 Å²	118	92.9 Å²	92.9	45%	0.447	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	156.2	172.6	56.2	83.2	0	0	0	110.8	A496 L497 K509	A496-W511 HydrophobicContact CB-CB 4.2Å; A496-W511 HydrophobicContact CB-CG 4.23Å; L497-W511 CarbonylContact O-C 3.5Å; L497-W511 WeakPolarHBondContact O-CA 3.32Å; L497-W511 WeakPolarHBondContact O-CB 3.35Å; K509-W511 HydrophobicContact CG-CZ2 4.36Å; K509-W511 PolarHBondContact O-N 2.92Å; K509-W511 VanDerWaalsContact O-N 3.12Å
512	R	90.6	Very high	74.1	Confident	89 Å²	89	88 Å²	88	34%	0.336	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	132.3	172.2	-65.5	-69.4	177.9	-93.8	3.9	109.2	A496 L497 K509 D566 F567 L586	A496-R512 CarbonylContact C-O 3.48Å; A496-R512 VanDerWaalsContact CA-O 3.26Å; A496-R512 WeakPolarHBondContact CA-O 3.39Å; L497-R512 PolarHBondContact N-O 3.3Å; L497-R512 PolarHBondContact O-N 3.17Å; K509-R512 PolarHBondContact O-NH1 3.27Å; R512-D566 HydrophobicContact CG-CB 4.48Å; R512-D566 PolarHBondContact NE-O 3.47Å; R512-F567 HydrophobicContact CB-CD1 4.39Å; R512-F567 HydrophobicContact CB-CE1 3.51Å; R512-F567 HydrophobicContact CB-CE2 4.41Å; R512-F567 HydrophobicContact CB-CZ 3.54Å; R512-F567 HydrophobicContact CG-CD1 4.24Å; R512-F567 HydrophobicContact CG-CE1 3.83Å; R512-F567 HydrophobicContact CG-CZ 4.22Å; R512-L586 HydrophobicContact CG-CD2 3.73Å
513	T	93.7	Very high	75	Confident	65 Å²	65	86.2 Å²	86.2	40%	0.399	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.3	177.6	-57.8	0	0	0	0	108.9	Q494 F495 Y563	Q494-T513 HydrophobicContact CG-CG2 3.56Å; Q494-T513 VanDerWaalsContact NE2-CG2 3.3Å; F495-T513 CarbonylContact O-C 3.58Å; F495-T513 WeakPolarHBondContact O-CA 3.33Å; T513-Y563 WeakPolarHBondContact O-CE1 3.29Å
514	V	95.4	Very high	76.3	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134	179.5	-179.3	0	0	0	0	108.4	Q494 F495 L497 A516 I559 Y563 F567	Q494-V514 WeakPolarHBondContact CA-O 3.26Å; F495-V514 HydrophobicContact CD2-CB 4.47Å; F495-V514 HydrophobicContact CE2-CB 4.02Å; F495-V514 HydrophobicContact CE2-CG1 4.41Å; F495-V514 HydrophobicContact CZ-CB 4.27Å; F495-V514 HydrophobicContact CZ-CG1 4.23Å; F495-V514 PolarHBondContact N-O 3.06Å; F495-V514 VanDerWaalsContact N-O 3.07Å; F495-V514 PolarHBondContact O-N 2.96Å; L497-V514 HydrophobicContact CD1-CG2 4.19Å; V514-A516 HydrophobicContact CG1-CB 4.32Å; V514-I559 HydrophobicContact CG1-CD1 4.17Å; V514-I559 HydrophobicContact CG2-CD1 4.17Å; V514-Y563 HydrophobicContact CG1-CD2 3.85Å; V514-Y563 HydrophobicContact CG1-CE2 4.03Å; V514-Y563 HydrophobicContact CG1-CG 4.27Å; V514-Y563 HydrophobicContact CG2-CG 4.44Å; V514-F567 HydrophobicContact CG2-CE2 3.87Å; V514-F567 HydrophobicContact CG2-CZ 3.63Å
515	K	95.6	Very high	78.4	Confident	88 Å²	88	70.8 Å²	70.8	38%	0.383	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	119.1	166.2	-63.9	178.6	-179.1	176.6	0	107.6	V493 Q494 Y563	V493-K515 CarbonylContact O-C 3.53Å; V493-K515 VanDerWaalsContact O-CA 3.32Å; V493-K515 WeakPolarHBondContact O-CA 3.2Å; Q494-K515 HydrophobicContact CB-CG 4.27Å; Q494-K515 HydrophobicContact CG-CG 4.06Å; K515-Y563 WeakPolarHBondContact CB-OH 3.23Å; K515-Y563 PolarHBondContact N-OH 2.69Å; K515-Y563 WeakPolarHBondContact O-CE2 3.18Å
516	A	95.1	Very high	80.2	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	150.3	-173.1	0	0	0	0	0	112.3	S456 I458 R492 V493 F495 V514	S456-A516 VanDerWaalsContact O-CA 3.3Å; S456-A516 WeakPolarHBondContact O-CA 3.2Å; I458-A516 HydrophobicContact CB-CB 4.24Å; I458-A516 HydrophobicContact CG2-CB 4.01Å; R492-A516 WeakPolarHBondContact CA-O 3.17Å; V493-A516 PolarHBondContact N-O 2.77Å; V493-A516 PolarHBondContact O-N 3.25Å; F495-A516 HydrophobicContact CE1-CB 3.77Å; F495-A516 HydrophobicContact CZ-CB 4Å; V514-A516 HydrophobicContact CG1-CB 4.32Å
517	L	94	Very high	82.1	Confident	5 Å²	5	52.1 Å²	52.1	3%	0.026	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	134.1	176.5	-67.8	175.1	0	0	0	111.1	R455 S456 F457 I458 E473 V475 I490 R492 V611	R455-L517 HydrophobicContact CB-CD1 4.44Å; S456-L517 PolarHBondContact O-N 2.86Å; F457-L517 VanDerWaalsContact CA-O 3.32Å; F457-L517 WeakPolarHBondContact CA-O 3.43Å; F457-L517 HydrophobicContact CD1-CB 3.61Å; F457-L517 HydrophobicContact CD1-CD1 4.42Å; F457-L517 HydrophobicContact CE1-CB 3.82Å; F457-L517 HydrophobicContact CE1-CD1 3.79Å; F457-L517 HydrophobicContact CE1-CG 4.42Å; F457-L517 HydrophobicContact CZ-CD1 4.42Å; I458-L517 PolarHBondContact N-O 3.16Å; E473-L517 HydrophobicContact CG-CD2 4.21Å; E473-L517 WeakPolarHBondContact OE1-CD2 3.21Å; V475-L517 HydrophobicContact CG1-CD1 4.04Å; V475-L517 HydrophobicContact CG2-CD1 4.13Å; V475-L517 HydrophobicContact CG2-CD2 4.15Å; I490-L517 HydrophobicContact CG2-CB 3.93Å; I490-L517 HydrophobicContact CG2-CD2 3.99Å; R492-L517 HydrophobicContact CB-CD2 4.15Å; L517-V611 HydrophobicContact CD1-CG2 4.23Å
518	C	92.9	Very high	83.9	Confident	7 Å²	7	49.9 Å²	49.9	5%	0.047	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	120.7	179.9	-65.1	0	0	0	0	111.7	I458 I490 R491	I458-C518 WeakPolarHBondContact O-CA 2.94Å; I490-C518 VanDerWaalsContact CG2-O 3.24Å; I490-C518 WeakPolarHBondContact CG2-O 3.43Å; R491-C518 HydrophobicContact CB-CB 4.25Å; R491-C518 WeakPolarHBondContact O-CB 3.31Å; R491-C518 PolarHBondContact O-N 3.17Å; R491-C518 PolarHBondContact O-SG 3.1Å
519	L	89.9	Confident	85.7	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.037	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.3	172	-66.4	179.5	0	0	0	111.1	V415 F457 I458 T459 E460 I477 I490 K521	V415-L519 HydrophobicContact CG2-CD1 4.22Å; F457-L519 HydrophobicContact CB-CD1 4.28Å; F457-L519 HydrophobicContact CD1-CD1 3.35Å; F457-L519 HydrophobicContact CD1-CG 3.7Å; F457-L519 HydrophobicContact CE1-CD1 3.78Å; F457-L519 HydrophobicContact CE1-CG 4.27Å; F457-L519 HydrophobicContact CG-CD1 3.88Å; F457-L519 HydrophobicContact CG-CG 4.48Å; I458-L519 PolarHBondContact O-N 3.38Å; T459-L519 CarbonylContact C-O 3.53Å; T459-L519 VanDerWaalsContact CA-O 3.25Å; T459-L519 WeakPolarHBondContact CA-O 3.49Å; E460-L519 PolarHBondContact N-O 2.71Å; I477-L519 HydrophobicContact CD1-CD1 4.3Å; I477-L519 HydrophobicContact CD1-CD2 3.62Å; I490-L519 HydrophobicContact CD1-CD2 3.95Å; L519-K521 PolarHBondContact O-N 2.74Å; L519-K521 VanDerWaalsContact O-N 3.16Å
520	S	85.7	Confident	87	Confident	59 Å²	59	40.1 Å²	40.1	41%	0.413	21%	0.208	S	C	.	.	S	Bend	trans	-57.5	-30.2	173.8	62.5	0	0	0	0	113.2
521	K	83.1	Confident	87.6	Confident	72 Å²	72	42.5 Å²	42.5	31%	0.313	22%	0.222	S	C	.	.			trans	-151.9	125.4	176.4	-174.5	-179.7	-179.5	-176.2	0	110.6	Q414 L519 C523	Q414-K521 HydrophobicContact CG-CD 4.37Å; L519-K521 PolarHBondContact O-N 2.74Å; L519-K521 VanDerWaalsContact O-N 3.16Å; K521-C523 WeakPolarHBondContact CE-O 3.41Å
522	I	85.8	Confident	87.6	Confident	4 Å²	4	39.5 Å²	39.5	2%	0.021	22%	0.215	C	C	.	.	S	Bend	trans	-78.7	-59.4	175.1	-64.2	175	0	0	0	109.9	V415 F457 T459 I555 D556 L558	V415-I522 VanDerWaalsContact CB-O 3.29Å; V415-I522 WeakPolarHBondContact CB-O 3.43Å; V415-I522 VanDerWaalsContact CG2-O 3.23Å; V415-I522 WeakPolarHBondContact CG2-O 3.39Å; F457-I522 HydrophobicContact CB-CD1 4.43Å; F457-I522 HydrophobicContact CB-CG1 4.38Å; T459-I522 HydrophobicContact CG2-CD1 3.89Å; T459-I522 HydrophobicContact CG2-CG1 3.99Å; I522-I555 HydrophobicContact CD1-CG2 4.24Å; I522-I555 HydrophobicContact CG2-CG2 4.26Å; I522-D556 WeakPolarHBondContact CD1-O 3.39Å; I522-L558 HydrophobicContact CD1-CB 4.31Å; I522-L558 HydrophobicContact CG2-CB 3.82Å; I522-L558 HydrophobicContact CG2-CD1 3.79Å; I522-L558 HydrophobicContact CG2-CG 4.47Å
523	C	81.7	Confident	87.2	Confident	21 Å²	21	38.4 Å²	38.4	14%	0.142	21%	0.214	C	C	.	.	S	Bend	trans	-148	175.4	178.4	63.2	0	0	0	0	111.1	K521 L607	K521-C523 WeakPolarHBondContact CE-O 3.41Å; C523-L607 HydrophobicContact CB-CD2 4.45Å
524	S	79.7	Confident	86.7	Confident	29 Å²	29	45.5 Å²	45.5	20%	0.203	23%	0.233	C	C	.	.	S	Bend	trans	-69.1	153.6	167.7	53.9	0	0	0	0	110.6	I526	S524-I526 PolarHBondContact O-N 3.06Å
525	P	83.9	Confident	86.2	Confident	58 Å²	58	50.5 Å²	50.5	38%	0.377	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-48.5	135.3	178.4	-28.5	34.8	0	0	0	112.7	S553 K554 R605	P525-S553 CarbonylContact C-O 3.58Å; P525-S553 WeakPolarHBondContact CA-O 3.33Å; P525-K554 HydrophobicContact CG-CG 4.24Å; P525-R605 PolarHBondContact O-NH2 3.3Å
526	I	84.6	Confident	85.8	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.026	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-80.5	138.3	178.2	59.4	168.3	0	0	0	110.4	T430 S524 R550 C552 S553 I555	T430-I526 HydrophobicContact CG2-CD1 3.7Å; S524-I526 PolarHBondContact O-N 3.06Å; I526-R550 VanDerWaalsContact CD1-NH1 3.27Å; I526-R550 VanDerWaalsContact CD1-NH2 3.28Å; I526-C552 CarbonylContact O-C 3.57Å; I526-C552 VanDerWaalsContact O-CA 3.24Å; I526-C552 WeakPolarHBondContact O-CA 3.29Å; I526-C552 PolarHBondContact O-SG 3.08Å; I526-S553 WeakPolarHBondContact CG1-O 3.34Å; I526-S553 PolarHBondContact N-O 2.88Å; I526-S553 PolarHBondContact O-N 2.67Å; I526-I555 HydrophobicContact CD1-CD1 3.57Å; I526-I555 HydrophobicContact CD1-CG1 4.22Å; I526-I555 HydrophobicContact CG1-CD1 4.26Å; I526-I555 HydrophobicContact CG1-CG1 4.44Å; I526-I555 HydrophobicContact CG2-CD1 4.4Å; I526-I555 HydrophobicContact CG2-CG1 3.93Å
527	Q	80	Confident	85.4	Confident	73 Å²	73	54.2 Å²	54.2	34%	0.341	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-66.4	157.9	-176.3	-67.8	176.3	-19.1	0	0	111.9	N529 R550	Q527-N529 PolarHBondContact O-N 3.2Å; Q527-R550 PolarHBondContact O-NH2 3.4Å
528	A	83.7	Confident	85.2	Confident	42 Å²	42	55.6 Å²	55.6	35%	0.347	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-64.2	124.9	178.6	0	0	0	0	0	112	R425 R550	R425-A528 PolarHBondContact NH1-O 2.8Å; R425-A528 PolarHBondContact NH2-O 3.17Å; A528-R550 CarbonylContact C-O 3.6Å; A528-R550 VanDerWaalsContact C-O 3.32Å; A528-R550 WeakPolarHBondContact CA-O 3.48Å; A528-R550 WeakPolarHBondContact CB-O 3.47Å
529	N	88.1	Confident	85.2	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.027	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-77	152.5	177.4	67.5	23.4	0	0	0	110.1	L427 Q527 Q547 F548 P549 R550	L427-N529 HydrophobicContact CD2-CB 4.1Å; Q527-N529 PolarHBondContact O-N 3.2Å; N529-Q547 PolarHBondContact ND2-O 3.41Å; N529-Q547 PolarHBondContact OD1-O 3.08Å; N529-F548 HydrophobicContact CB-CD1 4.14Å; N529-F548 HydrophobicContact CB-CE1 3.73Å; N529-F548 HydrophobicContact CB-CZ 4.19Å; N529-F548 WeakPolarHBondContact ND2-CE2 3.27Å; N529-F548 WeakPolarHBondContact ND2-CZ 3.41Å; N529-P549 VanDerWaalsContact OD1-CA 3.3Å; N529-P549 WeakPolarHBondContact OD1-CA 3.41Å; N529-R550 PolarHBondContact N-O 2.89Å; N529-R550 PolarHBondContact OD1-N 2.83Å
530	P	84.5	Confident	85.1	Confident	22 Å²	22	59.2 Å²	59.2	14%	0.143	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-76.2	167.8	-176.2	32.8	-36.9	0	0	0	112	W536 F548 I595	P530-W536 HydrophobicContact CG-CH2 3.97Å; P530-W536 HydrophobicContact CG-CZ3 4.36Å; P530-F548 WeakPolarHBondContact O-CD1 3.42Å; P530-I595 HydrophobicContact CG-CD1 3.79Å
531	L	85.7	Confident	85.2	Confident	122 Å²	122	60.6 Å²	60.6	64%	0.639	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-58.4	142.4	162.5	-79	160.5	0	0	0	110.1	Q533 P549	L531-Q533 PolarHBondContact O-N 2.8Å; L531-Q533 VanDerWaalsContact O-N 3.1Å; L531-P549 HydrophobicContact CD2-CB 4.35Å; L531-P549 HydrophobicContact CD2-CG 3.66Å; L531-P549 HydrophobicContact CG-CB 4.21Å; L531-P549 HydrophobicContact CG-CG 3.94Å
532	L	85.5	Confident	85.6	Confident	56 Å²	56	58.3 Å²	58.3	29%	0.293	31%	0.305	S	S	.	.			trans	-60.4	115.9	173.9	-74.3	171.7	0	0	0	109.8	W536 L539 L544 F548	L532-W536 HydrophobicContact CD2-CE3 4.05Å; L532-W536 HydrophobicContact CD2-CZ3 4.42Å; L532-L539 HydrophobicContact CD2-CB 4.23Å; L532-L539 HydrophobicContact CD2-CD1 3.89Å; L532-L544 HydrophobicContact CD1-CD1 3.78Å; L532-L544 HydrophobicContact CD2-CD1 4.18Å; L532-L544 HydrophobicContact CG-CD1 4.36Å; L532-F548 HydrophobicContact CD1-CB 4.42Å; L532-F548 HydrophobicContact CD2-CB 4.5Å; L532-F548 HydrophobicContact CD2-CD1 4.24Å; L532-F548 HydrophobicContact CD2-CG 4.43Å; L532-F548 HydrophobicContact CG-CB 3.97Å; L532-F548 HydrophobicContact CG-CG 4.43Å
533	Q	83.7	Confident	85.8	Confident	65 Å²	65	63.6 Å²	63.6	30%	0.304	33%	0.328	S	S	.	.			trans	-77.4	140.7	-178.8	-63.1	179.9	-15	0	0	110.5	L531 R535 W536 H540	L531-Q533 PolarHBondContact O-N 2.8Å; L531-Q533 VanDerWaalsContact O-N 3.1Å; Q533-R535 HydrophobicContact CB-CG 4.03Å; Q533-R535 PolarHBondContact O-N 3.31Å; Q533-R535 VanDerWaalsContact OE1-NH2 3.08Å; Q533-W536 HydrophobicContact CB-CD2 3.99Å; Q533-W536 HydrophobicContact CB-CE3 3.92Å; Q533-W536 HydrophobicContact CB-CH2 4.23Å; Q533-W536 HydrophobicContact CB-CZ2 4.31Å; Q533-W536 HydrophobicContact CB-CZ3 4.04Å; Q533-W536 HydrophobicContact CG-CE3 4.28Å; Q533-W536 HydrophobicContact CG-CH2 3.75Å; Q533-W536 HydrophobicContact CG-CZ2 4.07Å; Q533-W536 HydrophobicContact CG-CZ3 3.87Å; Q533-W536 PolarHBondContact O-N 2.96Å; Q533-W536 VanDerWaalsContact OE1-CZ2 3.32Å; Q533-H540 PolarHBondContact O-CE1 2.86Å
534	R	83	Confident	86.3	Confident	214 Å²	214	64.3 Å²	64.3	81%	0.808	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-26.3	179.3	-164.2	179.4	72.4	94.1	-1.2	114	W536	R534-W536 VanDerWaalsContact C-N 3.34Å
535	R	84.5	Confident	86.9	Confident	105 Å²	105	63.1 Å²	63.1	40%	0.396	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.1	177.6	67.7	176.7	178.5	122.4	-6.4	113.7	Q533 K537	Q533-R535 HydrophobicContact CB-CG 4.03Å; Q533-R535 PolarHBondContact O-N 3.31Å; Q533-R535 VanDerWaalsContact OE1-NH2 3.08Å; R535-K537 PolarHBondContact O-N 3.43Å
536	W	87.2	Confident	87.3	Confident	1 Å²	1	60.7 Å²	60.7	0%	0.004	31%	0.306	C	S	.	.			trans	-80.8	59	-179.6	-55.7	-34.3	0	0	0	112	P530 L532 Q533 R534 H538 L539 H540 L580 I595	P530-W536 HydrophobicContact CG-CH2 3.97Å; P530-W536 HydrophobicContact CG-CZ3 4.36Å; L532-W536 HydrophobicContact CD2-CE3 4.05Å; L532-W536 HydrophobicContact CD2-CZ3 4.42Å; Q533-W536 HydrophobicContact CB-CD2 3.99Å; Q533-W536 HydrophobicContact CB-CE3 3.92Å; Q533-W536 HydrophobicContact CB-CH2 4.23Å; Q533-W536 HydrophobicContact CB-CZ2 4.31Å; Q533-W536 HydrophobicContact CB-CZ3 4.04Å; Q533-W536 HydrophobicContact CG-CE3 4.28Å; Q533-W536 HydrophobicContact CG-CH2 3.75Å; Q533-W536 HydrophobicContact CG-CZ2 4.07Å; Q533-W536 HydrophobicContact CG-CZ3 3.87Å; Q533-W536 PolarHBondContact O-N 2.96Å; Q533-W536 VanDerWaalsContact OE1-CZ2 3.32Å; R534-W536 VanDerWaalsContact C-N 3.34Å; W536-H538 PolarHBondContact O-N 3.43Å; W536-L539 HydrophobicContact CB-CB 4.29Å; W536-L539 HydrophobicContact CB-CD1 3.75Å; W536-L539 HydrophobicContact CB-CG 3.94Å; W536-L539 HydrophobicContact CD2-CD1 4.25Å; W536-L539 HydrophobicContact CE3-CD1 4.12Å; W536-L539 HydrophobicContact CG-CD1 4.13Å; W536-L539 WeakPolarHBondContact O-CB 3Å; W536-L539 PolarHBondContact O-N 3.45Å; W536-H540 PolarHBondContact O-CE1 3.26Å; W536-H540 PolarHBondContact O-ND1 2.83Å; W536-L580 HydrophobicContact CD2-CD1 4.08Å; W536-L580 HydrophobicContact CE3-CD1 4.03Å; W536-L580 HydrophobicContact CH2-CD1 3.68Å; W536-L580 HydrophobicContact CZ2-CD1 3.7Å; W536-L580 HydrophobicContact CZ2-CG 4.31Å; W536-L580 HydrophobicContact CZ3-CD1 3.85Å; W536-I595 HydrophobicContact CH2-CD1 4.44Å; W536-I595 HydrophobicContact CZ2-CG2 4.29Å
537	K	86.4	Confident	87.5	Confident	167 Å²	167	65.3 Å²	65.3	73%	0.726	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-55.2	-36.1	-174	-66.8	-178.4	-178.5	177.3	0	112.8	R535 L539 H540	R535-K537 PolarHBondContact O-N 3.43Å; K537-L539 PolarHBondContact O-N 3.37Å; K537-H540 PolarHBondContact O-N 2.77Å
538	H	90.9	Very high	87.9	Confident	33 Å²	33	63.4 Å²	63.4	15%	0.153	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-66.3	-19	179.3	65.3	-63	0	0	0	114.2	W536 G575 L580	W536-H538 PolarHBondContact O-N 3.43Å; H538-G575 VanDerWaalsContact CE1-CA 3.49Å; H538-G575 WeakPolarHBondContact CE1-CA 3.24Å; H538-G575 PolarHBondContact NE2-N 3.3Å; H538-L580 PolarHBondContact CE1-O 3.33Å; H538-L580 PolarHBondContact NE2-O 3.32Å
539	L	91.5	Very high	88.2	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.005	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-88.1	-17.8	176.7	-55.9	-173.9	0	0	0	113.2	L532 W536 K537 L542 L580 A582 V591	L532-L539 HydrophobicContact CD2-CB 4.23Å; L532-L539 HydrophobicContact CD2-CD1 3.89Å; W536-L539 HydrophobicContact CB-CB 4.29Å; W536-L539 HydrophobicContact CB-CD1 3.75Å; W536-L539 HydrophobicContact CB-CG 3.94Å; W536-L539 HydrophobicContact CD2-CD1 4.25Å; W536-L539 HydrophobicContact CE3-CD1 4.12Å; W536-L539 HydrophobicContact CG-CD1 4.13Å; W536-L539 WeakPolarHBondContact O-CB 3Å; W536-L539 PolarHBondContact O-N 3.45Å; K537-L539 PolarHBondContact O-N 3.37Å; L539-L542 HydrophobicContact CD2-CD1 4.35Å; L539-L542 WeakPolarHBondContact O-CB 3.39Å; L539-L542 WeakPolarHBondContact O-CG 3.16Å; L539-L542 PolarHBondContact O-N 3.34Å; L539-L580 HydrophobicContact CD1-CB 4.23Å; L539-L580 HydrophobicContact CD1-CD1 4.39Å; L539-A582 HydrophobicContact CD2-CB 3.6Å; L539-V591 HydrophobicContact CD1-CG1 3.84Å; L539-V591 HydrophobicContact CD1-CG2 4.38Å; L539-V591 HydrophobicContact CD2-CG1 4.48Å; L539-V591 HydrophobicContact CD2-CG2 4.27Å
540	H	88.4	Confident	88.3	Confident	89 Å²	89	65.1 Å²	65.1	41%	0.412	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	140.9	-177.2	-68.7	76.9	0	0	0	111	Q533 W536 K537 L542	Q533-H540 PolarHBondContact O-CE1 2.86Å; W536-H540 PolarHBondContact O-CE1 3.26Å; W536-H540 PolarHBondContact O-ND1 2.83Å; K537-H540 PolarHBondContact O-N 2.77Å; H540-L542 PolarHBondContact O-N 3.05Å
541	G	87.5	Confident	88.6	Confident	88 Å²	88	71.6 Å²	71.6	91%	0.907	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	-2	-175.9	0	0	0	0	0	114.5
542	L	90.7	Very high	88.7	Confident	24 Å²	24	69.8 Å²	69.8	13%	0.126	35%	0.348	C	S	.	.			trans	-77.3	136.6	173	-62.6	-173.7	0	0	0	110.9	L539 H540 L544 R573 A582 W589	L539-L542 HydrophobicContact CD2-CD1 4.35Å; L539-L542 WeakPolarHBondContact O-CB 3.39Å; L539-L542 WeakPolarHBondContact O-CG 3.16Å; L539-L542 PolarHBondContact O-N 3.34Å; H540-L542 PolarHBondContact O-N 3.05Å; L542-L544 HydrophobicContact CB-CD2 3.81Å; L542-L544 PolarHBondContact O-N 3.22Å; L542-R573 VanDerWaalsContact CD2-NH1 3.33Å; L542-A582 HydrophobicContact CD1-CB 3.8Å; L542-W589 HydrophobicContact CB-CB 4.21Å; L542-W589 HydrophobicContact CB-CG 4.02Å; L542-W589 HydrophobicContact CD1-CB 4.16Å; L542-W589 HydrophobicContact CD1-CD2 3.88Å; L542-W589 HydrophobicContact CD1-CE3 4.08Å; L542-W589 HydrophobicContact CD1-CG 3.93Å; L542-W589 HydrophobicContact CD2-CD2 4.03Å; L542-W589 HydrophobicContact CD2-CG 4.17Å; L542-W589 HydrophobicContact CD2-CZ2 4.26Å; L542-W589 HydrophobicContact CG-CD2 4.43Å; L542-W589 HydrophobicContact CG-CG 4.28Å
543	K	90.9	Very high	88.8	Confident	116 Å²	116	68.6 Å²	68.6	50%	0.504	34%	0.344	S	S	.	.			trans	-75	93.2	167.2	-174.8	175.9	-174.5	165.6	0	109.3	D501 G588 W589	D501-K543 VanDerWaalsContact CB-NZ 3.32Å; D501-K543 WeakPolarHBondContact OD2-CE 3.44Å; D501-K543 IonicContact OD2-NZ 2.68Å; D501-K543 PolarHBondContact OD2-NZ 2.9Å; K543-G588 CarbonylContact O-C 3.5Å; K543-G588 WeakPolarHBondContact O-CA 3.22Å; K543-W589 PolarHBondContact O-N 3.29Å
544	L	92.5	Very high	89.3	Confident	35 Å²	35	72.1 Å²	72.1	18%	0.183	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-70.5	137	-178.8	-57.8	-169.6	0	0	0	111.2	L532 L542 D546 F548 W589 V591	L532-L544 HydrophobicContact CD1-CD1 3.78Å; L532-L544 HydrophobicContact CD2-CD1 4.18Å; L532-L544 HydrophobicContact CG-CD1 4.36Å; L542-L544 HydrophobicContact CB-CD2 3.81Å; L542-L544 PolarHBondContact O-N 3.22Å; L544-D546 WeakPolarHBondContact CB-O 3.41Å; L544-F548 HydrophobicContact CD1-CB 4.17Å; L544-F548 HydrophobicContact CD1-CD2 3.53Å; L544-F548 HydrophobicContact CD1-CE2 4.15Å; L544-F548 HydrophobicContact CD1-CG 3.96Å; L544-W589 CarbonylContact C-O 3.49Å; L544-W589 VanDerWaalsContact CA-O 3.23Å; L544-W589 WeakPolarHBondContact CA-O 3.44Å; L544-W589 HydrophobicContact CD2-CB 3.9Å; L544-V591 HydrophobicContact CD1-CG2 4.15Å; L544-V591 HydrophobicContact CD2-CG2 3.76Å
545	A	91.5	Very high	89.8	Confident	4 Å²	4	62.3 Å²	62.3	3%	0.033	32%	0.322	C	S	.	.	S	Bend	trans	-75.3	-17.7	177.4	0	0	0	0	0	112.1	A431 R432 I585 F587 W589 I590	A431-A545 HydrophobicContact CB-CB 3.9Å; R432-A545 PolarHBondContact N-O 3.34Å; A545-I585 HydrophobicContact CB-CD1 4.09Å; A545-I585 HydrophobicContact CB-CG1 4.29Å; A545-F587 HydrophobicContact CB-CB 4.17Å; A545-W589 PolarHBondContact N-O 3.24Å; A545-I590 HydrophobicContact CB-CG2 3.85Å
546	D	91.7	Very high	90.3	Very high	8 Å²	8	58.9 Å²	58.9	4%	0.043	31%	0.312	C	S	.	.	S	Bend	trans	-117.6	159.1	174.6	-166	2.8	0	0	0	110	T430 M446 L544 F548 R550	T430-D546 WeakPolarHBondContact CB-OD2 3.32Å; T430-D546 WeakPolarHBondContact O-CB 3.23Å; T430-D546 PolarHBondContact OG1-OD2 3.48Å; M446-D546 HydrophobicContact CE-CB 4.46Å; M446-D546 WeakPolarHBondContact CE-OD1 3.32Å; M446-D546 WeakPolarHBondContact CE-OD2 3.46Å; L544-D546 WeakPolarHBondContact CB-O 3.41Å; D546-F548 HydrophobicContact CB-CD2 4.48Å; D546-F548 HydrophobicContact CB-CE2 4.04Å; D546-R550 IonicContact OD1-NH1 3.09Å; D546-R550 IonicContact OD2-CZ 2.79Å; D546-R550 IonicContact OD2-NH1 2.56Å; D546-R550 PolarHBondContact OD2-NH1 3.14Å
547	Q	89.1	Confident	90.8	Very high	101 Å²	101	58.9 Å²	58.9	47%	0.472	31%	0.312	S	S	.	.			trans	-79.1	137	177.6	-167.1	176.8	-13.2	0	0	109.7	N529 P549 R550	N529-Q547 PolarHBondContact ND2-O 3.41Å; N529-Q547 PolarHBondContact OD1-O 3.08Å; Q547-P549 WeakPolarHBondContact CG-O 3.36Å; Q547-R550 HydrophobicContact CB-CB 4.27Å; Q547-R550 VanDerWaalsContact O-CB 3.3Å; Q547-R550 WeakPolarHBondContact O-CB 3.24Å; Q547-R550 PolarHBondContact O-N 3.46Å
548	F	88.7	Confident	91.2	Very high	34 Å²	34	51.3 Å²	51.3	15%	0.149	28%	0.279	C	S	.	.	S	Bend	trans	-131.8	107	174.4	-82	-101.8	0	0	0	108.4	L427 N529 P530 L532 L544 D546 V591	L427-F548 HydrophobicContact CD1-CE1 3.96Å; L427-F548 HydrophobicContact CD1-CZ 4.26Å; N529-F548 HydrophobicContact CB-CD1 4.14Å; N529-F548 HydrophobicContact CB-CE1 3.73Å; N529-F548 HydrophobicContact CB-CZ 4.19Å; N529-F548 WeakPolarHBondContact ND2-CE2 3.27Å; N529-F548 WeakPolarHBondContact ND2-CZ 3.41Å; P530-F548 WeakPolarHBondContact O-CD1 3.42Å; L532-F548 HydrophobicContact CD1-CB 4.42Å; L532-F548 HydrophobicContact CD2-CB 4.5Å; L532-F548 HydrophobicContact CD2-CD1 4.24Å; L532-F548 HydrophobicContact CD2-CG 4.43Å; L532-F548 HydrophobicContact CG-CB 3.97Å; L532-F548 HydrophobicContact CG-CG 4.43Å; L544-F548 HydrophobicContact CD1-CB 4.17Å; L544-F548 HydrophobicContact CD1-CD2 3.53Å; L544-F548 HydrophobicContact CD1-CE2 4.15Å; L544-F548 HydrophobicContact CD1-CG 3.96Å; D546-F548 HydrophobicContact CB-CD2 4.48Å; D546-F548 HydrophobicContact CB-CE2 4.04Å; F548-V591 HydrophobicContact CE2-CB 4.24Å; F548-V591 HydrophobicContact CE2-CG2 4.35Å; F548-V591 HydrophobicContact CZ-CB 3.82Å; F548-V591 HydrophobicContact CZ-CG1 4.39Å; F548-V591 HydrophobicContact CZ-CG2 4.35Å
549	P	89.4	Confident	91.4	Very high	62 Å²	62	49.9 Å²	49.9	40%	0.403	27%	0.272	S	S	.	.	S	Bend	cis	-84.8	150.9	6.7	35.7	-28.8	0	0	0	111.9	N529 L531 Q547	N529-P549 VanDerWaalsContact OD1-CA 3.3Å; N529-P549 WeakPolarHBondContact OD1-CA 3.41Å; L531-P549 HydrophobicContact CD2-CB 4.35Å; L531-P549 HydrophobicContact CD2-CG 3.66Å; L531-P549 HydrophobicContact CG-CB 4.21Å; L531-P549 HydrophobicContact CG-CG 3.94Å; Q547-P549 WeakPolarHBondContact CG-O 3.36Å
550	R	91.2	Very high	91.5	Very high	20 Å²	20	49.8 Å²	49.8	8%	0.075	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-121.1	137.9	172.4	-178.9	-156.6	66	-145.6	-5.8	108	T430 I526 Q527 A528 N529 D546 Q547 S553	T430-R550 PolarHBondContact OG1-NH1 3.24Å; I526-R550 VanDerWaalsContact CD1-NH1 3.27Å; I526-R550 VanDerWaalsContact CD1-NH2 3.28Å; Q527-R550 PolarHBondContact O-NH2 3.4Å; A528-R550 CarbonylContact C-O 3.6Å; A528-R550 VanDerWaalsContact C-O 3.32Å; A528-R550 WeakPolarHBondContact CA-O 3.48Å; A528-R550 WeakPolarHBondContact CB-O 3.47Å; N529-R550 PolarHBondContact N-O 2.89Å; N529-R550 PolarHBondContact OD1-N 2.83Å; D546-R550 IonicContact OD1-NH1 3.09Å; D546-R550 IonicContact OD2-CZ 2.79Å; D546-R550 IonicContact OD2-NH1 2.56Å; D546-R550 PolarHBondContact OD2-NH1 3.14Å; Q547-R550 HydrophobicContact CB-CB 4.27Å; Q547-R550 VanDerWaalsContact O-CB 3.3Å; Q547-R550 WeakPolarHBondContact O-CB 3.24Å; Q547-R550 PolarHBondContact O-N 3.46Å; R550-S553 WeakPolarHBondContact CD-OG 3.32Å
551	E	90	Very high	91.6	Very high	159 Å²	159	49.5 Å²	49.5	74%	0.743	27%	0.273	S	S	*	.			trans	-68.1	174.3	173.2	-61.2	-174.8	172.5	0	0	113.1	S553	E551-S553 PolarHBondContact O-N 3.15Å; E551-S553 PolarHBondContact O-OG 3.29Å
552	C	88.2	Confident	91.8	Very high	83 Å²	83	47.8 Å²	47.8	56%	0.561	24%	0.243	S	C	*	.	S	Bend	trans	-59.4	120.4	172.3	-172.1	0	0	0	0	109.4	I526	I526-C552 CarbonylContact O-C 3.57Å; I526-C552 VanDerWaalsContact O-CA 3.24Å; I526-C552 WeakPolarHBondContact O-CA 3.29Å; I526-C552 PolarHBondContact O-SG 3.08Å
553	S	88.6	Confident	92	Very high	32 Å²	32	48.9 Å²	48.9	22%	0.224	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-129.9	152.1	-168.6	-62.2	0	0	0	0	111.4	P525 I526 R550 E551	P525-S553 CarbonylContact C-O 3.58Å; P525-S553 WeakPolarHBondContact CA-O 3.33Å; I526-S553 WeakPolarHBondContact CG1-O 3.34Å; I526-S553 PolarHBondContact N-O 2.88Å; I526-S553 PolarHBondContact O-N 2.67Å; R550-S553 WeakPolarHBondContact CD-OG 3.32Å; E551-S553 PolarHBondContact O-N 3.15Å; E551-S553 PolarHBondContact O-OG 3.29Å
554	K	92.6	Very high	92.1	Very high	138 Å²	138	44.1 Å²	44.1	60%	0.6	23%	0.225	S	C	*	.			trans	-83.5	151.2	169	-69.6	-179.7	-178.8	176.2	0	109.7	M446 P525	M446-K554 WeakPolarHBondContact CB-O 3.5Å; P525-K554 HydrophobicContact CG-CG 4.24Å
555	I	93.8	Very high	92.1	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.041	25%	0.247	C	C	.	.			trans	-92.8	127.2	169.7	-67.6	-58.3	0	0	0	108.3	T430 M446 L448 T459 I522 I526 V557	T430-I555 HydrophobicContact CG2-CD1 4.35Å; M446-I555 HydrophobicContact CB-CD1 4.4Å; M446-I555 HydrophobicContact CG-CD1 3.72Å; L448-I555 HydrophobicContact CB-CD1 3.88Å; L448-I555 HydrophobicContact CB-CG1 4.03Å; L448-I555 HydrophobicContact CB-CG2 3.78Å; L448-I555 HydrophobicContact CD2-CG1 4.42Å; T459-I555 WeakPolarHBondContact CG2-O 3.38Å; I522-I555 HydrophobicContact CD1-CG2 4.24Å; I522-I555 HydrophobicContact CG2-CG2 4.26Å; I526-I555 HydrophobicContact CD1-CD1 3.57Å; I526-I555 HydrophobicContact CD1-CG1 4.22Å; I526-I555 HydrophobicContact CG1-CD1 4.26Å; I526-I555 HydrophobicContact CG1-CG1 4.44Å; I526-I555 HydrophobicContact CG2-CD1 4.4Å; I526-I555 HydrophobicContact CG2-CG1 3.93Å; I555-V557 VanDerWaalsContact CG2-O 3.31Å; I555-V557 WeakPolarHBondContact CG2-O 3.38Å
