A0A3Q0KKL1_SCHMA Loading...

CST complex subunit CTC1

AlphaFold DB (A0A5K4EL08), UniProt , Accession A0A3Q0KKL1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 858 aa.

						>A0A3Q0KKL1_SCHMA|A0A3Q0KKL1
MALTTVLRDILPLLDMSAYCNYKSALEKTITCVSQYCKSGVCSEHLRIFFLNQRINQLFVLVVKDCGVTNDLSYPKIPVLLTPPPSPGISSLLCSQCGQFLALISETCVFVVDAQFGLKEFCQDQIVRPLYCAIDLRDLSSKSKLNGVIVKVRWHPKSNRTLVIVTENSFIYYIHCVKSSENQSIRFNLWLEADLSVFTHSALDATYQDMNDSDEGSYNENDDNSSSLSNTKMNLSFALGSKCVDFDFGSPLFISKRGLSEAQLQDCCLFLLYETGDVIQVCGCLSVRKMNQLKCNVLHIFPPSIDNYGDEFCAIHCIRPIDSSEMFSFEKPPDILVLADKIGRLHNGIVLRANIPGQNKNKNQITTPSVLLCLIDIVDLDLMSSNTTTSQQCHPNGSILHSSNYSEYNHFESPSLSLEPANLNFLDNIEYNSYSIDGSDFVKNKIFGLKYSHQGYYVIHHMGIHLVNLSWIENLSLWCSEFNSQLLSDSIKSPIEEIRDWQSCVKHLVCGQITISTPDGMNDDIEGKFRLAGFIELPSNFLSKNQPKSKNTTTLADCRSTKGVTLLFIRAPIQQIDSTASMTDYSCLVHFINLTRKPEIYAMKQQRYTGLDSRTTDQYDSCNSTLRSHFTSQIKQVLSGENSHFPVITGLNLQPDLTQQQLVQFFIKVSDILRKGPLDRLMRARSMIEHHSRQLQDIISAQHSEAMKLTSERQTLQSKAEELAKRHSIITERQSMLDKRMANLATRLAALGEGPTKAEIAMRNEVIVIRDRLHKGLRQWLSNLKNRRDKLERQILLRKKTDKSSIRSSLPGSLLRTTENIEGNQWQTVSEELRRETLEIKMLINAVKTLNTKTINPT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.7	Very low	42.9	Very low	148 Å²	148	51.1 Å²	51.1	73%	0.729	26%	0.261	S	S	*	.				0	-62.6	0	-80.3	-165.9	-171.9	0	0	112.5	L3 T4 T5 L72	M1-L3 VanDerWaalsContact C-N 3.29Å; M1-L3 PolarHBondContact O-N 3.06Å; M1-T4 PolarHBondContact O-N 2.76Å; M1-T4 VanDerWaalsContact O-N 3.08Å; M1-T5 PolarHBondContact O-N 3.09Å; M1-T5 PolarHBondContact O-OG1 2.88Å; M1-L72 HydrophobicContact SD-CD2 4.06Å
2	A	37.6	Very low	43.2	Very low	30 Å²	30	53.3 Å²	53.3	25%	0.248	28%	0.281	C	S	.	.	H	α-helix	trans	-48.1	-48.3	177.4	0	0	0	0	0	113.6	T5 V6 Y74	A2-T5 PolarHBondContact O-N 3.44Å; A2-V6 VanDerWaalsContact O-CG2 3.31Å; A2-V6 WeakPolarHBondContact O-CG2 3.47Å; A2-V6 PolarHBondContact O-N 3.28Å; A2-Y74 WeakPolarHBondContact CA-OH 3.35Å; A2-Y74 WeakPolarHBondContact CB-OH 3.19Å
3	L	38.5	Very low	43.4	Very low	52 Å²	52	50.5 Å²	50.5	27%	0.272	27%	0.266	S	S	.	.	H	α-helix	trans	-57.6	-49.4	176.1	-161	74.2	0	0	0	113.6	M1 T5 V6 L7 L542 F591	M1-L3 VanDerWaalsContact C-N 3.29Å; M1-L3 PolarHBondContact O-N 3.06Å; L3-T5 VanDerWaalsContact C-N 3.28Å; L3-T5 PolarHBondContact O-N 3.1Å; L3-V6 PolarHBondContact O-N 2.89Å; L3-L7 HydrophobicContact CG-CD1 4.18Å; L3-L7 WeakPolarHBondContact O-CB 3.32Å; L3-L7 WeakPolarHBondContact O-CG 3.29Å; L3-L7 PolarHBondContact O-N 2.98Å; L3-L542 HydrophobicContact CD1-CD2 3.82Å; L3-L542 HydrophobicContact CD2-CD2 4.33Å; L3-F591 HydrophobicContact CD1-CD1 4.2Å; L3-F591 HydrophobicContact CD1-CD2 4.37Å; L3-F591 HydrophobicContact CD1-CE1 3.39Å; L3-F591 HydrophobicContact CD1-CE2 3.63Å; L3-F591 HydrophobicContact CD1-CZ 3.09Å; L3-F591 HydrophobicContact CD2-CE2 4.16Å; L3-F591 HydrophobicContact CD2-CZ 4.46Å; L3-F591 HydrophobicContact CG-CE2 4.05Å; L3-F591 HydrophobicContact CG-CZ 3.92Å
4	T	38.5	Very low	43.7	Very low	86 Å²	86	47.9 Å²	47.9	53%	0.528	25%	0.253	S	S	.	.	H	α-helix	trans	-66.7	-32.8	-177.6	-26.3	0	0	0	0	111.3	M1 R8	M1-T4 PolarHBondContact O-N 2.76Å; M1-T4 VanDerWaalsContact O-N 3.08Å; T4-R8 WeakPolarHBondContact O-CB 3.15Å; T4-R8 PolarHBondContact O-N 3.48Å
5	T	44.3	Very low	43.7	Very low	7 Å²	7	49.5 Å²	49.5	4%	0.043	26%	0.261	C	S	.	.	H	α-helix	trans	-75.7	-44.9	175.7	-43.7	0	0	0	0	111.2	M1 A2 L3 L7 R8 D9 Y74	M1-T5 PolarHBondContact O-N 3.09Å; M1-T5 PolarHBondContact O-OG1 2.88Å; A2-T5 PolarHBondContact O-N 3.44Å; L3-T5 VanDerWaalsContact C-N 3.28Å; L3-T5 PolarHBondContact O-N 3.1Å; T5-L7 VanDerWaalsContact C-N 3.3Å; T5-L7 PolarHBondContact O-N 3.28Å; T5-R8 CarbonylContact O-C 3.58Å; T5-R8 PolarHBondContact O-N 2.71Å; T5-R8 PolarHBondContact OG1-NH2 2.92Å; T5-R8 VanDerWaalsContact OG1-NH2 3.09Å; T5-D9 WeakPolarHBondContact CG2-OD2 3.35Å; T5-D9 WeakPolarHBondContact O-CB 3.31Å; T5-D9 PolarHBondContact O-N 3.2Å; T5-Y74 HydrophobicContact CG2-CD2 3.58Å; T5-Y74 HydrophobicContact CG2-CE2 4.06Å