556	D	96.1	Very high	92	Very high	34 Å²	34	54 Å²	54	18%	0.182	27%	0.266	C	S	.	.			trans	-91.7	-38.2	179.2	-65.6	-52.6	0	0	0	111.9	V445 M446 I458 T459 L462 I522	V445-D556 WeakPolarHBondContact CA-OD2 3.1Å; V445-D556 HydrophobicContact CB-CB 3.98Å; V445-D556 HydrophobicContact CG1-CB 4.36Å; M446-D556 PolarHBondContact N-OD2 2.99Å; M446-D556 PolarHBondContact O-N 2.91Å; I458-D556 WeakPolarHBondContact CA-O 3.38Å; T459-D556 PolarHBondContact N-O 3.22Å; L462-D556 HydrophobicContact CD2-CB 3.75Å; I522-D556 WeakPolarHBondContact CD1-O 3.39Å
557	V	96.8	Very high	92	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	131.4	-175.5	-178.7	0	0	0	0	109.9	V445 M446 C447 L448 F457 I458 L462 F495 L497 I555 I559	V445-V557 HydrophobicContact CB-CG2 4.49Å; V445-V557 HydrophobicContact CG2-CG2 4.33Å; M446-V557 PolarHBondContact O-N 3.49Å; C447-V557 CarbonylContact C-O 3.6Å; C447-V557 VanDerWaalsContact CA-O 3.26Å; C447-V557 WeakPolarHBondContact CA-O 3.38Å; L448-V557 PolarHBondContact N-O 3.35Å; F457-V557 CarbonylContact O-C 3.54Å; F457-V557 WeakPolarHBondContact O-CA 3.45Å; I458-V557 HydrophobicContact CD1-CG2 4.41Å; I458-V557 HydrophobicContact CG1-CG2 4.22Å; L462-V557 HydrophobicContact CD2-CG2 4.23Å; F495-V557 HydrophobicContact CE2-CG1 4.19Å; F495-V557 HydrophobicContact CE2-CG2 4.36Å; F495-V557 HydrophobicContact CZ-CG1 3.9Å; F495-V557 HydrophobicContact CZ-CG2 4.16Å; L497-V557 HydrophobicContact CD1-CG1 4.49Å; I555-V557 VanDerWaalsContact CG2-O 3.31Å; I555-V557 WeakPolarHBondContact CG2-O 3.38Å; V557-I559 HydrophobicContact CG1-CD1 3.71Å; V557-I559 HydrophobicContact CG1-CG1 4.38Å
558	L	95.9	Very high	92.1	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.047	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.9	169	-174.1	151.5	0	0	0	108.6	L448 D450 S453 S456 F457 I522	L448-L558 HydrophobicContact CD2-CD1 4.28Å; L448-L558 CarbonylContact O-C 3.59Å; L448-L558 WeakPolarHBondContact O-CA 3.2Å; D450-L558 HydrophobicContact CB-CD1 4.24Å; D450-L558 HydrophobicContact CB-CD2 4.17Å; D450-L558 HydrophobicContact CB-CG 4.19Å; S453-L558 VanDerWaalsContact CB-CD2 3.48Å; S453-L558 WeakPolarHBondContact OG-CD2 3.15Å; S456-L558 CarbonylContact C-O 3.59Å; S456-L558 VanDerWaalsContact CA-O 3.22Å; S456-L558 WeakPolarHBondContact CA-O 3.31Å; S456-L558 WeakPolarHBondContact CB-O 3.39Å; F457-L558 HydrophobicContact CB-CB 4.33Å; F457-L558 HydrophobicContact CD2-CD2 4.05Å; F457-L558 PolarHBondContact N-O 3.05Å; F457-L558 PolarHBondContact O-N 2.92Å; I522-L558 HydrophobicContact CD1-CB 4.31Å; I522-L558 HydrophobicContact CG2-CB 3.82Å; I522-L558 HydrophobicContact CG2-CD1 3.79Å; I522-L558 HydrophobicContact CG2-CG 4.47Å
559	I	95.4	Very high	91.9	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	108.4	175.1	-57.2	-58.8	0	0	0	108.2	L448 L449 D450 L497 V514 V557 F567	L448-I559 PolarHBondContact O-N 2.84Å; L449-I559 HydrophobicContact CG-CB 4.45Å; D450-I559 PolarHBondContact N-O 3.49Å; L497-I559 HydrophobicContact CD1-CD1 3.81Å; L497-I559 HydrophobicContact CD1-CG1 4.49Å; V514-I559 HydrophobicContact CG1-CD1 4.17Å; V514-I559 HydrophobicContact CG2-CD1 4.17Å; V557-I559 HydrophobicContact CG1-CD1 3.71Å; V557-I559 HydrophobicContact CG1-CG1 4.38Å; I559-F567 HydrophobicContact CD1-CE2 4.18Å; I559-F567 HydrophobicContact CG1-CE2 4.42Å; I559-F567 HydrophobicContact CG2-CD2 3.83Å; I559-F567 HydrophobicContact CG2-CE2 3.95Å
560	G	92.5	Very high	91.5	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.281	C	S	.	.			trans	-81.4	178.5	176.3	0	0	0	0	0	112.4	S453 S456 D562 Y563 Y564	S453-G560 CarbonylContact O-C 3.48Å; S453-G560 VanDerWaalsContact O-CA 3.26Å; S453-G560 WeakPolarHBondContact O-CA 3.49Å; S456-G560 PolarHBondContact OG-N 2.98Å; G560-D562 VanDerWaalsContact C-OD1 3.23Å; G560-D562 WeakPolarHBondContact CA-OD1 3.41Å; G560-D562 PolarHBondContact O-N 3.47Å; G560-D562 VanDerWaalsContact O-N 3.15Å; G560-Y563 CarbonylContact O-C 3.43Å; G560-Y563 PolarHBondContact O-N 3.44Å; G560-Y564 WeakPolarHBondContact O-CA 3.5Å; G560-Y564 WeakPolarHBondContact O-CB 3.48Å; G560-Y564 PolarHBondContact O-N 2.96Å
561	L	89.8	Confident	91.5	Very high	82 Å²	82	60.3 Å²	60.3	43%	0.429	30%	0.297	S	S	.	.	H	α-helix	trans	-60.8	-21.9	-180	-154.4	75.1	0	0	0	113.1	A451 S453 Y563 Y565	A451-L561 HydrophobicContact CB-CD1 3.82Å; S453-L561 PolarHBondContact O-N 3.48Å; L561-Y563 PolarHBondContact O-N 3.31Å; L561-Y565 HydrophobicContact CD1-CE2 4.02Å
562	D	93.2	Very high	91.6	Very high	53 Å²	53	55.6 Å²	55.6	28%	0.283	28%	0.28	S	S	.	.	H	α-helix	trans	-61.2	-27.8	173.6	58.2	-17.4	0	0	0	113.7	R455 S456 G560	R455-D562 WeakPolarHBondContact CA-OD2 3.45Å; S456-D562 PolarHBondContact N-OD1 3.02Å; S456-D562 VanDerWaalsContact N-OD1 3.14Å; S456-D562 PolarHBondContact N-OD2 3.42Å; S456-D562 PolarHBondContact OG-OD1 3.43Å; G560-D562 VanDerWaalsContact C-OD1 3.23Å; G560-D562 WeakPolarHBondContact CA-OD1 3.41Å; G560-D562 PolarHBondContact O-N 3.47Å; G560-D562 VanDerWaalsContact O-N 3.15Å
563	Y	94.4	Very high	91.7	Very high	46 Å²	46	57.2 Å²	57.2	18%	0.18	27%	0.274	C	S	.	.	H	α-helix	trans	-128.7	-2.6	176.7	-68	-77.9	0	0	0	113.6	S456 T513 V514 K515 G560 L561 Y565 D566 F567	S456-Y563 WeakPolarHBondContact OG-CD2 3.33Å; T513-Y563 WeakPolarHBondContact O-CE1 3.29Å; V514-Y563 HydrophobicContact CG1-CD2 3.85Å; V514-Y563 HydrophobicContact CG1-CE2 4.03Å; V514-Y563 HydrophobicContact CG1-CG 4.27Å; V514-Y563 HydrophobicContact CG2-CG 4.44Å; K515-Y563 WeakPolarHBondContact CB-OH 3.23Å; K515-Y563 PolarHBondContact N-OH 2.69Å; K515-Y563 WeakPolarHBondContact O-CE2 3.18Å; G560-Y563 CarbonylContact O-C 3.43Å; G560-Y563 PolarHBondContact O-N 3.44Å; L561-Y563 PolarHBondContact O-N 3.31Å; Y563-Y565 PolarHBondContact O-N 3.05Å; Y563-D566 WeakPolarHBondContact CD1-OD2 3.38Å; Y563-D566 VanDerWaalsContact O-CB 3.3Å; Y563-D566 WeakPolarHBondContact O-CB 3.46Å; Y563-D566 PolarHBondContact O-N 3.15Å; Y563-F567 VanDerWaalsContact O-CD2 3.22Å; Y563-F567 WeakPolarHBondContact O-CD2 3.37Å
564	Y	93.6	Very high	91.6	Very high	17 Å²	17	62 Å²	62	7%	0.067	29%	0.293	C	S	.	.	H	α-helix	trans	-53.5	-49.6	-173	-177	-86.8	0	0	0	112.7	Q429 L449 A451 G560 D566 F567 V568	Q429-Y564 PolarHBondContact NE2-OH 2.98Å; Q429-Y564 VanDerWaalsContact NE2-OH 3.1Å; Q429-Y564 VanDerWaalsContact OE1-CE2 3.27Å; Q429-Y564 PolarHBondContact OE1-OH 3.01Å; L449-Y564 HydrophobicContact CB-CD2 4.13Å; L449-Y564 HydrophobicContact CB-CE2 3.92Å; A451-Y564 HydrophobicContact CB-CD2 4.27Å; A451-Y564 HydrophobicContact CB-CE2 4.07Å; G560-Y564 WeakPolarHBondContact O-CA 3.5Å; G560-Y564 WeakPolarHBondContact O-CB 3.48Å; G560-Y564 PolarHBondContact O-N 2.96Å; Y564-D566 PolarHBondContact O-N 2.98Å; Y564-F567 PolarHBondContact O-N 3.37Å; Y564-V568 HydrophobicContact CD1-CB 4.27Å; Y564-V568 HydrophobicContact CD1-CG2 3.88Å; Y564-V568 HydrophobicContact CE1-CB 4Å; Y564-V568 HydrophobicContact CE1-CG1 4.18Å; Y564-V568 HydrophobicContact CE1-CG2 3.52Å; Y564-V568 HydrophobicContact CE2-CG2 4.23Å; Y564-V568 HydrophobicContact CG-CG2 4.36Å; Y564-V568 WeakPolarHBondContact O-CG2 3.2Å; Y564-V568 PolarHBondContact O-N 3.3Å; Y564-V568 VanDerWaalsContact O-N 3.07Å
565	Y	91.2	Very high	91.1	Very high	166 Å²	166	56.7 Å²	56.7	65%	0.651	28%	0.276	S	S	*	.	H	α-helix	trans	-75.7	-7.2	-179.3	-66.7	-70.6	0	0	0	114	L561 Y563 F567	L561-Y565 HydrophobicContact CD1-CE2 4.02Å; Y563-Y565 PolarHBondContact O-N 3.05Å; Y565-F567 VanDerWaalsContact C-N 3.25Å
566	D	90.6	Very high	90.5	Very high	80 Å²	80	63.4 Å²	63.4	43%	0.428	31%	0.307	S	S	.	.	H	α-helix	trans	-75.6	-20.1	170.6	-68.7	-8.5	0	0	0	112.1	R512 Y563 Y564	R512-D566 HydrophobicContact CG-CB 4.48Å; R512-D566 PolarHBondContact NE-O 3.47Å; Y563-D566 WeakPolarHBondContact CD1-OD2 3.38Å; Y563-D566 VanDerWaalsContact O-CB 3.3Å; Y563-D566 WeakPolarHBondContact O-CB 3.46Å; Y563-D566 PolarHBondContact O-N 3.15Å; Y564-D566 PolarHBondContact O-N 2.98Å
567	F	91.1	Very high	89.5	Confident	7 Å²	7	67 Å²	67	3%	0.031	34%	0.342	C	S	.	.	H	α-helix	trans	-107.6	-38.6	-179.8	-63.6	-77.7	0	0	0	113.1	L449 L497 R512 V514 I559 Y563 Y564 Y565 I585 L586 F587	L449-F567 HydrophobicContact CD2-CB 4.41Å; L497-F567 HydrophobicContact CB-CE1 4.08Å; L497-F567 HydrophobicContact CB-CZ 4.25Å; L497-F567 HydrophobicContact CD1-CE1 4.41Å; L497-F567 HydrophobicContact CD1-CZ 4.01Å; R512-F567 HydrophobicContact CB-CD1 4.39Å; R512-F567 HydrophobicContact CB-CE1 3.51Å; R512-F567 HydrophobicContact CB-CE2 4.41Å; R512-F567 HydrophobicContact CB-CZ 3.54Å; R512-F567 HydrophobicContact CG-CD1 4.24Å; R512-F567 HydrophobicContact CG-CE1 3.83Å; R512-F567 HydrophobicContact CG-CZ 4.22Å; V514-F567 HydrophobicContact CG2-CE2 3.87Å; V514-F567 HydrophobicContact CG2-CZ 3.63Å; I559-F567 HydrophobicContact CD1-CE2 4.18Å; I559-F567 HydrophobicContact CG1-CE2 4.42Å; I559-F567 HydrophobicContact CG2-CD2 3.83Å; I559-F567 HydrophobicContact CG2-CE2 3.95Å; Y563-F567 VanDerWaalsContact O-CD2 3.22Å; Y563-F567 WeakPolarHBondContact O-CD2 3.37Å; Y564-F567 PolarHBondContact O-N 3.37Å; Y565-F567 VanDerWaalsContact C-N 3.25Å; F567-I585 CarbonylContact O-C 3.6Å; F567-I585 WeakPolarHBondContact O-CA 3.46Å; F567-I585 WeakPolarHBondContact O-CB 3.31Å; F567-L586 HydrophobicContact CD1-CB 4.33Å; F567-L586 HydrophobicContact CD1-CD2 4.26Å; F567-L586 PolarHBondContact O-N 2.82Å; F567-F587 HydrophobicContact CD1-CE1 4.12Å; F567-F587 AromaticContact CD1-CE2 3.93Å; F567-F587 HydrophobicContact CD1-CE2 3.93Å; F567-F587 AromaticContact CD1-CZ 3.49Å; F567-F587 HydrophobicContact CD1-CZ 3.49Å; F567-F587 VanDerWaalsContact CD1-CZ 3.49Å; F567-F587 HydrophobicContact CE1-CE1 4.11Å; F567-F587 HydrophobicContact CE1-CE2 4.09Å; F567-F587 AromaticContact CE1-CZ 3.37Å; F567-F587 HydrophobicContact CE1-CZ 3.37Å; F567-F587 HydrophobicContact CZ-CZ 4.46Å
568	V	90.2	Very high	88.3	Confident	22 Å²	22	69.3 Å²	69.3	13%	0.133	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	133.7	-176.4	174.6	0	0	0	0	111.4	L449 Y564 L583 I585	L449-V568 HydrophobicContact CD2-CG2 3.83Å; Y564-V568 HydrophobicContact CD1-CB 4.27Å; Y564-V568 HydrophobicContact CD1-CG2 3.88Å; Y564-V568 HydrophobicContact CE1-CB 4Å; Y564-V568 HydrophobicContact CE1-CG1 4.18Å; Y564-V568 HydrophobicContact CE1-CG2 3.52Å; Y564-V568 HydrophobicContact CE2-CG2 4.23Å; Y564-V568 HydrophobicContact CG-CG2 4.36Å; Y564-V568 WeakPolarHBondContact O-CG2 3.2Å; Y564-V568 PolarHBondContact O-N 3.3Å; Y564-V568 VanDerWaalsContact O-N 3.07Å; V568-L583 HydrophobicContact CG1-CD1 3.91Å; V568-L583 HydrophobicContact CG1-CD2 3.59Å; V568-L583 HydrophobicContact CG1-CG 3.9Å; V568-L583 HydrophobicContact CG2-CD2 4.15Å; V568-I585 HydrophobicContact CG2-CG2 3.92Å
569	S	84.8	Confident	87.7	Confident	43 Å²	43	70.2 Å²	70.2	30%	0.301	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	173.2	170.7	86.8	0	0	0	0	111.8	E571 R584	S569-E571 PolarHBondContact O-N 3.32Å; S569-E571 PolarHBondContact OG-N 3.15Å; S569-R584 PolarHBondContact N-O 3.42Å; S569-R584 WeakPolarHBondContact OG-CB 3.29Å; S569-R584 PolarHBondContact OG-O 2.91Å
570	Q	82.1	Confident	87.4	Confident	197 Å²	197	70.2 Å²	70.2	92%	0.921	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	-3.7	178.8	-61.9	-177.4	7.5	0	0	113.5	V572	Q570-V572 PolarHBondContact O-N 2.73Å
571	E	90.3	Very high	87.3	Confident	88 Å²	88	72 Å²	72	41%	0.411	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	114.6	-177.1	-71.1	175.1	-126.2	0	0	111.4	S569 R584 W589	S569-E571 PolarHBondContact O-N 3.32Å; S569-E571 PolarHBondContact OG-N 3.15Å; E571-R584 HydrophobicContact CB-CB 3.82Å; E571-R584 VanDerWaalsContact CD-CD 3.44Å; E571-R584 PolarHBondContact O-N 3.26Å; E571-R584 IonicContact OE1-CZ 3.55Å; E571-R584 IonicContact OE1-NE 3.85Å; E571-R584 IonicContact OE1-NH1 2.8Å; E571-R584 PolarHBondContact OE1-NH1 2.85Å; E571-R584 WeakPolarHBondContact OE2-CD 3.36Å; E571-R584 IonicContact OE2-CZ 3.69Å; E571-R584 IonicContact OE2-NE 3.83Å; E571-R584 IonicContact OE2-NH1 2.78Å; E571-R584 PolarHBondContact OE2-NH1 2.8Å; E571-W589 HydrophobicContact CB-CH2 4.02Å
572	V	92	Very high	87.4	Confident	61 Å²	61	68.1 Å²	68.1	37%	0.37	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	134	177.6	-165.4	0	0	0	0	109.5	Q570 H574 V581 A582 L583	Q570-V572 PolarHBondContact O-N 2.73Å; V572-H574 WeakPolarHBondContact CG1-CE1 3.45Å; V572-V581 HydrophobicContact CG1-CG1 3.42Å; V572-V581 VanDerWaalsContact CG1-CG1 3.42Å; V572-A582 CarbonylContact C-O 3.51Å; V572-A582 WeakPolarHBondContact CA-O 3.47Å; V572-L583 HydrophobicContact CG2-CD1 3.68Å
573	R	90.3	Very high	87.4	Confident	116 Å²	116	66.4 Å²	66.4	44%	0.438	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	116.7	170.4	-67.9	-178.2	176.4	-155.4	-0.2	109.6	L542 A582 W589	L542-R573 VanDerWaalsContact CD2-NH1 3.33Å; R573-A582 HydrophobicContact CB-CB 4.21Å; R573-A582 PolarHBondContact N-O 2.81Å; R573-A582 PolarHBondContact O-N 2.96Å; R573-W589 HydrophobicContact CB-CZ3 4.29Å; R573-W589 HydrophobicContact CG-CH2 3.83Å; R573-W589 HydrophobicContact CG-CZ3 3.75Å
574	H	87.2	Confident	87.3	Confident	134 Å²	134	69.3 Å²	69.3	62%	0.62	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	140	176.5	-60.4	89.2	0	0	0	109.8	V572	V572-H574 WeakPolarHBondContact CG1-CE1 3.45Å
575	G	82.4	Confident	87.2	Confident	25 Å²	25	68.9 Å²	68.9	26%	0.258	36%	0.36	S	S	.	.			trans	-84.3	-166.3	161.4	0	0	0	0	0	110.9	H538 E579	H538-G575 VanDerWaalsContact CE1-CA 3.49Å; H538-G575 WeakPolarHBondContact CE1-CA 3.24Å; H538-G575 PolarHBondContact NE2-N 3.3Å; G575-E579 WeakPolarHBondContact CA-OE2 3.43Å
576	H	79.9	Confident	87	Confident	150 Å²	150	63.8 Å²	63.8	69%	0.694	34%	0.344	S	S	*	.	S	Bend	trans	-66	166.3	168.7	-57.7	84.4	0	0	0	110.9	G578 E579	H576-G578 PolarHBondContact O-N 3.34Å; H576-E579 HydrophobicContact CB-CG 4.15Å; H576-E579 IonicContact CG-OE2 2.68Å; H576-E579 PolarHBondContact N-OE2 3.4Å; H576-E579 IonicContact ND1-OE2 2.81Å; H576-E579 PolarHBondContact ND1-OE2 2.95Å; H576-E579 VanDerWaalsContact O-CB 3.3Å; H576-E579 WeakPolarHBondContact O-CB 3.48Å; H576-E579 PolarHBondContact O-N 3.05Å
577	A	75.4	Confident	86.8	Confident	109 Å²	109	60.7 Å²	60.7	90%	0.901	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	126.1	176.4	0	0	0	0	0	111.1
578	G	72.1	Confident	86.7	Confident	48 Å²	48	61 Å²	61	50%	0.495	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-0.2	-176.2	0	0	0	0	0	115.3	H576	H576-G578 PolarHBondContact O-N 3.34Å
579	E	83.4	Confident	86.9	Confident	29 Å²	29	61.1 Å²	61.1	14%	0.136	33%	0.329	C	S	.	.	S	Bend	trans	-90.7	164.4	171.3	-57.8	-166.9	132.6	0	0	112.3	G575 H576	G575-E579 WeakPolarHBondContact CA-OE2 3.43Å; H576-E579 HydrophobicContact CB-CG 4.15Å; H576-E579 IonicContact CG-OE2 2.68Å; H576-E579 PolarHBondContact N-OE2 3.4Å; H576-E579 IonicContact ND1-OE2 2.81Å; H576-E579 PolarHBondContact ND1-OE2 2.95Å; H576-E579 VanDerWaalsContact O-CB 3.3Å; H576-E579 WeakPolarHBondContact O-CB 3.48Å; H576-E579 PolarHBondContact O-N 3.05Å
580	L	88.3	Confident	87.3	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	32%	0.315	C	S	.	.			trans	-66.9	153.9	178.2	-65.4	171.9	0	0	0	111.6	L427 W536 H538 L539 V591 G593 I595	L427-L580 HydrophobicContact CB-CD2 4.37Å; L427-L580 HydrophobicContact CD1-CD1 3.74Å; L427-L580 HydrophobicContact CD1-CD2 3.88Å; L427-L580 HydrophobicContact CD1-CG 4.48Å; L427-L580 HydrophobicContact CG-CD2 4.22Å; W536-L580 HydrophobicContact CD2-CD1 4.08Å; W536-L580 HydrophobicContact CE3-CD1 4.03Å; W536-L580 HydrophobicContact CH2-CD1 3.68Å; W536-L580 HydrophobicContact CZ2-CD1 3.7Å; W536-L580 HydrophobicContact CZ2-CG 4.31Å; W536-L580 HydrophobicContact CZ3-CD1 3.85Å; H538-L580 PolarHBondContact CE1-O 3.33Å; H538-L580 PolarHBondContact NE2-O 3.32Å; L539-L580 HydrophobicContact CD1-CB 4.23Å; L539-L580 HydrophobicContact CD1-CD1 4.39Å; L580-V591 HydrophobicContact CB-CG1 3.78Å; L580-V591 HydrophobicContact CD1-CG1 3.75Å; L580-V591 HydrophobicContact CG-CG1 4.25Å; L580-G593 WeakPolarHBondContact CD2-O 3.34Å; L580-I595 HydrophobicContact CD1-CD1 4.44Å; L580-I595 HydrophobicContact CD1-CG1 4.27Å; L580-I595 HydrophobicContact CD2-CG1 3.79Å; L580-I595 HydrophobicContact CG-CG1 4.27Å
581	V	90.6	Very high	87.8	Confident	38 Å²	38	49.8 Å²	49.8	23%	0.23	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.4	176.3	-179.7	0	0	0	0	108.9	V572 V591 C592	V572-V581 HydrophobicContact CG1-CG1 3.42Å; V572-V581 VanDerWaalsContact CG1-CG1 3.42Å; V581-V591 WeakPolarHBondContact O-CA 3.49Å; V581-C592 PolarHBondContact N-O 3.39Å; V581-C592 PolarHBondContact O-N 3.12Å
582	A	92.1	Very high	87.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.7	169.5	0	0	0	0	0	110.3	L539 L542 V572 R573 W589 I590	L539-A582 HydrophobicContact CD2-CB 3.6Å; L542-A582 HydrophobicContact CD1-CB 3.8Å; V572-A582 CarbonylContact C-O 3.51Å; V572-A582 WeakPolarHBondContact CA-O 3.47Å; R573-A582 HydrophobicContact CB-CB 4.21Å; R573-A582 PolarHBondContact N-O 2.81Å; R573-A582 PolarHBondContact O-N 2.96Å; A582-W589 HydrophobicContact CB-CE3 3.69Å; A582-W589 HydrophobicContact CB-CZ3 4.28Å; A582-I590 CarbonylContact C-O 3.55Å; A582-I590 VanDerWaalsContact CA-O 3.28Å; A582-I590 WeakPolarHBondContact CA-O 3.06Å
583	L	92.7	Very high	87.4	Confident	18 Å²	18	44.7 Å²	44.7	9%	0.094	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.1	174.8	-179	65.2	0	0	0	108.6	V568 V572 W589 I590	V568-L583 HydrophobicContact CG1-CD1 3.91Å; V568-L583 HydrophobicContact CG1-CD2 3.59Å; V568-L583 HydrophobicContact CG1-CG 3.9Å; V568-L583 HydrophobicContact CG2-CD2 4.15Å; V572-L583 HydrophobicContact CG2-CD1 3.68Å; L583-W589 WeakPolarHBondContact O-CA 3.28Å; L583-I590 HydrophobicContact CB-CD1 4.18Å; L583-I590 HydrophobicContact CB-CG1 3.85Å; L583-I590 HydrophobicContact CD2-CD1 4.09Å; L583-I590 HydrophobicContact CG-CD1 4.44Å; L583-I590 HydrophobicContact CG-CG1 4.49Å; L583-I590 PolarHBondContact N-O 3.36Å; L583-I590 VanDerWaalsContact O-CG1 3.24Å; L583-I590 WeakPolarHBondContact O-CG1 3.4Å; L583-I590 PolarHBondContact O-N 3.44Å
584	R	93.3	Very high	86.8	Confident	107 Å²	107	42 Å²	42	40%	0.404	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	131.8	177.7	-173	175.1	-178.5	175.2	-2.8	110	S569 E571 W589	S569-R584 PolarHBondContact N-O 3.42Å; S569-R584 WeakPolarHBondContact OG-CB 3.29Å; S569-R584 PolarHBondContact OG-O 2.91Å; E571-R584 HydrophobicContact CB-CB 3.82Å; E571-R584 VanDerWaalsContact CD-CD 3.44Å; E571-R584 PolarHBondContact O-N 3.26Å; E571-R584 IonicContact OE1-CZ 3.55Å; E571-R584 IonicContact OE1-NE 3.85Å; E571-R584 IonicContact OE1-NH1 2.8Å; E571-R584 PolarHBondContact OE1-NH1 2.85Å; E571-R584 WeakPolarHBondContact OE2-CD 3.36Å; E571-R584 IonicContact OE2-CZ 3.69Å; E571-R584 IonicContact OE2-NE 3.83Å; E571-R584 IonicContact OE2-NH1 2.78Å; E571-R584 PolarHBondContact OE2-NH1 2.8Å; R584-W589 HydrophobicContact CB-CD2 4.03Å; R584-W589 HydrophobicContact CB-CE3 3.9Å; R584-W589 HydrophobicContact CB-CH2 3.88Å; R584-W589 HydrophobicContact CB-CZ2 4Å; R584-W589 HydrophobicContact CB-CZ3 3.83Å; R584-W589 HydrophobicContact CG-CD2 4.41Å; R584-W589 HydrophobicContact CG-CZ2 4.21Å
585	I	91.8	Very high	86.1	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.036	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	171.2	173.8	67.8	162.4	0	0	0	110.2	A431 L449 A545 F567 V568 F587 G588 I590	A431-I585 HydrophobicContact CB-CD1 3.7Å; L449-I585 HydrophobicContact CD1-CD1 4.39Å; L449-I585 HydrophobicContact CD2-CG2 4.19Å; A545-I585 HydrophobicContact CB-CD1 4.09Å; A545-I585 HydrophobicContact CB-CG1 4.29Å; F567-I585 CarbonylContact O-C 3.6Å; F567-I585 WeakPolarHBondContact O-CA 3.46Å; F567-I585 WeakPolarHBondContact O-CB 3.31Å; V568-I585 HydrophobicContact CG2-CG2 3.92Å; I585-F587 HydrophobicContact CD1-CB 4Å; I585-F587 HydrophobicContact CD1-CD2 3.8Å; I585-F587 HydrophobicContact CD1-CG 4.22Å; I585-F587 HydrophobicContact CG1-CB 4.27Å; I585-F587 PolarHBondContact O-N 2.61Å; I585-G588 WeakPolarHBondContact CG1-O 3.4Å; I585-G588 PolarHBondContact N-O 3.01Å; I585-G588 PolarHBondContact O-N 3.41Å; I585-G588 VanDerWaalsContact O-O 3.07Å; I585-I590 HydrophobicContact CD1-CG2 3.54Å; I585-I590 HydrophobicContact CG1-CG2 3.97Å; I585-I590 HydrophobicContact CG2-CD1 3.78Å; I585-I590 HydrophobicContact CG2-CG1 3.91Å; I585-I590 HydrophobicContact CG2-CG2 4.46Å
586	L	86.8	Confident	85.4	Confident	59 Å²	59	40.3 Å²	40.3	31%	0.309	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-28.4	177.4	-174	62.8	0	0	0	113.5	R512 F567	R512-L586 HydrophobicContact CG-CD2 3.73Å; F567-L586 HydrophobicContact CD1-CB 4.33Å; F567-L586 HydrophobicContact CD1-CD2 4.26Å; F567-L586 PolarHBondContact O-N 2.82Å
587	F	86.2	Confident	84.5	Confident	16 Å²	16	37.1 Å²	37.1	7%	0.07	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-5.2	-176.7	-47.7	-34.1	0	0	0	114.8	A431 A433 L497 S498 A499 A545 F567 I585	A431-F587 HydrophobicContact CB-CD2 4.33Å; A433-F587 HydrophobicContact CB-CD2 3.8Å; A433-F587 HydrophobicContact CB-CE1 4.48Å; A433-F587 HydrophobicContact CB-CE2 3.55Å; A433-F587 HydrophobicContact CB-CG 4.37Å; A433-F587 HydrophobicContact CB-CZ 3.92Å; L497-F587 HydrophobicContact CB-CE1 4.36Å; L497-F587 HydrophobicContact CB-CE2 4.39Å; L497-F587 HydrophobicContact CB-CZ 3.59Å; S498-F587 VanDerWaalsContact C-CD1 3.48Å; S498-F587 VanDerWaalsContact C-CE1 3.43Å; A499-F587 HydrophobicContact CB-CB 4.47Å; A499-F587 HydrophobicContact CB-CD1 4.19Å; A545-F587 HydrophobicContact CB-CB 4.17Å; F567-F587 HydrophobicContact CD1-CE1 4.12Å; F567-F587 AromaticContact CD1-CE2 3.93Å; F567-F587 HydrophobicContact CD1-CE2 3.93Å; F567-F587 AromaticContact CD1-CZ 3.49Å; F567-F587 HydrophobicContact CD1-CZ 3.49Å; F567-F587 VanDerWaalsContact CD1-CZ 3.49Å; F567-F587 HydrophobicContact CE1-CE1 4.11Å; F567-F587 HydrophobicContact CE1-CE2 4.09Å; F567-F587 AromaticContact CE1-CZ 3.37Å; F567-F587 HydrophobicContact CE1-CZ 3.37Å; F567-F587 HydrophobicContact CZ-CZ 4.46Å; I585-F587 HydrophobicContact CD1-CB 4Å; I585-F587 HydrophobicContact CD1-CD2 3.8Å; I585-F587 HydrophobicContact CD1-CG 4.22Å; I585-F587 HydrophobicContact CG1-CB 4.27Å; I585-F587 PolarHBondContact O-N 2.61Å
588	G	89.3	Confident	83.5	Confident	13 Å²	13	35.2 Å²	35.2	13%	0.134	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	131.4	-158.9	-171.7	0	0	0	0	0	111.8	K543 I585	K543-G588 CarbonylContact O-C 3.5Å; K543-G588 WeakPolarHBondContact O-CA 3.22Å; I585-G588 WeakPolarHBondContact CG1-O 3.4Å; I585-G588 PolarHBondContact N-O 3.01Å; I585-G588 PolarHBondContact O-N 3.41Å; I585-G588 VanDerWaalsContact O-O 3.07Å
589	W	93.9	Very high	82.5	Confident	24 Å²	24	39 Å²	39	9%	0.091	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	121.7	179.1	-67.3	83.7	0	0	0	110.6	L542 K543 L544 A545 E571 R573 A582 L583 R584	L542-W589 HydrophobicContact CB-CB 4.21Å; L542-W589 HydrophobicContact CB-CG 4.02Å; L542-W589 HydrophobicContact CD1-CB 4.16Å; L542-W589 HydrophobicContact CD1-CD2 3.88Å; L542-W589 HydrophobicContact CD1-CE3 4.08Å; L542-W589 HydrophobicContact CD1-CG 3.93Å; L542-W589 HydrophobicContact CD2-CD2 4.03Å; L542-W589 HydrophobicContact CD2-CG 4.17Å; L542-W589 HydrophobicContact CD2-CZ2 4.26Å; L542-W589 HydrophobicContact CG-CD2 4.43Å; L542-W589 HydrophobicContact CG-CG 4.28Å; K543-W589 PolarHBondContact O-N 3.29Å; L544-W589 CarbonylContact C-O 3.49Å; L544-W589 VanDerWaalsContact CA-O 3.23Å; L544-W589 WeakPolarHBondContact CA-O 3.44Å; L544-W589 HydrophobicContact CD2-CB 3.9Å; A545-W589 PolarHBondContact N-O 3.24Å; E571-W589 HydrophobicContact CB-CH2 4.02Å; R573-W589 HydrophobicContact CB-CZ3 4.29Å; R573-W589 HydrophobicContact CG-CH2 3.83Å; R573-W589 HydrophobicContact CG-CZ3 3.75Å; A582-W589 HydrophobicContact CB-CE3 3.69Å; A582-W589 HydrophobicContact CB-CZ3 4.28Å; L583-W589 WeakPolarHBondContact O-CA 3.28Å; R584-W589 HydrophobicContact CB-CD2 4.03Å; R584-W589 HydrophobicContact CB-CE3 3.9Å; R584-W589 HydrophobicContact CB-CH2 3.88Å; R584-W589 HydrophobicContact CB-CZ2 4Å; R584-W589 HydrophobicContact CB-CZ3 3.83Å; R584-W589 HydrophobicContact CG-CD2 4.41Å; R584-W589 HydrophobicContact CG-CZ2 4.21Å
590	I	93.4	Very high	81	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	147.8	168.2	55.5	170.9	0	0	0	109.4	Q429 T430 A431 L449 A545 A582 L583 I585	Q429-I590 HydrophobicContact CB-CD1 3.72Å; Q429-I590 HydrophobicContact CG-CD1 3.85Å; T430-I590 VanDerWaalsContact O-CG2 3.3Å; T430-I590 WeakPolarHBondContact O-CG2 3.16Å; A431-I590 HydrophobicContact CB-CG2 3.82Å; L449-I590 HydrophobicContact CD2-CD1 4.43Å; A545-I590 HydrophobicContact CB-CG2 3.85Å; A582-I590 CarbonylContact C-O 3.55Å; A582-I590 VanDerWaalsContact CA-O 3.28Å; A582-I590 WeakPolarHBondContact CA-O 3.06Å; L583-I590 HydrophobicContact CB-CD1 4.18Å; L583-I590 HydrophobicContact CB-CG1 3.85Å; L583-I590 HydrophobicContact CD2-CD1 4.09Å; L583-I590 HydrophobicContact CG-CD1 4.44Å; L583-I590 HydrophobicContact CG-CG1 4.49Å; L583-I590 PolarHBondContact N-O 3.36Å; L583-I590 VanDerWaalsContact O-CG1 3.24Å; L583-I590 WeakPolarHBondContact O-CG1 3.4Å; L583-I590 PolarHBondContact O-N 3.44Å; I585-I590 HydrophobicContact CD1-CG2 3.54Å; I585-I590 HydrophobicContact CG1-CG2 3.97Å; I585-I590 HydrophobicContact CG2-CD1 3.78Å; I585-I590 HydrophobicContact CG2-CG1 3.91Å; I585-I590 HydrophobicContact CG2-CG2 4.46Å
591	V	91.4	Very high	79.2	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.2	-178.7	-177.5	0	0	0	0	108.7	L427 L539 L544 F548 L580 V581	L427-V591 HydrophobicContact CD1-CG1 4.48Å; L539-V591 HydrophobicContact CD1-CG1 3.84Å; L539-V591 HydrophobicContact CD1-CG2 4.38Å; L539-V591 HydrophobicContact CD2-CG1 4.48Å; L539-V591 HydrophobicContact CD2-CG2 4.27Å; L544-V591 HydrophobicContact CD1-CG2 4.15Å; L544-V591 HydrophobicContact CD2-CG2 3.76Å; F548-V591 HydrophobicContact CE2-CB 4.24Å; F548-V591 HydrophobicContact CE2-CG2 4.35Å; F548-V591 HydrophobicContact CZ-CB 3.82Å; F548-V591 HydrophobicContact CZ-CG1 4.39Å; F548-V591 HydrophobicContact CZ-CG2 4.35Å; L580-V591 HydrophobicContact CB-CG1 3.78Å; L580-V591 HydrophobicContact CD1-CG1 3.75Å; L580-V591 HydrophobicContact CG-CG1 4.25Å; V581-V591 WeakPolarHBondContact O-CA 3.49Å
592	C	89.6	Confident	77.1	Confident	19 Å²	19	57.2 Å²	57.2	13%	0.128	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	162.5	-179	58.8	0	0	0	0	111.7	L427 Q429 V581	L427-C592 WeakPolarHBondContact O-CA 3.5Å; L427-C592 WeakPolarHBondContact O-CB 3.5Å; Q429-C592 HydrophobicContact CG-CB 3.72Å; V581-C592 PolarHBondContact N-O 3.39Å; V581-C592 PolarHBondContact O-N 3.12Å
593	G	84.9	Confident	74.9	Confident	23 Å²	23	62.2 Å²	62.2	24%	0.237	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	126.3	-179.2	178.3	0	0	0	0	0	113.3	V426 L427 L580	V426-G593 WeakPolarHBondContact CA-O 3.11Å; L427-G593 PolarHBondContact N-O 2.91Å; L427-G593 PolarHBondContact O-N 2.85Å; L427-G593 VanDerWaalsContact O-N 3.08Å; L580-G593 WeakPolarHBondContact CD2-O 3.34Å
594	S	78.4	Confident	72.8	Confident	60 Å²	60	63.7 Å²	63.7	42%	0.42	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	141	-179.5	52.2	0	0	0	0	112.2	R425	R425-S594 CarbonylContact O-C 3.59Å; R425-S594 WeakPolarHBondContact O-CA 3.49Å
595	I	73.3	Confident	70.8	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.4	167.4	-49.4	172.7	0	0	0	106.9	R425 L427 P530 W536 L580 E597	R425-I595 PolarHBondContact N-O 3.35Å; R425-I595 PolarHBondContact O-N 3.14Å; L427-I595 HydrophobicContact CD1-CD1 3.82Å; L427-I595 HydrophobicContact CD1-CG1 4.46Å; L427-I595 HydrophobicContact CD2-CD1 4.03Å; L427-I595 HydrophobicContact CG-CD1 3.68Å; L427-I595 HydrophobicContact CG-CG1 4.24Å; P530-I595 HydrophobicContact CG-CD1 3.79Å; W536-I595 HydrophobicContact CH2-CD1 4.44Å; W536-I595 HydrophobicContact CZ2-CG2 4.29Å; L580-I595 HydrophobicContact CD1-CD1 4.44Å; L580-I595 HydrophobicContact CD1-CG1 4.27Å; L580-I595 HydrophobicContact CD2-CG1 3.79Å; L580-I595 HydrophobicContact CG-CG1 4.27Å; I595-E597 HydrophobicContact CB-CG 4.45Å; I595-E597 HydrophobicContact CG2-CG 3.6Å; I595-E597 PolarHBondContact O-N 3.27Å
596	D	67	Low	68.7	Low	121 Å²	121	63.3 Å²	63.3	65%	0.647	34%	0.338	S	S	*	.			trans	-83.1	101	171.1	-148.4	-6.8	0	0	0	108.5
597	E	61.2	Low	67.1	Low	83 Å²	83	61.8 Å²	61.8	39%	0.388	33%	0.331	S	S	.	.			trans	-105.9	12	177.9	-71.5	-171.7	159.1	0	0	112.4	I595 N599	I595-E597 HydrophobicContact CB-CG 4.45Å; I595-E597 HydrophobicContact CG2-CG 3.6Å; I595-E597 PolarHBondContact O-N 3.27Å; E597-N599 PolarHBondContact O-N 2.81Å
598	G	53.6	Low	65.6	Low	70 Å²	70	63.6 Å²	63.6	72%	0.722	34%	0.339	S	S	*	.	S	Bend	trans	65.4	-18.3	179.5	0	0	0	0	0	115.4
599	N	52.4	Low	64	Low	127 Å²	127	63.2 Å²	63.2	68%	0.679	33%	0.334	S	S	*	.	S	Bend	trans	-88.9	134.6	179.1	-85.7	-21.9	0	0	0	111.7	E597 V601	E597-N599 PolarHBondContact O-N 2.81Å; N599-V601 PolarHBondContact O-N 2.99Å
600	K	50.2	Low	62.1	Low	193 Å²	193	65.4 Å²	65.4	84%	0.839	35%	0.346	S	S	*	.			trans	-64.6	98.1	175.6	-68.6	179.9	-179.4	175.9	0	110.1	R602	K600-R602 PolarHBondContact O-N 3.12Å
601	V	50.2	Low	60.3	Low	32 Å²	32	66.4 Å²	66.4	19%	0.194	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-78.1	120.4	173.3	-177.7	0	0	0	0	109.2	R425 N599 N603	R425-V601 HydrophobicContact CB-CG2 4.13Å; N599-V601 PolarHBondContact O-N 2.99Å; V601-N603 VanDerWaalsContact C-N 3.33Å; V601-N603 PolarHBondContact O-N 3.1Å
602	R	47.3	Very low	58.5	Low	226 Å²	226	70.2 Å²	70.2	85%	0.853	37%	0.371	S	S	*	.			trans	-76.5	-9.9	-175.1	-79.2	-176.6	172.1	171.7	-1.6	115.3	K600	K600-R602 PolarHBondContact O-N 3.12Å
603	N	46.8	Very low	56.8	Low	104 Å²	104	74.7 Å²	74.7	56%	0.556	39%	0.39	S	S	*	.			trans	-126.7	101.3	-167	-65.9	-17.8	0	0	0	112.3	V601	V601-N603 VanDerWaalsContact C-N 3.33Å; V601-N603 PolarHBondContact O-N 3.1Å
604	V	48.3	Very low	55.5	Low	50 Å²	50	75.3 Å²	75.3	30%	0.303	39%	0.387	S	S	.	.			trans	-86.4	144.3	163.1	175	0	0	0	0	109.4	M420 T422	M420-V604 WeakPolarHBondContact O-CB 3.27Å; M420-V604 WeakPolarHBondContact O-CG2 3.43Å; T422-V604 HydrophobicContact CG2-CG2 3.93Å; T422-V604 VanDerWaalsContact OG1-CG2 3.25Å; T422-V604 WeakPolarHBondContact OG1-CG2 3.39Å
605	R	51.5	Low	54.3	Low	69 Å²	69	76.1 Å²	76.1	26%	0.26	39%	0.391	S	S	.	.			trans	-119	121.7	-177.3	-57.1	-172.2	171.9	177.3	-13.2	108.9	L417 P525	L417-R605 HydrophobicContact CD1-CB 3.79Å; L417-R605 HydrophobicContact CD1-CG 3.84Å; L417-R605 HydrophobicContact CD2-CG 4.28Å; L417-R605 HydrophobicContact CG-CB 4.5Å; L417-R605 HydrophobicContact CG-CG 4.43Å; P525-R605 PolarHBondContact O-NH2 3.3Å
606	S	46.6	Very low	53.4	Low	36 Å²	36	80.4 Å²	80.4	25%	0.252	41%	0.414	S	S	.	.			trans	-111.5	134.3	167	-175.2	0	0	0	0	108.8	L480	L480-S606 VanDerWaalsContact CD2-OG 3.27Å; L480-S606 WeakPolarHBondContact CD2-OG 3.4Å
607	L	54.3	Low	52.8	Low	28 Å²	28	79.3 Å²	79.3	15%	0.147	41%	0.405	C	S	.	.			trans	-119.9	120.7	179.1	-62.7	159.7	0	0	0	107.1	L428 L448 D450 C523	L428-L607 HydrophobicContact CD1-CD1 4.09Å; L448-L607 HydrophobicContact CD2-CD1 3.78Å; D450-L607 WeakPolarHBondContact OD2-CB 3.41Å; C523-L607 HydrophobicContact CB-CD2 4.45Å
608	H	53.6	Low	52.5	Low	54 Å²	54	79.7 Å²	79.7	25%	0.25	41%	0.409	C	S	.	.			trans	-150.2	126.3	174	179.8	59.2	0	0	0	107.8	G452 T479 L480	G452-H608 PolarHBondContact O-ND1 2.98Å; G452-H608 VanDerWaalsContact O-ND1 3.13Å; T479-H608 WeakPolarHBondContact CA-O 3.47Å; L480-H608 HydrophobicContact CB-CB 3.88Å; L480-H608 HydrophobicContact CD1-CB 4.1Å
609	A	55.4	Low	52.5	Low	4 Å²	4	80 Å²	80	3%	0.033	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	113.2	172.2	0	0	0	0	0	108.6	Q454 F457 S478	Q454-A609 PolarHBondContact N-O 2.75Å; F457-A609 HydrophobicContact CE2-CB 3.92Å; F457-A609 HydrophobicContact CZ-CB 4.13Å; S478-A609 WeakPolarHBondContact O-CA 3.5Å
610	Q	54.3	Low	52.7	Low	71 Å²	71	77.6 Å²	77.6	33%	0.332	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131	170.9	158.8	169.5	35.2	0	0	109.5	Q454 S478 M612	Q454-Q610 VanDerWaalsContact OE1-CA 3.24Å; Q454-Q610 VanDerWaalsContact OE1-CG 3.3Å; S478-Q610 PolarHBondContact N-O 3.24Å; S478-Q610 PolarHBondContact O-N 3.36Å; S478-Q610 VanDerWaalsContact OG-CB 3.28Å; S478-Q610 WeakPolarHBondContact OG-CB 3.43Å; S478-Q610 PolarHBondContact OG-O 3.48Å; Q610-M612 HydrophobicContact CG-CG 4.32Å
611	V	55.6	Low	53	Low	21 Å²	21	73.8 Å²	73.8	13%	0.127	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119.9	-177.9	162.6	0	0	0	0	108.8	Q454 R455 F457 V475 E476 I477 L517	Q454-V611 VanDerWaalsContact OE1-N 3.09Å; R455-V611 HydrophobicContact CB-CG2 4.11Å; R455-V611 HydrophobicContact CG-CB 3.74Å; R455-V611 HydrophobicContact CG-CG1 4.05Å; R455-V611 HydrophobicContact CG-CG2 3.79Å; F457-V611 HydrophobicContact CZ-CG2 4.1Å; V475-V611 HydrophobicContact CG1-CB 4.06Å; V475-V611 HydrophobicContact CG1-CG1 3.42Å; V475-V611 VanDerWaalsContact CG1-CG1 3.42Å; V475-V611 HydrophobicContact CG1-CG2 3.69Å; E476-V611 VanDerWaalsContact O-CA 3.3Å; E476-V611 WeakPolarHBondContact O-CA 3.5Å; I477-V611 HydrophobicContact CG1-CG2 4.47Å; L517-V611 HydrophobicContact CD1-CG2 4.23Å
612	M	53.8	Low	53.3	Low	83 Å²	83	76.2 Å²	76.2	41%	0.409	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	145.3	173.7	-55.6	-147.6	-55	0	0	110.9	E476 Q610	E476-M612 HydrophobicContact CB-CB 4.44Å; E476-M612 PolarHBondContact N-O 3.03Å; E476-M612 PolarHBondContact O-N 3.44Å; E476-M612 WeakPolarHBondContact OE2-CE 3.23Å; Q610-M612 HydrophobicContact CG-CG 4.32Å
613	E	55	Low	53.7	Low	113 Å²	113	73.3 Å²	73.3	53%	0.528	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	144.6	171.5	-67.7	-178.2	-178.6	0	0	110.2	P615 I618	E613-P615 WeakPolarHBondContact O-CD 3.38Å; E613-I618 HydrophobicContact CB-CD1 4.4Å
614	D	56.3	Low	54	Low	36 Å²	36	73.4 Å²	73.4	19%	0.193	37%	0.368	C	S	.	.			trans	-61.6	122.5	-178.7	-179.5	7.3	0	0	0	110.5	N616 E617 I618	D614-N616 PolarHBondContact O-N 3.05Å; D614-N616 VanDerWaalsContact O-N 3.07Å; D614-N616 PolarHBondContact OD1-N 3.4Å; D614-N616 VanDerWaalsContact OD1-N 3.09Å; D614-E617 HydrophobicContact CB-CB 4.37Å; D614-E617 PolarHBondContact O-N 2.96Å; D614-I618 PolarHBondContact O-N 3.45Å
615	P	52.9	Low	53.9	Low	76 Å²	76	76.8 Å²	76.8	49%	0.494	38%	0.384	S	S	.	.	H	α-helix	trans	-52.3	-30.3	175.9	-27.1	34	0	0	0	114.1	E613 I618 L619	E613-P615 WeakPolarHBondContact O-CD 3.38Å; P615-I618 PolarHBondContact O-N 2.91Å; P615-L619 WeakPolarHBondContact O-CB 3.12Å; P615-L619 WeakPolarHBondContact O-CG 3.3Å; P615-L619 PolarHBondContact O-N 3.19Å
616	N	55.8	Low	53.9	Low	91 Å²	91	80.3 Å²	80.3	49%	0.487	40%	0.403	S	S	.	.	H	α-helix	trans	-68.8	-34.9	177.7	-79.2	-3.9	0	0	0	112.7	D614 I618 L619 T620	D614-N616 PolarHBondContact O-N 3.05Å; D614-N616 VanDerWaalsContact O-N 3.07Å; D614-N616 PolarHBondContact OD1-N 3.4Å; D614-N616 VanDerWaalsContact OD1-N 3.09Å; N616-I618 VanDerWaalsContact C-N 3.35Å; N616-L619 PolarHBondContact O-N 3.28Å; N616-T620 WeakPolarHBondContact O-CB 3.48Å; N616-T620 PolarHBondContact O-N 2.68Å; N616-T620 PolarHBondContact O-OG1 3.45Å
617	E	53.2	Low	54	Low	99 Å²	99	81 Å²	81	46%	0.463	41%	0.411	S	S	.	.	H	α-helix	trans	-72.3	-34.6	178.1	-153.2	176.3	-157.5	0	0	110.6	D614 T620 K621	D614-E617 HydrophobicContact CB-CB 4.37Å; D614-E617 PolarHBondContact O-N 2.96Å; E617-T620 PolarHBondContact O-N 2.63Å; E617-K621 WeakPolarHBondContact O-CG 3.45Å; E617-K621 PolarHBondContact O-N 3.46Å
618	I	55.6	Low	53.6	Low	91 Å²	91	85.8 Å²	85.8	47%	0.467	44%	0.436	S	S	.	.	H	α-helix	trans	-64.1	-44.8	170.4	-60.5	173.1	0	0	0	110.6	E613 D614 P615 N616 T620 K621 L622	E613-I618 HydrophobicContact CB-CD1 4.4Å; D614-I618 PolarHBondContact O-N 3.45Å; P615-I618 PolarHBondContact O-N 2.91Å; N616-I618 VanDerWaalsContact C-N 3.35Å; I618-T620 VanDerWaalsContact C-N 3.35Å; I618-T620 PolarHBondContact O-N 3.19Å; I618-K621 PolarHBondContact O-N 3.45Å; I618-L622 WeakPolarHBondContact O-CB 3.47Å; I618-L622 PolarHBondContact O-N 3.3Å
619	L	54.1	Low	53.1	Low	76 Å²	76	86.7 Å²	86.7	40%	0.398	46%	0.459	S	S	.	.	H	α-helix	trans	-62.5	-39.9	175.8	-85.1	160.5	0	0	0	112.3	P615 N616 L622 W623	P615-L619 WeakPolarHBondContact O-CB 3.12Å; P615-L619 WeakPolarHBondContact O-CG 3.3Å; P615-L619 PolarHBondContact O-N 3.19Å; N616-L619 PolarHBondContact O-N 3.28Å; L619-L622 WeakPolarHBondContact O-CB 3.42Å; L619-L622 PolarHBondContact O-N 3.32Å; L619-W623 PolarHBondContact O-N 3.34Å
620	T	55.5	Low	52.6	Low	76 Å²	76	94 Å²	94	47%	0.466	50%	0.496	S	S	.	.	H	α-helix	trans	-64.8	-46.9	177.9	-53.1	0	0	0	0	110.5	N616 E617 I618 L622 W623 D624	N616-T620 WeakPolarHBondContact O-CB 3.48Å; N616-T620 PolarHBondContact O-N 2.68Å; N616-T620 PolarHBondContact O-OG1 3.45Å; E617-T620 PolarHBondContact O-N 2.63Å; I618-T620 VanDerWaalsContact C-N 3.35Å; I618-T620 PolarHBondContact O-N 3.19Å; T620-L622 VanDerWaalsContact C-N 3.29Å; T620-L622 PolarHBondContact O-N 3.22Å; T620-W623 PolarHBondContact O-N 2.89Å; T620-D624 PolarHBondContact O-N 3.12Å
621	K	56.3	Low	51.7	Low	113 Å²	113	99.1 Å²	99.1	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-35.9	174.7	-73.7	173.6	-176.4	164.6	0	112.8	E617 I618 L625	E617-K621 WeakPolarHBondContact O-CG 3.45Å; E617-K621 PolarHBondContact O-N 3.46Å; I618-K621 PolarHBondContact O-N 3.45Å; K621-L625 WeakPolarHBondContact O-CB 3.36Å; K621-L625 PolarHBondContact O-N 2.97Å; K621-L625 VanDerWaalsContact O-N 3.13Å
622	L	57.2	Low	51.1	Low	84 Å²	84	105 Å²	105	44%	0.44	54%	0.543	S	S	.	.	H	α-helix	trans	-62.7	-48.5	174.8	-175.7	79.3	0	0	0	110.4	I618 L619 T620 L625 E626	I618-L622 WeakPolarHBondContact O-CB 3.47Å; I618-L622 PolarHBondContact O-N 3.3Å; L619-L622 WeakPolarHBondContact O-CB 3.42Å; L619-L622 PolarHBondContact O-N 3.32Å; T620-L622 VanDerWaalsContact C-N 3.29Å; T620-L622 PolarHBondContact O-N 3.22Å; L622-L625 WeakPolarHBondContact O-CB 3.39Å; L622-L625 PolarHBondContact O-N 3.35Å; L622-E626 PolarHBondContact O-N 3.17Å
623	W	54.9	Low	50.9	Low	165 Å²	165	104.4 Å²	104.4	63%	0.625	55%	0.551	S	S	*	*	H	α-helix	trans	-68.6	-35.1	178.7	-71.5	-14.7	0	0	0	113.2	L619 T620 L625 E626 A627	L619-W623 PolarHBondContact O-N 3.34Å; T620-W623 PolarHBondContact O-N 2.89Å; W623-L625 VanDerWaalsContact C-N 3.27Å; W623-L625 PolarHBondContact O-N 2.96Å; W623-E626 PolarHBondContact O-N 3.3Å; W623-A627 WeakPolarHBondContact O-CB 3.42Å; W623-A627 PolarHBondContact O-N 3.34Å
624	D	53.6	Low	50.6	Low	106 Å²	106	106.5 Å²	106.5	57%	0.567	56%	0.561	S	S	*	*	H	α-helix	trans	-62.2	-35.3	172.4	-76.5	-21.2	0	0	0	112.1	T620	T620-D624 PolarHBondContact O-N 3.12Å
625	L	47.1	Very low	50.1	Low	120 Å²	120	111.2 Å²	111.2	63%	0.628	58%	0.582	S	S	*	*	H	α-helix	trans	-75.1	-38.4	174.5	-84.5	162.5	0	0	0	112.4	K621 L622 W623 L628	K621-L625 WeakPolarHBondContact O-CB 3.36Å; K621-L625 PolarHBondContact O-N 2.97Å; K621-L625 VanDerWaalsContact O-N 3.13Å; L622-L625 WeakPolarHBondContact O-CB 3.39Å; L622-L625 PolarHBondContact O-N 3.35Å; W623-L625 VanDerWaalsContact C-N 3.27Å; W623-L625 PolarHBondContact O-N 2.96Å; L625-L628 HydrophobicContact CD2-CD1 4.21Å; L625-L628 WeakPolarHBondContact O-CB 3.41Å; L625-L628 VanDerWaalsContact O-CD1 3.32Å; L625-L628 WeakPolarHBondContact O-CD1 3.47Å; L625-L628 VanDerWaalsContact O-CG 3.31Å; L625-L628 WeakPolarHBondContact O-CG 3.37Å
626	E	50.6	Low	49.8	Very low	144 Å²	144	110.9 Å²	110.9	67%	0.673	59%	0.586	S	S	*	*	H	α-helix	trans	-71.3	-30.4	175.7	-74.4	-173	160	0	0	112.2	L622 W623 L628	L622-E626 PolarHBondContact O-N 3.17Å; W623-E626 PolarHBondContact O-N 3.3Å; E626-L628 PolarHBondContact O-N 3.43Å; E626-L628 VanDerWaalsContact O-N 3.16Å
627	A	49.6	Very low	49.3	Very low	49 Å²	49	115.7 Å²	115.7	41%	0.405	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	15.3	177.6	0	0	0	0	0	114.5	W623 G629 I630	W623-A627 WeakPolarHBondContact O-CB 3.42Å; W623-A627 PolarHBondContact O-N 3.34Å; A627-G629 PolarHBondContact O-N 2.92Å; A627-I630 PolarHBondContact O-N 3.33Å
628	L	44.2	Very low	48.9	Very low	130 Å²	130	121.4 Å²	121.4	68%	0.681	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	21.7	178.1	-88.1	172.7	0	0	0	115.8	L625 E626	L625-L628 HydrophobicContact CD2-CD1 4.21Å; L625-L628 WeakPolarHBondContact O-CB 3.41Å; L625-L628 VanDerWaalsContact O-CD1 3.32Å; L625-L628 WeakPolarHBondContact O-CD1 3.47Å; L625-L628 VanDerWaalsContact O-CG 3.31Å; L625-L628 WeakPolarHBondContact O-CG 3.37Å; E626-L628 PolarHBondContact O-N 3.43Å; E626-L628 VanDerWaalsContact O-N 3.16Å
629	G	44.5	Very low	48.6	Very low	72 Å²	72	120 Å²	120	74%	0.742	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.5	-4.7	176.8	0	0	0	0	0	116.6	A627	A627-G629 PolarHBondContact O-N 2.92Å
630	I	43.6	Very low	48.4	Very low	158 Å²	158	124.7 Å²	124.7	81%	0.81	64%	0.643	S	S	*	*			trans	-120.1	89.3	178.6	-50	176.1	0	0	0	107.8	A627	A627-I630 PolarHBondContact O-N 3.33Å
631	R	37.2	Very low	48.5	Very low	179 Å²	179	124.3 Å²	124.3	68%	0.675	64%	0.643	S	S	*	*			trans	-123.6	148.7	169.8	-67	-172.3	179.4	-156	-1.6	109	A633	R631-A633 PolarHBondContact O-N 3.46Å
632	N	42.3	Very low	48.6	Very low	144 Å²	144	123.5 Å²	123.5	77%	0.77	65%	0.648	S	S	*	*			trans	-48.8	136.5	-171.8	-73.7	-21.9	0	0	0	112.5	E634 E635	N632-E634 PolarHBondContact O-N 2.85Å; N632-E635 PolarHBondContact O-N 3.44Å; N632-E635 VanDerWaalsContact O-N 3.13Å
633	A	50.1	Low	49	Very low	70 Å²	70	127.2 Å²	127.2	58%	0.579	66%	0.663	S	S	*	*	H	α-helix	trans	-55.6	-14.7	-171.7	0	0	0	0	0	115.4	R631	R631-A633 PolarHBondContact O-N 3.46Å
634	E	47.4	Very low	49.4	Very low	157 Å²	157	121.5 Å²	121.5	73%	0.734	65%	0.651	S	S	*	*	H	α-helix	trans	-70.2	-30.6	177.1	-66.5	-166.6	151.4	0	0	113.5	N632	N632-E634 PolarHBondContact O-N 2.85Å
635	E	45.4	Very low	50	Low	135 Å²	135	120 Å²	120	63%	0.631	64%	0.642	S	S	*	*	H	α-helix	trans	-80.5	-27.7	177.6	-70.2	-173	153.7	0	0	112.6	N632 R637 R638	N632-E635 PolarHBondContact O-N 3.44Å; N632-E635 VanDerWaalsContact O-N 3.13Å; E635-R637 VanDerWaalsContact C-N 3.27Å; E635-R637 PolarHBondContact O-N 3.37Å; E635-R638 PolarHBondContact O-N 3.33Å
636	A	48.5	Very low	51.2	Low	70 Å²	70	117.4 Å²	117.4	58%	0.579	63%	0.631	S	S	*	*	H	α-helix	trans	-69.5	-20.8	179.6	0	0	0	0	0	113.7	R638	A636-R638 VanDerWaalsContact C-N 3.26Å; A636-R638 PolarHBondContact O-N 3.14Å
637	R	44.9	Very low	52.1	Low	192 Å²	192	113.5 Å²	113.5	73%	0.725	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-1.5	177.7	-74.8	-171.5	-76.8	-135.1	0.4	114.4	E635 G639	E635-R637 VanDerWaalsContact C-N 3.27Å; E635-R637 PolarHBondContact O-N 3.37Å; R637-G639 VanDerWaalsContact C-N 3.31Å; R637-G639 PolarHBondContact O-N 2.88Å
638	R	44.5	Very low	53.2	Low	219 Å²	219	111.3 Å²	111.3	83%	0.826	59%	0.594	S	S	*	*	S	Bend	trans	-78.1	78.8	175.3	-76.5	-172.5	177.2	-165.7	0.6	112.2	E635 A636 Q640	E635-R638 PolarHBondContact O-N 3.33Å; A636-R638 VanDerWaalsContact C-N 3.26Å; A636-R638 PolarHBondContact O-N 3.14Å; R638-Q640 VanDerWaalsContact C-N 3.31Å; R638-Q640 PolarHBondContact O-N 2.98Å
639	G	48.9	Very low	54.7	Low	62 Å²	62	107.7 Å²	107.7	64%	0.639	58%	0.575	S	S	*	*	S	Bend	trans	67.4	-26.8	138.4	0	0	0	0	0	121.4	R637	R637-G639 VanDerWaalsContact C-N 3.31Å; R637-G639 PolarHBondContact O-N 2.88Å
640	Q	50.8	Low	56.4	Low	173 Å²	173	111.1 Å²	111.1	81%	0.808	57%	0.572	S	S	*	*	S	Bend	trans	-98.6	-16	-174.6	-76.2	-178.2	-8.7	0	0	114.6	R638	R638-Q640 VanDerWaalsContact C-N 3.31Å; R638-Q640 PolarHBondContact O-N 2.98Å
641	S	55.7	Low	58	Low	69 Å²	69	104.1 Å²	104.1	48%	0.483	54%	0.537	S	S	.	.	H	α-helix	trans	-80.5	-23.9	-174	-66.7	0	0	0	0	114.3	I645	S641-I645 WeakPolarHBondContact O-CB 3.28Å; S641-I645 WeakPolarHBondContact O-CD1 3.3Å; S641-I645 WeakPolarHBondContact O-CG1 3.48Å; S641-I645 PolarHBondContact O-N 3.23Å; S641-I645 VanDerWaalsContact O-N 3.14Å
642	T	59.9	Low	60.1	Low	96 Å²	96	96.2 Å²	96.2	59%	0.589	51%	0.508	S	S	*	.	H	α-helix	trans	-70.5	-41.6	-172.4	9.2	0	0	0	0	113.6	I645 T646	T642-I645 PolarHBondContact O-N 2.86Å; T642-T646 WeakPolarHBondContact O-CB 3.33Å; T642-T646 PolarHBondContact O-N 3.09Å; T642-T646 PolarHBondContact O-OG1 3.05Å
643	E	64.5	Low	62	Low	162 Å²	162	93 Å²	93	76%	0.757	49%	0.493	S	S	*	.	H	α-helix	trans	-65.9	-44.2	179.1	-71.9	179	177.4	0	0	111.7	I645 T646 H647	E643-I645 VanDerWaalsContact C-N 3.33Å; E643-I645 PolarHBondContact O-N 3.4Å; E643-T646 PolarHBondContact O-N 2.99Å; E643-T646 VanDerWaalsContact O-N 3.15Å; E643-H647 PolarHBondContact O-N 3.46Å
644	A	64.3	Low	63.3	Low	45 Å²	45	93.5 Å²	93.5	37%	0.372	48%	0.483	S	S	.	.	H	α-helix	trans	-62.9	-39.1	177.4	0	0	0	0	0	112.3	Y648	A644-Y648 WeakPolarHBondContact O-CB 3.09Å; A644-Y648 PolarHBondContact O-N 3.22Å
645	I	65.2	Low	64.8	Low	74 Å²	74	91.3 Å²	91.3	38%	0.379	47%	0.473	S	S	.	.	H	α-helix	trans	-65.2	-41.4	174.5	-70.7	167.2	0	0	0	110.5	S641 T642 E643 Y648 I649 M730	S641-I645 WeakPolarHBondContact O-CB 3.28Å; S641-I645 WeakPolarHBondContact O-CD1 3.3Å; S641-I645 WeakPolarHBondContact O-CG1 3.48Å; S641-I645 PolarHBondContact O-N 3.23Å; S641-I645 VanDerWaalsContact O-N 3.14Å; T642-I645 PolarHBondContact O-N 2.86Å; E643-I645 VanDerWaalsContact C-N 3.33Å; E643-I645 PolarHBondContact O-N 3.4Å; I645-Y648 PolarHBondContact O-N 3.45Å; I645-I649 HydrophobicContact CG2-CD1 3.73Å; I645-I649 HydrophobicContact CG2-CG1 4.39Å; I645-I649 WeakPolarHBondContact O-CB 3.24Å; I645-I649 VanDerWaalsContact O-CG1 3.29Å; I645-I649 WeakPolarHBondContact O-CG1 3.3Å; I645-I649 PolarHBondContact O-N 3.26Å; I645-M730 HydrophobicContact CG2-CE 4.45Å
646	T	73.1	Confident	66.1	Low	66 Å²	66	87.5 Å²	87.5	41%	0.405	47%	0.469	S	S	.	.	H	α-helix	trans	-64.8	-52.1	-179.5	-53.2	0	0	0	0	111.1	T642 E643 Y648 I649 E650	T642-T646 WeakPolarHBondContact O-CB 3.33Å; T642-T646 PolarHBondContact O-N 3.09Å; T642-T646 PolarHBondContact O-OG1 3.05Å; E643-T646 PolarHBondContact O-N 2.99Å; E643-T646 VanDerWaalsContact O-N 3.15Å; T646-Y648 VanDerWaalsContact C-N 3.26Å; T646-Y648 PolarHBondContact O-N 3.48Å; T646-I649 WeakPolarHBondContact O-CB 3.49Å; T646-I649 PolarHBondContact O-N 3.38Å; T646-I649 VanDerWaalsContact O-N 3.13Å; T646-E650 WeakPolarHBondContact O-CG 3.44Å; T646-E650 PolarHBondContact O-N 3.16Å
647	H	70.1	Confident	67	Low	62 Å²	62	92.3 Å²	92.3	29%	0.287	48%	0.48	S	S	.	.	H	α-helix	trans	-58.5	-39	175.5	174.5	-84.4	0	0	0	111.9	E643 E650 S651 D668	E643-H647 PolarHBondContact O-N 3.46Å; H647-E650 PolarHBondContact O-N 3.28Å; H647-S651 PolarHBondContact O-N 3.39Å; H647-D668 IonicContact CD2-OD2 2.74Å
648	Y	72	Confident	68.2	Low	3 Å²	3	87.8 Å²	87.8	1%	0.012	46%	0.463	C	S	.	.	H	α-helix	trans	-62.9	-46.5	176.1	179.5	-90.1	0	0	0	112	A644 I645 T646 E650 S651 I652 V661 P664 F726 L727 M730	A644-Y648 WeakPolarHBondContact O-CB 3.09Å; A644-Y648 PolarHBondContact O-N 3.22Å; I645-Y648 PolarHBondContact O-N 3.45Å; T646-Y648 VanDerWaalsContact C-N 3.26Å; T646-Y648 PolarHBondContact O-N 3.48Å; Y648-E650 VanDerWaalsContact C-N 3.34Å; Y648-E650 PolarHBondContact O-N 3.19Å; Y648-S651 WeakPolarHBondContact O-CB 3.44Å; Y648-S651 PolarHBondContact O-N 3.28Å; Y648-S651 VanDerWaalsContact O-N 3.12Å; Y648-S651 PolarHBondContact O-OG 3.04Å; Y648-I652 HydrophobicContact CD1-CD1 4.5Å; Y648-I652 HydrophobicContact CE1-CD1 4.05Å; Y648-V661 HydrophobicContact CD2-CG1 4.11Å; Y648-V661 HydrophobicContact CE1-CG1 4.13Å; Y648-V661 HydrophobicContact CE2-CG1 3.41Å; Y648-V661 VanDerWaalsContact CE2-CG1 3.41Å; Y648-V661 VanDerWaalsContact CZ-CG1 3.44Å; Y648-V661 WeakPolarHBondContact OH-CG1 3.21Å; Y648-P664 HydrophobicContact CD2-CB 4.21Å; Y648-P664 HydrophobicContact CD2-CG 4.34Å; Y648-F726 HydrophobicContact CD2-CE1 4.46Å; Y648-F726 HydrophobicContact CE1-CE1 4.36Å; Y648-F726 HydrophobicContact CE2-CE1 4.16Å; Y648-L727 HydrophobicContact CE2-CD2 3.46Å; Y648-L727 VanDerWaalsContact CE2-CD2 3.46Å; Y648-L727 WeakPolarHBondContact OH-CA 3.5Å; Y648-L727 WeakPolarHBondContact OH-CD2 3.35Å; Y648-M730 HydrophobicContact CD1-CB 4.39Å; Y648-M730 HydrophobicContact CD1-CE 3.74Å; Y648-M730 HydrophobicContact CE1-CB 3.45Å; Y648-M730 VanDerWaalsContact CE1-CB 3.45Å; Y648-M730 HydrophobicContact CE1-CE 3.93Å; Y648-M730 HydrophobicContact CE1-CG 3.93Å
649	I	76	Confident	69.7	Low	53 Å²	53	78.6 Å²	78.6	27%	0.272	43%	0.432	S	S	.	.	H	α-helix	trans	-58.3	-45.5	176.7	-76.8	170.1	0	0	0	111	I645 T646 S651 I652 M730	I645-I649 HydrophobicContact CG2-CD1 3.73Å; I645-I649 HydrophobicContact CG2-CG1 4.39Å; I645-I649 WeakPolarHBondContact O-CB 3.24Å; I645-I649 VanDerWaalsContact O-CG1 3.29Å; I645-I649 WeakPolarHBondContact O-CG1 3.3Å; I645-I649 PolarHBondContact O-N 3.26Å; T646-I649 WeakPolarHBondContact O-CB 3.49Å; T646-I649 PolarHBondContact O-N 3.38Å; T646-I649 VanDerWaalsContact O-N 3.13Å; I649-S651 PolarHBondContact O-N 2.98Å; I649-I652 PolarHBondContact O-N 3.15Å; I649-M730 HydrophobicContact CG1-CE 4.21Å
650	E	79.6	Confident	70.9	Confident	145 Å²	145	77.9 Å²	77.9	68%	0.678	42%	0.415	S	S	*	.	H	α-helix	trans	-65.1	-20.1	178.7	-70.2	174.3	175.5	0	0	113.3	T646 H647 Y648	T646-E650 WeakPolarHBondContact O-CG 3.44Å; T646-E650 PolarHBondContact O-N 3.16Å; H647-E650 PolarHBondContact O-N 3.28Å; Y648-E650 VanDerWaalsContact C-N 3.34Å; Y648-E650 PolarHBondContact O-N 3.19Å
651	S	78.5	Confident	72	Confident	10 Å²	10	71.6 Å²	71.6	7%	0.07	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-7.9	-179	82.9	0	0	0	0	115	H647 Y648 I649 R662	H647-S651 PolarHBondContact O-N 3.39Å; Y648-S651 WeakPolarHBondContact O-CB 3.44Å; Y648-S651 PolarHBondContact O-N 3.28Å; Y648-S651 VanDerWaalsContact O-N 3.12Å; Y648-S651 PolarHBondContact O-OG 3.04Å; I649-S651 PolarHBondContact O-N 2.98Å; S651-R662 PolarHBondContact OG-N 3.16Å
652	I	81.1	Confident	72.7	Confident	14 Å²	14	76.4 Å²	76.4	7%	0.072	40%	0.396	C	S	.	.			trans	-80.8	119	-176.7	-58.3	171.1	0	0	0	109.7	Y648 I649 V660 V661 H734	Y648-I652 HydrophobicContact CD1-CD1 4.5Å; Y648-I652 HydrophobicContact CE1-CD1 4.05Å; I649-I652 PolarHBondContact O-N 3.15Å; I652-V660 WeakPolarHBondContact CA-O 3.47Å; I652-V661 HydrophobicContact CB-CG2 4.46Å; I652-V661 HydrophobicContact CG1-CB 4.38Å; I652-V661 HydrophobicContact CG1-CG1 3.69Å; I652-V661 HydrophobicContact CG1-CG2 3.92Å; I652-V661 HydrophobicContact CG2-CG2 4.27Å; I652-H734 HydrophobicContact CD1-CB 3.57Å
653	T	81.7	Confident	72.8	Confident	76 Å²	76	74.5 Å²	74.5	47%	0.466	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.7	176.2	61.7	0	0	0	0	111.9	C659 V660 R735	T653-C659 CarbonylContact O-C 3.47Å; T653-C659 VanDerWaalsContact O-CA 3.3Å; T653-C659 WeakPolarHBondContact O-CA 3.34Å; T653-V660 PolarHBondContact N-O 2.84Å; T653-V660 PolarHBondContact O-N 3.26Å; T653-R735 PolarHBondContact O-NH2 3.42Å
654	F	76.9	Confident	72.7	Confident	81 Å²	81	69.8 Å²	69.8	36%	0.355	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.7	174.1	-157.7	-129.3	0	0	0	110.4	G656 R658 L782	F654-G656 VanDerWaalsContact CE1-C 3.43Å; F654-G656 VanDerWaalsContact CE1-CA 3.41Å; F654-G656 VanDerWaalsContact CE1-O 3.26Å; F654-G656 WeakPolarHBondContact CE1-O 3.42Å; F654-G656 VanDerWaalsContact CZ-O 3.29Å; F654-G656 WeakPolarHBondContact CZ-O 3.43Å; F654-R658 VanDerWaalsContact CD2-O 3.29Å; F654-R658 WeakPolarHBondContact CD2-O 3.37Å; F654-L782 WeakPolarHBondContact CE2-O 3.36Å; F654-L782 WeakPolarHBondContact CZ-O 3.46Å
655	E	79.2	Confident	72.3	Confident	111 Å²	111	76.5 Å²	76.5	52%	0.519	38%	0.381	S	S	.	.			trans	-97.4	20.5	174.8	-66.2	-176.7	159.3	0	0	112.5	E657 R658 V660	E655-E657 VanDerWaalsContact C-N 3.26Å; E655-E657 PolarHBondContact O-N 3.23Å; E655-R658 HydrophobicContact CB-CG 4.43Å; E655-R658 PolarHBondContact N-O 2.83Å; E655-R658 IonicContact OE2-CZ 3.3Å; E655-R658 VanDerWaalsContact OE2-CZ 3.26Å; E655-R658 IonicContact OE2-NE 2.61Å; E655-R658 PolarHBondContact OE2-NE 3.37Å; E655-R658 IonicContact OE2-NH2 3.67Å; E655-R658 PolarHBondContact OE2-NH2 3.42Å; E655-V660 VanDerWaalsContact CD-CG2 3.5Å; E655-V660 HydrophobicContact CG-CG2 3.83Å
656	G	71.6	Confident	71.8	Confident	55 Å²	55	82.9 Å²	82.9	57%	0.567	41%	0.406	S	S	*	.	S	Bend	trans	86.6	-33.8	-178.8	0	0	0	0	0	114.7	F654	F654-G656 VanDerWaalsContact CE1-C 3.43Å; F654-G656 VanDerWaalsContact CE1-CA 3.41Å; F654-G656 VanDerWaalsContact CE1-O 3.26Å; F654-G656 WeakPolarHBondContact CE1-O 3.42Å; F654-G656 VanDerWaalsContact CZ-O 3.29Å; F654-G656 WeakPolarHBondContact CZ-O 3.43Å
657	E	67.6	Low	70.7	Confident	171 Å²	171	84.8 Å²	84.8	80%	0.799	42%	0.418	S	S	*	.	S	Bend	trans	-110.9	-21.9	174.3	-68.1	-171.5	159	0	0	113.7	E655	E655-E657 VanDerWaalsContact C-N 3.26Å; E655-E657 PolarHBondContact O-N 3.23Å
658	R	70.7	Confident	69.9	Low	96 Å²	96	88.1 Å²	88.1	36%	0.362	44%	0.438	S	S	.	.			trans	-153.2	154.5	-170.3	64.6	-179.2	-179.3	-155.9	-5	112.7	F654 E655 V660	F654-R658 VanDerWaalsContact CD2-O 3.29Å; F654-R658 WeakPolarHBondContact CD2-O 3.37Å; E655-R658 HydrophobicContact CB-CG 4.43Å; E655-R658 PolarHBondContact N-O 2.83Å; E655-R658 IonicContact OE2-CZ 3.3Å; E655-R658 VanDerWaalsContact OE2-CZ 3.26Å; E655-R658 IonicContact OE2-NE 2.61Å; E655-R658 PolarHBondContact OE2-NE 3.37Å; E655-R658 IonicContact OE2-NH2 3.67Å; E655-R658 PolarHBondContact OE2-NH2 3.42Å; R658-V660 HydrophobicContact CG-CG2 4.49Å
659	C	75.6	Confident	68.9	Low	27 Å²	27	92.6 Å²	92.6	18%	0.182	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	137.2	168	-58.5	0	0	0	0	111.1	T653 V731 R735 G783	T653-C659 CarbonylContact O-C 3.47Å; T653-C659 VanDerWaalsContact O-CA 3.3Å; T653-C659 WeakPolarHBondContact O-CA 3.34Å; C659-V731 HydrophobicContact CB-CG1 3.48Å; C659-V731 VanDerWaalsContact CB-CG1 3.48Å; C659-V731 HydrophobicContact CB-CG2 4.5Å; C659-V731 VanDerWaalsContact SG-CG1 3.55Å; C659-R735 PolarHBondContact SG-NE 2.84Å; C659-R735 PolarHBondContact SG-NH2 3.47Å; C659-G783 PolarHBondContact SG-O 3.46Å; C659-G783 VanDerWaalsContact SG-O 3.42Å
660	V	74.4	Confident	67.9	Low	46 Å²	46	95 Å²	95	28%	0.279	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.9	173.5	-179.5	0	0	0	0	108	I652 T653 E655 R658	I652-V660 WeakPolarHBondContact CA-O 3.47Å; T653-V660 PolarHBondContact N-O 2.84Å; T653-V660 PolarHBondContact O-N 3.26Å; E655-V660 VanDerWaalsContact CD-CG2 3.5Å; E655-V660 HydrophobicContact CG-CG2 3.83Å; R658-V660 HydrophobicContact CG-CG2 4.49Å