6	V	45.3	Very low	43.4	Very low	9 Å²	9	48 Å²	48	6%	0.055	25%	0.253	C	S	.	.	H	α-helix	trans	-57.4	-43.4	172.4	170.8	0	0	0	0	111.2	A2 L3 D9 I10 L61 Y74	A2-V6 VanDerWaalsContact O-CG2 3.31Å; A2-V6 WeakPolarHBondContact O-CG2 3.47Å; A2-V6 PolarHBondContact O-N 3.28Å; L3-V6 PolarHBondContact O-N 2.89Å; V6-D9 PolarHBondContact O-N 3.46Å; V6-I10 HydrophobicContact CG1-CD1 3.41Å; V6-I10 VanDerWaalsContact CG1-CD1 3.41Å; V6-I10 HydrophobicContact CG1-CG1 4.16Å; V6-I10 VanDerWaalsContact O-CB 3.24Å; V6-I10 WeakPolarHBondContact O-CB 3.31Å; V6-I10 WeakPolarHBondContact O-CG1 3.38Å; V6-I10 PolarHBondContact O-N 3.42Å; V6-L61 HydrophobicContact CG1-CD2 4.44Å; V6-Y74 HydrophobicContact CG2-CE2 4.48Å
7	L	44	Very low	43	Very low	27 Å²	27	51.3 Å²	51.3	14%	0.141	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-48.2	174.8	-71.6	170.6	0	0	0	112.2	L3 T5 D9 I10 L11 V589 F591	L3-L7 HydrophobicContact CG-CD1 4.18Å; L3-L7 WeakPolarHBondContact O-CB 3.32Å; L3-L7 WeakPolarHBondContact O-CG 3.29Å; L3-L7 PolarHBondContact O-N 2.98Å; T5-L7 VanDerWaalsContact C-N 3.3Å; T5-L7 PolarHBondContact O-N 3.28Å; L7-D9 PolarHBondContact O-N 2.86Å; L7-I10 PolarHBondContact O-N 3.26Å; L7-L11 HydrophobicContact CB-CD1 4.22Å; L7-L11 WeakPolarHBondContact O-CB 3.39Å; L7-L11 VanDerWaalsContact O-CD1 3.3Å; L7-L11 WeakPolarHBondContact O-CD1 3.44Å; L7-L11 WeakPolarHBondContact O-CG 3.36Å; L7-L11 PolarHBondContact O-N 3.4Å; L7-V589 HydrophobicContact CD2-CB 3.28Å; L7-V589 HydrophobicContact CD2-CG1 3.32Å; L7-V589 HydrophobicContact CD2-CG2 3.56Å; L7-F591 HydrophobicContact CD1-CE2 4.4Å; L7-F591 HydrophobicContact CD2-CE2 4.47Å
8	R	46.9	Very low	42.6	Very low	147 Å²	147	51.1 Å²	51.1	56%	0.555	29%	0.287	S	S	*	.	H	α-helix	trans	-62.2	-24.1	176.4	174	174.3	43.5	176.1	-7.7	113.4	T4 T5 P12	T4-R8 WeakPolarHBondContact O-CB 3.15Å; T4-R8 PolarHBondContact O-N 3.48Å; T5-R8 CarbonylContact O-C 3.58Å; T5-R8 PolarHBondContact O-N 2.71Å; T5-R8 PolarHBondContact OG1-NH2 2.92Å; T5-R8 VanDerWaalsContact OG1-NH2 3.09Å; R8-P12 WeakPolarHBondContact O-CD 3.35Å; R8-P12 WeakPolarHBondContact O-CG 3.49Å
9	D	48.4	Very low	42.3	Very low	36 Å²	36	51.6 Å²	51.6	19%	0.193	28%	0.284	C	S	.	.	H	α-helix	trans	-95	-34.2	179.7	-62.1	-21.3	0	0	0	112	T5 V6 L7 L13	T5-D9 WeakPolarHBondContact CG2-OD2 3.35Å; T5-D9 WeakPolarHBondContact O-CB 3.31Å; T5-D9 PolarHBondContact O-N 3.2Å; V6-D9 PolarHBondContact O-N 3.46Å; L7-D9 PolarHBondContact O-N 2.86Å; D9-L13 VanDerWaalsContact O-CD1 3.25Å; D9-L13 WeakPolarHBondContact O-CD1 3.29Å; D9-L13 VanDerWaalsContact O-CG 3.25Å; D9-L13 WeakPolarHBondContact O-CG 3.43Å
10	I	49.2	Very low	41.6	Very low	4 Å²	4	53.7 Å²	53.7	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-74.2	-40.4	175.6	-69.3	176.1	0	0	0	111.9	V6 L7 L13 L14 F50 L61 I569	V6-I10 HydrophobicContact CG1-CD1 3.41Å; V6-I10 VanDerWaalsContact CG1-CD1 3.41Å; V6-I10 HydrophobicContact CG1-CG1 4.16Å; V6-I10 VanDerWaalsContact O-CB 3.24Å; V6-I10 WeakPolarHBondContact O-CB 3.31Å; V6-I10 WeakPolarHBondContact O-CG1 3.38Å; V6-I10 PolarHBondContact O-N 3.42Å; L7-I10 PolarHBondContact O-N 3.26Å; I10-L13 VanDerWaalsContact O-CB 3.29Å; I10-L13 WeakPolarHBondContact O-CB 3.46Å; I10-L13 PolarHBondContact O-N 2.93Å; I10-L13 VanDerWaalsContact O-N 3.13Å; I10-L14 PolarHBondContact O-N 2.95Å; I10-F50 HydrophobicContact CD1-CZ 4.09Å; I10-F50 HydrophobicContact CG1-CZ 4.04Å; I10-L61 HydrophobicContact CD1-CD2 4.43Å; I10-L61 HydrophobicContact CG1-CD2 4.34Å; I10-I569 HydrophobicContact CG2-CD1 4.08Å