661	V	73.6	Confident	66.2	Low	42 Å²	42	96 Å²	96	26%	0.255	50%	0.502	S	S	.	.			trans	-134.6	144.4	-175.7	-163.8	0	0	0	0	110.1	Y648 I652 V731	Y648-V661 HydrophobicContact CD2-CG1 4.11Å; Y648-V661 HydrophobicContact CE1-CG1 4.13Å; Y648-V661 HydrophobicContact CE2-CG1 3.41Å; Y648-V661 VanDerWaalsContact CE2-CG1 3.41Å; Y648-V661 VanDerWaalsContact CZ-CG1 3.44Å; Y648-V661 WeakPolarHBondContact OH-CG1 3.21Å; I652-V661 HydrophobicContact CB-CG2 4.46Å; I652-V661 HydrophobicContact CG1-CB 4.38Å; I652-V661 HydrophobicContact CG1-CG1 3.69Å; I652-V661 HydrophobicContact CG1-CG2 3.92Å; I652-V661 HydrophobicContact CG2-CG2 4.27Å; V661-V731 HydrophobicContact CG2-CG2 3.33Å
662	R	70.9	Confident	65	Low	170 Å²	170	102 Å²	102	64%	0.642	53%	0.532	S	S	*	.			trans	-88.2	157	176.3	-62.2	-177.8	176.7	161.3	-0.9	111.4	S651	S651-R662 PolarHBondContact OG-N 3.16Å
663	L	63.1	Low	63.4	Low	56 Å²	56	106.4 Å²	106.4	29%	0.293	56%	0.562	S	S	.	*			trans	-73.5	137.8	176.2	-67.3	173.3	0	0	0	111.2	W665 D692	L663-W665 VanDerWaalsContact O-CD1 3.25Å; L663-W665 PolarHBondContact O-N 2.73Å; L663-D692 HydrophobicContact CD1-CB 4.14Å
664	P	60.6	Low	61.5	Low	62 Å²	62	110.1 Å²	110.1	40%	0.403	58%	0.579	S	S	.	*			trans	-79.8	115.6	-179.2	29.5	-32.1	0	0	0	111.7	Y648	Y648-P664 HydrophobicContact CD2-CB 4.21Å; Y648-P664 HydrophobicContact CD2-CG 4.34Å
665	W	57.5	Low	60.5	Low	186 Å²	186	110.6 Å²	110.6	71%	0.705	59%	0.585	S	S	*	*			trans	-106	160.8	176.1	-61.9	103.4	0	0	0	111.4	L663	L663-W665 VanDerWaalsContact O-CD1 3.25Å; L663-W665 PolarHBondContact O-N 2.73Å
666	K	53.3	Low	59.1	Low	208 Å²	208	113 Å²	113	90%	0.904	59%	0.591	S	S	*	*	S	Bend	trans	-82	-28.1	-165.9	-78.9	-172.7	176.1	-175.7	0	116.8
667	T	51.4	Low	58.1	Low	106 Å²	106	119.4 Å²	119.4	65%	0.65	60%	0.603	S	S	*	*			trans	-164.7	134.9	-178.4	44	0	0	0	0	110.8
668	D	53.4	Low	57.5	Low	133 Å²	133	116.8 Å²	116.8	71%	0.711	59%	0.591	S	S	*	*	S	Bend	trans	-91.8	-4.3	-174.2	-68	-28.8	0	0	0	115.3	H647	H647-D668 IonicContact CD2-OD2 2.74Å
669	A	50	Low	56.5	Low	96 Å²	96	114.3 Å²	114.3	79%	0.793	59%	0.591	S	S	*	*			trans	-136.3	93	-178.2	0	0	0	0	0	112.4
670	V	54.5	Low	55.6	Low	103 Å²	103	118 Å²	118	62%	0.624	60%	0.604	S	S	*	*			trans	-104.8	118.4	171.5	177.9	0	0	0	0	108.5	L672	V670-L672 HydrophobicContact CG1-CD1 3.64Å; V670-L672 HydrophobicContact CG1-CG 3.97Å
671	N	44.2	Very low	55.1	Low	167 Å²	167	117.7 Å²	117.7	89%	0.893	61%	0.61	S	S	*	*			trans	-93.1	107.8	-175.3	-153.2	0.2	0	0	0	110.6
672	L	53.9	Low	54.4	Low	135 Å²	135	122.7 Å²	122.7	71%	0.707	62%	0.624	S	S	*	*			trans	-142.6	150.4	-174.9	-78	170.1	0	0	0	111	V670	V670-L672 HydrophobicContact CG1-CD1 3.64Å; V670-L672 HydrophobicContact CG1-CG 3.97Å
673	P	46.8	Very low	53.2	Low	108 Å²	108	118.7 Å²	118.7	70%	0.701	62%	0.615	S	S	*	*			trans	-71.7	160	-159.2	26.2	-34.6	0	0	0	116	N675	P673-N675 PolarHBondContact O-N 3.43Å; P673-N675 VanDerWaalsContact O-N 3.08Å
674	N	43.1	Very low	52.8	Low	153 Å²	153	121.7 Å²	121.7	82%	0.818	63%	0.626	S	S	*	*			trans	-58.7	102.1	-166.2	-173.8	0.6	0	0	0	114.1	Y676	N674-Y676 PolarHBondContact OD1-N 2.83Å
675	N	55.8	Low	52.4	Low	91 Å²	91	124.6 Å²	124.6	49%	0.487	63%	0.634	S	S	.	*			trans	-123.1	34.2	177.8	63.1	1.5	0	0	0	111.8	P673 K677 Q678 A679	P673-N675 PolarHBondContact O-N 3.43Å; P673-N675 VanDerWaalsContact O-N 3.08Å; N675-K677 VanDerWaalsContact C-N 3.26Å; N675-K677 PolarHBondContact O-N 3.42Å; N675-Q678 PolarHBondContact O-N 3.16Å; N675-A679 PolarHBondContact O-N 3.46Å
676	Y	48.6	Very low	51.8	Low	163 Å²	163	119.7 Å²	119.7	64%	0.639	62%	0.621	S	S	*	*	H	α-helix	trans	-44.6	-40	-171	179.8	-105.1	0	0	0	115.3	N674 A679 K680	N674-Y676 PolarHBondContact OD1-N 2.83Å; Y676-A679 PolarHBondContact O-N 2.87Å; Y676-K680 WeakPolarHBondContact O-CB 3.49Å; Y676-K680 PolarHBondContact O-N 2.69Å
677	K	50.7	Low	51.4	Low	188 Å²	188	115.6 Å²	115.6	82%	0.817	61%	0.605	S	S	*	*	H	α-helix	trans	-70	-40.5	178	-83.2	-176.7	176.7	174.7	0	113.4	N675 A679 K680 G681	N675-K677 VanDerWaalsContact C-N 3.26Å; N675-K677 PolarHBondContact O-N 3.42Å; K677-A679 VanDerWaalsContact C-N 3.34Å; K677-K680 PolarHBondContact O-N 2.92Å; K677-G681 PolarHBondContact O-N 3.4Å
678	Q	55.6	Low	51.2	Low	116 Å²	116	121.4 Å²	121.4	54%	0.542	62%	0.615	S	S	.	*	H	α-helix	trans	-68.4	-37.7	172.5	-78.5	-174	12	0	0	110.8	N675 G681 R682	N675-Q678 PolarHBondContact O-N 3.16Å; Q678-G681 PolarHBondContact O-N 3.3Å; Q678-R682 VanDerWaalsContact O-CB 3.24Å; Q678-R682 WeakPolarHBondContact O-CB 3.14Å; Q678-R682 VanDerWaalsContact O-CG 3.27Å; Q678-R682 WeakPolarHBondContact O-CG 3.48Å; Q678-R682 PolarHBondContact O-N 3.49Å
679	A	49.2	Very low	50.8	Low	44 Å²	44	121.8 Å²	121.8	36%	0.364	61%	0.61	S	S	.	*	H	α-helix	trans	-62	-42.1	174.6	0	0	0	0	0	111.4	N675 Y676 K677 R682 L683	N675-A679 PolarHBondContact O-N 3.46Å; Y676-A679 PolarHBondContact O-N 2.87Å; K677-A679 VanDerWaalsContact C-N 3.34Å; A679-R682 PolarHBondContact O-N 2.98Å; A679-L683 WeakPolarHBondContact O-CA 3.39Å; A679-L683 WeakPolarHBondContact O-CB 3.44Å; A679-L683 PolarHBondContact O-N 3.24Å
680	K	57.4	Low	50.4	Low	105 Å²	105	121.4 Å²	121.4	46%	0.457	59%	0.594	S	S	.	*	H	α-helix	trans	-67.8	-43.1	176.2	-169.7	173.3	-177.1	176.3	0	112.7	Y676 K677 R682 L683 F684	Y676-K680 WeakPolarHBondContact O-CB 3.49Å; Y676-K680 PolarHBondContact O-N 2.69Å; K677-K680 PolarHBondContact O-N 2.92Å; K680-R682 VanDerWaalsContact C-N 3.32Å; K680-R682 PolarHBondContact O-N 3.1Å; K680-L683 PolarHBondContact O-N 2.99Å; K680-F684 HydrophobicContact CD-CE2 4.3Å; K680-F684 HydrophobicContact CG-CD2 4.2Å; K680-F684 HydrophobicContact CG-CE2 3.78Å; K680-F684 HydrophobicContact CG-CZ 4.42Å; K680-F684 WeakPolarHBondContact O-CD2 3.42Å; K680-F684 PolarHBondContact O-N 3.26Å; K680-F684 VanDerWaalsContact O-N 3.09Å
681	G	64.5	Low	50	Low	39 Å²	39	123.7 Å²	123.7	40%	0.402	60%	0.603	S	S	.	*	H	α-helix	trans	-64.5	-36.7	176.1	0	0	0	0	0	112.8	K677 Q678 Q685	K677-G681 PolarHBondContact O-N 3.4Å; Q678-G681 PolarHBondContact O-N 3.3Å; G681-Q685 PolarHBondContact O-N 3.41Å
682	R	56.9	Low	50.9	Low	148 Å²	148	118.7 Å²	118.7	56%	0.558	58%	0.577	S	S	*	*	H	α-helix	trans	-77.2	-35.8	174.6	-71.3	179.9	-177.8	-176.1	3.7	112.1	Q678 A679 K680 F684 Q685 I686	Q678-R682 VanDerWaalsContact O-CB 3.24Å; Q678-R682 WeakPolarHBondContact O-CB 3.14Å; Q678-R682 VanDerWaalsContact O-CG 3.27Å; Q678-R682 WeakPolarHBondContact O-CG 3.48Å; Q678-R682 PolarHBondContact O-N 3.49Å; A679-R682 PolarHBondContact O-N 2.98Å; K680-R682 VanDerWaalsContact C-N 3.32Å; K680-R682 PolarHBondContact O-N 3.1Å; R682-F684 PolarHBondContact O-N 3.38Å; R682-Q685 CarbonylContact O-C 3.32Å; R682-Q685 PolarHBondContact O-N 3.19Å; R682-Q685 VanDerWaalsContact O-N 3.11Å; R682-I686 HydrophobicContact CB-CD1 4.07Å; R682-I686 WeakPolarHBondContact O-CA 3.4Å; R682-I686 WeakPolarHBondContact O-CB 3.44Å; R682-I686 WeakPolarHBondContact O-CG1 3.13Å; R682-I686 PolarHBondContact O-N 3.36Å
683	L	47.3	Very low	51.2	Low	86 Å²	86	117.1 Å²	117.1	45%	0.45	56%	0.561	S	S	.	*	H	α-helix	trans	-57	-50.1	174	-177.4	69.3	0	0	0	109.6	A679 K680 Q685 I686 E687	A679-L683 WeakPolarHBondContact O-CA 3.39Å; A679-L683 WeakPolarHBondContact O-CB 3.44Å; A679-L683 PolarHBondContact O-N 3.24Å; K680-L683 PolarHBondContact O-N 2.99Å; L683-Q685 VanDerWaalsContact C-N 3.29Å; L683-Q685 PolarHBondContact O-N 3.31Å; L683-I686 PolarHBondContact O-N 3.38Å; L683-E687 HydrophobicContact CD1-CG 3.86Å; L683-E687 HydrophobicContact CG-CG 4.1Å; L683-E687 VanDerWaalsContact O-CB 3.23Å; L683-E687 WeakPolarHBondContact O-CB 3.36Å; L683-E687 VanDerWaalsContact O-CG 3.31Å; L683-E687 WeakPolarHBondContact O-CG 3.24Å; L683-E687 PolarHBondContact O-N 3Å
684	F	53.6	Low	52.3	Low	118 Å²	118	113.8 Å²	113.8	52%	0.518	54%	0.537	S	S	.	.	H	α-helix	trans	-66.6	-26.3	177	-68.1	-43.5	0	0	0	114.6	K680 R682 R688	K680-F684 HydrophobicContact CD-CE2 4.3Å; K680-F684 HydrophobicContact CG-CD2 4.2Å; K680-F684 HydrophobicContact CG-CE2 3.78Å; K680-F684 HydrophobicContact CG-CZ 4.42Å; K680-F684 WeakPolarHBondContact O-CD2 3.42Å; K680-F684 PolarHBondContact O-N 3.26Å; K680-F684 VanDerWaalsContact O-N 3.09Å; R682-F684 PolarHBondContact O-N 3.38Å; F684-R688 WeakPolarHBondContact O-CB 3.11Å; F684-R688 WeakPolarHBondContact O-CD 3.21Å; F684-R688 VanDerWaalsContact O-CG 3.24Å; F684-R688 WeakPolarHBondContact O-CG 3.23Å
685	Q	52.9	Low	53.7	Low	124 Å²	124	112.6 Å²	112.6	58%	0.579	54%	0.535	S	S	*	.	H	α-helix	trans	-83.7	-26.6	174.4	-79.1	-174.2	-2	0	0	113.4	G681 R682 L683 K689	G681-Q685 PolarHBondContact O-N 3.41Å; R682-Q685 CarbonylContact O-C 3.32Å; R682-Q685 PolarHBondContact O-N 3.19Å; R682-Q685 VanDerWaalsContact O-N 3.11Å; L683-Q685 VanDerWaalsContact C-N 3.29Å; L683-Q685 PolarHBondContact O-N 3.31Å; Q685-K689 VanDerWaalsContact O-CB 3.24Å; Q685-K689 WeakPolarHBondContact O-CB 3.33Å; Q685-K689 VanDerWaalsContact O-CG 3.27Å; Q685-K689 WeakPolarHBondContact O-CG 3.33Å; Q685-K689 PolarHBondContact O-N 2.98Å
686	I	45.4	Very low	54.4	Low	82 Å²	82	109.5 Å²	109.5	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-90.4	-40.4	-177.6	-71.4	172.5	0	0	0	110.4	R682 L683 R688 K689 L690	R682-I686 HydrophobicContact CB-CD1 4.07Å; R682-I686 WeakPolarHBondContact O-CA 3.4Å; R682-I686 WeakPolarHBondContact O-CB 3.44Å; R682-I686 WeakPolarHBondContact O-CG1 3.13Å; R682-I686 PolarHBondContact O-N 3.36Å; L683-I686 PolarHBondContact O-N 3.38Å; I686-R688 PolarHBondContact O-N 3.2Å; I686-K689 CarbonylContact O-C 3.19Å; I686-K689 PolarHBondContact O-N 3.24Å; I686-L690 HydrophobicContact CG2-CD1 3.37Å; I686-L690 HydrophobicContact CG2-CG 3.91Å; I686-L690 PolarHBondContact O-N 3.46Å
687	E	43.9	Very low	55.8	Low	123 Å²	123	107.7 Å²	107.7	58%	0.575	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.7	165.9	-73.2	-179.7	156.7	0	0	111.2	L683	L683-E687 HydrophobicContact CD1-CG 3.86Å; L683-E687 HydrophobicContact CG-CG 4.1Å; L683-E687 VanDerWaalsContact O-CB 3.23Å; L683-E687 WeakPolarHBondContact O-CB 3.36Å; L683-E687 VanDerWaalsContact O-CG 3.31Å; L683-E687 WeakPolarHBondContact O-CG 3.24Å; L683-E687 PolarHBondContact O-N 3Å
688	R	47.4	Very low	57.3	Low	227 Å²	227	102.7 Å²	102.7	86%	0.857	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-12.2	171.2	-73.6	177.7	86	167.8	6	114.7	F684 I686	F684-R688 WeakPolarHBondContact O-CB 3.11Å; F684-R688 WeakPolarHBondContact O-CD 3.21Å; F684-R688 VanDerWaalsContact O-CG 3.24Å; F684-R688 WeakPolarHBondContact O-CG 3.23Å; I686-R688 PolarHBondContact O-N 3.2Å
689	K	45.3	Very low	58.8	Low	142 Å²	142	102.6 Å²	102.6	62%	0.617	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.2	-2.2	-174.4	-77.6	-176.2	175.4	-179.9	0	115.7	Q685 I686	Q685-K689 VanDerWaalsContact O-CB 3.24Å; Q685-K689 WeakPolarHBondContact O-CB 3.33Å; Q685-K689 VanDerWaalsContact O-CG 3.27Å; Q685-K689 WeakPolarHBondContact O-CG 3.33Å; Q685-K689 PolarHBondContact O-N 2.98Å; I686-K689 CarbonylContact O-C 3.19Å; I686-K689 PolarHBondContact O-N 3.24Å
690	L	41.9	Very low	60.7	Low	87 Å²	87	107 Å²	107	46%	0.455	50%	0.499	S	S	.	.			trans	-117.8	127.9	168.7	-63.4	177.1	0	0	0	106.6	I686	I686-L690 HydrophobicContact CG2-CD1 3.37Å; I686-L690 HydrophobicContact CG2-CG 3.91Å; I686-L690 PolarHBondContact O-N 3.46Å
691	N	46.2	Very low	62.2	Low	151 Å²	151	107.1 Å²	107.1	81%	0.807	50%	0.496	S	S	*	.	S	Bend		-133	91.9	78.9	-66.8	-35.4	0	0	0	110.8	R693	N691-R693 PolarHBondContact O-N 3.22Å
692	D	62.8	Low	63.2	Low	63 Å²	63	110.9 Å²	110.9	34%	0.337	51%	0.507	S	S	.	.	S	Bend	trans	47.7	-21.3	164.7	-61.3	-18.2	0	0	0	121.5	L663 D694 V695	L663-D692 HydrophobicContact CD1-CB 4.14Å; D692-D694 PolarHBondContact O-N 2.78Å; D692-D694 VanDerWaalsContact O-N 3.11Å; D692-V695 WeakPolarHBondContact O-CG2 3.24Å
693	R	61	Low	64.3	Low	101 Å²	101	111 Å²	111	38%	0.381	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-65.1	-18	176.9	-67	-176.5	174.3	167	0.4	112.7	N691 V695 T696 R713	N691-R693 PolarHBondContact O-N 3.22Å; R693-V695 PolarHBondContact O-N 3.15Å; R693-T696 PolarHBondContact O-N 3.39Å; R693-T696 VanDerWaalsContact O-N 3.16Å; R693-T696 PolarHBondContact O-OG1 3.37Å; R693-R713 HydrophobicContact CB-CB 4.39Å
694	D	69.9	Low	66.2	Low	38 Å²	38	110.1 Å²	110.1	20%	0.203	51%	0.511	C	S	.	.	G	3₁₀ helix	trans	-70.5	-24.9	-175.5	-98.8	-12.5	0	0	0	115	D692 T696 R697 R713	D692-D694 PolarHBondContact O-N 2.78Å; D692-D694 VanDerWaalsContact O-N 3.11Å; D694-T696 PolarHBondContact O-N 3.07Å; D694-R697 WeakPolarHBondContact O-CD 3.39Å; D694-R697 VanDerWaalsContact O-CG 3.26Å; D694-R697 WeakPolarHBondContact O-CG 3.48Å; D694-R697 IonicContact OD1-CZ 3.36Å; D694-R697 IonicContact OD1-NE 3.34Å; D694-R697 PolarHBondContact OD1-NE 3.29Å; D694-R697 IonicContact OD1-NH2 3.95Å; D694-R697 PolarHBondContact OD1-NH2 2.91Å; D694-R697 IonicContact OD2-CZ 3.54Å; D694-R697 IonicContact OD2-NE 3.31Å; D694-R697 IonicContact OD2-NH2 3.54Å; D694-R697 PolarHBondContact OD2-NH2 2.95Å; D694-R713 IonicContact OD1-CZ 2.92Å; D694-R713 IonicContact OD1-NE 2.73Å; D694-R713 PolarHBondContact OD1-NE 2.93Å; D694-R713 IonicContact OD1-NH2 3.42Å; D694-R713 PolarHBondContact OD1-NH2 3.27Å; D694-R713 IonicContact OD2-NH2 3.95Å; D694-R713 PolarHBondContact OD2-NH2 2.82Å
695	V	70.9	Confident	67.8	Low	128 Å²	128	108.6 Å²	108.6	78%	0.776	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-76.9	-12.1	173.5	-60.1	0	0	0	0	112.5	D692 R693	D692-V695 WeakPolarHBondContact O-CG2 3.24Å; R693-V695 PolarHBondContact O-N 3.15Å
696	T	70.5	Confident	69.6	Low	26 Å²	26	109.6 Å²	109.6	16%	0.16	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-103.3	33.3	176.6	68.3	0	0	0	0	111.9	R693 D694 F714 T718 L721	R693-T696 PolarHBondContact O-N 3.39Å; R693-T696 VanDerWaalsContact O-N 3.16Å; R693-T696 PolarHBondContact O-OG1 3.37Å; D694-T696 PolarHBondContact O-N 3.07Å; T696-F714 WeakPolarHBondContact O-CD2 3.32Å; T696-F714 PolarHBondContact O-N 3.28Å; T696-T718 HydrophobicContact CG2-CG2 4.49Å; T696-L721 HydrophobicContact CG2-CD1 4.2Å
697	R	79.6	Confident	71.6	Confident	126 Å²	126	109.7 Å²	109.7	48%	0.475	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	143.3	176.1	-77	171.1	-173.3	-169	6.1	111.4	D694 I711 F712 R713	D694-R697 WeakPolarHBondContact O-CD 3.39Å; D694-R697 VanDerWaalsContact O-CG 3.26Å; D694-R697 WeakPolarHBondContact O-CG 3.48Å; D694-R697 IonicContact OD1-CZ 3.36Å; D694-R697 IonicContact OD1-NE 3.34Å; D694-R697 PolarHBondContact OD1-NE 3.29Å; D694-R697 IonicContact OD1-NH2 3.95Å; D694-R697 PolarHBondContact OD1-NH2 2.91Å; D694-R697 IonicContact OD2-CZ 3.54Å; D694-R697 IonicContact OD2-NE 3.31Å; D694-R697 IonicContact OD2-NH2 3.54Å; D694-R697 PolarHBondContact OD2-NH2 2.95Å; R697-I711 HydrophobicContact CB-CG2 4.37Å; R697-I711 HydrophobicContact CG-CG2 4.21Å; R697-F712 CarbonylContact C-O 3.53Å; R697-F712 WeakPolarHBondContact CA-O 3.28Å; R697-F712 WeakPolarHBondContact CB-O 3.45Å; R697-R713 HydrophobicContact CG-CG 3.78Å
698	Y	80.8	Confident	73.7	Confident	82 Å²	82	109.3 Å²	109.3	32%	0.322	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	150.1	172.7	67.4	-83.1	0	0	0	110.6	W700 F712 F714	Y698-W700 HydrophobicContact CD2-CB 4.09Å; Y698-W700 HydrophobicContact CE2-CB 3.89Å; Y698-W700 HydrophobicContact CE2-CG 4.46Å; Y698-F712 HydrophobicContact CD1-CB 3.94Å; Y698-F712 HydrophobicContact CD2-CB 4.12Å; Y698-F712 HydrophobicContact CE1-CB 3.46Å; Y698-F712 VanDerWaalsContact CE1-CB 3.46Å; Y698-F712 HydrophobicContact CE2-CB 3.67Å; Y698-F712 HydrophobicContact CE2-CD2 4.37Å; Y698-F712 HydrophobicContact CE2-CG 4.14Å; Y698-F712 HydrophobicContact CG-CB 4.24Å; Y698-F712 PolarHBondContact N-O 3.49Å; Y698-F712 PolarHBondContact O-N 3.28Å; Y698-F714 HydrophobicContact CD1-CD1 4.31Å; Y698-F714 AromaticContact CD1-CD2 3.69Å; Y698-F714 HydrophobicContact CD1-CD2 3.69Å; Y698-F714 HydrophobicContact CD1-CE1 4.24Å; Y698-F714 AromaticContact CD1-CE2 3.61Å; Y698-F714 HydrophobicContact CD1-CE2 3.61Å; Y698-F714 HydrophobicContact CD1-CG 4.05Å; Y698-F714 AromaticContact CD1-CZ 3.89Å; Y698-F714 HydrophobicContact CD1-CZ 3.89Å; Y698-F714 HydrophobicContact CE1-CD1 4.13Å; Y698-F714 HydrophobicContact CE1-CD2 4.27Å; Y698-F714 HydrophobicContact CE1-CE1 4.22Å; Y698-F714 HydrophobicContact CE1-CE2 4.35Å; Y698-F714 HydrophobicContact CE1-CG 4.16Å; Y698-F714 HydrophobicContact CE1-CZ 4.33Å; Y698-F714 HydrophobicContact CG-CE2 4.02Å; Y698-F714 HydrophobicContact CG-CZ 4.18Å
699	L	87.8	Confident	75.6	Confident	114 Å²	114	101 Å²	101	60%	0.597	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	131.8	176.6	-65.3	-179.3	0	0	0	109.1	P709 G710 I711	L699-P709 HydrophobicContact CB-CB 4.03Å; L699-P709 HydrophobicContact CB-CG 4.42Å; L699-P709 HydrophobicContact CD1-CG 4.35Å; L699-G710 WeakPolarHBondContact CA-O 3.46Å; L699-I711 HydrophobicContact CD2-CB 4.41Å; L699-I711 HydrophobicContact CD2-CG1 3.71Å
700	W	89	Confident	77.6	Confident	138 Å²	138	95.6 Å²	95.6	52%	0.523	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	138.3	179.6	-176.6	-102.9	0	0	0	111.8	Y698 N702 G710 F712	Y698-W700 HydrophobicContact CD2-CB 4.09Å; Y698-W700 HydrophobicContact CE2-CB 3.89Å; Y698-W700 HydrophobicContact CE2-CG 4.46Å; W700-N702 HydrophobicContact CZ2-CB 4.44Å; W700-G710 PolarHBondContact N-O 3.46Å; W700-G710 PolarHBondContact O-N 3.46Å; W700-F712 HydrophobicContact CB-CD2 3.58Å; W700-F712 HydrophobicContact CB-CE2 3.64Å; W700-F712 HydrophobicContact CG-CE2 4.37Å
701	R	89.2	Confident	79.9	Confident	106 Å²	106	97 Å²	97	40%	0.4	50%	0.497	S	S	.	.			trans	-140.7	15.1	178.6	65.7	-170.7	179.3	166.1	-5	114.5	M703 N704 T705 I707 P709	R701-M703 PolarHBondContact O-N 3.31Å; R701-M703 VanDerWaalsContact O-N 3.14Å; R701-N704 WeakPolarHBondContact CD-O 3.23Å; R701-N704 WeakPolarHBondContact CG-O 3.22Å; R701-N704 WeakPolarHBondContact O-CB 3.32Å; R701-N704 PolarHBondContact O-N 2.98Å; R701-T705 PolarHBondContact NH1-O 2.98Å; R701-I707 HydrophobicContact CB-CG1 4.4Å; R701-P709 HydrophobicContact CB-CB 4.23Å
702	N	84.7	Confident	81.6	Confident	118 Å²	118	94.1 Å²	94.1	63%	0.631	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.1	48	-178.4	-163.1	34.2	0	0	0	113.8	W700 N704	W700-N702 HydrophobicContact CZ2-CB 4.44Å; N702-N704 PolarHBondContact O-N 3.04Å
703	M	80.5	Confident	82.4	Confident	152 Å²	152	97.3 Å²	97.3	75%	0.749	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	0.5	-177.2	-57.1	-63.4	-72	0	0	116.8	R701 T705	R701-M703 PolarHBondContact O-N 3.31Å; R701-M703 VanDerWaalsContact O-N 3.14Å; M703-T705 PolarHBondContact O-N 2.98Å
704	N	87.9	Confident	82.9	Confident	67 Å²	67	96.8 Å²	96.8	36%	0.358	49%	0.485	S	S	.	.			trans	-77.9	106.3	175.5	-174.2	-18.9	0	0	0	109.8	R701 N702 D706 I707	R701-N704 WeakPolarHBondContact CD-O 3.23Å; R701-N704 WeakPolarHBondContact CG-O 3.22Å; R701-N704 WeakPolarHBondContact O-CB 3.32Å; R701-N704 PolarHBondContact O-N 2.98Å; N702-N704 PolarHBondContact O-N 3.04Å; N704-D706 VanDerWaalsContact C-N 3.31Å; N704-D706 WeakPolarHBondContact OD1-CB 3.46Å; N704-D706 PolarHBondContact OD1-N 3.25Å; N704-I707 HydrophobicContact CB-CD1 4.12Å; N704-I707 HydrophobicContact CB-CG1 4.02Å
705	T	87	Confident	82.9	Confident	85 Å²	85	102.2 Å²	102.2	52%	0.521	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.9	-177.8	48.2	0	0	0	0	114.1	R701 M703 I707	R701-T705 PolarHBondContact NH1-O 2.98Å; M703-T705 PolarHBondContact O-N 2.98Å; T705-I707 VanDerWaalsContact C-N 3.31Å
706	D	90.1	Very high	82.9	Confident	146 Å²	146	106.7 Å²	106.7	78%	0.781	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-12.5	-172.8	-53.9	-31.4	0	0	0	112.3	N704	N704-D706 VanDerWaalsContact C-N 3.31Å; N704-D706 WeakPolarHBondContact OD1-CB 3.46Å; N704-D706 PolarHBondContact OD1-N 3.25Å
707	I	87.3	Confident	82.9	Confident	84 Å²	84	109.5 Å²	109.5	43%	0.431	52%	0.523	S	S	.	.	S	Bend	trans	-110.6	145.7	176	62.4	175.8	0	0	0	111.7	R701 N704 T705	R701-I707 HydrophobicContact CB-CG1 4.4Å; N704-I707 HydrophobicContact CB-CD1 4.12Å; N704-I707 HydrophobicContact CB-CG1 4.02Å; T705-I707 VanDerWaalsContact C-N 3.31Å
708	P	87.8	Confident	82.4	Confident	114 Å²	114	104.4 Å²	104.4	74%	0.74	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-57.1	140.6	167.3	-22.5	33.1	0	0	0	110.8	G710	P708-G710 PolarHBondContact O-N 3.33Å
709	P	87.4	Confident	81.9	Confident	52 Å²	52	110.1 Å²	110.1	34%	0.338	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-65.4	133.1	177.2	25.9	-31.8	0	0	0	111.9	L699 R701	L699-P709 HydrophobicContact CB-CB 4.03Å; L699-P709 HydrophobicContact CB-CG 4.42Å; L699-P709 HydrophobicContact CD1-CG 4.35Å; R701-P709 HydrophobicContact CB-CB 4.23Å
710	G	87.7	Confident	81	Confident	29 Å²	29	108.5 Å²	108.5	30%	0.299	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	147.7	170.2	0	0	0	0	0	110.5	L699 W700 P708 F712	L699-G710 WeakPolarHBondContact CA-O 3.46Å; W700-G710 PolarHBondContact N-O 3.46Å; W700-G710 PolarHBondContact O-N 3.46Å; P708-G710 PolarHBondContact O-N 3.33Å; G710-F712 WeakPolarHBondContact O-CD2 3.4Å
711	I	89.9	Confident	80.1	Confident	118 Å²	118	105.7 Å²	105.7	61%	0.605	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.8	176.5	-54.3	173.5	0	0	0	108	R697 L699	R697-I711 HydrophobicContact CB-CG2 4.37Å; R697-I711 HydrophobicContact CG-CG2 4.21Å; L699-I711 HydrophobicContact CD2-CB 4.41Å; L699-I711 HydrophobicContact CD2-CG1 3.71Å
712	F	81.1	Confident	79.2	Confident	89 Å²	89	112.8 Å²	112.8	39%	0.39	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.3	168.5	179.7	-63.4	-94.7	0	0	0	110.6	R697 Y698 W700 G710	R697-F712 CarbonylContact C-O 3.53Å; R697-F712 WeakPolarHBondContact CA-O 3.28Å; R697-F712 WeakPolarHBondContact CB-O 3.45Å; Y698-F712 HydrophobicContact CD1-CB 3.94Å; Y698-F712 HydrophobicContact CD2-CB 4.12Å; Y698-F712 HydrophobicContact CE1-CB 3.46Å; Y698-F712 VanDerWaalsContact CE1-CB 3.46Å; Y698-F712 HydrophobicContact CE2-CB 3.67Å; Y698-F712 HydrophobicContact CE2-CD2 4.37Å; Y698-F712 HydrophobicContact CE2-CG 4.14Å; Y698-F712 HydrophobicContact CG-CB 4.24Å; Y698-F712 PolarHBondContact N-O 3.49Å; Y698-F712 PolarHBondContact O-N 3.28Å; W700-F712 HydrophobicContact CB-CD2 3.58Å; W700-F712 HydrophobicContact CB-CE2 3.64Å; W700-F712 HydrophobicContact CG-CE2 4.37Å; G710-F712 WeakPolarHBondContact O-CD2 3.4Å
713	R	79.8	Confident	78.5	Confident	131 Å²	131	109.7 Å²	109.7	49%	0.494	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129	138.2	176.8	-63.6	160	178.2	158.8	-17.5	108.7	R693 D694 R697 K715	R693-R713 HydrophobicContact CB-CB 4.39Å; D694-R713 IonicContact OD1-CZ 2.92Å; D694-R713 IonicContact OD1-NE 2.73Å; D694-R713 PolarHBondContact OD1-NE 2.93Å; D694-R713 IonicContact OD1-NH2 3.42Å; D694-R713 PolarHBondContact OD1-NH2 3.27Å; D694-R713 IonicContact OD2-NH2 3.95Å; D694-R713 PolarHBondContact OD2-NH2 2.82Å; R697-R713 HydrophobicContact CG-CG 3.78Å; R713-K715 PolarHBondContact O-N 2.95Å
714	F	72	Confident	78.1	Confident	89 Å²	89	102.9 Å²	102.9	39%	0.39	52%	0.52	S	S	.	.			trans	-66	131.8	172.1	-75.2	-77.2	0	0	0	110.6	T696 Y698 T718	T696-F714 WeakPolarHBondContact O-CD2 3.32Å; T696-F714 PolarHBondContact O-N 3.28Å; Y698-F714 HydrophobicContact CD1-CD1 4.31Å; Y698-F714 AromaticContact CD1-CD2 3.69Å; Y698-F714 HydrophobicContact CD1-CD2 3.69Å; Y698-F714 HydrophobicContact CD1-CE1 4.24Å; Y698-F714 AromaticContact CD1-CE2 3.61Å; Y698-F714 HydrophobicContact CD1-CE2 3.61Å; Y698-F714 HydrophobicContact CD1-CG 4.05Å; Y698-F714 AromaticContact CD1-CZ 3.89Å; Y698-F714 HydrophobicContact CD1-CZ 3.89Å; Y698-F714 HydrophobicContact CE1-CD1 4.13Å; Y698-F714 HydrophobicContact CE1-CD2 4.27Å; Y698-F714 HydrophobicContact CE1-CE1 4.22Å; Y698-F714 HydrophobicContact CE1-CE2 4.35Å; Y698-F714 HydrophobicContact CE1-CG 4.16Å; Y698-F714 HydrophobicContact CE1-CZ 4.33Å; Y698-F714 HydrophobicContact CG-CE2 4.02Å; Y698-F714 HydrophobicContact CG-CZ 4.18Å; F714-T718 HydrophobicContact CB-CG2 3.43Å; F714-T718 VanDerWaalsContact CB-CG2 3.43Å; F714-T718 HydrophobicContact CD1-CG2 3.73Å; F714-T718 HydrophobicContact CD2-CG2 3.23Å; F714-T718 HydrophobicContact CE1-CG2 4.26Å; F714-T718 HydrophobicContact CE2-CG2 3.83Å; F714-T718 HydrophobicContact CG-CG2 3.18Å; F714-T718 HydrophobicContact CZ-CG2 4.31Å
715	K	70.7	Confident	77.4	Confident	152 Å²	152	103 Å²	103	66%	0.661	52%	0.524	S	S	*	.	S	Bend	trans	-99.2	2.8	175.1	-67.3	-177	178.6	179.7	0	112.6	R713	R713-K715 PolarHBondContact O-N 2.95Å
716	R	70.6	Confident	77	Confident	223 Å²	223	103.3 Å²	103.3	84%	0.842	52%	0.519	S	S	*	.	S	Bend	trans	-132.7	158.4	-177.2	-64.5	-178.8	-177.7	155.3	-0.4	108.6	T718	R716-T718 PolarHBondContact O-N 3.48Å
717	L	71.1	Confident	76.4	Confident	85 Å²	85	97.4 Å²	97.4	45%	0.445	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-57.5	125.1	172.3	-171	66.1	0	0	0	109.6	S724 L727 A728	L717-S724 WeakPolarHBondContact CD2-O 3.3Å; L717-L727 HydrophobicContact CD1-CB 4Å; L717-L727 HydrophobicContact CD1-CD1 3.65Å; L717-L727 HydrophobicContact CD1-CG 4.47Å; L717-L727 HydrophobicContact CD2-CB 4.14Å; L717-A728 HydrophobicContact CD2-CB 3.83Å
718	T	68.2	Low	76	Confident	18 Å²	18	95 Å²	95	11%	0.11	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-88.8	128.6	-172.7	41.5	0	0	0	0	111.7	T696 F714 R716 L721 S724	T696-T718 HydrophobicContact CG2-CG2 4.49Å; F714-T718 HydrophobicContact CB-CG2 3.43Å; F714-T718 VanDerWaalsContact CB-CG2 3.43Å; F714-T718 HydrophobicContact CD1-CG2 3.73Å; F714-T718 HydrophobicContact CD2-CG2 3.23Å; F714-T718 HydrophobicContact CE1-CG2 4.26Å; F714-T718 HydrophobicContact CE2-CG2 3.83Å; F714-T718 HydrophobicContact CG-CG2 3.18Å; F714-T718 HydrophobicContact CZ-CG2 4.31Å; R716-T718 PolarHBondContact O-N 3.48Å; T718-L721 WeakPolarHBondContact OG1-CD1 3.48Å; T718-L721 WeakPolarHBondContact OG1-CG 3.44Å; T718-S724 WeakPolarHBondContact O-CB 3.34Å; T718-S724 PolarHBondContact O-OG 3.07Å
719	F	69.6	Low	75.8	Confident	203 Å²	203	91 Å²	91	89%	0.89	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	141.6	169.9	-71.1	-78.6	0	0	0	111.1
720	G	69	Low	75.6	Confident	79 Å²	79	89.4 Å²	89.4	81%	0.814	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	-8.7	177.3	0	0	0	0	0	116.1
721	L	69.8	Low	75.5	Confident	80 Å²	80	88.6 Å²	88.6	42%	0.419	43%	0.429	S	S	.	.			trans	-75.8	137.3	166.6	-57.5	-175	0	0	0	109.9	T696 T718 S723 S724 P725	T696-L721 HydrophobicContact CG2-CD1 4.2Å; T718-L721 WeakPolarHBondContact OG1-CD1 3.48Å; T718-L721 WeakPolarHBondContact OG1-CG 3.44Å; L721-S723 PolarHBondContact O-N 3.45Å; L721-S723 VanDerWaalsContact O-N 3.15Å; L721-S724 WeakPolarHBondContact CB-OG 3.44Å; L721-S724 WeakPolarHBondContact O-CB 3.38Å; L721-S724 PolarHBondContact O-N 2.87Å; L721-P725 WeakPolarHBondContact O-CD 3.48Å
722	R	70.2	Confident	75.3	Confident	255 Å²	255	83.2 Å²	83.2	96%	0.962	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-33.1	179.7	-71.5	-176.4	-178.8	174.7	-1.1	113.5
723	S	71.1	Confident	75.7	Confident	52 Å²	52	81.3 Å²	81.3	36%	0.364	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-20.7	179	52.5	0	0	0	0	113.6	L721 F726 L727	L721-S723 PolarHBondContact O-N 3.45Å; L721-S723 VanDerWaalsContact O-N 3.15Å; S723-F726 WeakPolarHBondContact O-CB 3.43Å; S723-F726 PolarHBondContact O-N 3.4Å; S723-L727 WeakPolarHBondContact O-CG 2.87Å; S723-L727 PolarHBondContact O-N 3.41Å
724	S	72.9	Confident	76	Confident	9 Å²	9	76.4 Å²	76.4	6%	0.063	38%	0.377	C	S	.	.	H	α-helix	trans	-60.3	-44.2	-170.9	-68.4	0	0	0	0	114.5	L717 T718 L721 F726 L727 A728	L717-S724 WeakPolarHBondContact CD2-O 3.3Å; T718-S724 WeakPolarHBondContact O-CB 3.34Å; T718-S724 PolarHBondContact O-OG 3.07Å; L721-S724 WeakPolarHBondContact CB-OG 3.44Å; L721-S724 WeakPolarHBondContact O-CB 3.38Å; L721-S724 PolarHBondContact O-N 2.87Å; S724-F726 VanDerWaalsContact C-N 3.31Å; S724-F726 PolarHBondContact O-N 3.07Å; S724-L727 PolarHBondContact O-N 3.3Å; S724-A728 WeakPolarHBondContact O-CB 3.25Å; S724-A728 PolarHBondContact O-N 3.37Å
725	P	72.1	Confident	76.7	Confident	69 Å²	69	73.3 Å²	73.3	45%	0.448	36%	0.362	S	S	.	.	H	α-helix	trans	-58.4	-43.1	177	-25.5	35.5	0	0	0	112.5	L721 A728 I729 V756	L721-P725 WeakPolarHBondContact O-CD 3.48Å; P725-A728 PolarHBondContact O-N 3.36Å; P725-I729 WeakPolarHBondContact O-CG2 3.35Å; P725-I729 PolarHBondContact O-N 3.04Å; P725-V756 HydrophobicContact CB-CG1 4.37Å
726	F	79	Confident	77.6	Confident	93 Å²	93	66.2 Å²	66.2	41%	0.408	33%	0.332	S	S	.	.	H	α-helix	trans	-63	-46.2	176	173.4	-94.7	0	0	0	112	Y648 S723 S724 A728 I729 M730	Y648-F726 HydrophobicContact CD2-CE1 4.46Å; Y648-F726 HydrophobicContact CE1-CE1 4.36Å; Y648-F726 HydrophobicContact CE2-CE1 4.16Å; S723-F726 WeakPolarHBondContact O-CB 3.43Å; S723-F726 PolarHBondContact O-N 3.4Å; S724-F726 VanDerWaalsContact C-N 3.31Å; S724-F726 PolarHBondContact O-N 3.07Å; F726-A728 VanDerWaalsContact C-N 3.34Å; F726-A728 PolarHBondContact O-N 3.17Å; F726-I729 WeakPolarHBondContact O-CG2 3.16Å; F726-M730 HydrophobicContact CD1-CG 4.24Å; F726-M730 HydrophobicContact CD2-CG 3.96Å; F726-M730 HydrophobicContact CE1-CG 3.86Å; F726-M730 HydrophobicContact CE2-CG 3.55Å; F726-M730 HydrophobicContact CE2-SD 4Å; F726-M730 HydrophobicContact CG-CG 4.29Å; F726-M730 HydrophobicContact CZ-CE 4.49Å; F726-M730 HydrophobicContact CZ-CG 3.51Å; F726-M730 HydrophobicContact CZ-SD 4.12Å; F726-M730 VanDerWaalsContact O-CB 3.29Å; F726-M730 WeakPolarHBondContact O-CB 3.4Å; F726-M730 WeakPolarHBondContact O-CG 3.47Å; F726-M730 PolarHBondContact O-N 3.25Å
727	L	77.6	Confident	78.6	Confident	21 Å²	21	61.2 Å²	61.2	11%	0.11	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-43.2	-179.7	-65.8	174.8	0	0	0	111.3	Y648 L717 S723 S724 V731	Y648-L727 HydrophobicContact CE2-CD2 3.46Å; Y648-L727 VanDerWaalsContact CE2-CD2 3.46Å; Y648-L727 WeakPolarHBondContact OH-CA 3.5Å; Y648-L727 WeakPolarHBondContact OH-CD2 3.35Å; L717-L727 HydrophobicContact CD1-CB 4Å; L717-L727 HydrophobicContact CD1-CD1 3.65Å; L717-L727 HydrophobicContact CD1-CG 4.47Å; L717-L727 HydrophobicContact CD2-CB 4.14Å; S723-L727 WeakPolarHBondContact O-CG 2.87Å; S723-L727 PolarHBondContact O-N 3.41Å; S724-L727 PolarHBondContact O-N 3.3Å; L727-V731 VanDerWaalsContact O-CG2 3.28Å; L727-V731 WeakPolarHBondContact O-CG2 3.46Å; L727-V731 PolarHBondContact O-N 3.46Å; L727-V731 VanDerWaalsContact O-N 3.16Å
728	A	78.2	Confident	79.5	Confident	33 Å²	33	61.9 Å²	61.9	27%	0.273	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-53.7	178.6	0	0	0	0	0	111.8	L717 S724 P725 F726 M730 V731 V732	L717-A728 HydrophobicContact CD2-CB 3.83Å; S724-A728 WeakPolarHBondContact O-CB 3.25Å; S724-A728 PolarHBondContact O-N 3.37Å; P725-A728 PolarHBondContact O-N 3.36Å; F726-A728 VanDerWaalsContact C-N 3.34Å; F726-A728 PolarHBondContact O-N 3.17Å; A728-M730 VanDerWaalsContact C-N 3.32Å; A728-M730 PolarHBondContact O-N 3.49Å; A728-V731 PolarHBondContact O-N 2.98Å; A728-V732 WeakPolarHBondContact O-CG2 3.23Å; A728-V732 PolarHBondContact O-N 3.27Å; A728-V732 VanDerWaalsContact O-N 3.15Å
729	I	83.9	Confident	80.5	Confident	32 Å²	32	63.4 Å²	63.4	16%	0.164	32%	0.322	C	S	.	.	H	α-helix	trans	-64.9	-36.9	-177.1	-165.5	63.5	0	0	0	111.7	P725 F726 V732 Q733 M754	P725-I729 WeakPolarHBondContact O-CG2 3.35Å; P725-I729 PolarHBondContact O-N 3.04Å; F726-I729 WeakPolarHBondContact O-CG2 3.16Å; I729-V732 PolarHBondContact O-N 3.43Å; I729-Q733 HydrophobicContact CG1-CG 4.49Å; I729-Q733 WeakPolarHBondContact O-CG 3.4Å; I729-Q733 PolarHBondContact O-N 3.24Å; I729-M754 HydrophobicContact CD1-CB 4.39Å; I729-M754 HydrophobicContact CD1-CG 4.01Å; I729-M754 HydrophobicContact CD1-SD 4.4Å
730	M	83.5	Confident	81.5	Confident	18 Å²	18	56.7 Å²	56.7	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-68	-38.1	178.8	-75.8	-66.7	-63.7	0	0	113	I645 Y648 I649 F726 A728 V732 Q733 H734	I645-M730 HydrophobicContact CG2-CE 4.45Å; Y648-M730 HydrophobicContact CD1-CB 4.39Å; Y648-M730 HydrophobicContact CD1-CE 3.74Å; Y648-M730 HydrophobicContact CE1-CB 3.45Å; Y648-M730 VanDerWaalsContact CE1-CB 3.45Å; Y648-M730 HydrophobicContact CE1-CE 3.93Å; Y648-M730 HydrophobicContact CE1-CG 3.93Å; I649-M730 HydrophobicContact CG1-CE 4.21Å; F726-M730 HydrophobicContact CD1-CG 4.24Å; F726-M730 HydrophobicContact CD2-CG 3.96Å; F726-M730 HydrophobicContact CE1-CG 3.86Å; F726-M730 HydrophobicContact CE2-CG 3.55Å; F726-M730 HydrophobicContact CE2-SD 4Å; F726-M730 HydrophobicContact CG-CG 4.29Å; F726-M730 HydrophobicContact CZ-CE 4.49Å; F726-M730 HydrophobicContact CZ-CG 3.51Å; F726-M730 HydrophobicContact CZ-SD 4.12Å; F726-M730 VanDerWaalsContact O-CB 3.29Å; F726-M730 WeakPolarHBondContact O-CB 3.4Å; F726-M730 WeakPolarHBondContact O-CG 3.47Å; F726-M730 PolarHBondContact O-N 3.25Å; A728-M730 VanDerWaalsContact C-N 3.32Å; A728-M730 PolarHBondContact O-N 3.49Å; M730-V732 VanDerWaalsContact C-N 3.33Å; M730-Q733 PolarHBondContact O-N 3.13Å; M730-H734 VanDerWaalsContact O-CB 3.27Å; M730-H734 WeakPolarHBondContact O-CB 3.17Å; M730-H734 PolarHBondContact O-N 3.25Å
731	V	84.3	Confident	82.6	Confident	11 Å²	11	61.8 Å²	61.8	7%	0.067	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-44.4	174.6	171.4	0	0	0	0	110.4	C659 V661 L727 A728 H734 R735 F785	C659-V731 HydrophobicContact CB-CG1 3.48Å; C659-V731 VanDerWaalsContact CB-CG1 3.48Å; C659-V731 HydrophobicContact CB-CG2 4.5Å; C659-V731 VanDerWaalsContact SG-CG1 3.55Å; V661-V731 HydrophobicContact CG2-CG2 3.33Å; L727-V731 VanDerWaalsContact O-CG2 3.28Å; L727-V731 WeakPolarHBondContact O-CG2 3.46Å; L727-V731 PolarHBondContact O-N 3.46Å; L727-V731 VanDerWaalsContact O-N 3.16Å; A728-V731 PolarHBondContact O-N 2.98Å; V731-H734 PolarHBondContact O-N 3.14Å; V731-R735 HydrophobicContact CG1-CG 4.48Å; V731-R735 WeakPolarHBondContact O-CB 3.37Å; V731-R735 VanDerWaalsContact O-CG 3.32Å; V731-R735 WeakPolarHBondContact O-CG 3.38Å; V731-R735 PolarHBondContact O-N 3.39Å; V731-F785 HydrophobicContact CB-CZ 4.2Å; V731-F785 HydrophobicContact CG1-CE2 3.79Å; V731-F785 HydrophobicContact CG1-CZ 3.68Å
732	V	86.9	Confident	83.7	Confident	5 Å²	5	62.6 Å²	62.6	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-58.8	-54.8	175.4	174.1	0	0	0	0	110.1	A728 I729 M730 H734 R735 T736 V750 M754 M780 F785	A728-V732 WeakPolarHBondContact O-CG2 3.23Å; A728-V732 PolarHBondContact O-N 3.27Å; A728-V732 VanDerWaalsContact O-N 3.15Å; I729-V732 PolarHBondContact O-N 3.43Å; M730-V732 VanDerWaalsContact C-N 3.33Å; V732-H734 VanDerWaalsContact C-N 3.31Å; V732-H734 PolarHBondContact O-N 2.79Å; V732-R735 PolarHBondContact O-N 3.01Å; V732-T736 WeakPolarHBondContact O-CB 3.46Å; V732-T736 PolarHBondContact O-N 3.4Å; V732-T736 PolarHBondContact O-OG1 3.14Å; V732-V750 HydrophobicContact CG1-CG1 3.52Å; V732-M754 HydrophobicContact CB-SD 4.38Å; V732-M754 HydrophobicContact CG1-CE 4.41Å; V732-M754 HydrophobicContact CG1-SD 3.6Å; V732-M754 HydrophobicContact CG2-CE 4.17Å; V732-M754 HydrophobicContact CG2-SD 4.41Å; V732-M780 HydrophobicContact CG1-CE 3.82Å; V732-M780 HydrophobicContact CG1-SD 4.07Å; V732-M780 HydrophobicContact CG2-CE 3.91Å; V732-F785 HydrophobicContact CG2-CD1 4.45Å; V732-F785 HydrophobicContact CG2-CD2 4.03Å; V732-F785 HydrophobicContact CG2-CE1 4.09Å; V732-F785 HydrophobicContact CG2-CE2 3.63Å; V732-F785 HydrophobicContact CG2-CG 4.43Å; V732-F785 HydrophobicContact CG2-CZ 3.66Å
733	Q	88.8	Confident	84.8	Confident	50 Å²	50	52.6 Å²	52.6	23%	0.234	27%	0.268	C	S	.	.	H	α-helix	trans	-58.6	-40.6	-179.1	-72.5	-169.4	5.3	0	0	113.2	I729 M730 T736 R737 L751	I729-Q733 HydrophobicContact CG1-CG 4.49Å; I729-Q733 WeakPolarHBondContact O-CG 3.4Å; I729-Q733 PolarHBondContact O-N 3.24Å; M730-Q733 PolarHBondContact O-N 3.13Å; Q733-T736 PolarHBondContact O-N 2.95Å; Q733-R737 VanDerWaalsContact O-CG 3.32Å; Q733-R737 WeakPolarHBondContact O-CG 3.31Å; Q733-R737 PolarHBondContact O-N 3.14Å; Q733-L751 HydrophobicContact CB-CD2 4.16Å; Q733-L751 HydrophobicContact CG-CD2 4.11Å
734	H	87.1	Confident	85.7	Confident	27 Å²	27	56.6 Å²	56.6	13%	0.125	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-47.1	178.6	178.1	68.2	0	0	0	111.8	I652 M730 V731 V732 T736 R737 L738	I652-H734 HydrophobicContact CD1-CB 3.57Å; M730-H734 VanDerWaalsContact O-CB 3.27Å; M730-H734 WeakPolarHBondContact O-CB 3.17Å; M730-H734 PolarHBondContact O-N 3.25Å; V731-H734 PolarHBondContact O-N 3.14Å; V732-H734 VanDerWaalsContact C-N 3.31Å; V732-H734 PolarHBondContact O-N 2.79Å; H734-T736 VanDerWaalsContact C-N 3.32Å; H734-T736 PolarHBondContact O-N 3.5Å; H734-R737 PolarHBondContact O-N 3.31Å; H734-L738 WeakPolarHBondContact NE2-CD1 3.34Å; H734-L738 PolarHBondContact O-N 3.12Å; H734-L738 VanDerWaalsContact O-N 3.07Å
735	R	85.7	Confident	86.5	Confident	25 Å²	25	60.8 Å²	60.8	9%	0.094	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-42.6	176.2	-72.6	-71.7	173	-161.4	-10.6	111.9	T653 C659 V731 V732 R737 L738 H739	T653-R735 PolarHBondContact O-NH2 3.42Å; C659-R735 PolarHBondContact SG-NE 2.84Å; C659-R735 PolarHBondContact SG-NH2 3.47Å; V731-R735 HydrophobicContact CG1-CG 4.48Å; V731-R735 WeakPolarHBondContact O-CB 3.37Å; V731-R735 VanDerWaalsContact O-CG 3.32Å; V731-R735 WeakPolarHBondContact O-CG 3.38Å; V731-R735 PolarHBondContact O-N 3.39Å; V732-R735 PolarHBondContact O-N 3.01Å; R735-R737 VanDerWaalsContact C-N 3.34Å; R735-R737 PolarHBondContact O-N 2.95Å; R735-L738 PolarHBondContact O-N 3.5Å; R735-H739 PolarHBondContact O-CD2 2.81Å; R735-H739 PolarHBondContact O-N 3.21Å
736	T	91	Very high	87.6	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-59.5	-44.8	176.7	-61.5	0	0	0	0	111.9	V732 Q733 H734 L738 H739 I740 A747 V750 L751 L779	V732-T736 WeakPolarHBondContact O-CB 3.46Å; V732-T736 PolarHBondContact O-N 3.4Å; V732-T736 PolarHBondContact O-OG1 3.14Å; Q733-T736 PolarHBondContact O-N 2.95Å; H734-T736 VanDerWaalsContact C-N 3.32Å; H734-T736 PolarHBondContact O-N 3.5Å; T736-L738 PolarHBondContact O-N 2.89Å; T736-H739 CarbonylContact O-C 3.56Å; T736-H739 PolarHBondContact O-N 3.36Å; T736-I740 PolarHBondContact O-N 3.01Å; T736-I740 VanDerWaalsContact O-N 3.08Å; T736-A747 VanDerWaalsContact CG2-CA 3.41Å; T736-A747 HydrophobicContact CG2-CB 3.52Å; T736-A747 VanDerWaalsContact CG2-O 3.25Å; T736-A747 WeakPolarHBondContact CG2-O 3.47Å; T736-V750 HydrophobicContact CG2-CB 4.09Å; T736-V750 HydrophobicContact CG2-CG1 4.14Å; T736-V750 VanDerWaalsContact OG1-CG1 3.28Å; T736-V750 WeakPolarHBondContact OG1-CG1 3.39Å; T736-L751 HydrophobicContact CG2-CD1 4.1Å; T736-L751 HydrophobicContact CG2-CD2 4.05Å; T736-L751 HydrophobicContact CG2-CG 3.66Å; T736-L779 HydrophobicContact CG2-CD2 4.19Å
737	R	90.5	Very high	88.3	Confident	118 Å²	118	53.1 Å²	53.1	45%	0.445	25%	0.253	S	S	.	.	H	α-helix	trans	-64.9	-36.9	177.1	-72.1	178.9	-171.4	113	6.2	113.1	Q733 H734 R735 H739 I740 L751	Q733-R737 VanDerWaalsContact O-CG 3.32Å; Q733-R737 WeakPolarHBondContact O-CG 3.31Å; Q733-R737 PolarHBondContact O-N 3.14Å; H734-R737 PolarHBondContact O-N 3.31Å; R735-R737 VanDerWaalsContact C-N 3.34Å; R735-R737 PolarHBondContact O-N 2.95Å; R737-H739 VanDerWaalsContact C-N 3.26Å; R737-H739 PolarHBondContact O-N 2.95Å; R737-I740 VanDerWaalsContact O-CG2 3.29Å; R737-I740 WeakPolarHBondContact O-CG2 3.29Å; R737-L751 HydrophobicContact CG-CD1 4.23Å; R737-L751 HydrophobicContact CG-CD2 4.23Å
738	L	89.6	Confident	88.9	Confident	99 Å²	99	56 Å²	56	52%	0.518	27%	0.266	S	S	.	.	H	α-helix	trans	-65.8	-28.1	177.5	-74.3	175.8	0	0	0	113.5	H734 R735 T736	H734-L738 WeakPolarHBondContact NE2-CD1 3.34Å; H734-L738 PolarHBondContact O-N 3.12Å; H734-L738 VanDerWaalsContact O-N 3.07Å; R735-L738 PolarHBondContact O-N 3.5Å; T736-L738 PolarHBondContact O-N 2.89Å
739	H	90.3	Very high	89.7	Confident	50 Å²	50	55.2 Å²	55.2	23%	0.231	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	17.6	-176.8	-63.7	-68.7	0	0	0	113.2	R735 T736 R737 E741 T742 Y743 L779	R735-H739 PolarHBondContact O-CD2 2.81Å; R735-H739 PolarHBondContact O-N 3.21Å; T736-H739 CarbonylContact O-C 3.56Å; T736-H739 PolarHBondContact O-N 3.36Å; R737-H739 VanDerWaalsContact C-N 3.26Å; R737-H739 PolarHBondContact O-N 2.95Å; H739-E741 VanDerWaalsContact C-N 3.26Å; H739-E741 PolarHBondContact O-N 3.4Å; H739-T742 PolarHBondContact O-N 3.49Å; H739-T742 VanDerWaalsContact O-N 3.14Å; H739-Y743 HydrophobicContact CB-CD2 4.07Å; H739-Y743 PolarHBondContact O-N 3.06Å; H739-L779 HydrophobicContact CB-CD1 3.7Å
740	I	91.1	Very high	90.1	Very high	62 Å²	62	54 Å²	54	32%	0.318	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.6	-177.7	-164.7	166.3	0	0	0	112.2	T736 R737 K744 A747 L751	T736-I740 PolarHBondContact O-N 3.01Å; T736-I740 VanDerWaalsContact O-N 3.08Å; R737-I740 VanDerWaalsContact O-CG2 3.29Å; R737-I740 WeakPolarHBondContact O-CG2 3.29Å; I740-K744 WeakPolarHBondContact O-CA 3.32Å; I740-K744 WeakPolarHBondContact O-CB 3.36Å; I740-K744 PolarHBondContact O-N 3.35Å; I740-A747 HydrophobicContact CB-CB 4.17Å; I740-A747 HydrophobicContact CG1-CB 3.86Å; I740-L751 HydrophobicContact CD1-CD1 4.29Å
741	E	90.2	Very high	90.4	Very high	186 Å²	186	55.7 Å²	55.7	87%	0.869	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-32.9	178.1	-62.6	-170	167.4	0	0	112.4	H739	H739-E741 VanDerWaalsContact C-N 3.26Å; H739-E741 PolarHBondContact O-N 3.4Å
742	T	93.2	Very high	90.6	Very high	97 Å²	97	58.9 Å²	58.9	60%	0.595	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-39.7	-178.4	-47.5	0	0	0	0	112.4	H739	H739-T742 PolarHBondContact O-N 3.49Å; H739-T742 VanDerWaalsContact O-N 3.14Å
743	Y	93.1	Very high	90.7	Very high	46 Å²	46	61.7 Å²	61.7	18%	0.18	30%	0.297	C	S	.	.	S	Bend	trans	-123.3	51.3	-176.2	-56.8	-75.2	0	0	0	110.9	H739 R745 A746 A747 Q775 K778 L779 L782	H739-Y743 HydrophobicContact CB-CD2 4.07Å; H739-Y743 PolarHBondContact O-N 3.06Å; Y743-R745 PolarHBondContact O-N 3.45Å; Y743-A746 PolarHBondContact O-N 3.33Å; Y743-A747 VanDerWaalsContact O-CB 3.23Å; Y743-A747 WeakPolarHBondContact O-CB 3.29Å; Y743-A747 PolarHBondContact O-N 2.83Å; Y743-Q775 HydrophobicContact CD1-CB 4.12Å; Y743-Q775 HydrophobicContact CD1-CG 4.13Å; Y743-K778 HydrophobicContact CE1-CB 3.8Å; Y743-K778 HydrophobicContact CE1-CD 4.26Å; Y743-L779 HydrophobicContact CD2-CB 4.15Å; Y743-L779 HydrophobicContact CD2-CD1 3.89Å; Y743-L779 HydrophobicContact CG-CB 4.18Å; Y743-L779 HydrophobicContact CG-CD1 4.46Å; Y743-L782 HydrophobicContact CD2-CD1 4.44Å; Y743-L782 HydrophobicContact CE2-CD1 3.63Å
744	K	90.8	Very high	90.7	Very high	136 Å²	136	61 Å²	61	59%	0.591	30%	0.295	S	S	*	.	H	α-helix	trans	-48	-55.2	-168.5	-171.9	179.6	176.4	-174.2	0	114.2	I740 A747 E748	I740-K744 WeakPolarHBondContact O-CA 3.32Å; I740-K744 WeakPolarHBondContact O-CB 3.36Å; I740-K744 PolarHBondContact O-N 3.35Å; K744-A747 PolarHBondContact O-N 2.89Å; K744-E748 WeakPolarHBondContact CE-OE1 3.34Å; K744-E748 WeakPolarHBondContact O-CG 3.42Å; K744-E748 PolarHBondContact O-N 3.27Å
745	R	90.7	Very high	90.4	Very high	97 Å²	97	66.8 Å²	66.8	37%	0.366	32%	0.316	S	S	.	.	H	α-helix	trans	-61.7	-50	-178.7	-176	72.8	-176.9	113.4	11.3	111.7	Y743 A747 E748 E749 L772	Y743-R745 PolarHBondContact O-N 3.45Å; R745-A747 VanDerWaalsContact C-N 3.3Å; R745-A747 PolarHBondContact O-N 2.74Å; R745-E748 PolarHBondContact O-N 2.65Å; R745-E749 IonicContact CZ-OE1 2.74Å; R745-E749 IonicContact NH1-OE1 3.25Å; R745-E749 PolarHBondContact NH1-OE1 3.06Å; R745-E749 IonicContact NH2-OE1 3.88Å; R745-E749 PolarHBondContact NH2-OE1 2.94Å; R745-E749 WeakPolarHBondContact O-CG 3.25Å; R745-E749 PolarHBondContact O-N 2.81Å; R745-E749 VanDerWaalsContact O-N 3.12Å; R745-L772 HydrophobicContact CG-CD1 3.85Å
746	A	93.7	Very high	90.3	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.7	-35.5	178.8	0	0	0	0	0	112.7	Y743 E749 V750 L772 Q775 L776 L779	Y743-A746 PolarHBondContact O-N 3.33Å; A746-E749 PolarHBondContact O-N 3.12Å; A746-V750 VanDerWaalsContact O-CG2 3.29Å; A746-V750 WeakPolarHBondContact O-CG2 3.44Å; A746-V750 PolarHBondContact O-N 2.78Å; A746-L772 HydrophobicContact CB-CD1 4.07Å; A746-Q775 HydrophobicContact CB-CB 3.65Å; A746-L776 HydrophobicContact CB-CD2 3.87Å; A746-L776 HydrophobicContact CB-CG 3.92Å; A746-L779 HydrophobicContact CB-CD2 4.09Å
747	A	93.6	Very high	89.7	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-70.1	-42.4	179.4	0	0	0	0	0	112.3	T736 I740 Y743 K744 R745 E749 V750 L751 L779	T736-A747 VanDerWaalsContact CG2-CA 3.41Å; T736-A747 HydrophobicContact CG2-CB 3.52Å; T736-A747 VanDerWaalsContact CG2-O 3.25Å; T736-A747 WeakPolarHBondContact CG2-O 3.47Å; I740-A747 HydrophobicContact CB-CB 4.17Å; I740-A747 HydrophobicContact CG1-CB 3.86Å; Y743-A747 VanDerWaalsContact O-CB 3.23Å; Y743-A747 WeakPolarHBondContact O-CB 3.29Å; Y743-A747 PolarHBondContact O-N 2.83Å; K744-A747 PolarHBondContact O-N 2.89Å; R745-A747 VanDerWaalsContact C-N 3.3Å; R745-A747 PolarHBondContact O-N 2.74Å; A747-E749 VanDerWaalsContact C-N 3.33Å; A747-E749 PolarHBondContact O-N 2.94Å; A747-V750 PolarHBondContact O-N 3.26Å; A747-L751 WeakPolarHBondContact O-CB 3.48Å; A747-L751 VanDerWaalsContact O-CG 3.26Å; A747-L751 WeakPolarHBondContact O-CG 3.45Å; A747-L751 PolarHBondContact O-N 2.83Å; A747-L779 HydrophobicContact CB-CD2 4.1Å
748	E	91.9	Very high	89.5	Confident	83 Å²	83	72.2 Å²	72.2	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-56.4	-49.3	171.9	-73.7	167.2	179.1	0	0	110.4	K744 R745 V750 L751 S752	K744-E748 WeakPolarHBondContact CE-OE1 3.34Å; K744-E748 WeakPolarHBondContact O-CG 3.42Å; K744-E748 PolarHBondContact O-N 3.27Å; R745-E748 PolarHBondContact O-N 2.65Å; E748-V750 PolarHBondContact O-N 2.92Å; E748-L751 PolarHBondContact O-N 3.37Å; E748-S752 PolarHBondContact O-N 2.72Å; E748-S752 PolarHBondContact O-OG 3.09Å
749	E	93.2	Very high	89.5	Confident	16 Å²	16	69.2 Å²	69.2	8%	0.075	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-44.1	178.8	-72.4	-64.1	148.7	0	0	113.4	R745 A746 A747 L751 S752 N753 F759 T761 L772	R745-E749 IonicContact CZ-OE1 2.74Å; R745-E749 IonicContact NH1-OE1 3.25Å; R745-E749 PolarHBondContact NH1-OE1 3.06Å; R745-E749 IonicContact NH2-OE1 3.88Å; R745-E749 PolarHBondContact NH2-OE1 2.94Å; R745-E749 WeakPolarHBondContact O-CG 3.25Å; R745-E749 PolarHBondContact O-N 2.81Å; R745-E749 VanDerWaalsContact O-N 3.12Å; A746-E749 PolarHBondContact O-N 3.12Å; A747-E749 VanDerWaalsContact C-N 3.33Å; A747-E749 PolarHBondContact O-N 2.94Å; E749-L751 VanDerWaalsContact C-N 3.31Å; E749-L751 PolarHBondContact O-N 3.08Å; E749-S752 PolarHBondContact O-N 3.16Å; E749-S752 PolarHBondContact O-OG 2.79Å; E749-N753 WeakPolarHBondContact O-CA 3.41Å; E749-N753 WeakPolarHBondContact O-CB 3.32Å; E749-N753 PolarHBondContact O-N 3.49Å; E749-N753 PolarHBondContact OE2-ND2 3Å; E749-F759 HydrophobicContact CB-CE2 4Å; E749-F759 HydrophobicContact CB-CZ 3.92Å; E749-T761 WeakPolarHBondContact OE2-CB 3.46Å; E749-T761 PolarHBondContact OE2-OG1 3.36Å; E749-L772 HydrophobicContact CG-CD1 4.33Å; E749-L772 HydrophobicContact CG-CD2 4.36Å
750	V	92.7	Very high	89.4	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.03	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-35.2	178.6	168.5	0	0	0	0	111.5	V732 T736 A746 A747 E748 M754 F759 L776 L779 M780	V732-V750 HydrophobicContact CG1-CG1 3.52Å; T736-V750 HydrophobicContact CG2-CB 4.09Å; T736-V750 HydrophobicContact CG2-CG1 4.14Å; T736-V750 VanDerWaalsContact OG1-CG1 3.28Å; T736-V750 WeakPolarHBondContact OG1-CG1 3.39Å; A746-V750 VanDerWaalsContact O-CG2 3.29Å; A746-V750 WeakPolarHBondContact O-CG2 3.44Å; A746-V750 PolarHBondContact O-N 2.78Å; A747-V750 PolarHBondContact O-N 3.26Å; E748-V750 PolarHBondContact O-N 2.92Å; V750-M754 HydrophobicContact CG1-SD 4.18Å; V750-M754 VanDerWaalsContact O-CB 3.26Å; V750-M754 WeakPolarHBondContact O-CB 3.32Å; V750-F759 HydrophobicContact CG2-CD2 4.28Å; V750-F759 HydrophobicContact CG2-CE2 4.06Å; V750-L776 HydrophobicContact CG2-CD2 3.53Å; V750-L779 HydrophobicContact CG2-CD2 4.35Å; V750-M780 HydrophobicContact CG1-SD 4.3Å; V750-M780 HydrophobicContact CG2-SD 4.16Å
751	L	91.1	Very high	89.3	Confident	55 Å²	55	68.8 Å²	68.8	29%	0.288	34%	0.343	S	S	.	.	H	α-helix	trans	-73.4	-32.4	179.1	-70.1	172.5	0	0	0	112.7	Q733 T736 R737 I740 A747 E748 E749	Q733-L751 HydrophobicContact CB-CD2 4.16Å; Q733-L751 HydrophobicContact CG-CD2 4.11Å; T736-L751 HydrophobicContact CG2-CD1 4.1Å; T736-L751 HydrophobicContact CG2-CD2 4.05Å; T736-L751 HydrophobicContact CG2-CG 3.66Å; R737-L751 HydrophobicContact CG-CD1 4.23Å; R737-L751 HydrophobicContact CG-CD2 4.23Å; I740-L751 HydrophobicContact CD1-CD1 4.29Å; A747-L751 WeakPolarHBondContact O-CB 3.48Å; A747-L751 VanDerWaalsContact O-CG 3.26Å; A747-L751 WeakPolarHBondContact O-CG 3.45Å; A747-L751 PolarHBondContact O-N 2.83Å; E748-L751 PolarHBondContact O-N 3.37Å; E749-L751 VanDerWaalsContact C-N 3.31Å; E749-L751 PolarHBondContact O-N 3.08Å
752	S	87.3	Confident	89.2	Confident	77 Å²	77	63.4 Å²	63.4	54%	0.538	33%	0.326	S	S	.	.	H	α-helix	trans	-90.1	-36.9	-179.7	54.5	0	0	0	0	113.5	E748 E749	E748-S752 PolarHBondContact O-N 2.72Å; E748-S752 PolarHBondContact O-OG 3.09Å; E749-S752 PolarHBondContact O-N 3.16Å; E749-S752 PolarHBondContact O-OG 2.79Å
753	N	89.8	Confident	88.7	Confident	64 Å²	64	61 Å²	61	34%	0.342	31%	0.312	S	S	.	.	H	α-helix	trans	-124.3	19.1	-160.7	-53.7	-45.8	0	0	0	115	E749 L760	E749-N753 WeakPolarHBondContact O-CA 3.41Å; E749-N753 WeakPolarHBondContact O-CB 3.32Å; E749-N753 PolarHBondContact O-N 3.49Å; E749-N753 PolarHBondContact OE2-ND2 3Å; N753-L760 WeakPolarHBondContact CB-O 3.35Å; N753-L760 PolarHBondContact O-N 3.4Å; N753-L760 VanDerWaalsContact O-N 3.14Å
754	M	87.2	Confident	88	Confident	36 Å²	36	65 Å²	65	18%	0.177	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.1	168.6	-167.1	158.3	-177.9	0	0	111.5	I729 V732 V750 F759 M780	I729-M754 HydrophobicContact CD1-CB 4.39Å; I729-M754 HydrophobicContact CD1-CG 4.01Å; I729-M754 HydrophobicContact CD1-SD 4.4Å; V732-M754 HydrophobicContact CB-SD 4.38Å; V732-M754 HydrophobicContact CG1-CE 4.41Å; V732-M754 HydrophobicContact CG1-SD 3.6Å; V732-M754 HydrophobicContact CG2-CE 4.17Å; V732-M754 HydrophobicContact CG2-SD 4.41Å; V750-M754 HydrophobicContact CG1-SD 4.18Å; V750-M754 VanDerWaalsContact O-CB 3.26Å; V750-M754 WeakPolarHBondContact O-CB 3.32Å; M754-F759 HydrophobicContact CB-CD2 4.46Å; M754-M780 HydrophobicContact CE-CE 4.3Å; M754-M780 HydrophobicContact SD-CE 4.37Å
755	Y	82.5	Confident	87.5	Confident	149 Å²	149	62.6 Å²	62.6	58%	0.584	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	101.8	176.9	-175.7	-97	0	0	0	110.6	D757 D758 L818	Y755-D757 PolarHBondContact O-N 3Å; Y755-D758 PolarHBondContact N-O 2.87Å; Y755-D758 PolarHBondContact O-N 3.21Å; Y755-L818 HydrophobicContact CD1-CD2 3.53Å; Y755-L818 HydrophobicContact CE1-CD2 4.26Å; Y755-L818 HydrophobicContact CG-CD2 4.03Å
756	V	82	Confident	87.1	Confident	67 Å²	67	60 Å²	60	41%	0.406	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	-99.1	-176	-170.3	0	0	0	0	111.1	P725	P725-V756 HydrophobicContact CB-CG1 4.37Å
757	D	79.3	Confident	86.7	Confident	116 Å²	116	65.8 Å²	65.8	62%	0.62	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-7.3	179.1	57.8	-38.1	0	0	0	113.8	Y755	Y755-D757 PolarHBondContact O-N 3Å
758	D	85.6	Confident	86.3	Confident	75 Å²	75	70.5 Å²	70.5	40%	0.401	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.4	178.1	-70.8	-35	0	0	0	110.9	Y755 L760 L818	Y755-D758 PolarHBondContact N-O 2.87Å; Y755-D758 PolarHBondContact O-N 3.21Å; D758-L760 HydrophobicContact CB-CD1 3.87Å; D758-L818 HydrophobicContact CB-CD2 4.14Å
759	F	89.4	Confident	86.2	Confident	37 Å²	37	67.2 Å²	67.2	16%	0.162	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.3	171.1	171.7	-98.2	0	0	0	109.4	E749 V750 M754 T761 L776	E749-F759 HydrophobicContact CB-CE2 4Å; E749-F759 HydrophobicContact CB-CZ 3.92Å; V750-F759 HydrophobicContact CG2-CD2 4.28Å; V750-F759 HydrophobicContact CG2-CE2 4.06Å; M754-F759 HydrophobicContact CB-CD2 4.46Å; F759-T761 HydrophobicContact CE1-CG2 3.47Å; F759-T761 VanDerWaalsContact CE1-CG2 3.47Å; F759-T761 HydrophobicContact CZ-CG2 3.67Å; F759-L776 HydrophobicContact CD1-CD1 4.31Å; F759-L776 HydrophobicContact CE1-CD1 3.36Å; F759-L776 HydrophobicContact CE1-CD2 4Å; F759-L776 HydrophobicContact CE1-CG 4.34Å; F759-L776 HydrophobicContact CE2-CD2 4.07Å; F759-L776 HydrophobicContact CZ-CD1 3.64Å; F759-L776 HydrophobicContact CZ-CD2 3.64Å; F759-L776 HydrophobicContact CZ-CG 4.31Å
760	L	89.4	Confident	85.8	Confident	50 Å²	50	69.9 Å²	69.9	26%	0.262	39%	0.385	S	S	.	.			trans	-131.8	132.7	-178.4	-65.3	92.2	0	0	0	109	N753 D758 V817 L818	N753-L760 WeakPolarHBondContact CB-O 3.35Å; N753-L760 PolarHBondContact O-N 3.4Å; N753-L760 VanDerWaalsContact O-N 3.14Å; D758-L760 HydrophobicContact CB-CD1 3.87Å; L760-V817 HydrophobicContact CD2-CB 4.49Å; L760-V817 HydrophobicContact CD2-CG2 3.05Å; L760-V817 HydrophobicContact CG-CG2 4.22Å; L760-L818 HydrophobicContact CD1-CD1 4.24Å; L760-L818 HydrophobicContact CD1-CD2 3.8Å; L760-L818 HydrophobicContact CD1-CG 3.98Å; L760-L818 HydrophobicContact CD2-CD1 4.06Å; L760-L818 HydrophobicContact CD2-CG 3.9Å
761	T	89.4	Confident	85.6	Confident	53 Å²	53	72.8 Å²	72.8	33%	0.325	40%	0.404	S	S	.	.			trans	-148.4	173.9	175.6	-173.4	0	0	0	0	110	E749 F759 L772	E749-T761 WeakPolarHBondContact OE2-CB 3.46Å; E749-T761 PolarHBondContact OE2-OG1 3.36Å; F759-T761 HydrophobicContact CE1-CG2 3.47Å; F759-T761 VanDerWaalsContact CE1-CG2 3.47Å; F759-T761 HydrophobicContact CZ-CG2 3.67Å; T761-L772 HydrophobicContact CG2-CD2 4.19Å
762	S	86.8	Confident	85.7	Confident	73 Å²	73	70.5 Å²	70.5	51%	0.51	39%	0.391	S	S	.	.			trans	-141.5	140.4	175.4	55	0	0	0	0	110.2
763	C	83.5	Confident	85.9	Confident	45 Å²	45	67.5 Å²	67.5	30%	0.304	37%	0.37	S	S	.	.			trans	-111.2	150	168.7	-56.8	0	0	0	0	109.3	D765 E768 A769	C763-D765 WeakPolarHBondContact CB-O 3.4Å; C763-E768 HydrophobicContact CB-CB 4.3Å; C763-A769 HydrophobicContact CB-CB 4.37Å