11	L	47.9	Very low	41	Very low	16 Å²	16	57.4 Å²	57.4	8%	0.084	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-41	-175.2	-75	162.8	0	0	0	113.5	L7 L13 L14 Y585 L588 V589	L7-L11 HydrophobicContact CB-CD1 4.22Å; L7-L11 WeakPolarHBondContact O-CB 3.39Å; L7-L11 VanDerWaalsContact O-CD1 3.3Å; L7-L11 WeakPolarHBondContact O-CD1 3.44Å; L7-L11 WeakPolarHBondContact O-CG 3.36Å; L7-L11 PolarHBondContact O-N 3.4Å; L11-L13 VanDerWaalsContact C-N 3.32Å; L11-L13 PolarHBondContact O-N 2.93Å; L11-L14 HydrophobicContact CD2-CD1 4.16Å; L11-L14 WeakPolarHBondContact O-CB 3.46Å; L11-L14 PolarHBondContact O-N 3.45Å; L11-Y585 WeakPolarHBondContact CD2-O 3.46Å; L11-L588 HydrophobicContact CD2-CB 3.96Å; L11-L588 HydrophobicContact CD2-CD1 4.02Å; L11-L588 HydrophobicContact CD2-CG 4.44Å; L11-V589 HydrophobicContact CD2-CG2 4.05Å; L11-V589 HydrophobicContact CG-CG2 4.41Å
12	P	46.4	Very low	40.8	Very low	78 Å²	78	51.8 Å²	51.8	51%	0.506	29%	0.292	S	S	.	.	H	α-helix	trans	-72.6	-21.6	172.2	-19.2	33.5	0	0	0	113.8	R8 L14 D15	R8-P12 WeakPolarHBondContact O-CD 3.35Å; R8-P12 WeakPolarHBondContact O-CG 3.49Å; P12-L14 PolarHBondContact O-N 3.23Å; P12-D15 PolarHBondContact O-N 2.93Å
13	L	45.7	Very low	40.2	Very low	16 Å²	16	55.9 Å²	55.9	8%	0.084	30%	0.304	C	S	.	.	H	α-helix	trans	-65.4	-20.1	173	-80.6	165.1	0	0	0	112.5	D9 I10 L11 D15 F50 F59 K76	D9-L13 VanDerWaalsContact O-CD1 3.25Å; D9-L13 WeakPolarHBondContact O-CD1 3.29Å; D9-L13 VanDerWaalsContact O-CG 3.25Å; D9-L13 WeakPolarHBondContact O-CG 3.43Å; I10-L13 VanDerWaalsContact O-CB 3.29Å; I10-L13 WeakPolarHBondContact O-CB 3.46Å; I10-L13 PolarHBondContact O-N 2.93Å; I10-L13 VanDerWaalsContact O-N 3.13Å; L11-L13 VanDerWaalsContact C-N 3.32Å; L11-L13 PolarHBondContact O-N 2.93Å; L13-D15 PolarHBondContact O-N 2.61Å; L13-F50 HydrophobicContact CD1-CD2 4.32Å; L13-F50 HydrophobicContact CD1-CE2 4.48Å; L13-F59 HydrophobicContact CD2-CB 3.9Å; L13-F59 HydrophobicContact CD2-CD1 3.63Å; L13-F59 HydrophobicContact CD2-CD2 3.68Å; L13-F59 HydrophobicContact CD2-CE1 4.02Å; L13-F59 HydrophobicContact CD2-CE2 4.08Å; L13-F59 HydrophobicContact CD2-CG 3.44Å; L13-F59 VanDerWaalsContact CD2-CG 3.44Å; L13-F59 HydrophobicContact CD2-CZ 4.23Å; L13-K76 HydrophobicContact CD1-CD 4.21Å; L13-K76 HydrophobicContact CD1-CG 4.44Å; L13-K76 HydrophobicContact CD2-CD 3.6Å; L13-K76 HydrophobicContact CD2-CG 4.12Å; L13-K76 VanDerWaalsContact CD2-NZ 3.33Å; L13-K76 HydrophobicContact CG-CD 3.83Å
14	L	48.1	Very low	39.6	Very low	15 Å²	15	56.8 Å²	56.8	8%	0.079	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-8.6	172.2	-57.2	175.8	0	0	0	113	I10 L11 P12 M16 Y19 I30 I569 L588	I10-L14 PolarHBondContact O-N 2.95Å; L11-L14 HydrophobicContact CD2-CD1 4.16Å; L11-L14 WeakPolarHBondContact O-CB 3.46Å; L11-L14 PolarHBondContact O-N 3.45Å; P12-L14 PolarHBondContact O-N 3.23Å; L14-M16 VanDerWaalsContact C-N 3.35Å; L14-M16 HydrophobicContact CB-CG 4.05Å; L14-M16 HydrophobicContact CB-SD 3.94Å; L14-M16 PolarHBondContact O-N 2.95Å; L14-Y19 WeakPolarHBondContact O-CE2 3.38Å; L14-Y19 PolarHBondContact O-OH 3Å; L14-I30 HydrophobicContact CD2-CD1 3.09Å; L14-I569 HydrophobicContact CD1-CG2 4.38Å; L14-L588 HydrophobicContact CD1-CD1 4.3Å
15	D	42.7	Very low	39	Very low	71 Å²	71	54.2 Å²	54.2	38%	0.38	30%	0.302	S	S	.	.			trans	40.1	54.2	-173.5	-165.3	10.5	0	0	0	114.4	P12 L13 S17 A18 Y19	P12-D15 PolarHBondContact O-N 2.93Å; L13-D15 PolarHBondContact O-N 2.61Å; D15-S17 PolarHBondContact O-N 2.96Å; D15-S17 PolarHBondContact OD1-OG 3.17Å; D15-A18 PolarHBondContact O-N 3.17Å; D15-Y19 WeakPolarHBondContact O-CD2 3.4Å; D15-Y19 WeakPolarHBondContact O-CE2 3.35Å
16	M	39	Very low	38.3	Very low	26 Å²	26	57.3 Å²	57.3	13%	0.128	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-59.6	-10.9	-177.8	-61.5	-61.5	-70.1	0	0	114.2	L14 A18 Y19 P572 Y585 L588	L14-M16 VanDerWaalsContact C-N 3.35Å; L14-M16 HydrophobicContact CB-CG 4.05Å; L14-M16 HydrophobicContact CB-SD 3.94Å; L14-M16 PolarHBondContact O-N 2.95Å; M16-A18 PolarHBondContact O-N 3.46Å; M16-Y19 VanDerWaalsContact CA-CD2 3.5Å; M16-Y19 HydrophobicContact SD-CD2 4.5Å; M16-Y19 HydrophobicContact SD-CE2 4.32Å; M16-P572 HydrophobicContact CE-CG 4.39Å; M16-Y585 HydrophobicContact CB-CE1 3.7Å; M16-Y585 HydrophobicContact CB-CE2 4.46Å; M16-Y585 HydrophobicContact CE-CD1 4.41Å; M16-Y585 HydrophobicContact CE-CE1 4.11Å; M16-Y585 HydrophobicContact CG-CD1 4.16Å; M16-Y585 HydrophobicContact CG-CE1 3.81Å; M16-L588 HydrophobicContact CE-CD1 4.08Å; M16-L588 HydrophobicContact SD-CD1 4.44Å
17	S	36.8	Very low	37.7	Very low	104 Å²	104	64.4 Å²	64.4	73%	0.727	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-76.4	-18.7	-175.2	74.4	0	0	0	0	114.5	D15	D15-S17 PolarHBondContact O-N 2.96Å; D15-S17 PolarHBondContact OD1-OG 3.17Å
18	A	35.6	Very low	37.1	Very low	47 Å²	47	67.7 Å²	67.7	39%	0.388	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-105.9	11	-179.4	0	0	0	0	0	114.4	D15 M16 C20	D15-A18 PolarHBondContact O-N 3.17Å; M16-A18 PolarHBondContact O-N 3.46Å; A18-C20 VanDerWaalsContact C-N 3.28Å; A18-C20 PolarHBondContact O-N 3.37Å
19	Y	36.9	Very low	36.7	Very low	61 Å²	61	64.6 Å²	64.6	24%	0.239	36%	0.361	C	S	.	.			trans	-85	48.5	-173.2	-79.6	-107.3	0	0	0	114	L14 D15 M16 N21 Y22 A25	L14-Y19 WeakPolarHBondContact O-CE2 3.38Å; L14-Y19 PolarHBondContact O-OH 3Å; D15-Y19 WeakPolarHBondContact O-CD2 3.4Å; D15-Y19 WeakPolarHBondContact O-CE2 3.35Å; M16-Y19 VanDerWaalsContact CA-CD2 3.5Å; M16-Y19 HydrophobicContact SD-CD2 4.5Å; M16-Y19 HydrophobicContact SD-CE2 4.32Å; Y19-N21 PolarHBondContact O-N 3.09Å; Y19-Y22 WeakPolarHBondContact O-CD2 3.42Å; Y19-Y22 WeakPolarHBondContact O-CE2 3.28Å; Y19-A25 HydrophobicContact CD1-CB 3.86Å; Y19-A25 HydrophobicContact CE1-CB 3.3Å
20	C	28.7	Very low	36.3	Very low	94 Å²	94	65.4 Å²	65.4	64%	0.635	37%	0.365	S	S	*	.	S	Bend	trans	-79.6	8	173.4	-62.7	0	0	0	0	113.9	A18	A18-C20 VanDerWaalsContact C-N 3.28Å; A18-C20 PolarHBondContact O-N 3.37Å
21	N	28.4	Very low	36.3	Very low	131 Å²	131	66.4 Å²	66.4	70%	0.701	37%	0.371	S	S	*	.			trans	-149.3	85.4	173.2	-101.5	-29.4	0	0	0	110.1	Y19 K23 S24	Y19-N21 PolarHBondContact O-N 3.09Å; N21-K23 PolarHBondContact O-N 2.67Å; N21-K23 VanDerWaalsContact O-N 3.09Å; N21-S24 PolarHBondContact O-N 3.15Å
22	Y	27.1	Very low	36.3	Very low	31 Å²	31	67.1 Å²	67.1	12%	0.122	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.7	-176.8	-95.2	-102.2	0	0	0	114.6	Y19 S24 L26 P572 Q575	Y19-Y22 WeakPolarHBondContact O-CD2 3.42Å; Y19-Y22 WeakPolarHBondContact O-CE2 3.28Å; Y22-S24 PolarHBondContact O-N 3.11Å; Y22-L26 VanDerWaalsContact O-CD1 3.29Å; Y22-L26 WeakPolarHBondContact O-CD1 3.37Å; Y22-P572 WeakPolarHBondContact CD1-O 3.46Å; Y22-P572 HydrophobicContact CE1-CB 3.78Å; Y22-P572 HydrophobicContact CE1-CG 3.87Å; Y22-P572 WeakPolarHBondContact CE1-O 3.11Å; Y22-Q575 VanDerWaalsContact CD2-CA 3.5Å; Y22-Q575 HydrophobicContact CD2-CB 3.49Å; Y22-Q575 VanDerWaalsContact CD2-CB 3.49Å; Y22-Q575 HydrophobicContact CD2-CG 3.67Å; Y22-Q575 VanDerWaalsContact CE2-CA 3.43Å; Y22-Q575 HydrophobicContact CE2-CB 3.76Å; Y22-Q575 HydrophobicContact CE2-CG 3.67Å; Y22-Q575 HydrophobicContact CG-CB 4.22Å