764	T	78.8	Confident	85.9	Confident	132 Å²	132	68 Å²	68	81%	0.81	37%	0.372	S	S	*	.	S	Bend	trans	-76.8	-29.6	172.5	40.9	0	0	0	0	111.9
765	D	79.9	Confident	86.2	Confident	85 Å²	85	69.1 Å²	69.1	46%	0.455	38%	0.377	S	S	.	.	S	Bend	trans	-125.7	145.3	179.4	-158.8	-40.4	0	0	0	111	C763 D767 E768	C763-D765 WeakPolarHBondContact CB-O 3.4Å; D765-D767 PolarHBondContact O-N 3.07Å; D765-D767 PolarHBondContact OD1-N 2.96Å; D765-E768 HydrophobicContact CB-CG 4.32Å; D765-E768 PolarHBondContact O-N 3.15Å
766	S	82.7	Confident	86.8	Confident	41 Å²	41	62 Å²	62	29%	0.287	35%	0.35	S	S	.	.	H	α-helix	trans	-59.8	-34.9	171.1	-70.8	0	0	0	0	111.7	E768 A769 S794	S766-E768 PolarHBondContact O-N 2.93Å; S766-A769 WeakPolarHBondContact O-CB 3.36Å; S766-A769 PolarHBondContact O-N 3.13Å; S766-S794 PolarHBondContact OG-OG 3.18Å; S766-S794 VanDerWaalsContact OG-OG 3.12Å
767	D	83.8	Confident	87.3	Confident	123 Å²	123	63.3 Å²	63.3	66%	0.658	35%	0.347	S	S	*	.	H	α-helix	trans	-67.1	-25.4	-177.2	-70.5	-9.2	0	0	0	112.3	D765 P771	D765-D767 PolarHBondContact O-N 3.07Å; D765-D767 PolarHBondContact OD1-N 2.96Å; D767-P771 WeakPolarHBondContact O-CD 3.41Å
768	E	86.4	Confident	87.9	Confident	98 Å²	98	62.1 Å²	62.1	46%	0.458	34%	0.337	S	S	.	.	H	α-helix	trans	-81.2	-22.4	174.5	-66.3	-175.4	174.8	0	0	113	C763 D765 S766 P771 L772	C763-E768 HydrophobicContact CB-CB 4.3Å; D765-E768 HydrophobicContact CB-CG 4.32Å; D765-E768 PolarHBondContact O-N 3.15Å; S766-E768 PolarHBondContact O-N 2.93Å; E768-P771 WeakPolarHBondContact O-CD 3.18Å; E768-L772 WeakPolarHBondContact O-CB 3.49Å; E768-L772 PolarHBondContact O-N 3.1Å
769	A	88.9	Confident	88.3	Confident	15 Å²	15	58.7 Å²	58.7	12%	0.124	32%	0.318	C	S	.	.	H	α-helix	trans	-70.1	-41.8	-174.2	0	0	0	0	0	112	C763 S766 L772 V773 V797	C763-A769 HydrophobicContact CB-CB 4.37Å; S766-A769 WeakPolarHBondContact O-CB 3.36Å; S766-A769 PolarHBondContact O-N 3.13Å; A769-L772 PolarHBondContact O-N 3.02Å; A769-V773 VanDerWaalsContact O-CG2 3.27Å; A769-V773 WeakPolarHBondContact O-CG2 3.42Å; A769-V773 PolarHBondContact O-N 3.36Å; A769-V797 HydrophobicContact CB-CG1 3.85Å; A769-V797 HydrophobicContact CB-CG2 3.88Å
770	E	85.1	Confident	88.4	Confident	72 Å²	72	57.1 Å²	57.1	34%	0.336	31%	0.311	S	S	.	.	H	α-helix	trans	-65.4	-49.5	-177.1	-48.6	179.1	164	0	0	112.6	L772 V773 D774 T800	E770-L772 VanDerWaalsContact C-N 3.26Å; E770-L772 PolarHBondContact O-N 2.76Å; E770-V773 PolarHBondContact O-N 2.87Å; E770-D774 PolarHBondContact O-N 2.91Å; E770-T800 HydrophobicContact CG-CG2 4.07Å; E770-T800 WeakPolarHBondContact OE1-CB 3.25Å; E770-T800 WeakPolarHBondContact OE1-CG2 3.33Å; E770-T800 PolarHBondContact OE1-OG1 3.41Å
771	P	89.8	Confident	88.5	Confident	66 Å²	66	61.5 Å²	61.5	43%	0.429	33%	0.331	S	S	.	.	H	α-helix	trans	-60.4	-36.9	175.3	-22.7	34.6	0	0	0	112.3	D767 E768 D774 Q775	D767-P771 WeakPolarHBondContact O-CD 3.41Å; E768-P771 WeakPolarHBondContact O-CD 3.18Å; P771-D774 PolarHBondContact O-N 2.87Å; P771-Q775 WeakPolarHBondContact O-CB 3.47Å; P771-Q775 VanDerWaalsContact O-CG 3.32Å; P771-Q775 WeakPolarHBondContact O-CG 3.2Å; P771-Q775 PolarHBondContact O-N 3.13Å
772	L	92.5	Very high	88.2	Confident	6 Å²	6	61.8 Å²	61.8	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-65.2	-45.7	177.1	179.1	56.8	0	0	0	111.6	R745 A746 E749 T761 E768 A769 E770 D774 Q775 L776	R745-L772 HydrophobicContact CG-CD1 3.85Å; A746-L772 HydrophobicContact CB-CD1 4.07Å; E749-L772 HydrophobicContact CG-CD1 4.33Å; E749-L772 HydrophobicContact CG-CD2 4.36Å; T761-L772 HydrophobicContact CG2-CD2 4.19Å; E768-L772 WeakPolarHBondContact O-CB 3.49Å; E768-L772 PolarHBondContact O-N 3.1Å; A769-L772 PolarHBondContact O-N 3.02Å; E770-L772 VanDerWaalsContact C-N 3.26Å; E770-L772 PolarHBondContact O-N 2.76Å; L772-D774 VanDerWaalsContact C-N 3.33Å; L772-D774 PolarHBondContact O-N 3.37Å; L772-Q775 PolarHBondContact O-N 2.93Å; L772-L776 HydrophobicContact CD1-CD1 4.09Å; L772-L776 HydrophobicContact CD1-CG 4.1Å; L772-L776 HydrophobicContact CG-CD1 3.85Å; L772-L776 HydrophobicContact CG-CG 4.36Å; L772-L776 WeakPolarHBondContact O-CB 3.4Å; L772-L776 VanDerWaalsContact O-CG 3.23Å; L772-L776 WeakPolarHBondContact O-CG 3.38Å; L772-L776 PolarHBondContact O-N 2.9Å
773	V	91.3	Very high	87.9	Confident	15 Å²	15	58.6 Å²	58.6	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-42	177.7	170.9	0	0	0	0	111.2	A769 E770 L776 R777 W790 I801	A769-V773 VanDerWaalsContact O-CG2 3.27Å; A769-V773 WeakPolarHBondContact O-CG2 3.42Å; A769-V773 PolarHBondContact O-N 3.36Å; E770-V773 PolarHBondContact O-N 2.87Å; V773-L776 PolarHBondContact O-N 3.13Å; V773-R777 WeakPolarHBondContact O-CG 3.37Å; V773-R777 PolarHBondContact O-N 3.46Å; V773-W790 HydrophobicContact CB-CH2 4.45Å; V773-W790 HydrophobicContact CB-CZ3 4.46Å; V773-W790 HydrophobicContact CG1-CE3 4.43Å; V773-W790 HydrophobicContact CG1-CH2 3.98Å; V773-W790 HydrophobicContact CG1-CZ2 4.15Å; V773-W790 HydrophobicContact CG1-CZ3 4.14Å; V773-W790 HydrophobicContact CG2-CE3 4.3Å; V773-W790 HydrophobicContact CG2-CH2 4.24Å; V773-W790 HydrophobicContact CG2-CZ3 3.79Å; V773-I801 HydrophobicContact CB-CG2 4.11Å; V773-I801 HydrophobicContact CG1-CB 4.34Å; V773-I801 HydrophobicContact CG1-CG2 3.79Å; V773-I801 HydrophobicContact CG2-CG2 4.21Å
774	D	90.1	Very high	87.9	Confident	73 Å²	73	58.7 Å²	58.7	39%	0.39	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-46.8	175.6	178.9	60.9	0	0	0	111.9	E770 P771 L772 L776 R777 K778	E770-D774 PolarHBondContact O-N 2.91Å; P771-D774 PolarHBondContact O-N 2.87Å; L772-D774 VanDerWaalsContact C-N 3.33Å; L772-D774 PolarHBondContact O-N 3.37Å; D774-L776 PolarHBondContact O-N 2.94Å; D774-R777 PolarHBondContact O-N 3.15Å; D774-K778 WeakPolarHBondContact O-CG 3.26Å; D774-K778 PolarHBondContact O-N 3.17Å; D774-K778 WeakPolarHBondContact OD1-CE 3.37Å; D774-K778 IonicContact OD1-NZ 2.73Å; D774-K778 PolarHBondContact OD1-NZ 2.86Å; D774-K778 VanDerWaalsContact OD2-CE 3.31Å; D774-K778 WeakPolarHBondContact OD2-CE 3.17Å; D774-K778 IonicContact OD2-NZ 2.9Å; D774-K778 PolarHBondContact OD2-NZ 2.82Å
775	Q	93.4	Very high	88.3	Confident	60 Å²	60	55.5 Å²	55.5	28%	0.28	29%	0.292	S	S	.	.	H	α-helix	trans	-61.2	-41.9	175	-72.3	-176.3	25	0	0	112.2	Y743 A746 P771 L772 K778 L779	Y743-Q775 HydrophobicContact CD1-CB 4.12Å; Y743-Q775 HydrophobicContact CD1-CG 4.13Å; A746-Q775 HydrophobicContact CB-CB 3.65Å; P771-Q775 WeakPolarHBondContact O-CB 3.47Å; P771-Q775 VanDerWaalsContact O-CG 3.32Å; P771-Q775 WeakPolarHBondContact O-CG 3.2Å; P771-Q775 PolarHBondContact O-N 3.13Å; L772-Q775 PolarHBondContact O-N 2.93Å; Q775-K778 PolarHBondContact O-N 3.14Å; Q775-L779 WeakPolarHBondContact O-CB 3.2Å; Q775-L779 PolarHBondContact O-N 3.26Å
776	L	94.2	Very high	88.5	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-62.2	-46.3	177.2	-76.1	165.3	0	0	0	111.6	A746 V750 F759 L772 V773 D774 K778 L779 M780 L787 W790	A746-L776 HydrophobicContact CB-CD2 3.87Å; A746-L776 HydrophobicContact CB-CG 3.92Å; V750-L776 HydrophobicContact CG2-CD2 3.53Å; F759-L776 HydrophobicContact CD1-CD1 4.31Å; F759-L776 HydrophobicContact CE1-CD1 3.36Å; F759-L776 HydrophobicContact CE1-CD2 4Å; F759-L776 HydrophobicContact CE1-CG 4.34Å; F759-L776 HydrophobicContact CE2-CD2 4.07Å; F759-L776 HydrophobicContact CZ-CD1 3.64Å; F759-L776 HydrophobicContact CZ-CD2 3.64Å; F759-L776 HydrophobicContact CZ-CG 4.31Å; L772-L776 HydrophobicContact CD1-CD1 4.09Å; L772-L776 HydrophobicContact CD1-CG 4.1Å; L772-L776 HydrophobicContact CG-CD1 3.85Å; L772-L776 HydrophobicContact CG-CG 4.36Å; L772-L776 WeakPolarHBondContact O-CB 3.4Å; L772-L776 VanDerWaalsContact O-CG 3.23Å; L772-L776 WeakPolarHBondContact O-CG 3.38Å; L772-L776 PolarHBondContact O-N 2.9Å; V773-L776 PolarHBondContact O-N 3.13Å; D774-L776 PolarHBondContact O-N 2.94Å; L776-K778 PolarHBondContact O-N 3.21Å; L776-L779 PolarHBondContact O-N 3.39Å; L776-M780 VanDerWaalsContact O-CB 3.31Å; L776-M780 WeakPolarHBondContact O-CB 3.27Å; L776-M780 WeakPolarHBondContact O-CG 3.46Å; L776-M780 PolarHBondContact O-N 2.76Å; L776-L787 HydrophobicContact CB-CD1 4.08Å; L776-W790 HydrophobicContact CB-CH2 4.14Å; L776-W790 HydrophobicContact CD1-CH2 4.02Å; L776-W790 HydrophobicContact CD1-CZ3 4.42Å
777	R	92.3	Very high	88.8	Confident	94 Å²	94	57.5 Å²	57.5	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-58.1	-49.3	176.3	-76.5	176.7	176	175.1	-0.4	110.7	V773 D774 Q781 W790 I801	V773-R777 WeakPolarHBondContact O-CG 3.37Å; V773-R777 PolarHBondContact O-N 3.46Å; D774-R777 PolarHBondContact O-N 3.15Å; R777-Q781 WeakPolarHBondContact O-CB 3.38Å; R777-Q781 PolarHBondContact O-N 3.37Å; R777-W790 HydrophobicContact CG-CZ2 4.06Å; R777-I801 PolarHBondContact NH2-O 3.37Å
778	K	93.1	Very high	88.8	Confident	91 Å²	91	56.1 Å²	56.1	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-62.6	-48.9	179.4	-72.1	170.7	179.1	167	0	112	Y743 D774 Q775 L776 M780 Q781 L782	Y743-K778 HydrophobicContact CE1-CB 3.8Å; Y743-K778 HydrophobicContact CE1-CD 4.26Å; D774-K778 WeakPolarHBondContact O-CG 3.26Å; D774-K778 PolarHBondContact O-N 3.17Å; D774-K778 WeakPolarHBondContact OD1-CE 3.37Å; D774-K778 IonicContact OD1-NZ 2.73Å; D774-K778 PolarHBondContact OD1-NZ 2.86Å; D774-K778 VanDerWaalsContact OD2-CE 3.31Å; D774-K778 WeakPolarHBondContact OD2-CE 3.17Å; D774-K778 IonicContact OD2-NZ 2.9Å; D774-K778 PolarHBondContact OD2-NZ 2.82Å; Q775-K778 PolarHBondContact O-N 3.14Å; L776-K778 PolarHBondContact O-N 3.21Å; K778-M780 PolarHBondContact O-N 2.82Å; K778-Q781 PolarHBondContact O-N 3.49Å; K778-L782 WeakPolarHBondContact O-CG 3.27Å; K778-L782 PolarHBondContact O-N 3.37Å
779	L	93.8	Very high	88.7	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-59.1	-48.2	179.3	176.6	61.8	0	0	0	111.8	T736 H739 Y743 A746 A747 V750 Q775 L776 L782	T736-L779 HydrophobicContact CG2-CD2 4.19Å; H739-L779 HydrophobicContact CB-CD1 3.7Å; Y743-L779 HydrophobicContact CD2-CB 4.15Å; Y743-L779 HydrophobicContact CD2-CD1 3.89Å; Y743-L779 HydrophobicContact CG-CB 4.18Å; Y743-L779 HydrophobicContact CG-CD1 4.46Å; A746-L779 HydrophobicContact CB-CD2 4.09Å; A747-L779 HydrophobicContact CB-CD2 4.1Å; V750-L779 HydrophobicContact CG2-CD2 4.35Å; Q775-L779 WeakPolarHBondContact O-CB 3.2Å; Q775-L779 PolarHBondContact O-N 3.26Å; L776-L779 PolarHBondContact O-N 3.39Å; L779-L782 WeakPolarHBondContact O-CB 3.31Å; L779-L782 PolarHBondContact O-N 2.76Å
780	M	92.4	Very high	88.6	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.025	31%	0.314	C	S	.	.	H	α-helix	trans	-70.7	-34.5	-178.4	-65.7	-57.4	-66.5	0	0	112	V732 V750 M754 L776 K778 L782 G783 G784 F785 L787	V732-M780 HydrophobicContact CG1-CE 3.82Å; V732-M780 HydrophobicContact CG1-SD 4.07Å; V732-M780 HydrophobicContact CG2-CE 3.91Å; V750-M780 HydrophobicContact CG1-SD 4.3Å; V750-M780 HydrophobicContact CG2-SD 4.16Å; M754-M780 HydrophobicContact CE-CE 4.3Å; M754-M780 HydrophobicContact SD-CE 4.37Å; L776-M780 VanDerWaalsContact O-CB 3.31Å; L776-M780 WeakPolarHBondContact O-CB 3.27Å; L776-M780 WeakPolarHBondContact O-CG 3.46Å; L776-M780 PolarHBondContact O-N 2.76Å; K778-M780 PolarHBondContact O-N 2.82Å; M780-L782 VanDerWaalsContact C-N 3.27Å; M780-L782 PolarHBondContact O-N 3.33Å; M780-G783 WeakPolarHBondContact O-CA 3.47Å; M780-G783 PolarHBondContact O-N 3.2Å; M780-G784 PolarHBondContact O-N 3.19Å; M780-F785 CarbonylContact C-O 3.58Å; M780-F785 HydrophobicContact CB-CB 4.15Å; M780-F785 WeakPolarHBondContact CB-O 3.41Å; M780-F785 HydrophobicContact CE-CB 3.77Å; M780-F785 HydrophobicContact CE-CD2 4.04Å; M780-F785 HydrophobicContact CE-CG 4Å; M780-F785 PolarHBondContact O-N 3.41Å; M780-L787 HydrophobicContact CB-CD1 4.3Å; M780-L787 HydrophobicContact CB-CG 4.1Å; M780-L787 HydrophobicContact CE-CD2 4.48Å; M780-L787 HydrophobicContact CG-CD1 3.73Å; M780-L787 HydrophobicContact CG-CD2 4.32Å; M780-L787 HydrophobicContact CG-CG 3.9Å
781	Q	89.5	Confident	88.6	Confident	142 Å²	142	62.6 Å²	62.6	66%	0.664	32%	0.317	S	S	*	.	H	α-helix	trans	-63.3	-31.7	175.8	-172.4	171.7	18	0	0	112.5	R777 K778 G783 G784 F785	R777-Q781 WeakPolarHBondContact O-CB 3.38Å; R777-Q781 PolarHBondContact O-N 3.37Å; K778-Q781 PolarHBondContact O-N 3.49Å; Q781-G783 PolarHBondContact O-N 3.37Å; Q781-G784 PolarHBondContact O-N 3.25Å; Q781-F785 PolarHBondContact N-O 2.88Å
782	L	84.9	Confident	88.4	Confident	59 Å²	59	60.4 Å²	60.4	31%	0.309	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.7	171.9	-66.9	171.9	0	0	0	113	F654 Y743 K778 L779 M780	F654-L782 WeakPolarHBondContact CE2-O 3.36Å; F654-L782 WeakPolarHBondContact CZ-O 3.46Å; Y743-L782 HydrophobicContact CD2-CD1 4.44Å; Y743-L782 HydrophobicContact CE2-CD1 3.63Å; K778-L782 WeakPolarHBondContact O-CG 3.27Å; K778-L782 PolarHBondContact O-N 3.37Å; L779-L782 WeakPolarHBondContact O-CB 3.31Å; L779-L782 PolarHBondContact O-N 2.76Å; M780-L782 VanDerWaalsContact C-N 3.27Å; M780-L782 PolarHBondContact O-N 3.33Å
783	G	80.4	Confident	88	Confident	5 Å²	5	63.5 Å²	63.5	5%	0.052	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.6	171.8	0	0	0	0	0	114.4	C659 M780 Q781	C659-G783 PolarHBondContact SG-O 3.46Å; C659-G783 VanDerWaalsContact SG-O 3.42Å; M780-G783 WeakPolarHBondContact O-CA 3.47Å; M780-G783 PolarHBondContact O-N 3.2Å; Q781-G783 PolarHBondContact O-N 3.37Å
784	G	82.9	Confident	87.6	Confident	48 Å²	48	64 Å²	64	50%	0.495	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	15.3	-168.6	0	0	0	0	0	113.8	M780 Q781	M780-G784 PolarHBondContact O-N 3.19Å; Q781-G784 PolarHBondContact O-N 3.25Å
785	F	86.5	Confident	87	Confident	65 Å²	65	63.8 Å²	63.8	29%	0.285	33%	0.328	S	S	.	.			trans	-95.5	120.6	178.1	-57.8	-78.5	0	0	0	110.3	V731 V732 M780 Q781	V731-F785 HydrophobicContact CB-CZ 4.2Å; V731-F785 HydrophobicContact CG1-CE2 3.79Å; V731-F785 HydrophobicContact CG1-CZ 3.68Å; V732-F785 HydrophobicContact CG2-CD1 4.45Å; V732-F785 HydrophobicContact CG2-CD2 4.03Å; V732-F785 HydrophobicContact CG2-CE1 4.09Å; V732-F785 HydrophobicContact CG2-CE2 3.63Å; V732-F785 HydrophobicContact CG2-CG 4.43Å; V732-F785 HydrophobicContact CG2-CZ 3.66Å; M780-F785 CarbonylContact C-O 3.58Å; M780-F785 HydrophobicContact CB-CB 4.15Å; M780-F785 WeakPolarHBondContact CB-O 3.41Å; M780-F785 HydrophobicContact CE-CB 3.77Å; M780-F785 HydrophobicContact CE-CD2 4.04Å; M780-F785 HydrophobicContact CE-CG 4Å; M780-F785 PolarHBondContact O-N 3.41Å; Q781-F785 PolarHBondContact N-O 2.88Å
786	N	85.1	Confident	86.5	Confident	137 Å²	137	63.6 Å²	63.6	73%	0.733	33%	0.333	S	S	*	.			trans	-97.5	108.1	174.1	-168.7	8.6	0	0	0	109.6	T788	N786-T788 PolarHBondContact O-N 3.14Å
787	L	87.7	Confident	86	Confident	31 Å²	31	63.8 Å²	63.8	16%	0.162	33%	0.334	C	S	.	.			trans	-68.7	121.7	175	-70	179	0	0	0	109.6	L776 M780 W790	L776-L787 HydrophobicContact CB-CD1 4.08Å; M780-L787 HydrophobicContact CB-CD1 4.3Å; M780-L787 HydrophobicContact CB-CG 4.1Å; M780-L787 HydrophobicContact CE-CD2 4.48Å; M780-L787 HydrophobicContact CG-CD1 3.73Å; M780-L787 HydrophobicContact CG-CD2 4.32Å; M780-L787 HydrophobicContact CG-CG 3.9Å; L787-W790 HydrophobicContact CB-CZ2 3.54Å; L787-W790 HydrophobicContact CD1-CH2 3.75Å; L787-W790 HydrophobicContact CD1-CZ2 3.49Å; L787-W790 VanDerWaalsContact CD1-CZ2 3.49Å; L787-W790 HydrophobicContact CG-CZ2 4.18Å; L787-W790 PolarHBondContact O-NE1 3.35Å
788	T	85.2	Confident	85.6	Confident	93 Å²	93	59.4 Å²	59.4	57%	0.571	32%	0.318	S	S	*	.			trans	-129.4	172.1	-177.2	58.7	0	0	0	0	110.5	N786 W790	N786-T788 PolarHBondContact O-N 3.14Å; T788-W790 VanDerWaalsContact C-N 3.29Å; T788-W790 PolarHBondContact O-N 2.81Å
789	K	83.9	Confident	85	Confident	185 Å²	185	62.4 Å²	62.4	80%	0.804	33%	0.334	S	S	*	.	S	Bend	trans	59.5	37.6	179.6	-50.8	175.1	-176.5	171.4	0	113.4
790	W	86.5	Confident	84.3	Confident	46 Å²	46	66.3 Å²	66.3	17%	0.174	36%	0.358	C	S	.	.			trans	-56.6	139.6	174.3	-70.1	92.8	0	0	0	111.2	V773 L776 R777 L787 T788 I801 V803	V773-W790 HydrophobicContact CB-CH2 4.45Å; V773-W790 HydrophobicContact CB-CZ3 4.46Å; V773-W790 HydrophobicContact CG1-CE3 4.43Å; V773-W790 HydrophobicContact CG1-CH2 3.98Å; V773-W790 HydrophobicContact CG1-CZ2 4.15Å; V773-W790 HydrophobicContact CG1-CZ3 4.14Å; V773-W790 HydrophobicContact CG2-CE3 4.3Å; V773-W790 HydrophobicContact CG2-CH2 4.24Å; V773-W790 HydrophobicContact CG2-CZ3 3.79Å; L776-W790 HydrophobicContact CB-CH2 4.14Å; L776-W790 HydrophobicContact CD1-CH2 4.02Å; L776-W790 HydrophobicContact CD1-CZ3 4.42Å; R777-W790 HydrophobicContact CG-CZ2 4.06Å; L787-W790 HydrophobicContact CB-CZ2 3.54Å; L787-W790 HydrophobicContact CD1-CH2 3.75Å; L787-W790 HydrophobicContact CD1-CZ2 3.49Å; L787-W790 VanDerWaalsContact CD1-CZ2 3.49Å; L787-W790 HydrophobicContact CG-CZ2 4.18Å; L787-W790 PolarHBondContact O-NE1 3.35Å; T788-W790 VanDerWaalsContact C-N 3.29Å; T788-W790 PolarHBondContact O-N 2.81Å; W790-I801 HydrophobicContact CB-CD1 4.27Å; W790-V803 HydrophobicContact CB-CG2 3.6Å; W790-V803 WeakPolarHBondContact O-CG1 3.41Å
791	K	85.2	Confident	83.8	Confident	91 Å²	91	66.8 Å²	66.8	40%	0.396	36%	0.36	S	S	.	.			trans	-144	137.5	179.5	-65.6	163.8	-177.9	-174.5	0	108.3	S815	K791-S815 WeakPolarHBondContact CD-OG 3.37Å; K791-S815 WeakPolarHBondContact CE-OG 3.36Å; K791-S815 PolarHBondContact NZ-OG 3.27Å
792	C	85.6	Confident	83.1	Confident	19 Å²	19	63 Å²	63	13%	0.128	36%	0.359	C	S	.	.			trans	-148.7	159.7	173.8	65.2	0	0	0	0	110.2	S794	C792-S794 PolarHBondContact SG-O 3.29Å
793	N	83.8	Confident	82.3	Confident	72 Å²	72	61.3 Å²	61.3	39%	0.385	35%	0.351	S	S	.	.	S	Bend	trans	-89.8	1.4	178.6	62.3	-35.4	0	0	0	113.3	W822 L824 D827	N793-W822 HydrophobicContact CB-CZ2 3.94Å; N793-L824 VanDerWaalsContact CB-O 3.28Å; N793-L824 WeakPolarHBondContact CB-O 3.29Å; N793-D827 HydrophobicContact CB-CB 4.4Å; N793-D827 PolarHBondContact ND2-OD2 3.17Å
794	S	83.4	Confident	81.1	Confident	24 Å²	24	66.7 Å²	66.7	17%	0.168	38%	0.383	C	S	.	.			trans	-110.6	118.7	-179.3	179	0	0	0	0	109.9	S766 C792 S796 V797 A798	S766-S794 PolarHBondContact OG-OG 3.18Å; S766-S794 VanDerWaalsContact OG-OG 3.12Å; C792-S794 PolarHBondContact SG-O 3.29Å; S794-S796 VanDerWaalsContact C-N 3.34Å; S794-S796 PolarHBondContact O-N 3.25Å; S794-S796 PolarHBondContact OG-OG 3.46Å; S794-S796 VanDerWaalsContact OG-OG 3.1Å; S794-V797 PolarHBondContact O-N 3.03Å; S794-A798 WeakPolarHBondContact O-CB 3.18Å; S794-A798 PolarHBondContact O-N 3.49Å
795	S	77.8	Confident	79.6	Confident	69 Å²	69	70.9 Å²	70.9	48%	0.483	39%	0.394	S	S	.	.	H	α-helix	trans	-62.6	-39.7	179.2	49.4	0	0	0	0	112.2	A798 E799	S795-A798 WeakPolarHBondContact O-CB 3.43Å; S795-A798 PolarHBondContact O-N 2.95Å; S795-E799 WeakPolarHBondContact O-CG 3.37Å; S795-E799 PolarHBondContact O-N 3.46Å
796	S	82.3	Confident	77.9	Confident	56 Å²	56	69.3 Å²	69.3	39%	0.392	39%	0.39	S	S	.	.	H	α-helix	trans	-61.8	-46.9	178.7	61.6	0	0	0	0	111.5	S794 A798 E799 T800	S794-S796 VanDerWaalsContact C-N 3.34Å; S794-S796 PolarHBondContact O-N 3.25Å; S794-S796 PolarHBondContact OG-OG 3.46Å; S794-S796 VanDerWaalsContact OG-OG 3.1Å; S796-A798 VanDerWaalsContact C-N 3.33Å; S796-A798 PolarHBondContact O-N 2.87Å; S796-E799 PolarHBondContact O-N 3.39Å; S796-T800 PolarHBondContact O-N 2.88Å; S796-T800 VanDerWaalsContact O-N 3.15Å; S796-T800 PolarHBondContact O-OG1 3.3Å
797	V	84.4	Confident	75.9	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.03	38%	0.383	C	S	.	.	H	α-helix	trans	-63.9	-41.8	177	-179.5	0	0	0	0	110.2	A769 S794 E799 T800 I801	A769-V797 HydrophobicContact CB-CG1 3.85Å; A769-V797 HydrophobicContact CB-CG2 3.88Å; S794-V797 PolarHBondContact O-N 3.03Å; V797-E799 PolarHBondContact O-N 3.36Å; V797-T800 PolarHBondContact O-N 2.92Å; V797-I801 HydrophobicContact CG1-CD1 4.43Å; V797-I801 HydrophobicContact CG1-CG2 4.17Å; V797-I801 VanDerWaalsContact O-CG1 3.24Å; V797-I801 WeakPolarHBondContact O-CG1 3.04Å; V797-I801 WeakPolarHBondContact O-CG2 3.42Å; V797-I801 PolarHBondContact O-N 3.39Å
798	A	83.1	Confident	73.5	Confident	3 Å²	3	70.2 Å²	70.2	3%	0.025	41%	0.411	C	S	.	.	H	α-helix	trans	-59.1	-43.7	179.1	0	0	0	0	0	112.5	S794 S795 S796 G802 V803 V806	S794-A798 WeakPolarHBondContact O-CB 3.18Å; S794-A798 PolarHBondContact O-N 3.49Å; S795-A798 WeakPolarHBondContact O-CB 3.43Å; S795-A798 PolarHBondContact O-N 2.95Å; S796-A798 VanDerWaalsContact C-N 3.33Å; S796-A798 PolarHBondContact O-N 2.87Å; A798-G802 PolarHBondContact O-N 3.14Å; A798-V803 PolarHBondContact O-N 3.04Å; A798-V806 HydrophobicContact CB-CB 3.9Å; A798-V806 HydrophobicContact CB-CG1 4.4Å; A798-V806 HydrophobicContact CB-CG2 3.71Å
799	E	80.7	Confident	71.2	Confident	154 Å²	154	71 Å²	71	72%	0.72	41%	0.412	S	S	*	.	H	α-helix	trans	-61	-50.1	175.5	-74.4	176.5	-167.2	0	0	111.1	S795 S796 V797 I801 G802	S795-E799 WeakPolarHBondContact O-CG 3.37Å; S795-E799 PolarHBondContact O-N 3.46Å; S796-E799 PolarHBondContact O-N 3.39Å; V797-E799 PolarHBondContact O-N 3.36Å; E799-I801 PolarHBondContact O-N 2.95Å; E799-G802 PolarHBondContact O-N 2.61Å
800	T	78.7	Confident	69.2	Low	84 Å²	84	65.9 Å²	65.9	52%	0.515	39%	0.393	S	S	.	.	H	α-helix	trans	-64.1	-40.6	-177.9	-54.1	0	0	0	0	113	E770 S796 V797 G802	E770-T800 HydrophobicContact CG-CG2 4.07Å; E770-T800 WeakPolarHBondContact OE1-CB 3.25Å; E770-T800 WeakPolarHBondContact OE1-CG2 3.33Å; E770-T800 PolarHBondContact OE1-OG1 3.41Å; S796-T800 PolarHBondContact O-N 2.88Å; S796-T800 VanDerWaalsContact O-N 3.15Å; S796-T800 PolarHBondContact O-OG1 3.3Å; V797-T800 PolarHBondContact O-N 2.92Å; T800-G802 PolarHBondContact O-N 3.32Å
801	I	81.5	Confident	67.5	Low	15 Å²	15	68.9 Å²	68.9	8%	0.077	41%	0.413	C	S	.	.	H	α-helix	trans	-79.4	-5.3	-179.6	70.5	-179.5	0	0	0	113.2	V773 R777 W790 V797 E799 V803	V773-I801 HydrophobicContact CB-CG2 4.11Å; V773-I801 HydrophobicContact CG1-CB 4.34Å; V773-I801 HydrophobicContact CG1-CG2 3.79Å; V773-I801 HydrophobicContact CG2-CG2 4.21Å; R777-I801 PolarHBondContact NH2-O 3.37Å; W790-I801 HydrophobicContact CB-CD1 4.27Å; V797-I801 HydrophobicContact CG1-CD1 4.43Å; V797-I801 HydrophobicContact CG1-CG2 4.17Å; V797-I801 VanDerWaalsContact O-CG1 3.24Å; V797-I801 WeakPolarHBondContact O-CG1 3.04Å; V797-I801 WeakPolarHBondContact O-CG2 3.42Å; V797-I801 PolarHBondContact O-N 3.39Å; E799-I801 PolarHBondContact O-N 2.95Å; I801-V803 HydrophobicContact CD1-CB 4.36Å; I801-V803 HydrophobicContact CD1-CG2 3.72Å; I801-V803 HydrophobicContact CG1-CB 4.15Å; I801-V803 HydrophobicContact CG1-CG2 3.64Å
802	G	74.7	Confident	65.9	Low	61 Å²	61	72.8 Å²	72.8	63%	0.629	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	35.5	178	0	0	0	0	0	114.1	A798 E799 T800	A798-G802 PolarHBondContact O-N 3.14Å; E799-G802 PolarHBondContact O-N 2.61Å; T800-G802 PolarHBondContact O-N 3.32Å
803	V	69.5	Low	64.6	Low	24 Å²	24	74.1 Å²	74.1	15%	0.145	43%	0.43	C	S	.	.			trans	-102.5	102.4	178.1	177	0	0	0	0	109.3	W790 A798 I801 D805 V806	W790-V803 HydrophobicContact CB-CG2 3.6Å; W790-V803 WeakPolarHBondContact O-CG1 3.41Å; A798-V803 PolarHBondContact O-N 3.04Å; I801-V803 HydrophobicContact CD1-CB 4.36Å; I801-V803 HydrophobicContact CD1-CG2 3.72Å; I801-V803 HydrophobicContact CG1-CB 4.15Å; I801-V803 HydrophobicContact CG1-CG2 3.64Å; V803-D805 VanDerWaalsContact C-N 3.32Å; V803-D805 HydrophobicContact CG1-CB 4.29Å; V803-V806 HydrophobicContact CG1-CG2 4.14Å
804	T	53.9	Low	63.6	Low	119 Å²	119	74.5 Å²	74.5	73%	0.73	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-11.5	178.6	51.1	0	0	0	0	114.1	V806	T804-V806 PolarHBondContact O-N 3.25Å
805	D	52.6	Low	63	Low	136 Å²	136	74.2 Å²	74.2	73%	0.727	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	4.6	-179.6	-79.7	-10.2	0	0	0	113.2	V803	V803-D805 VanDerWaalsContact C-N 3.32Å; V803-D805 HydrophobicContact CG1-CB 4.29Å
806	V	50.1	Low	63.1	Low	31 Å²	31	77 Å²	77	19%	0.188	44%	0.437	C	S	.	.	S	Bend	trans	-107.3	61.2	172	-163.7	0	0	0	0	108.7	A798 V803 T804 A808	A798-V806 HydrophobicContact CB-CB 3.9Å; A798-V806 HydrophobicContact CB-CG1 4.4Å; A798-V806 HydrophobicContact CB-CG2 3.71Å; V803-V806 HydrophobicContact CG1-CG2 4.14Å; T804-V806 PolarHBondContact O-N 3.25Å; V806-A808 PolarHBondContact O-N 3.04Å
807	T	42.5	Very low	63	Low	97 Å²	97	75.9 Å²	75.9	60%	0.595	43%	0.427	S	S	*	.			trans	-61.4	121	175.1	48.7	0	0	0	0	109.7	N809	T807-N809 PolarHBondContact O-N 2.82Å
808	A	39.3	Very low	62.9	Low	90 Å²	90	80.1 Å²	80.1	74%	0.744	45%	0.449	S	S	*	.	S	Bend	trans	-60.5	8.2	-166.5	0	0	0	0	0	118	V806	V806-A808 PolarHBondContact O-N 3.04Å
809	N	35.4	Very low	62.7	Low	110 Å²	110	82.8 Å²	82.8	59%	0.588	48%	0.477	S	S	*	.	S	Bend	trans	-124.4	136.4	177.8	-86.8	-2.2	0	0	0	111.1	T807	T807-N809 PolarHBondContact O-N 2.82Å
810	N	43.2	Very low	62.8	Low	78 Å²	78	78.4 Å²	78.4	42%	0.417	46%	0.461	S	S	.	.			trans	93.3	118.5	170.2	-59.2	-41.6	0	0	0	116.4	R812	N810-R812 PolarHBondContact O-N 3.23Å
811	D	49.3	Very low	63.1	Low	109 Å²	109	74.9 Å²	74.9	58%	0.583	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	22	169.6	-69.4	-45.3	0	0	0	116	N823	D811-N823 PolarHBondContact O-ND2 2.87Å
812	R	53	Low	63.3	Low	172 Å²	172	75.4 Å²	75.4	65%	0.649	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.3	9.1	-163.5	-66.2	-172.3	175.9	174.2	1.7	115.4	N810 V814	N810-R812 PolarHBondContact O-N 3.23Å; R812-V814 VanDerWaalsContact C-N 3.28Å; R812-V814 PolarHBondContact O-N 2.88Å
813	I	57.3	Low	63.7	Low	47 Å²	47	73 Å²	73	24%	0.241	41%	0.413	C	S	.	.			trans	-69.7	93.4	171.6	-55.8	-179.4	0	0	0	108.5	S815 L824	I813-S815 PolarHBondContact O-N 3.36Å; I813-L824 HydrophobicContact CG2-CD1 4.04Å; I813-L824 PolarHBondContact O-N 3.26Å
814	V	62.2	Low	64.3	Low	80 Å²	80	72.2 Å²	72.2	49%	0.485	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	103.8	175.4	-179.8	0	0	0	0	108.1	R812 P821	R812-V814 VanDerWaalsContact C-N 3.28Å; R812-V814 PolarHBondContact O-N 2.88Å; V814-P821 HydrophobicContact CG1-CB 3.65Å
815	S	72.2	Confident	65.4	Low	19 Å²	19	69.3 Å²	69.3	13%	0.133	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	179.2	166.8	-141.8	0	0	0	0	111.3	K791 I813 P821 W822	K791-S815 WeakPolarHBondContact CD-OG 3.37Å; K791-S815 WeakPolarHBondContact CE-OG 3.36Å; K791-S815 PolarHBondContact NZ-OG 3.27Å; I813-S815 PolarHBondContact O-N 3.36Å; S815-P821 CarbonylContact O-C 3.59Å; S815-P821 VanDerWaalsContact O-CA 3.24Å; S815-P821 WeakPolarHBondContact O-CA 3.09Å; S815-W822 PolarHBondContact N-O 2.96Å; S815-W822 PolarHBondContact O-N 3.36Å
816	K	78.3	Confident	66.8	Low	128 Å²	128	66.8 Å²	66.8	56%	0.557	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.1	169.4	-66.4	-176.8	-176.3	179.7	0	110.5	V820	K816-V820 CarbonylContact C-O 3.54Å; K816-V820 VanDerWaalsContact CA-O 3.29Å; K816-V820 WeakPolarHBondContact CA-O 3.23Å
817	V	80.9	Confident	68.5	Low	31 Å²	31	66.7 Å²	66.7	19%	0.188	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	112.8	177.8	68.9	0	0	0	0	107.4	L760 G819 V820 W822 L829	L760-V817 HydrophobicContact CD2-CB 4.49Å; L760-V817 HydrophobicContact CD2-CG2 3.05Å; L760-V817 HydrophobicContact CG-CG2 4.22Å; V817-G819 PolarHBondContact O-N 3.02Å; V817-V820 HydrophobicContact CG1-CB 4.43Å; V817-V820 PolarHBondContact N-O 3.08Å; V817-V820 WeakPolarHBondContact O-CB 3.36Å; V817-V820 PolarHBondContact O-N 3.07Å; V817-W822 HydrophobicContact CB-CB 4.37Å; V817-W822 HydrophobicContact CG1-CB 3.84Å; V817-W822 HydrophobicContact CG1-CG 4.48Å; V817-L829 HydrophobicContact CG1-CD2 3.7Å