23	K	26.3	Very low	36.5	Very low	116 Å²	116	64.6 Å²	64.6	50%	0.504	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-29.3	-177.1	-127.9	-174.8	178	-161.3	0	113.9	N21 E407	N21-K23 PolarHBondContact O-N 2.67Å; N21-K23 VanDerWaalsContact O-N 3.09Å; K23-E407 PolarHBondContact NZ-O 3.37Å
24	S	25.6	Very low	36.7	Very low	70 Å²	70	66.1 Å²	66.1	49%	0.49	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-22.5	-171	158.1	0	0	0	0	114.8	N21 Y22 L26	N21-S24 PolarHBondContact O-N 3.15Å; Y22-S24 PolarHBondContact O-N 3.11Å; S24-L26 PolarHBondContact O-N 3.33Å
25	A	26.9	Very low	36.9	Very low	33 Å²	33	66.2 Å²	66.2	27%	0.273	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-77.6	-13.7	-179.4	0	0	0	0	0	113.2	Y19 E27	Y19-A25 HydrophobicContact CD1-CB 3.86Å; Y19-A25 HydrophobicContact CE1-CB 3.3Å; A25-E27 VanDerWaalsContact C-N 3.31Å; A25-E27 PolarHBondContact O-N 3.29Å
26	L	28.8	Very low	37.3	Very low	71 Å²	71	66.4 Å²	66.4	37%	0.372	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-78	-9.6	-178.1	-77.2	159.1	0	0	0	114.1	Y22 S24	Y22-L26 VanDerWaalsContact O-CD1 3.29Å; Y22-L26 WeakPolarHBondContact O-CD1 3.37Å; S24-L26 PolarHBondContact O-N 3.33Å
27	E	32	Very low	37.7	Very low	158 Å²	158	66 Å²	66	74%	0.738	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-87.2	-6.1	176.4	-73.5	177.5	169.1	0	0	113.3	A25	A25-E27 VanDerWaalsContact C-N 3.31Å; A25-E27 PolarHBondContact O-N 3.29Å
28	K	32.2	Very low	37.9	Very low	97 Å²	97	69 Å²	69	42%	0.422	37%	0.368	S	S	.	.	S	Bend	trans	-128.6	96.1	-165.5	-64.6	-165.2	177.8	180	0	112.3	I30 Q53	K28-I30 PolarHBondContact O-N 3.18Å; K28-Q53 HydrophobicContact CB-CB 4.13Å; K28-Q53 HydrophobicContact CB-CG 4.49Å; K28-Q53 HydrophobicContact CD-CB 3.98Å; K28-Q53 HydrophobicContact CG-CB 4.44Å
29	T	37.9	Very low	38.1	Very low	82 Å²	82	70.3 Å²	70.3	50%	0.503	37%	0.374	S	S	.	.			trans	-54.2	122.8	176.7	31.9	0	0	0	0	112.2	T31 Q53 S90	T29-T31 VanDerWaalsContact C-N 3.26Å; T29-T31 PolarHBondContact O-N 3.36Å; T29-Q53 PolarHBondContact O-NE2 3.18Å; T29-Q53 VanDerWaalsContact O-NE2 3.1Å; T29-Q53 PolarHBondContact OG1-NE2 3.07Å; T29-Q53 VanDerWaalsContact OG1-NE2 3.09Å; T29-S90 PolarHBondContact OG1-O 3.37Å
30	I	40.5	Very low	37.9	Very low	52 Å²	52	70.6 Å²	70.6	27%	0.267	40%	0.396	S	S	.	.			trans	-73.4	92.8	159.6	-62.9	178.4	0	0	0	106.2	L14 K28 C32 F50	L14-I30 HydrophobicContact CD2-CD1 3.09Å; K28-I30 PolarHBondContact O-N 3.18Å; I30-C32 PolarHBondContact O-N 3.02Å; I30-F50 HydrophobicContact CG2-CD1 4Å
31	T	48.1	Very low	38.1	Very low	25 Å²	25	72.6 Å²	72.6	15%	0.153	41%	0.405	C	S	.	.			trans	-74.9	123.9	174.2	-10.5	0	0	0	0	109.1	T29 L92	T29-T31 VanDerWaalsContact C-N 3.26Å; T29-T31 PolarHBondContact O-N 3.36Å; T31-L92 HydrophobicContact CG2-CB 4.36Å; T31-L92 WeakPolarHBondContact O-CD1 3.47Å
32	C	48.7	Very low	38.4	Very low	32 Å²	32	72.4 Å²	72.4	22%	0.216	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.1	178.9	172.1	0	0	0	0	109.1	I30 I48 F49 F50 I535	I30-C32 PolarHBondContact O-N 3.02Å; C32-I48 WeakPolarHBondContact SG-CG2 3.37Å; C32-F49 WeakPolarHBondContact CA-O 3.43Å; C32-F50 HydrophobicContact CB-CD1 4.48Å; C32-F50 HydrophobicContact CB-CE1 4.43Å; C32-I535 WeakPolarHBondContact SG-CD1 3.47Å
33	V	49.6	Very low	39.2	Very low	25 Å²	25	73.5 Å²	73.5	15%	0.152	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.3	168.6	-178.6	0	0	0	0	108.6	I48 F49 L92 C94	V33-I48 WeakPolarHBondContact O-CA 3.46Å; V33-F49 PolarHBondContact N-O 3.35Å; V33-F49 PolarHBondContact O-N 3.48Å; V33-L92 HydrophobicContact CG2-CB 3.65Å; V33-L92 WeakPolarHBondContact CG2-O 3.33Å; V33-C94 HydrophobicContact CG1-CB 3.5Å
34	S	51.6	Low	40.3	Very low	48 Å²	48	71.1 Å²	71.1	34%	0.336	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	137.3	172.8	62.4	0	0	0	0	110.2	R47	S34-R47 CarbonylContact C-O 3.38Å; S34-R47 VanDerWaalsContact CA-O 3.28Å; S34-R47 WeakPolarHBondContact CA-O 3.32Å
35	Q	52.4	Low	42	Very low	17 Å²	17	68.9 Å²	68.9	8%	0.079	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	125.1	175.9	-155	-147.5	-11.8	0	0	112.6	C37 R47 C94 S95	Q35-C37 VanDerWaalsContact CD-SG 3.5Å; Q35-C37 PolarHBondContact O-SG 3.05Å; Q35-C37 PolarHBondContact OE1-SG 3.1Å; Q35-R47 PolarHBondContact N-O 3.41Å; Q35-R47 PolarHBondContact O-N 3.25Å; Q35-C94 HydrophobicContact CB-CB 4.43Å; Q35-C94 VanDerWaalsContact CD-SG 3.52Å; Q35-C94 HydrophobicContact CG-CB 4.43Å; Q35-C94 PolarHBondContact OE1-SG 3.17Å; Q35-S95 PolarHBondContact NE2-O 3.37Å
36	Y	51	Low	43.6	Very low	75 Å²	75	67.5 Å²	67.5	29%	0.294	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	124	167.9	-88.9	-85.2	0	0	0	110.7	L46 P538	Y36-L46 HydrophobicContact CD2-CD1 3.88Å; Y36-L46 HydrophobicContact CE2-CD1 3.56Å; Y36-P538 WeakPolarHBondContact OH-CD 3.33Å; Y36-P538 WeakPolarHBondContact OH-CG 3.25Å
37	C	46.2	Very low	45.5	Very low	16 Å²	16	65.3 Å²	65.3	11%	0.108	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	113.2	-173.9	-54.1	0	0	0	0	109.2	Q35 S39 H45 R47	Q35-C37 VanDerWaalsContact CD-SG 3.5Å; Q35-C37 PolarHBondContact O-SG 3.05Å; Q35-C37 PolarHBondContact OE1-SG 3.1Å; C37-S39 PolarHBondContact O-N 3.28Å; C37-H45 PolarHBondContact N-O 2.71Å; C37-H45 PolarHBondContact O-N 3.41Å; C37-H45 VanDerWaalsContact O-N 3.11Å; C37-R47 PolarHBondContact SG-NE 3.31Å; C37-R47 PolarHBondContact SG-NH2 2.91Å
38	K	42.4	Very low	47.3	Very low	168 Å²	168	58 Å²	58	73%	0.73	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	100.7	167.8	-75.6	-177.8	175.5	-179.2	0	108.3	E44	K38-E44 WeakPolarHBondContact CE-OE1 3.28Å; K38-E44 HydrophobicContact CG-CG 4.2Å; K38-E44 IonicContact NZ-OE1 3.91Å
39	S	38.7	Very low	49.3	Very low	75 Å²	75	53.4 Å²	53.4	52%	0.524	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	135.5	163.1	179.5	0	0	0	0	108.3	C37 V41	C37-S39 PolarHBondContact O-N 3.28Å; S39-V41 PolarHBondContact O-N 2.95Å
40	G	32.5	Very low	50.9	Low	67 Å²	67	50 Å²	50	69%	0.691	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	134.2	176.3	0	0	0	0	0	111.8
41	V	33.1	Very low	52.4	Low	136 Å²	136	47.6 Å²	47.6	82%	0.824	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	82.8	-179.4	-154.1	0	0	0	0	114	S39	S39-V41 PolarHBondContact O-N 2.95Å
42	C	35.6	Very low	53.3	Low	126 Å²	126	47.9 Å²	47.9	85%	0.851	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	18.4	150.1	-57.7	0	0	0	0	122
43	S	44.1	Very low	53.9	Low	54 Å²	54	47.3 Å²	47.3	38%	0.378	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	118.3	164.2	37.5	0	0	0	0	114.9	H45	S43-H45 VanDerWaalsContact CB-CE1 3.46Å; S43-H45 WeakPolarHBondContact CB-CE1 3.38Å; S43-H45 PolarHBondContact O-ND1 3.46Å; S43-H45 PolarHBondContact OG-CE1 2.97Å
44	E	49.2	Very low	54.2	Low	66 Å²	66	54.3 Å²	54.3	31%	0.308	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	133.7	165.8	-63.3	-169.4	165.5	0	0	108.4	K38 D65	K38-E44 WeakPolarHBondContact CE-OE1 3.28Å; K38-E44 HydrophobicContact CG-CG 4.2Å; K38-E44 IonicContact NZ-OE1 3.91Å; E44-D65 HydrophobicContact CB-CB 4.32Å; E44-D65 WeakPolarHBondContact O-CB 3.5Å; E44-D65 PolarHBondContact O-N 3.39Å; E44-D65 VanDerWaalsContact O-N 3.1Å
45	H	59.8	Low	54.8	Low	23 Å²	23	55.7 Å²	55.7	11%	0.106	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.6	176.1	-65.4	62.6	0	0	0	108	C37 S43 V62	C37-H45 PolarHBondContact N-O 2.71Å; C37-H45 PolarHBondContact O-N 3.41Å; C37-H45 VanDerWaalsContact O-N 3.11Å; S43-H45 VanDerWaalsContact CB-CE1 3.46Å; S43-H45 WeakPolarHBondContact CB-CE1 3.38Å; S43-H45 PolarHBondContact O-ND1 3.46Å; S43-H45 PolarHBondContact OG-CE1 2.97Å; H45-V62 HydrophobicContact CB-CG1 4.41Å