818	L	81.7	Confident	70.6	Confident	94 Å²	94	62 Å²	62	49%	0.492	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	35.7	-172.6	-58.2	177.5	0	0	0	114.1	Y755 D758 L760 V820	Y755-L818 HydrophobicContact CD1-CD2 3.53Å; Y755-L818 HydrophobicContact CE1-CD2 4.26Å; Y755-L818 HydrophobicContact CG-CD2 4.03Å; D758-L818 HydrophobicContact CB-CD2 4.14Å; L760-L818 HydrophobicContact CD1-CD1 4.24Å; L760-L818 HydrophobicContact CD1-CD2 3.8Å; L760-L818 HydrophobicContact CD1-CG 3.98Å; L760-L818 HydrophobicContact CD2-CD1 4.06Å; L760-L818 HydrophobicContact CD2-CG 3.9Å; L818-V820 VanDerWaalsContact C-N 3.28Å; L818-V820 PolarHBondContact O-N 3.25Å
819	G	80.4	Confident	72.9	Confident	59 Å²	59	60 Å²	60	61%	0.608	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	-11	-177.4	0	0	0	0	0	115.6	V817	V817-G819 PolarHBondContact O-N 3.02Å
820	V	83.2	Confident	75.3	Confident	63 Å²	63	55 Å²	55	38%	0.382	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	132.6	176.1	-175.1	0	0	0	0	110	K816 V817 L818 L829	K816-V820 CarbonylContact C-O 3.54Å; K816-V820 VanDerWaalsContact CA-O 3.29Å; K816-V820 WeakPolarHBondContact CA-O 3.23Å; V817-V820 HydrophobicContact CG1-CB 4.43Å; V817-V820 PolarHBondContact N-O 3.08Å; V817-V820 WeakPolarHBondContact O-CB 3.36Å; V817-V820 PolarHBondContact O-N 3.07Å; L818-V820 VanDerWaalsContact C-N 3.28Å; L818-V820 PolarHBondContact O-N 3.25Å; V820-L829 HydrophobicContact CG1-CB 4.25Å; V820-L829 HydrophobicContact CG1-CD2 4.31Å
821	P	83.9	Confident	77.1	Confident	10 Å²	10	55.5 Å²	55.5	7%	0.065	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	134.1	171.9	-23.8	33.8	0	0	0	112.7	V814 S815 L829 S830 I832	V814-P821 HydrophobicContact CG1-CB 3.65Å; S815-P821 CarbonylContact O-C 3.59Å; S815-P821 VanDerWaalsContact O-CA 3.24Å; S815-P821 WeakPolarHBondContact O-CA 3.09Å; P821-L829 CarbonylContact O-C 3.53Å; P821-L829 WeakPolarHBondContact O-CA 3.26Å; P821-S830 WeakPolarHBondContact CB-O 3.4Å; P821-S830 VanDerWaalsContact CB-OG 3.31Å; P821-S830 WeakPolarHBondContact CB-OG 3.32Å; P821-S830 VanDerWaalsContact CD-O 3.27Å; P821-S830 WeakPolarHBondContact CD-O 3.25Å; P821-S830 WeakPolarHBondContact CG-O 3.35Å; P821-S830 PolarHBondContact O-N 3.11Å; P821-I832 HydrophobicContact CB-CD1 4.43Å; P821-I832 HydrophobicContact CB-CG1 4.28Å; P821-I832 HydrophobicContact CG-CB 4.23Å; P821-I832 HydrophobicContact CG-CD1 3.52Å; P821-I832 HydrophobicContact CG-CG1 3.44Å; P821-I832 VanDerWaalsContact CG-CG1 3.44Å
822	W	85.4	Confident	78.2	Confident	25 Å²	25	54.1 Å²	54.1	10%	0.095	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.6	175.8	179.5	29.6	0	0	0	109.4	N793 S815 V817 L824 D827 L829	N793-W822 HydrophobicContact CB-CZ2 3.94Å; S815-W822 PolarHBondContact N-O 2.96Å; S815-W822 PolarHBondContact O-N 3.36Å; V817-W822 HydrophobicContact CB-CB 4.37Å; V817-W822 HydrophobicContact CG1-CB 3.84Å; V817-W822 HydrophobicContact CG1-CG 4.48Å; W822-L824 HydrophobicContact CD2-CD2 3.62Å; W822-L824 HydrophobicContact CE3-CD2 3.42Å; W822-L824 VanDerWaalsContact CE3-CD2 3.42Å; W822-L824 HydrophobicContact CG-CD2 4.46Å; W822-L824 HydrophobicContact CH2-CD2 3.57Å; W822-L824 HydrophobicContact CZ2-CD2 3.75Å; W822-L824 HydrophobicContact CZ3-CD2 3.39Å; W822-L824 PolarHBondContact O-N 3.3Å; W822-D827 WeakPolarHBondContact CZ2-OD1 3.25Å; W822-D827 PolarHBondContact NE1-OD1 3.35Å; W822-L829 HydrophobicContact CB-CD2 4.16Å; W822-L829 HydrophobicContact CG-CD2 4.34Å
823	N	83.5	Confident	78.8	Confident	10 Å²	10	46.8 Å²	46.8	5%	0.053	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	107.8	169.7	-172.4	-22.7	0	0	0	108.5	D811 G825 Q826 D827 A828	D811-N823 PolarHBondContact O-ND2 2.87Å; N823-G825 PolarHBondContact OD1-N 2.92Å; N823-G825 VanDerWaalsContact OD1-N 3.12Å; N823-Q826 HydrophobicContact CB-CB 4.49Å; N823-Q826 PolarHBondContact ND2-OE1 3.48Å; N823-Q826 PolarHBondContact OD1-N 3.23Å; N823-D827 WeakPolarHBondContact O-CA 3.29Å; N823-D827 PolarHBondContact O-N 3.09Å; N823-D827 VanDerWaalsContact O-N 3.08Å; N823-A828 WeakPolarHBondContact CB-O 3.28Å; N823-A828 PolarHBondContact N-O 3.21Å; N823-A828 PolarHBondContact O-N 3.44Å
824	L	81.2	Confident	78.9	Confident	9 Å²	9	47.5 Å²	47.5	5%	0.047	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-38.4	-178.2	-66.8	174.3	0	0	0	112.2	N793 I813 W822 D827	N793-L824 VanDerWaalsContact CB-O 3.28Å; N793-L824 WeakPolarHBondContact CB-O 3.29Å; I813-L824 HydrophobicContact CG2-CD1 4.04Å; I813-L824 PolarHBondContact O-N 3.26Å; W822-L824 HydrophobicContact CD2-CD2 3.62Å; W822-L824 HydrophobicContact CE3-CD2 3.42Å; W822-L824 VanDerWaalsContact CE3-CD2 3.42Å; W822-L824 HydrophobicContact CG-CD2 4.46Å; W822-L824 HydrophobicContact CH2-CD2 3.57Å; W822-L824 HydrophobicContact CZ2-CD2 3.75Å; W822-L824 HydrophobicContact CZ3-CD2 3.39Å; W822-L824 PolarHBondContact O-N 3.3Å; L824-D827 PolarHBondContact O-N 2.91Å
825	G	77.7	Confident	78.5	Confident	58 Å²	58	51.2 Å²	51.2	60%	0.598	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-35.5	-176	0	0	0	0	0	113.4	N823	N823-G825 PolarHBondContact OD1-N 2.92Å; N823-G825 VanDerWaalsContact OD1-N 3.12Å
826	Q	81.6	Confident	77.4	Confident	82 Å²	82	55.3 Å²	55.3	38%	0.383	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	0.7	179	-64.8	-178.9	-36.8	0	0	113.5	N823 A828	N823-Q826 HydrophobicContact CB-CB 4.49Å; N823-Q826 PolarHBondContact ND2-OE1 3.48Å; N823-Q826 PolarHBondContact OD1-N 3.23Å; Q826-A828 HydrophobicContact CB-CB 4.37Å; Q826-A828 PolarHBondContact O-N 3.18Å
827	D	85.5	Confident	76.1	Confident	29 Å²	29	51.4 Å²	51.4	16%	0.155	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	43.4	44.4	-170.1	-162.5	24.5	0	0	0	114.8	N793 W822 N823 L824 R884	N793-D827 HydrophobicContact CB-CB 4.4Å; N793-D827 PolarHBondContact ND2-OD2 3.17Å; W822-D827 WeakPolarHBondContact CZ2-OD1 3.25Å; W822-D827 PolarHBondContact NE1-OD1 3.35Å; N823-D827 WeakPolarHBondContact O-CA 3.29Å; N823-D827 PolarHBondContact O-N 3.09Å; N823-D827 VanDerWaalsContact O-N 3.08Å; L824-D827 PolarHBondContact O-N 2.91Å; D827-R884 WeakPolarHBondContact O-CB 3.44Å; D827-R884 PolarHBondContact O-N 3.24Å; D827-R884 IonicContact OD1-CZ 2.59Å; D827-R884 IonicContact OD1-NE 3.2Å; D827-R884 PolarHBondContact OD1-NE 3.15Å; D827-R884 IonicContact OD1-NH2 2.79Å; D827-R884 PolarHBondContact OD1-NH2 3.18Å; D827-R884 IonicContact OD2-CZ 2.71Å; D827-R884 IonicContact OD2-NE 2.94Å; D827-R884 IonicContact OD2-NH2 2.62Å; D827-R884 PolarHBondContact OD2-NH2 3.36Å
828	A	87.7	Confident	74.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	140	-174	0	0	0	0	0	111.9	N823 Q826 L881 V882	N823-A828 WeakPolarHBondContact CB-O 3.28Å; N823-A828 PolarHBondContact N-O 3.21Å; N823-A828 PolarHBondContact O-N 3.44Å; Q826-A828 HydrophobicContact CB-CB 4.37Å; Q826-A828 PolarHBondContact O-N 3.18Å; A828-L881 HydrophobicContact CB-CB 3.98Å; A828-L881 HydrophobicContact CB-CD2 4.3Å; A828-V882 CarbonylContact C-O 3.53Å; A828-V882 WeakPolarHBondContact CA-O 3.1Å
829	L	87.6	Confident	72.7	Confident	46 Å²	46	53.5 Å²	53.5	24%	0.241	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	140.9	168.1	-57.4	178.2	0	0	0	109.4	V817 V820 P821 W822 L881 V882 R884	V817-L829 HydrophobicContact CG1-CD2 3.7Å; V820-L829 HydrophobicContact CG1-CB 4.25Å; V820-L829 HydrophobicContact CG1-CD2 4.31Å; P821-L829 CarbonylContact O-C 3.53Å; P821-L829 WeakPolarHBondContact O-CA 3.26Å; W822-L829 HydrophobicContact CB-CD2 4.16Å; W822-L829 HydrophobicContact CG-CD2 4.34Å; L829-L881 WeakPolarHBondContact O-CA 2.96Å; L829-V882 HydrophobicContact CB-CB 4.42Å; L829-V882 PolarHBondContact N-O 3.21Å; L829-V882 PolarHBondContact O-N 3.08Å; L829-R884 HydrophobicContact CD2-CG 4.48Å; L829-R884 HydrophobicContact CG-CB 4.4Å
830	S	84.7	Confident	70.8	Confident	6 Å²	6	56.9 Å²	56.9	4%	0.042	31%	0.311	C	S	.	.			trans	-133	178.8	179.7	72.9	0	0	0	0	111.6	P821	P821-S830 WeakPolarHBondContact CB-O 3.4Å; P821-S830 VanDerWaalsContact CB-OG 3.31Å; P821-S830 WeakPolarHBondContact CB-OG 3.32Å; P821-S830 VanDerWaalsContact CD-O 3.27Å; P821-S830 WeakPolarHBondContact CD-O 3.25Å; P821-S830 WeakPolarHBondContact CG-O 3.35Å; P821-S830 PolarHBondContact O-N 3.11Å
831	F	81.8	Confident	69	Low	89 Å²	89	57 Å²	57	39%	0.39	32%	0.315	S	S	.	.			trans	-119.2	137.2	-177.8	-60.7	-94.6	0	0	0	110.2	L877 P878 L880 V882	F831-L877 HydrophobicContact CB-CB 4.18Å; F831-P878 VanDerWaalsContact O-CA 3.29Å; F831-P878 WeakPolarHBondContact O-CA 3.37Å; F831-P878 WeakPolarHBondContact O-CG 3.22Å; F831-L880 HydrophobicContact CD2-CB 4.22Å; F831-L880 HydrophobicContact CD2-CD2 3.84Å; F831-L880 WeakPolarHBondContact CD2-O 3.38Å; F831-L880 HydrophobicContact CE2-CD2 3.36Å; F831-L880 HydrophobicContact CE2-CG 4.5Å; F831-L880 HydrophobicContact CZ-CD2 4.1Å; F831-V882 HydrophobicContact CE2-CG2 4.05Å; F831-V882 HydrophobicContact CZ-CG2 4.36Å
832	I	71.4	Confident	67.2	Low	80 Å²	80	66.8 Å²	66.8	41%	0.41	35%	0.35	S	S	.	.			trans	-89.4	128.1	170.5	-72.4	160.3	0	0	0	108.2	P821 P834	P821-I832 HydrophobicContact CB-CD1 4.43Å; P821-I832 HydrophobicContact CB-CG1 4.28Å; P821-I832 HydrophobicContact CG-CB 4.23Å; P821-I832 HydrophobicContact CG-CD1 3.52Å; P821-I832 HydrophobicContact CG-CG1 3.44Å; P821-I832 VanDerWaalsContact CG-CG1 3.44Å; I832-P834 VanDerWaalsContact O-CD 3.23Å; I832-P834 WeakPolarHBondContact O-CD 3.46Å
833	T	66.5	Low	65.7	Low	17 Å²	17	67.4 Å²	67.4	10%	0.104	35%	0.354	C	S	.	.			trans	-66.8	115.1	163.5	-47.4	0	0	0	0	108.7	H835 I838 L874	T833-H835 PolarHBondContact O-N 2.84Å; T833-H835 VanDerWaalsContact O-N 3.1Å; T833-I838 HydrophobicContact CG2-CD1 3.94Å; T833-I838 HydrophobicContact CG2-CG1 4.14Å; T833-L874 HydrophobicContact CG2-CB 3.71Å; T833-L874 WeakPolarHBondContact CG2-O 3.48Å; T833-L874 PolarHBondContact OG1-O 3.09Å
834	P	59.1	Low	64.4	Low	63 Å²	63	70.8 Å²	70.8	41%	0.409	38%	0.375	S	S	.	.			trans	-63.8	119.7	-179	-16.3	29.3	0	0	0	109.4	I832 D836 V837	I832-P834 VanDerWaalsContact O-CD 3.23Å; I832-P834 WeakPolarHBondContact O-CD 3.46Å; P834-D836 PolarHBondContact O-N 3.03Å; P834-V837 HydrophobicContact CB-CB 4.33Å; P834-V837 HydrophobicContact CB-CG2 3.76Å; P834-V837 HydrophobicContact CG-CG2 3.96Å; P834-V837 PolarHBondContact O-N 2.62Å
835	H	54.5	Low	63.2	Low	157 Å²	157	76.7 Å²	76.7	73%	0.727	40%	0.401	S	S	*	.	H	α-helix	trans	-52.9	-32.5	-178.7	-76.2	-69.7	0	0	0	112.6	T833 I838	T833-H835 PolarHBondContact O-N 2.84Å; T833-H835 VanDerWaalsContact O-N 3.1Å; H835-I838 PolarHBondContact O-N 2.94Å
836	D	49.4	Very low	62.3	Low	105 Å²	105	78.6 Å²	78.6	56%	0.561	39%	0.39	S	S	*	.	H	α-helix	trans	-73.8	-25.3	-178.7	-62.8	-9.1	0	0	0	113.7	P834 I838 S839 K840	P834-D836 PolarHBondContact O-N 3.03Å; D836-I838 VanDerWaalsContact C-N 3.32Å; D836-S839 PolarHBondContact O-N 3.45Å; D836-S839 PolarHBondContact O-OG 3.48Å; D836-K840 WeakPolarHBondContact O-CB 3.27Å; D836-K840 PolarHBondContact O-N 3.46Å
837	V	49.8	Very low	61.4	Low	47 Å²	47	77.6 Å²	77.6	29%	0.285	39%	0.387	S	S	.	.	H	α-helix	trans	-73.2	-31.2	178.8	176.5	0	0	0	0	110.2	P834 S839 W870 K871 L874	P834-V837 HydrophobicContact CB-CB 4.33Å; P834-V837 HydrophobicContact CB-CG2 3.76Å; P834-V837 HydrophobicContact CG-CG2 3.96Å; P834-V837 PolarHBondContact O-N 2.62Å; V837-S839 VanDerWaalsContact C-N 3.32Å; V837-S839 PolarHBondContact O-N 2.71Å; V837-W870 HydrophobicContact CG1-CH2 4.14Å; V837-W870 HydrophobicContact CG1-CZ3 3.98Å; V837-K871 WeakPolarHBondContact O-CE 3.47Å; V837-L874 HydrophobicContact CB-CD1 4.36Å; V837-L874 HydrophobicContact CG1-CD1 3.51Å
838	I	46.4	Very low	60.2	Low	82 Å²	82	78 Å²	78	42%	0.421	39%	0.388	S	S	.	.	H	α-helix	trans	-66.7	-37.1	175.1	-56.1	176.1	0	0	0	110.3	T833 H835 D836 K871	T833-I838 HydrophobicContact CG2-CD1 3.94Å; T833-I838 HydrophobicContact CG2-CG1 4.14Å; H835-I838 PolarHBondContact O-N 2.94Å; D836-I838 VanDerWaalsContact C-N 3.32Å; I838-K871 VanDerWaalsContact O-CE 3.22Å; I838-K871 WeakPolarHBondContact O-CE 3.38Å; I838-K871 PolarHBondContact O-NZ 2.9Å
839	S	45.5	Very low	59	Low	86 Å²	86	86.2 Å²	86.2	60%	0.601	42%	0.419	S	S	*	.	H	α-helix	trans	-86.3	-34.5	-178	65.2	0	0	0	0	114.2	D836 V837	D836-S839 PolarHBondContact O-N 3.45Å; D836-S839 PolarHBondContact O-OG 3.48Å; V837-S839 VanDerWaalsContact C-N 3.32Å; V837-S839 PolarHBondContact O-N 2.71Å
840	K	40.6	Very low	58.1	Low	131 Å²	131	90.8 Å²	90.8	57%	0.57	44%	0.439	S	S	*	.	S	Bend	trans	-99.5	108.8	-174.6	-68	174.7	-178.3	165.5	0	111.5	D836 R842	D836-K840 WeakPolarHBondContact O-CB 3.27Å; D836-K840 PolarHBondContact O-N 3.46Å; K840-R842 PolarHBondContact O-N 3.29Å
841	S	44.4	Very low	57.3	Low	65 Å²	65	93 Å²	93	46%	0.455	46%	0.455	S	S	.	.			trans	-62.7	100	174	61.6	0	0	0	0	111.8
842	R	46.5	Very low	56.5	Low	215 Å²	215	91.9 Å²	91.9	81%	0.811	47%	0.469	S	S	*	.			trans	-145.2	79.1	169.4	-66.2	-169.8	178.3	-174.2	-1	108.7	K840 W867	K840-R842 PolarHBondContact O-N 3.29Å; R842-W867 WeakPolarHBondContact O-CH2 3.47Å
843	E	53.8	Low	56.2	Low	38 Å²	38	89.1 Å²	89.1	18%	0.178	46%	0.456	C	S	.	.			trans	-60.6	164.8	162.1	-93.9	-162.8	144	0	0	111	K845 L863 W867	E843-K845 PolarHBondContact O-N 3.2Å; E843-L863 VanDerWaalsContact OE2-O 3.09Å; E843-W867 HydrophobicContact CB-CD2 4.43Å; E843-W867 HydrophobicContact CB-CE3 4.06Å; E843-W867 HydrophobicContact CB-CZ3 4.32Å; E843-W867 HydrophobicContact CG-CB 3.56Å; E843-W867 HydrophobicContact CG-CD2 3.43Å; E843-W867 VanDerWaalsContact CG-CD2 3.43Å; E843-W867 HydrophobicContact CG-CE3 2.96Å; E843-W867 HydrophobicContact CG-CG 3.75Å; E843-W867 HydrophobicContact CG-CZ3 3.58Å; E843-W867 WeakPolarHBondContact OE1-CA 3.35Å; E843-W867 PolarHBondContact OE1-N 3.17Å
844	T	57.2	Low	56.2	Low	81 Å²	81	89.4 Å²	89.4	50%	0.497	46%	0.463	S	S	.	.			trans	-32.1	109.7	-179.4	60.7	0	0	0	0	109.4	R846 D847	T844-R846 CarbonylContact O-C 3.49Å; T844-R846 PolarHBondContact O-N 3.32Å; T844-D847 PolarHBondContact O-N 2.83Å
845	K	55	Low	56.8	Low	134 Å²	134	97.3 Å²	97.3	58%	0.583	49%	0.485	S	S	*	.	H	α-helix	trans	-42.2	-27	178.3	-168.2	-174.9	-174.5	-169.5	0	112.3	E843 W849	E843-K845 PolarHBondContact O-N 3.2Å; K845-W849 HydrophobicContact CD-CE3 4.26Å; K845-W849 HydrophobicContact CD-CH2 4.03Å; K845-W849 HydrophobicContact CD-CZ3 3.77Å; K845-W849 HydrophobicContact CG-CD2 4.26Å; K845-W849 HydrophobicContact CG-CE3 3.83Å; K845-W849 HydrophobicContact CG-CH2 4.32Å; K845-W849 HydrophobicContact CG-CZ3 3.86Å; K845-W849 VanDerWaalsContact O-CB 3.27Å; K845-W849 WeakPolarHBondContact O-CB 3.45Å; K845-W849 PolarHBondContact O-N 2.99Å
846	R	59.4	Low	57.6	Low	98 Å²	98	95.3 Å²	95.3	37%	0.37	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-53.8	176.7	-160.9	174.6	-167.4	166	1	115.1	T844 W849 Q850 E907	T844-R846 CarbonylContact O-C 3.49Å; T844-R846 PolarHBondContact O-N 3.32Å; R846-W849 PolarHBondContact O-N 3.23Å; R846-Q850 WeakPolarHBondContact O-CG 3.2Å; R846-Q850 PolarHBondContact O-N 3.17Å; R846-E907 PolarHBondContact NH1-O 2.97Å; R846-E907 PolarHBondContact NH2-O 3.47Å; R846-E907 VanDerWaalsContact NH2-O 3.13Å
847	D	62.2	Low	58.6	Low	60 Å²	60	95.6 Å²	95.6	32%	0.321	48%	0.478	S	S	.	.	H	α-helix	trans	-72.8	-36.9	-171.7	-72.4	-7.1	0	0	0	111.8	T844 W849 Q850 S851 L863	T844-D847 PolarHBondContact O-N 2.83Å; D847-W849 VanDerWaalsContact C-N 3.35Å; D847-Q850 PolarHBondContact O-N 3.35Å; D847-S851 PolarHBondContact O-N 3.37Å; D847-L863 HydrophobicContact CB-CD2 4.19Å
848	H	59.9	Low	59.6	Low	37 Å²	37	98.9 Å²	98.9	17%	0.171	50%	0.502	C	S	.	.	H	α-helix	trans	-67	-35.4	171.8	-170.1	79.8	0	0	0	112	Q850 S851 S853 G854	H848-Q850 VanDerWaalsContact C-N 3.33Å; H848-S851 PolarHBondContact O-N 3.45Å; H848-S851 PolarHBondContact O-OG 3.17Å; H848-S853 WeakPolarHBondContact CE1-CB 3.25Å; H848-G854 PolarHBondContact NE2-O 3.02Å; H848-G854 VanDerWaalsContact NE2-O 3.11Å
849	W	64.5	Low	60.7	Low	174 Å²	174	96.6 Å²	96.6	66%	0.659	49%	0.491	S	S	*	.	H	α-helix	trans	-67.2	-36.1	171.5	-95.5	-26.2	0	0	0	112.4	K845 R846 D847 S851 G852	K845-W849 HydrophobicContact CD-CE3 4.26Å; K845-W849 HydrophobicContact CD-CH2 4.03Å; K845-W849 HydrophobicContact CD-CZ3 3.77Å; K845-W849 HydrophobicContact CG-CD2 4.26Å; K845-W849 HydrophobicContact CG-CE3 3.83Å; K845-W849 HydrophobicContact CG-CH2 4.32Å; K845-W849 HydrophobicContact CG-CZ3 3.86Å; K845-W849 VanDerWaalsContact O-CB 3.27Å; K845-W849 WeakPolarHBondContact O-CB 3.45Å; K845-W849 PolarHBondContact O-N 2.99Å; R846-W849 PolarHBondContact O-N 3.23Å; D847-W849 VanDerWaalsContact C-N 3.35Å; W849-S851 VanDerWaalsContact C-N 3.32Å; W849-S851 PolarHBondContact O-N 3.41Å; W849-G852 PolarHBondContact O-N 2.75Å
850	Q	67.6	Low	62.1	Low	141 Å²	141	94.9 Å²	94.9	66%	0.659	48%	0.478	S	S	*	.	H	α-helix	trans	-69.1	-27.6	176.6	-74	179.2	-1.1	0	0	112.9	R846 D847 H848 G852	R846-Q850 WeakPolarHBondContact O-CG 3.2Å; R846-Q850 PolarHBondContact O-N 3.17Å; D847-Q850 PolarHBondContact O-N 3.35Å; H848-Q850 VanDerWaalsContact C-N 3.33Å; Q850-G852 PolarHBondContact O-N 3.03Å
851	S	67.6	Low	63.8	Low	52 Å²	52	95.3 Å²	95.3	36%	0.364	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-11.9	172.8	71.4	0	0	0	0	113.5	D847 H848 W849 S853	D847-S851 PolarHBondContact O-N 3.37Å; H848-S851 PolarHBondContact O-N 3.45Å; H848-S851 PolarHBondContact O-OG 3.17Å; W849-S851 VanDerWaalsContact C-N 3.32Å; W849-S851 PolarHBondContact O-N 3.41Å; S851-S853 PolarHBondContact O-N 3.32Å; S851-S853 WeakPolarHBondContact OG-CB 3.26Å; S851-S853 PolarHBondContact OG-OG 3.15Å
852	G	64.7	Low	65.2	Low	67 Å²	67	97.5 Å²	97.5	69%	0.691	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	12.9	-177.5	0	0	0	0	0	113.8	W849 Q850	W849-G852 PolarHBondContact O-N 2.75Å; Q850-G852 PolarHBondContact O-N 3.03Å
853	S	66.8	Low	66.4	Low	21 Å²	21	88.5 Å²	88.5	15%	0.147	46%	0.464	C	S	.	.			trans	-75.3	139	-179.8	-58.9	0	0	0	0	110.9	H848 S851 E857	H848-S853 WeakPolarHBondContact CE1-CB 3.25Å; S851-S853 PolarHBondContact O-N 3.32Å; S851-S853 WeakPolarHBondContact OG-CB 3.26Å; S851-S853 PolarHBondContact OG-OG 3.15Å; S853-E857 WeakPolarHBondContact CA-OE2 3.45Å
854	G	66	Low	67.2	Low	24 Å²	24	89.6 Å²	89.6	25%	0.247	47%	0.471	C	S	.	.			trans	-59.3	157.2	175	0	0	0	0	0	112.3	H848 N856 E857	H848-G854 PolarHBondContact NE2-O 3.02Å; H848-G854 VanDerWaalsContact NE2-O 3.11Å; G854-N856 PolarHBondContact O-N 3.46Å; G854-N856 VanDerWaalsContact O-N 3.13Å; G854-E857 PolarHBondContact N-OE2 3.01Å; G854-E857 PolarHBondContact O-N 3.5Å; G854-E857 VanDerWaalsContact O-N 3.16Å
855	W	71.1	Confident	68.1	Low	229 Å²	229	88.6 Å²	88.6	87%	0.867	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-19.6	179.6	68	-89.9	0	0	0	113.5
856	N	71.6	Confident	68.7	Low	114 Å²	114	87.8 Å²	87.8	61%	0.61	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	4.9	-179.4	65.2	-47	0	0	0	113.3	G854	G854-N856 PolarHBondContact O-N 3.46Å; G854-N856 VanDerWaalsContact O-N 3.13Å
857	E	70.3	Confident	69.2	Low	112 Å²	112	83.5 Å²	83.5	52%	0.523	45%	0.452	S	S	.	.	S	Bend	trans	-89.7	149.5	179.2	-68.1	-179.8	170.8	0	0	111.1	S853 G854	S853-E857 WeakPolarHBondContact CA-OE2 3.45Å; G854-E857 PolarHBondContact N-OE2 3.01Å; G854-E857 PolarHBondContact O-N 3.5Å; G854-E857 VanDerWaalsContact O-N 3.16Å
858	S	71	Confident	69.7	Low	115 Å²	115	83.9 Å²	83.9	80%	0.804	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-60.7	137	175.8	-47	0	0	0	0	110.6
859	I	69.9	Low	70.3	Confident	35 Å²	35	89.8 Å²	89.8	18%	0.179	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-66.6	134.3	179.4	-57	172.6	0	0	0	108.8	D861 L863 N864	I859-D861 PolarHBondContact O-N 3.43Å; I859-L863 HydrophobicContact CG2-CB 3.62Å; I859-L863 HydrophobicContact CG2-CD1 4.45Å; I859-N864 HydrophobicContact CG2-CB 4.49Å
860	P	73.1	Confident	70.7	Confident	50 Å²	50	86.9 Å²	86.9	33%	0.325	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-53.5	137.6	174	-26	33.1	0	0	0	112.5	V862 L863 N864	P860-V862 PolarHBondContact O-N 3.4Å; P860-L863 HydrophobicContact CG-CD1 4.34Å; P860-L863 PolarHBondContact O-N 3.17Å; P860-N864 PolarHBondContact O-N 2.98Å
861	D	76.7	Confident	70.9	Confident	139 Å²	139	81.9 Å²	81.9	74%	0.743	44%	0.44	S	S	*	.	H	α-helix	trans	-50.8	-37.4	-171.9	-65.7	-28.9	0	0	0	114.2	I859 L863 N864 A865	I859-D861 PolarHBondContact O-N 3.43Å; D861-L863 PolarHBondContact O-N 3.33Å; D861-N864 PolarHBondContact O-N 3.42Å; D861-A865 PolarHBondContact O-N 2.93Å
862	V	73.9	Confident	71.2	Confident	112 Å²	112	85.7 Å²	85.7	68%	0.679	45%	0.451	S	S	*	.	H	α-helix	trans	-64.1	-40.1	179.7	-179.5	0	0	0	0	111.9	P860 K866	P860-V862 PolarHBondContact O-N 3.4Å; V862-K866 PolarHBondContact O-N 3.14Å
863	L	71.2	Confident	71.6	Confident	26 Å²	26	87.4 Å²	87.4	14%	0.136	44%	0.441	C	S	.	.	H	α-helix	trans	-72.9	-42.8	175.7	-66.9	176.2	0	0	0	109.9	E843 D847 I859 P860 D861 A865 K866 W867	E843-L863 VanDerWaalsContact OE2-O 3.09Å; D847-L863 HydrophobicContact CB-CD2 4.19Å; I859-L863 HydrophobicContact CG2-CB 3.62Å; I859-L863 HydrophobicContact CG2-CD1 4.45Å; P860-L863 HydrophobicContact CG-CD1 4.34Å; P860-L863 PolarHBondContact O-N 3.17Å; D861-L863 PolarHBondContact O-N 3.33Å; L863-A865 PolarHBondContact O-N 2.99Å; L863-A865 VanDerWaalsContact O-N 3.17Å; L863-K866 PolarHBondContact O-N 3.22Å; L863-W867 PolarHBondContact O-N 3.33Å
864	N	72.5	Confident	72.1	Confident	60 Å²	60	87 Å²	87	32%	0.321	44%	0.438	S	S	.	.	H	α-helix	trans	-57.9	-33.8	176.8	-168.5	42.6	0	0	0	113	I859 P860 D861 W867 N868	I859-N864 HydrophobicContact CG2-CB 4.49Å; P860-N864 PolarHBondContact O-N 2.98Å; D861-N864 PolarHBondContact O-N 3.42Å; N864-W867 WeakPolarHBondContact O-CB 3.26Å; N864-N868 VanDerWaalsContact O-CG 3.27Å; N864-N868 PolarHBondContact O-N 3.25Å; N864-N868 PolarHBondContact O-ND2 2.91Å
865	A	74.8	Confident	72.4	Confident	60 Å²	60	91.4 Å²	91.4	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-68.3	-42.9	175	0	0	0	0	0	113.2	D861 L863 W867 N868 R869	D861-A865 PolarHBondContact O-N 2.93Å; L863-A865 PolarHBondContact O-N 2.99Å; L863-A865 VanDerWaalsContact O-N 3.17Å; A865-W867 VanDerWaalsContact C-N 3.32Å; A865-N868 PolarHBondContact O-N 3.03Å; A865-R869 PolarHBondContact O-N 2.86Å
866	K	68.3	Low	72.7	Confident	118 Å²	118	85 Å²	85	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-62.2	-42.4	174.9	-73.2	-176.6	179.1	179.6	0	111	V862 L863 N868 R869 W870	V862-K866 PolarHBondContact O-N 3.14Å; L863-K866 PolarHBondContact O-N 3.22Å; K866-N868 PolarHBondContact O-N 2.91Å; K866-R869 WeakPolarHBondContact O-CB 3.35Å; K866-R869 PolarHBondContact O-N 2.99Å; K866-W870 PolarHBondContact O-N 3.23Å
867	W	70.5	Confident	73	Confident	8 Å²	8	82.5 Å²	82.5	3%	0.03	42%	0.419	C	S	.	.	H	α-helix	trans	-57.3	-51.1	175.8	177	-129.4	0	0	0	113.6	R842 E843 L863 N864 A865 R869 W870 K871	R842-W867 WeakPolarHBondContact O-CH2 3.47Å; E843-W867 HydrophobicContact CB-CD2 4.43Å; E843-W867 HydrophobicContact CB-CE3 4.06Å; E843-W867 HydrophobicContact CB-CZ3 4.32Å; E843-W867 HydrophobicContact CG-CB 3.56Å; E843-W867 HydrophobicContact CG-CD2 3.43Å; E843-W867 VanDerWaalsContact CG-CD2 3.43Å; E843-W867 HydrophobicContact CG-CE3 2.96Å; E843-W867 HydrophobicContact CG-CG 3.75Å; E843-W867 HydrophobicContact CG-CZ3 3.58Å; E843-W867 WeakPolarHBondContact OE1-CA 3.35Å; E843-W867 PolarHBondContact OE1-N 3.17Å; L863-W867 PolarHBondContact O-N 3.33Å; N864-W867 WeakPolarHBondContact O-CB 3.26Å; A865-W867 VanDerWaalsContact C-N 3.32Å; W867-R869 PolarHBondContact O-N 3.02Å; W867-W870 HydrophobicContact CE3-CD2 4.41Å; W867-W870 AromaticContact CE3-CE3 3.47Å; W867-W870 HydrophobicContact CE3-CE3 3.47Å; W867-W870 VanDerWaalsContact CE3-CE3 3.47Å; W867-W870 AromaticContact CE3-CZ3 3.94Å; W867-W870 HydrophobicContact CE3-CZ3 3.94Å; W867-W870 HydrophobicContact CH2-CE3 4.03Å; W867-W870 AromaticContact CH2-CZ3 3.6Å; W867-W870 HydrophobicContact CH2-CZ3 3.6Å; W867-W870 HydrophobicContact CZ3-CD2 4.26Å; W867-W870 AromaticContact CZ3-CE3 3.17Å; W867-W870 HydrophobicContact CZ3-CE3 3.17Å; W867-W870 HydrophobicContact CZ3-CH2 4.21Å; W867-W870 AromaticContact CZ3-CZ3 3.14Å; W867-W870 HydrophobicContact CZ3-CZ3 3.14Å; W867-W870 PolarHBondContact O-N 2.87Å; W867-K871 HydrophobicContact CD2-CD 4.02Å; W867-K871 HydrophobicContact CD2-CG 3.89Å; W867-K871 HydrophobicContact CE3-CG 4.14Å; W867-K871 HydrophobicContact CG-CD 4.34Å; W867-K871 HydrophobicContact CG-CG 4.49Å; W867-K871 HydrophobicContact CH2-CG 4.4Å; W867-K871 HydrophobicContact CZ2-CD 3.98Å; W867-K871 HydrophobicContact CZ2-CG 4.02Å; W867-K871 HydrophobicContact CZ3-CG 4.47Å; W867-K871 WeakPolarHBondContact O-CB 3.29Å; W867-K871 PolarHBondContact O-N 3.38Å
868	N	71.8	Confident	73.4	Confident	67 Å²	67	79.9 Å²	79.9	36%	0.358	41%	0.412	S	S	.	.	H	α-helix	trans	-63.1	-30.7	-177.4	-72.4	-38.1	0	0	0	111.2	N864 A865 K866 Q872	N864-N868 VanDerWaalsContact O-CG 3.27Å; N864-N868 PolarHBondContact O-N 3.25Å; N864-N868 PolarHBondContact O-ND2 2.91Å; A865-N868 PolarHBondContact O-N 3.03Å; K866-N868 PolarHBondContact O-N 2.91Å; N868-Q872 WeakPolarHBondContact O-CB 3.45Å; N868-Q872 WeakPolarHBondContact O-CG 3.39Å; N868-Q872 PolarHBondContact O-N 3.39Å
869	R	73.3	Confident	73.8	Confident	161 Å²	161	80.3 Å²	80.3	61%	0.608	40%	0.401	S	S	*	.	H	α-helix	trans	-67.8	-51.4	171.8	-170.5	-179.6	-63.4	148.8	0.8	112.1	A865 K866 W867 K871 Q872 E873	A865-R869 PolarHBondContact O-N 2.86Å; K866-R869 WeakPolarHBondContact O-CB 3.35Å; K866-R869 PolarHBondContact O-N 2.99Å; W867-R869 PolarHBondContact O-N 3.02Å; R869-K871 VanDerWaalsContact C-N 3.31Å; R869-K871 PolarHBondContact O-N 3.24Å; R869-Q872 WeakPolarHBondContact O-CA 3.47Å; R869-Q872 WeakPolarHBondContact O-CB 3.19Å; R869-Q872 PolarHBondContact O-N 3.41Å; R869-E873 PolarHBondContact O-N 2.88Å
870	W	72.5	Confident	74.3	Confident	113 Å²	113	83.4 Å²	83.4	43%	0.428	42%	0.417	S	S	.	.	H	α-helix	trans	-60	-40.6	177.3	178.5	81.2	0	0	0	112.3	V837 K866 W867 Q872 E873 L874	V837-W870 HydrophobicContact CG1-CH2 4.14Å; V837-W870 HydrophobicContact CG1-CZ3 3.98Å; K866-W870 PolarHBondContact O-N 3.23Å; W867-W870 HydrophobicContact CE3-CD2 4.41Å; W867-W870 AromaticContact CE3-CE3 3.47Å; W867-W870 HydrophobicContact CE3-CE3 3.47Å; W867-W870 VanDerWaalsContact CE3-CE3 3.47Å; W867-W870 AromaticContact CE3-CZ3 3.94Å; W867-W870 HydrophobicContact CE3-CZ3 3.94Å; W867-W870 HydrophobicContact CH2-CE3 4.03Å; W867-W870 AromaticContact CH2-CZ3 3.6Å; W867-W870 HydrophobicContact CH2-CZ3 3.6Å; W867-W870 HydrophobicContact CZ3-CD2 4.26Å; W867-W870 AromaticContact CZ3-CE3 3.17Å; W867-W870 HydrophobicContact CZ3-CE3 3.17Å; W867-W870 HydrophobicContact CZ3-CH2 4.21Å; W867-W870 AromaticContact CZ3-CZ3 3.14Å; W867-W870 HydrophobicContact CZ3-CZ3 3.14Å; W867-W870 PolarHBondContact O-N 2.87Å; W870-Q872 VanDerWaalsContact C-N 3.29Å; W870-Q872 PolarHBondContact O-N 3.01Å; W870-E873 WeakPolarHBondContact O-CB 3.46Å; W870-E873 PolarHBondContact O-N 3.42Å; W870-L874 HydrophobicContact CE3-CD1 4.11Å; W870-L874 HydrophobicContact CE3-CG 4.25Å; W870-L874 HydrophobicContact CH2-CD1 3.86Å; W870-L874 HydrophobicContact CH2-CD2 3.72Å; W870-L874 HydrophobicContact CH2-CG 4.07Å; W870-L874 HydrophobicContact CZ2-CD2 3.78Å; W870-L874 HydrophobicContact CZ2-CG 4.36Å; W870-L874 HydrophobicContact CZ3-CD1 3.54Å; W870-L874 HydrophobicContact CZ3-CD2 4.18Å; W870-L874 HydrophobicContact CZ3-CG 3.99Å; W870-L874 PolarHBondContact O-N 3.21Å