46	L	61.4	Low	55.5	Low	5 Å²	5	56.5 Å²	56.5	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114.1	170.5	178.5	66.4	0	0	0	108.1	Y36 I48 V63 L537	Y36-L46 HydrophobicContact CD2-CD1 3.88Å; Y36-L46 HydrophobicContact CE2-CD1 3.56Å; L46-I48 HydrophobicContact CD2-CD1 4.27Å; L46-I48 HydrophobicContact CD2-CG1 4.43Å; L46-I48 HydrophobicContact CG-CG1 4.18Å; L46-V63 HydrophobicContact CB-CB 4.15Å; L46-V63 PolarHBondContact N-O 3.4Å; L46-V63 PolarHBondContact O-N 3.41Å; L46-L537 HydrophobicContact CD2-CD2 3.68Å
47	R	68.1	Low	56.5	Low	24 Å²	24	56 Å²	56	9%	0.091	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.5	173.5	-70.2	-176.9	-89.9	168.2	-0.2	108.8	S34 Q35 C37 F49 L61 V62 G98 A114	S34-R47 CarbonylContact C-O 3.38Å; S34-R47 VanDerWaalsContact CA-O 3.28Å; S34-R47 WeakPolarHBondContact CA-O 3.32Å; Q35-R47 PolarHBondContact N-O 3.41Å; Q35-R47 PolarHBondContact O-N 3.25Å; C37-R47 PolarHBondContact SG-NE 3.31Å; C37-R47 PolarHBondContact SG-NH2 2.91Å; R47-F49 HydrophobicContact CB-CE2 4.01Å; R47-F49 HydrophobicContact CB-CZ 4.42Å; R47-L61 WeakPolarHBondContact CA-O 3.45Å; R47-V62 HydrophobicContact CG-CG2 4Å; R47-G98 PolarHBondContact NH1-O 2.91Å; R47-G98 PolarHBondContact NH2-O 3.04Å; R47-A114 PolarHBondContact NH1-O 2.95Å
48	I	69.6	Low	58	Low	4 Å²	4	55.2 Å²	55.2	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.6	176.4	-50.6	-179.2	0	0	0	108.2	C32 V33 L46 F50 V60 L61 V63 I535	C32-I48 WeakPolarHBondContact SG-CG2 3.37Å; V33-I48 WeakPolarHBondContact O-CA 3.46Å; L46-I48 HydrophobicContact CD2-CD1 4.27Å; L46-I48 HydrophobicContact CD2-CG1 4.43Å; L46-I48 HydrophobicContact CG-CG1 4.18Å; I48-F50 HydrophobicContact CB-CE2 3.94Å; I48-F50 HydrophobicContact CB-CZ 4.26Å; I48-F50 HydrophobicContact CG2-CD2 4.2Å; I48-F50 HydrophobicContact CG2-CE1 4.09Å; I48-F50 HydrophobicContact CG2-CE2 3.46Å; I48-F50 VanDerWaalsContact CG2-CE2 3.46Å; I48-F50 HydrophobicContact CG2-CZ 3.4Å; I48-F50 VanDerWaalsContact CG2-CZ 3.4Å; I48-V60 WeakPolarHBondContact O-CA 3.18Å; I48-L61 HydrophobicContact CB-CB 4.29Å; I48-L61 HydrophobicContact CD1-CD2 4.37Å; I48-L61 PolarHBondContact N-O 2.99Å; I48-L61 PolarHBondContact O-N 3.43Å; I48-V63 HydrophobicContact CD1-CG2 4.47Å; I48-I535 HydrophobicContact CD1-CD1 4.23Å; I48-I535 HydrophobicContact CG2-CD1 4.23Å
49	F	73.8	Confident	59.6	Low	1 Å²	1	48 Å²	48	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130	179.2	-64.2	-91.3	0	0	0	109.7	C32 V33 R47 L58 F59 V60 L92 L101 A114 F116	C32-F49 WeakPolarHBondContact CA-O 3.43Å; V33-F49 PolarHBondContact N-O 3.35Å; V33-F49 PolarHBondContact O-N 3.48Å; R47-F49 HydrophobicContact CB-CE2 4.01Å; R47-F49 HydrophobicContact CB-CZ 4.42Å; F49-L58 HydrophobicContact CB-CD1 4.29Å; F49-L58 HydrophobicContact CD1-CD1 4.44Å; F49-L58 HydrophobicContact CD1-CD2 4.48Å; F49-F59 CarbonylContact C-O 3.28Å; F49-F59 WeakPolarHBondContact CA-O 3.48Å; F49-V60 HydrophobicContact CD1-CG2 3.33Å; F49-V60 HydrophobicContact CE1-CG2 3.37Å; F49-V60 HydrophobicContact CG-CG2 4.29Å; F49-V60 HydrophobicContact CZ-CG2 4.36Å; F49-L92 HydrophobicContact CB-CD1 4.39Å; F49-L101 HydrophobicContact CB-CD2 4.26Å; F49-L101 HydrophobicContact CD1-CD2 3.55Å; F49-L101 HydrophobicContact CD2-CD1 4.41Å; F49-L101 HydrophobicContact CE1-CD2 4.01Å; F49-L101 HydrophobicContact CG-CD1 4.31Å; F49-L101 HydrophobicContact CG-CD2 3.94Å; F49-A114 HydrophobicContact CE1-CB 4.2Å; F49-A114 HydrophobicContact CZ-CB 3.77Å; F49-F116 AromaticContact CE1-CE2 3.69Å; F49-F116 HydrophobicContact CE1-CE2 3.69Å; F49-F116 HydrophobicContact CE1-CZ 4.14Å; F49-F116 AromaticContact CZ-CE2 3.96Å; F49-F116 HydrophobicContact CZ-CE2 3.96Å