871	K	70.8	Confident	74.8	Confident	37 Å²	37	84.3 Å²	84.3	16%	0.161	42%	0.419	C	S	.	.	H	α-helix	trans	-58.9	-39.6	172.1	-88.3	-174.2	156.6	177.5	0	112.8	V837 I838 W867 R869 E873 L874	V837-K871 WeakPolarHBondContact O-CE 3.47Å; I838-K871 VanDerWaalsContact O-CE 3.22Å; I838-K871 WeakPolarHBondContact O-CE 3.38Å; I838-K871 PolarHBondContact O-NZ 2.9Å; W867-K871 HydrophobicContact CD2-CD 4.02Å; W867-K871 HydrophobicContact CD2-CG 3.89Å; W867-K871 HydrophobicContact CE3-CG 4.14Å; W867-K871 HydrophobicContact CG-CD 4.34Å; W867-K871 HydrophobicContact CG-CG 4.49Å; W867-K871 HydrophobicContact CH2-CG 4.4Å; W867-K871 HydrophobicContact CZ2-CD 3.98Å; W867-K871 HydrophobicContact CZ2-CG 4.02Å; W867-K871 HydrophobicContact CZ3-CG 4.47Å; W867-K871 WeakPolarHBondContact O-CB 3.29Å; W867-K871 PolarHBondContact O-N 3.38Å; R869-K871 VanDerWaalsContact C-N 3.31Å; R869-K871 PolarHBondContact O-N 3.24Å; K871-E873 PolarHBondContact O-N 3.11Å; K871-L874 WeakPolarHBondContact O-CB 3.33Å; K871-L874 PolarHBondContact O-N 3Å
872	Q	74.7	Confident	75.2	Confident	131 Å²	131	80.4 Å²	80.4	61%	0.612	40%	0.4	S	S	*	.	H	α-helix	trans	-65.5	-21.2	174.8	-77.3	168.7	4.2	0	0	111.5	N868 R869 W870 H875	N868-Q872 WeakPolarHBondContact O-CB 3.45Å; N868-Q872 WeakPolarHBondContact O-CG 3.39Å; N868-Q872 PolarHBondContact O-N 3.39Å; R869-Q872 WeakPolarHBondContact O-CA 3.47Å; R869-Q872 WeakPolarHBondContact O-CB 3.19Å; R869-Q872 PolarHBondContact O-N 3.41Å; W870-Q872 VanDerWaalsContact C-N 3.29Å; W870-Q872 PolarHBondContact O-N 3.01Å; Q872-H875 PolarHBondContact O-CE1 3.15Å; Q872-H875 PolarHBondContact O-ND1 3.22Å
873	E	73.9	Confident	75.7	Confident	103 Å²	103	80.8 Å²	80.8	48%	0.481	39%	0.394	S	S	.	.	H	α-helix	trans	-83.8	-22.3	176.1	-65.5	162.9	-169.8	0	0	112.1	R869 W870 K871 H875 M876	R869-E873 PolarHBondContact O-N 2.88Å; W870-E873 WeakPolarHBondContact O-CB 3.46Å; W870-E873 PolarHBondContact O-N 3.42Å; K871-E873 PolarHBondContact O-N 3.11Å; E873-H875 VanDerWaalsContact C-N 3.27Å; E873-H875 PolarHBondContact O-N 3.04Å; E873-H875 VanDerWaalsContact O-N 3.17Å; E873-M876 VanDerWaalsContact O-CB 3.24Å; E873-M876 WeakPolarHBondContact O-CB 3.46Å; E873-M876 PolarHBondContact O-N 3.05Å
874	L	75.4	Confident	76.3	Confident	14 Å²	14	82.9 Å²	82.9	7%	0.073	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-60.5	-29	-176.4	-77.1	178.5	0	0	0	114.9	T833 V837 W870 K871 M876 L877	T833-L874 HydrophobicContact CG2-CB 3.71Å; T833-L874 WeakPolarHBondContact CG2-O 3.48Å; T833-L874 PolarHBondContact OG1-O 3.09Å; V837-L874 HydrophobicContact CB-CD1 4.36Å; V837-L874 HydrophobicContact CG1-CD1 3.51Å; W870-L874 HydrophobicContact CE3-CD1 4.11Å; W870-L874 HydrophobicContact CE3-CG 4.25Å; W870-L874 HydrophobicContact CH2-CD1 3.86Å; W870-L874 HydrophobicContact CH2-CD2 3.72Å; W870-L874 HydrophobicContact CH2-CG 4.07Å; W870-L874 HydrophobicContact CZ2-CD2 3.78Å; W870-L874 HydrophobicContact CZ2-CG 4.36Å; W870-L874 HydrophobicContact CZ3-CD1 3.54Å; W870-L874 HydrophobicContact CZ3-CD2 4.18Å; W870-L874 HydrophobicContact CZ3-CG 3.99Å; W870-L874 PolarHBondContact O-N 3.21Å; K871-L874 WeakPolarHBondContact O-CB 3.33Å; K871-L874 PolarHBondContact O-N 3Å; L874-M876 PolarHBondContact O-N 3.27Å; L874-L877 HydrophobicContact CD2-CD1 3.59Å; L874-L877 WeakPolarHBondContact O-CB 3.36Å; L874-L877 PolarHBondContact O-N 2.92Å; L874-L877 VanDerWaalsContact O-N 3.17Å
875	H	73.5	Confident	76.8	Confident	115 Å²	115	83.5 Å²	83.5	53%	0.532	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-70.8	-9.9	176.5	76.2	-88.6	0	0	0	112.7	Q872 E873 P878	Q872-H875 PolarHBondContact O-CE1 3.15Å; Q872-H875 PolarHBondContact O-ND1 3.22Å; E873-H875 VanDerWaalsContact C-N 3.27Å; E873-H875 PolarHBondContact O-N 3.04Å; E873-H875 VanDerWaalsContact O-N 3.17Å; H875-P878 WeakPolarHBondContact O-CD 3.4Å
876	M	77.3	Confident	76.9	Confident	95 Å²	95	86.4 Å²	86.4	47%	0.468	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-84.1	-13.4	172.3	-60	-170.6	50.5	0	0	112.9	E873 L874 P878 Q879	E873-M876 VanDerWaalsContact O-CB 3.24Å; E873-M876 WeakPolarHBondContact O-CB 3.46Å; E873-M876 PolarHBondContact O-N 3.05Å; L874-M876 PolarHBondContact O-N 3.27Å; M876-P878 VanDerWaalsContact C-CD 3.49Å; M876-Q879 WeakPolarHBondContact O-CA 3.39Å; M876-Q879 WeakPolarHBondContact O-CB 3.49Å; M876-Q879 PolarHBondContact O-N 3.47Å
877	L	78.3	Confident	77.4	Confident	62 Å²	62	82.4 Å²	82.4	33%	0.325	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-54.2	-42	178.8	-80.8	170.5	0	0	0	114.1	F831 L874 Q879 L880	F831-L877 HydrophobicContact CB-CB 4.18Å; L874-L877 HydrophobicContact CD2-CD1 3.59Å; L874-L877 WeakPolarHBondContact O-CB 3.36Å; L874-L877 PolarHBondContact O-N 2.92Å; L874-L877 VanDerWaalsContact O-N 3.17Å; L877-Q879 PolarHBondContact O-N 3.14Å; L877-L880 WeakPolarHBondContact O-CB 3.33Å; L877-L880 PolarHBondContact O-N 3.41Å
878	P	77.5	Confident	77.5	Confident	57 Å²	57	88 Å²	88	37%	0.37	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-64	-16.9	175.4	-21.4	33.5	0	0	0	114.3	F831 H875 M876 L880	F831-P878 VanDerWaalsContact O-CA 3.29Å; F831-P878 WeakPolarHBondContact O-CA 3.37Å; F831-P878 WeakPolarHBondContact O-CG 3.22Å; H875-P878 WeakPolarHBondContact O-CD 3.4Å; M876-P878 VanDerWaalsContact C-CD 3.49Å; P878-L880 VanDerWaalsContact C-N 3.31Å
879	Q	80.4	Confident	77.7	Confident	123 Å²	123	88 Å²	88	58%	0.575	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-80.8	-15.5	174.9	-51.2	173.3	13.5	0	0	111.9	M876 L877 L881	M876-Q879 WeakPolarHBondContact O-CA 3.39Å; M876-Q879 WeakPolarHBondContact O-CB 3.49Å; M876-Q879 PolarHBondContact O-N 3.47Å; L877-Q879 PolarHBondContact O-N 3.14Å; Q879-L881 PolarHBondContact O-N 3.37Å
880	L	80.1	Confident	77.7	Confident	100 Å²	100	84.8 Å²	84.8	52%	0.524	43%	0.431	S	S	.	.			trans	-79.2	104.7	173.1	-161.3	117.7	0	0	0	108.6	F831 L877 P878 V882	F831-L880 HydrophobicContact CD2-CB 4.22Å; F831-L880 HydrophobicContact CD2-CD2 3.84Å; F831-L880 WeakPolarHBondContact CD2-O 3.38Å; F831-L880 HydrophobicContact CE2-CD2 3.36Å; F831-L880 HydrophobicContact CE2-CG 4.5Å; F831-L880 HydrophobicContact CZ-CD2 4.1Å; L877-L880 WeakPolarHBondContact O-CB 3.33Å; L877-L880 PolarHBondContact O-N 3.41Å; P878-L880 VanDerWaalsContact C-N 3.31Å; L880-V882 HydrophobicContact CD2-CG2 4.37Å
881	L	83.1	Confident	77.8	Confident	69 Å²	69	84.8 Å²	84.8	36%	0.361	44%	0.439	S	S	.	.			trans	-105.1	127.7	-178.6	-60.2	172.2	0	0	0	109.2	A828 L829 Q879	A828-L881 HydrophobicContact CB-CB 3.98Å; A828-L881 HydrophobicContact CB-CD2 4.3Å; L829-L881 WeakPolarHBondContact O-CA 2.96Å; Q879-L881 PolarHBondContact O-N 3.37Å
882	V	84.8	Confident	78.1	Confident	58 Å²	58	89.7 Å²	89.7	35%	0.352	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.2	172.6	179.3	0	0	0	0	106.9	A828 L829 F831 L880 R884 L886	A828-V882 CarbonylContact C-O 3.53Å; A828-V882 WeakPolarHBondContact CA-O 3.1Å; L829-V882 HydrophobicContact CB-CB 4.42Å; L829-V882 PolarHBondContact N-O 3.21Å; L829-V882 PolarHBondContact O-N 3.08Å; F831-V882 HydrophobicContact CE2-CG2 4.05Å; F831-V882 HydrophobicContact CZ-CG2 4.36Å; L880-V882 HydrophobicContact CD2-CG2 4.37Å; V882-R884 PolarHBondContact O-N 3.47Å; V882-L886 HydrophobicContact CG1-CD2 4.42Å
883	Q	84.3	Confident	78.5	Confident	119 Å²	119	84.7 Å²	84.7	56%	0.556	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.2	128.9	177	-71.9	-63.7	-28	0	0	109.9	T885	Q883-T885 VanDerWaalsContact C-N 3.31Å; Q883-T885 PolarHBondContact O-N 2.99Å
884	R	85.4	Confident	79	Confident	70 Å²	70	80.9 Å²	80.9	26%	0.264	43%	0.432	S	S	.	.	S	Bend	trans	-64.9	-39.9	-177.9	-176.6	-176.8	59.3	79.1	8.1	110.8	D827 L829 V882 L886	D827-R884 WeakPolarHBondContact O-CB 3.44Å; D827-R884 PolarHBondContact O-N 3.24Å; D827-R884 IonicContact OD1-CZ 2.59Å; D827-R884 IonicContact OD1-NE 3.2Å; D827-R884 PolarHBondContact OD1-NE 3.15Å; D827-R884 IonicContact OD1-NH2 2.79Å; D827-R884 PolarHBondContact OD1-NH2 3.18Å; D827-R884 IonicContact OD2-CZ 2.71Å; D827-R884 IonicContact OD2-NE 2.94Å; D827-R884 IonicContact OD2-NH2 2.62Å; D827-R884 PolarHBondContact OD2-NH2 3.36Å; L829-R884 HydrophobicContact CD2-CG 4.48Å; L829-R884 HydrophobicContact CG-CB 4.4Å; V882-R884 PolarHBondContact O-N 3.47Å; R884-L886 PolarHBondContact O-N 2.91Å
885	T	81.4	Confident	79.6	Confident	74 Å²	74	84.8 Å²	84.8	45%	0.454	46%	0.456	S	S	.	.			trans	-83	102.9	175.6	-56.2	0	0	0	0	109.9	Q883 I887	Q883-T885 VanDerWaalsContact C-N 3.31Å; Q883-T885 PolarHBondContact O-N 2.99Å; T885-I887 WeakPolarHBondContact CG2-O 3.5Å
886	L	77.2	Confident	80.4	Confident	120 Å²	120	80.7 Å²	80.7	63%	0.628	44%	0.44	S	S	*	.	S	Bend	trans	-81.1	-23.3	-179.7	-64.1	177.7	0	0	0	113.5	V882 R884 L916	V882-L886 HydrophobicContact CG1-CD2 4.42Å; R884-L886 PolarHBondContact O-N 2.91Å; L886-L916 HydrophobicContact CB-CD2 4.25Å
887	I	79.4	Confident	80.9	Confident	34 Å²	34	80.4 Å²	80.4	17%	0.174	44%	0.44	C	S	.	.			trans	-114.9	105.2	-179.1	-54.4	-174.3	0	0	0	107.7	T885 V889 V894 I897 L916 V918	T885-I887 WeakPolarHBondContact CG2-O 3.5Å; I887-V889 HydrophobicContact CG2-CG2 3.58Å; I887-V889 PolarHBondContact O-N 3.47Å; I887-V894 HydrophobicContact CG2-CG2 4.02Å; I887-I897 HydrophobicContact CD1-CD1 3.7Å; I887-I897 HydrophobicContact CD1-CG1 4.45Å; I887-L916 HydrophobicContact CD1-CD2 4.43Å; I887-L916 HydrophobicContact CG1-CD2 4.12Å; I887-V918 HydrophobicContact CD1-CG2 4.11Å; I887-V918 HydrophobicContact CG1-CG2 4.02Å; I887-V918 HydrophobicContact CG2-CG1 4.01Å; I887-V918 HydrophobicContact CG2-CG2 4.47Å
888	P	72.5	Confident	81.4	Confident	125 Å²	125	80.8 Å²	80.8	81%	0.812	44%	0.44	S	S	*	.			trans	-81.9	11.7	-174.3	34.2	-36.8	0	0	0	113.7
889	V	76.5	Confident	82	Confident	67 Å²	67	84 Å²	84	41%	0.406	45%	0.453	S	S	.	.	S	Bend	trans	-122.2	155.6	-179.8	-66.8	0	0	0	0	109.5	I887 I891 V894 V918 A920	I887-V889 HydrophobicContact CG2-CG2 3.58Å; I887-V889 PolarHBondContact O-N 3.47Å; V889-I891 PolarHBondContact O-N 3.4Å; V889-V894 HydrophobicContact CG2-CG2 3.76Å; V889-V918 HydrophobicContact CG2-CG1 4.47Å; V889-A920 HydrophobicContact CG2-CB 4.23Å
890	D	72.6	Confident	82.4	Confident	94 Å²	94	81.5 Å²	81.5	50%	0.503	44%	0.441	S	S	.	.			trans	-54.6	127.1	173.1	-177	-9.4	0	0	0	109.6	N892 A893 V894	D890-N892 PolarHBondContact O-N 2.74Å; D890-N892 VanDerWaalsContact O-N 3.16Å; D890-N892 WeakPolarHBondContact OD1-CB 3.42Å; D890-N892 PolarHBondContact OD1-N 3.49Å; D890-N892 PolarHBondContact OD1-ND2 3.26Å; D890-A893 HydrophobicContact CB-CB 4.46Å; D890-A893 WeakPolarHBondContact O-CB 3.47Å; D890-A893 PolarHBondContact O-N 3.19Å; D890-V894 PolarHBondContact O-N 3.03Å
891	I	75	Confident	82.8	Confident	113 Å²	113	80.2 Å²	80.2	58%	0.579	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-60.9	-25.1	-179.2	-160.1	154.7	0	0	0	112.2	V889 A893 V894	V889-I891 PolarHBondContact O-N 3.4Å; I891-A893 VanDerWaalsContact C-N 3.29Å; I891-A893 PolarHBondContact O-N 3.37Å; I891-V894 WeakPolarHBondContact O-CB 3.49Å; I891-V894 PolarHBondContact O-N 2.93Å
892	N	77.7	Confident	83	Confident	141 Å²	141	83 Å²	83	75%	0.754	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-72.9	-22.5	175	-60.2	-54	0	0	0	112.9	D890 V894	D890-N892 PolarHBondContact O-N 2.74Å; D890-N892 VanDerWaalsContact O-N 3.16Å; D890-N892 WeakPolarHBondContact OD1-CB 3.42Å; D890-N892 PolarHBondContact OD1-N 3.49Å; D890-N892 PolarHBondContact OD1-ND2 3.26Å; N892-V894 VanDerWaalsContact C-N 3.32Å
893	A	82.7	Confident	83.1	Confident	25 Å²	25	84.3 Å²	84.3	21%	0.207	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-82.5	-13.9	172.5	0	0	0	0	0	112	D890 I891 T895 A920 A921	D890-A893 HydrophobicContact CB-CB 4.46Å; D890-A893 WeakPolarHBondContact O-CB 3.47Å; D890-A893 PolarHBondContact O-N 3.19Å; I891-A893 VanDerWaalsContact C-N 3.29Å; I891-A893 PolarHBondContact O-N 3.37Å; A893-T895 PolarHBondContact O-N 3.29Å; A893-A920 CarbonylContact O-C 3.59Å; A893-A920 WeakPolarHBondContact O-CA 3.47Å; A893-A921 PolarHBondContact O-N 3.26Å
894	V	84.3	Confident	82.8	Confident	24 Å²	24	85 Å²	85	15%	0.145	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	119.2	-179.5	179.2	0	0	0	0	110.4	I887 V889 D890 I891 N892 S896 I897 V918 E919	I887-V894 HydrophobicContact CG2-CG2 4.02Å; V889-V894 HydrophobicContact CG2-CG2 3.76Å; D890-V894 PolarHBondContact O-N 3.03Å; I891-V894 WeakPolarHBondContact O-CB 3.49Å; I891-V894 PolarHBondContact O-N 2.93Å; N892-V894 VanDerWaalsContact C-N 3.32Å; V894-S896 WeakPolarHBondContact CG1-O 3.34Å; V894-I897 HydrophobicContact CG1-CD1 3.96Å; V894-I897 HydrophobicContact CG1-CG1 3.45Å; V894-I897 VanDerWaalsContact CG1-CG1 3.45Å; V894-V918 HydrophobicContact CB-CG1 4.27Å; V894-V918 HydrophobicContact CG1-CG1 3.59Å; V894-V918 HydrophobicContact CG2-CG1 3.64Å; V894-E919 CarbonylContact C-O 3.5Å
895	T	88.6	Confident	82.3	Confident	95 Å²	95	84.3 Å²	84.3	58%	0.583	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	-32.5	177.6	56.4	0	0	0	0	112.8	A893 E919 A921	A893-T895 PolarHBondContact O-N 3.29Å; T895-E919 PolarHBondContact N-O 3.27Å; T895-E919 PolarHBondContact OG1-O 2.96Å; T895-A921 HydrophobicContact CG2-CB 3.74Å
896	S	88.8	Confident	81.9	Confident	30 Å²	30	84 Å²	84	21%	0.21	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145.1	178	84.6	0	0	0	0	111.5	V894 E919	V894-S896 WeakPolarHBondContact CG1-O 3.34Å; S896-E919 PolarHBondContact N-O 3.43Å; S896-E919 PolarHBondContact O-N 2.74Å; S896-E919 VanDerWaalsContact OG-CB 3.32Å; S896-E919 WeakPolarHBondContact OG-CB 3.33Å; S896-E919 VanDerWaalsContact OG-CD 3.29Å; S896-E919 WeakPolarHBondContact OG-CG 3.47Å; S896-E919 PolarHBondContact OG-OE2 3.42Å
897	I	87.8	Confident	81.1	Confident	88 Å²	88	86.3 Å²	86.3	45%	0.451	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	123	171.8	-58.4	177.4	0	0	0	107.3	I887 V894 L916 K917	I887-I897 HydrophobicContact CD1-CD1 3.7Å; I887-I897 HydrophobicContact CD1-CG1 4.45Å; V894-I897 HydrophobicContact CG1-CD1 3.96Å; V894-I897 HydrophobicContact CG1-CG1 3.45Å; V894-I897 VanDerWaalsContact CG1-CG1 3.45Å; I897-L916 HydrophobicContact CG2-CD1 3.48Å; I897-L916 VanDerWaalsContact CG2-CD1 3.48Å; I897-L916 HydrophobicContact CG2-CG 4.21Å; I897-K917 WeakPolarHBondContact CA-O 3.43Å
898	E	88.9	Confident	79.9	Confident	70 Å²	70	94 Å²	94	33%	0.327	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135	178.1	-57	172.1	-166.3	0	0	110.4	H900 L916 K917	E898-H900 WeakPolarHBondContact CB-NE2 3.42Å; E898-H900 IonicContact OE2-CD2 3.83Å; E898-H900 IonicContact OE2-CE1 3.01Å; E898-H900 PolarHBondContact OE2-CE1 3.08Å; E898-H900 IonicContact OE2-NE2 2.69Å; E898-H900 PolarHBondContact OE2-NE2 3.47Å; E898-L916 WeakPolarHBondContact O-CA 3.29Å; E898-K917 HydrophobicContact CB-CB 4.27Å; E898-K917 PolarHBondContact N-O 3.07Å; E898-K917 PolarHBondContact O-N 3.43Å; E898-K917 IonicContact OE1-NZ 3.14Å; E898-K917 PolarHBondContact OE1-NZ 3.08Å; E898-K917 WeakPolarHBondContact OE2-CD 3.35Å; E898-K917 IonicContact OE2-NZ 3.02Å
899	L	90.4	Very high	79.2	Confident	125 Å²	125	90.7 Å²	90.7	65%	0.654	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	110.3	175.2	-165.5	76.3	0	0	0	109.7	V914 Y915 L916	L899-V914 HydrophobicContact CD1-CG1 3.38Å; L899-V914 HydrophobicContact CD2-CG1 4.12Å; L899-V914 HydrophobicContact CG-CG1 3.63Å; L899-Y915 CarbonylContact C-O 3.6Å; L899-Y915 WeakPolarHBondContact CA-O 3.44Å; L899-L916 HydrophobicContact CD1-CD1 3.87Å
900	H	89.7	Confident	78.5	Confident	70 Å²	70	96.5 Å²	96.5	32%	0.324	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	104	-179.6	-66.7	-99.7	0	0	0	109.9	E898 F902 V914 Y915	E898-H900 WeakPolarHBondContact CB-NE2 3.42Å; E898-H900 IonicContact OE2-CD2 3.83Å; E898-H900 IonicContact OE2-CE1 3.01Å; E898-H900 PolarHBondContact OE2-CE1 3.08Å; E898-H900 IonicContact OE2-NE2 2.69Å; E898-H900 PolarHBondContact OE2-NE2 3.47Å; H900-F902 HydrophobicContact CB-CE2 3.76Å; H900-F902 HydrophobicContact CB-CZ 4.3Å; H900-V914 CarbonylContact O-C 3.54Å; H900-V914 WeakPolarHBondContact O-CA 3.34Å; H900-Y915 PolarHBondContact N-O 2.98Å; H900-Y915 PolarHBondContact O-N 3.07Å
901	A	88.2	Confident	78.3	Confident	74 Å²	74	94.2 Å²	94.2	61%	0.612	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	120.6	176.8	0	0	0	0	0	110.5	V914	A901-V914 HydrophobicContact CB-CG2 4.11Å
902	F	86.4	Confident	78.4	Confident	126 Å²	126	92.5 Å²	92.5	55%	0.553	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.8	171.7	-58.6	-88.6	0	0	0	108	H900 A912 V913 Y915	H900-F902 HydrophobicContact CB-CE2 3.76Å; H900-F902 HydrophobicContact CB-CZ 4.3Å; F902-A912 CarbonylContact O-C 3.55Å; F902-A912 VanDerWaalsContact O-CA 3.25Å; F902-A912 WeakPolarHBondContact O-CA 3.17Å; F902-V913 PolarHBondContact N-O 2.96Å; F902-V913 PolarHBondContact O-N 3.36Å; F902-Y915 AromaticContact CD2-CD2 3.72Å; F902-Y915 HydrophobicContact CD2-CD2 3.72Å; F902-Y915 AromaticContact CD2-CE2 3.79Å; F902-Y915 HydrophobicContact CD2-CE2 3.79Å; F902-Y915 AromaticContact CE2-CD2 3.74Å; F902-Y915 HydrophobicContact CE2-CD2 3.74Å; F902-Y915 HydrophobicContact CE2-CE2 4.03Å
903	A	86.4	Confident	78.7	Confident	86 Å²	86	89.2 Å²	89.2	71%	0.711	52%	0.515	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.8	175.4	0	0	0	0	0	109.6	G911 A912	A903-G911 CarbonylContact C-O 3.53Å; A903-G911 WeakPolarHBondContact CA-O 3.32Å; A903-A912 HydrophobicContact CB-CB 4.12Å
904	D	79.4	Confident	78.7	Confident	135 Å²	135	92.1 Å²	92.1	72%	0.722	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	155.4	174.3	-163.9	8.9	0	0	0	110.1	G911	D904-G911 PolarHBondContact N-O 2.96Å; D904-G911 PolarHBondContact O-N 3.47Å; D904-G911 VanDerWaalsContact O-O 3.08Å
905	A	74.3	Confident	78.8	Confident	54 Å²	54	97.4 Å²	97.4	45%	0.446	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	119.4	-174.4	0	0	0	0	0	110.2	Y910	A905-Y910 HydrophobicContact CB-CD1 3.37Å; A905-Y910 HydrophobicContact CB-CE1 3.58Å; A905-Y910 HydrophobicContact CB-CG 4.47Å
906	S	72.7	Confident	78.6	Confident	68 Å²	68	96.4 Å²	96.4	48%	0.476	54%	0.538	S	S	.	.			trans	-95.4	171.8	167.3	69.1	0	0	0	0	110.9	K908 A909	S906-K908 PolarHBondContact O-N 3.45Å; S906-K908 PolarHBondContact OG-N 3.47Å; S906-A909 PolarHBondContact N-O 3Å; S906-A909 PolarHBondContact OG-N 3.01Å; S906-A909 PolarHBondContact OG-O 3.37Å; S906-A909 VanDerWaalsContact OG-O 3.06Å
907	E	61.8	Low	78.6	Confident	168 Å²	168	99 Å²	99	79%	0.785	55%	0.546	S	S	*	.	S	Bend	trans	-60.2	-13.5	168.6	-65	-169.5	161.8	0	0	113.5	R846	R846-E907 PolarHBondContact NH1-O 2.97Å; R846-E907 PolarHBondContact NH2-O 3.47Å; R846-E907 VanDerWaalsContact NH2-O 3.13Å
908	K	53.7	Low	78.5	Confident	195 Å²	195	97 Å²	97	85%	0.848	54%	0.538	S	S	*	.	S	Bend	trans	-108.7	-36.4	-175.5	-64.6	-177.4	-178.8	174.1	0	113.9	S906	S906-K908 PolarHBondContact O-N 3.45Å; S906-K908 PolarHBondContact OG-N 3.47Å
909	A	57.3	Low	78.4	Confident	57 Å²	57	97.6 Å²	97.6	47%	0.471	54%	0.541	S	S	.	.			trans	-153.3	152.9	-173.9	0	0	0	0	0	112	S906	S906-A909 PolarHBondContact N-O 3Å; S906-A909 PolarHBondContact OG-N 3.01Å; S906-A909 PolarHBondContact OG-O 3.37Å; S906-A909 VanDerWaalsContact OG-O 3.06Å
910	Y	62.4	Low	78.1	Confident	189 Å²	189	93.8 Å²	93.8	74%	0.741	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	134.1	166.2	-56.7	-84.2	0	0	0	107.8	A905	A905-Y910 HydrophobicContact CB-CD1 3.37Å; A905-Y910 HydrophobicContact CB-CE1 3.58Å; A905-Y910 HydrophobicContact CB-CG 4.47Å
911	G	67.7	Low	77.6	Confident	46 Å²	46	93 Å²	93	47%	0.474	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.2	174.6	0	0	0	0	0	109.4	A903 D904	A903-G911 CarbonylContact C-O 3.53Å; A903-G911 WeakPolarHBondContact CA-O 3.32Å; D904-G911 PolarHBondContact N-O 2.96Å; D904-G911 PolarHBondContact O-N 3.47Å; D904-G911 VanDerWaalsContact O-O 3.08Å
912	A	77.1	Confident	76.4	Confident	76 Å²	76	98.4 Å²	98.4	63%	0.628	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.3	139.5	170.7	0	0	0	0	0	108.9	F902 A903	F902-A912 CarbonylContact O-C 3.55Å; F902-A912 VanDerWaalsContact O-CA 3.25Å; F902-A912 WeakPolarHBondContact O-CA 3.17Å; A903-A912 HydrophobicContact CB-CB 4.12Å
913	V	83.5	Confident	74.8	Confident	73 Å²	73	98.2 Å²	98.2	44%	0.442	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.8	132.4	172.6	-175.1	0	0	0	0	107.4	F902 Y915	F902-V913 PolarHBondContact N-O 2.96Å; F902-V913 PolarHBondContact O-N 3.36Å; V913-Y915 HydrophobicContact CB-CE2 4.12Å; V913-Y915 HydrophobicContact CG1-CD2 4.04Å; V913-Y915 HydrophobicContact CG1-CE1 4.15Å; V913-Y915 HydrophobicContact CG1-CE2 3.44Å; V913-Y915 VanDerWaalsContact CG1-CE2 3.44Å; V913-Y915 VanDerWaalsContact CG1-CZ 3.49Å
914	V	83.1	Confident	72.9	Confident	86 Å²	86	100.4 Å²	100.4	52%	0.521	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.9	123.2	178.5	-175.9	0	0	0	0	107.7	L899 H900 A901	L899-V914 HydrophobicContact CD1-CG1 3.38Å; L899-V914 HydrophobicContact CD2-CG1 4.12Å; L899-V914 HydrophobicContact CG-CG1 3.63Å; H900-V914 CarbonylContact O-C 3.54Å; H900-V914 WeakPolarHBondContact O-CA 3.34Å; A901-V914 HydrophobicContact CB-CG2 4.11Å
915	Y	86.4	Confident	70.8	Confident	135 Å²	135	105.2 Å²	105.2	53%	0.529	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.2	135	174.5	-60.6	-88.1	0	0	0	109.6	L899 H900 F902 V913	L899-Y915 CarbonylContact C-O 3.6Å; L899-Y915 WeakPolarHBondContact CA-O 3.44Å; H900-Y915 PolarHBondContact N-O 2.98Å; H900-Y915 PolarHBondContact O-N 3.07Å; F902-Y915 AromaticContact CD2-CD2 3.72Å; F902-Y915 HydrophobicContact CD2-CD2 3.72Å; F902-Y915 AromaticContact CD2-CE2 3.79Å; F902-Y915 HydrophobicContact CD2-CE2 3.79Å; F902-Y915 AromaticContact CE2-CD2 3.74Å; F902-Y915 HydrophobicContact CE2-CD2 3.74Å; F902-Y915 HydrophobicContact CE2-CE2 4.03Å; V913-Y915 HydrophobicContact CB-CE2 4.12Å; V913-Y915 HydrophobicContact CG1-CD2 4.04Å; V913-Y915 HydrophobicContact CG1-CE1 4.15Å; V913-Y915 HydrophobicContact CG1-CE2 3.44Å; V913-Y915 VanDerWaalsContact CG1-CE2 3.44Å; V913-Y915 VanDerWaalsContact CG1-CZ 3.49Å
916	L	84.6	Confident	70.6	Confident	73 Å²	73	107.8 Å²	107.8	38%	0.382	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.1	107.9	169	-171.7	72.2	0	0	0	107.7	L886 I887 I897 E898 L899 V918	L886-L916 HydrophobicContact CB-CD2 4.25Å; I887-L916 HydrophobicContact CD1-CD2 4.43Å; I887-L916 HydrophobicContact CG1-CD2 4.12Å; I897-L916 HydrophobicContact CG2-CD1 3.48Å; I897-L916 VanDerWaalsContact CG2-CD1 3.48Å; I897-L916 HydrophobicContact CG2-CG 4.21Å; E898-L916 WeakPolarHBondContact O-CA 3.29Å; L899-L916 HydrophobicContact CD1-CD1 3.87Å; L916-V918 HydrophobicContact CD2-CG2 4.21Å; L916-V918 HydrophobicContact CG-CG2 4.1Å
917	K	88.4	Confident	70.5	Confident	85 Å²	85	109.9 Å²	109.9	37%	0.37	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.7	125.9	173.9	-176.7	-162.8	171.4	-155.9	0	107.7	I897 E898 E919	I897-K917 WeakPolarHBondContact CA-O 3.43Å; E898-K917 HydrophobicContact CB-CB 4.27Å; E898-K917 PolarHBondContact N-O 3.07Å; E898-K917 PolarHBondContact O-N 3.43Å; E898-K917 IonicContact OE1-NZ 3.14Å; E898-K917 PolarHBondContact OE1-NZ 3.08Å; E898-K917 WeakPolarHBondContact OE2-CD 3.35Å; E898-K917 IonicContact OE2-NZ 3.02Å; K917-E919 WeakPolarHBondContact CE-OE1 3.41Å; K917-E919 IonicContact NZ-OE1 3.91Å; K917-E919 PolarHBondContact NZ-OE1 3.32Å
918	V	86.8	Confident	71	Confident	46 Å²	46	106.7 Å²	106.7	28%	0.279	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.5	124.4	179	-176.1	0	0	0	0	108.1	I887 V889 V894 L916	I887-V918 HydrophobicContact CD1-CG2 4.11Å; I887-V918 HydrophobicContact CG1-CG2 4.02Å; I887-V918 HydrophobicContact CG2-CG1 4.01Å; I887-V918 HydrophobicContact CG2-CG2 4.47Å; V889-V918 HydrophobicContact CG2-CG1 4.47Å; V894-V918 HydrophobicContact CB-CG1 4.27Å; V894-V918 HydrophobicContact CG1-CG1 3.59Å; V894-V918 HydrophobicContact CG2-CG1 3.64Å; L916-V918 HydrophobicContact CD2-CG2 4.21Å; L916-V918 HydrophobicContact CG-CG2 4.1Å
919	E	86.1	Confident	72	Confident	82 Å²	82	101.5 Å²	101.5	38%	0.383	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	119	171.6	-60.6	176.6	159.5	0	0	108.7	V894 T895 S896 K917	V894-E919 CarbonylContact C-O 3.5Å; T895-E919 PolarHBondContact N-O 3.27Å; T895-E919 PolarHBondContact OG1-O 2.96Å; S896-E919 PolarHBondContact N-O 3.43Å; S896-E919 PolarHBondContact O-N 2.74Å; S896-E919 VanDerWaalsContact OG-CB 3.32Å; S896-E919 WeakPolarHBondContact OG-CB 3.33Å; S896-E919 VanDerWaalsContact OG-CD 3.29Å; S896-E919 WeakPolarHBondContact OG-CG 3.47Å; S896-E919 PolarHBondContact OG-OE2 3.42Å; K917-E919 WeakPolarHBondContact CE-OE1 3.41Å; K917-E919 IonicContact NZ-OE1 3.91Å; K917-E919 PolarHBondContact NZ-OE1 3.32Å
920	A	84	Confident	72.9	Confident	45 Å²	45	104.3 Å²	104.3	37%	0.372	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.4	143.1	172.7	0	0	0	0	0	110.1	V889 A893 Q922	V889-A920 HydrophobicContact CG2-CB 4.23Å; A893-A920 CarbonylContact O-C 3.59Å; A893-A920 WeakPolarHBondContact O-CA 3.47Å; A920-Q922 PolarHBondContact O-N 3.4Å
921	A	78.6	Confident	73.7	Confident	53 Å²	53	98.6 Å²	98.6	44%	0.438	57%	0.566	S	S	.	*			trans	-57.2	130.1	166.5	0	0	0	0	0	107.5	A893 T895 T923	A893-A921 PolarHBondContact O-N 3.26Å; T895-A921 HydrophobicContact CG2-CB 3.74Å; A921-T923 VanDerWaalsContact C-N 3.34Å; A921-T923 PolarHBondContact O-N 2.95Å
922	Q	64	Low	74.1	Confident	189 Å²	189	102.4 Å²	102.4	88%	0.883	57%	0.573	S	S	*	*			trans	-60	102.4	171.2	-81.3	-177.3	-16.5	0	0	107.8	A920 T924	A920-Q922 PolarHBondContact O-N 3.4Å; Q922-T924 VanDerWaalsContact C-N 3.3Å; Q922-T924 PolarHBondContact O-N 3.47Å
923	T	53.2	Low	73.8	Confident	122 Å²	122	104.4 Å²	104.4	75%	0.748	57%	0.569	S	S	*	*			trans	-64.1	101.8	155.7	13.9	0	0	0	0	105.2	A921 L925	A921-T923 VanDerWaalsContact C-N 3.34Å; A921-T923 PolarHBondContact O-N 2.95Å; T923-L925 VanDerWaalsContact C-N 3.29Å; T923-L925 PolarHBondContact O-N 3.04Å
924	T	45.1	Very low	73	Confident	132 Å²	132	107 Å²	107	81%	0.81	58%	0.579	S	S	*	*			trans	-52.5	102.2	157.8	27.6	0	0	0	0	107	Q922	Q922-T924 VanDerWaalsContact C-N 3.3Å; Q922-T924 PolarHBondContact O-N 3.47Å
925	L	36.3	Very low	72.1	Confident	236 Å²	236	108.9 Å²	108.9	100%	1.236	59%	0.585	S	S	*	*			trans	-52.4	0	145.7	-77.6	161.1	0	0	0	108.1	T923	T923-L925 VanDerWaalsContact C-N 3.29Å; T923-L925 PolarHBondContact O-N 3.04Å

Retrieved 925 of 925 residues in 943.4 ms (Link to these results)

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