50	F	71.9	Confident	61.3	Low	11 Å²	11	44.5 Å²	44.5	5%	0.048	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.6	175.6	-59.7	-88.2	0	0	0	109.6	I10 L13 I30 C32 I48 L58 F59 L61	I10-F50 HydrophobicContact CD1-CZ 4.09Å; I10-F50 HydrophobicContact CG1-CZ 4.04Å; L13-F50 HydrophobicContact CD1-CD2 4.32Å; L13-F50 HydrophobicContact CD1-CE2 4.48Å; I30-F50 HydrophobicContact CG2-CD1 4Å; C32-F50 HydrophobicContact CB-CD1 4.48Å; C32-F50 HydrophobicContact CB-CE1 4.43Å; I48-F50 HydrophobicContact CB-CE2 3.94Å; I48-F50 HydrophobicContact CB-CZ 4.26Å; I48-F50 HydrophobicContact CG2-CD2 4.2Å; I48-F50 HydrophobicContact CG2-CE1 4.09Å; I48-F50 HydrophobicContact CG2-CE2 3.46Å; I48-F50 VanDerWaalsContact CG2-CE2 3.46Å; I48-F50 HydrophobicContact CG2-CZ 3.4Å; I48-F50 VanDerWaalsContact CG2-CZ 3.4Å; F50-L58 CarbonylContact O-C 3.52Å; F50-L58 WeakPolarHBondContact O-CA 3.47Å; F50-F59 HydrophobicContact CB-CB 4.32Å; F50-F59 PolarHBondContact N-O 3.45Å; F50-F59 PolarHBondContact O-N 3.32Å; F50-L61 HydrophobicContact CE2-CB 3.96Å; F50-L61 HydrophobicContact CE2-CD2 4.42Å
51	L	71.5	Confident	63.1	Low	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120.6	170.1	-178.9	70.4	0	0	0	109.7	Q53 L58 I89 L92 L103	L51-Q53 HydrophobicContact CD2-CG 4.49Å; L51-L58 HydrophobicContact CB-CD1 4.46Å; L51-L58 HydrophobicContact CD1-CB 4.41Å; L51-I89 HydrophobicContact CD2-CB 3.64Å; L51-I89 HydrophobicContact CD2-CD1 3.79Å; L51-I89 HydrophobicContact CD2-CG1 4.35Å; L51-I89 HydrophobicContact CD2-CG2 3.39Å; L51-L92 HydrophobicContact CB-CD1 3.89Å; L51-L92 HydrophobicContact CB-CD2 4.37Å; L51-L92 HydrophobicContact CB-CG 4.34Å; L51-L92 HydrophobicContact CD2-CD2 4.28Å; L51-L103 HydrophobicContact CD1-CD2 4.45Å; L51-L103 HydrophobicContact CD2-CD2 4.49Å
52	N	67.7	Low	64.6	Low	32 Å²	32	35.2 Å²	35.2	17%	0.171	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	102.4	167.4	-174.6	-33.5	0	0	0	108.8	R54 I55 N56 Q57 F59	N52-R54 PolarHBondContact O-N 2.97Å; N52-R54 WeakPolarHBondContact OD1-CB 3.46Å; N52-R54 PolarHBondContact OD1-N 3.35Å; N52-I55 HydrophobicContact CB-CD1 4.01Å; N52-I55 HydrophobicContact CB-CG1 3.7Å; N52-I55 PolarHBondContact O-N 3.03Å; N52-I55 PolarHBondContact OD1-N 3.3Å; N52-N56 VanDerWaalsContact O-CA 3.31Å; N52-N56 WeakPolarHBondContact O-CA 3.48Å; N52-N56 PolarHBondContact O-N 3.4Å; N52-Q57 PolarHBondContact N-O 3.46Å; N52-Q57 PolarHBondContact O-N 3.02Å; N52-F59 HydrophobicContact CB-CE2 4.29Å
53	Q	62.1	Low	65.8	Low	19 Å²	19	29.5 Å²	29.5	9%	0.089	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20	-178	-64.5	-178.3	14.8	0	0	114.1	K28 T29 L51 N56 I89	K28-Q53 HydrophobicContact CB-CB 4.13Å; K28-Q53 HydrophobicContact CB-CG 4.49Å; K28-Q53 HydrophobicContact CD-CB 3.98Å; K28-Q53 HydrophobicContact CG-CB 4.44Å; T29-Q53 PolarHBondContact O-NE2 3.18Å; T29-Q53 VanDerWaalsContact O-NE2 3.1Å; T29-Q53 PolarHBondContact OG1-NE2 3.07Å; T29-Q53 VanDerWaalsContact OG1-NE2 3.09Å; L51-Q53 HydrophobicContact CD2-CG 4.49Å; Q53-N56 PolarHBondContact O-OD1 3.25Å; Q53-I89 PolarHBondContact NE2-O 3.43Å
54	R	55.7	Low	66.4	Low	173 Å²	173	32.2 Å²	32.2	65%	0.653	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-42	-179.3	-175.1	176.6	-179.9	149.2	-1.1	111.4	N52	N52-R54 PolarHBondContact O-N 2.97Å; N52-R54 WeakPolarHBondContact OD1-CB 3.46Å; N52-R54 PolarHBondContact OD1-N 3.35Å
55	I	64.7	Low	66.4	Low	76 Å²	76	31.9 Å²	31.9	39%	0.39	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-3	-179.9	61.5	-179.1	0	0	0	112.4	N52 Q57 F59	N52-I55 HydrophobicContact CB-CD1 4.01Å; N52-I55 HydrophobicContact CB-CG1 3.7Å; N52-I55 PolarHBondContact O-N 3.03Å; N52-I55 PolarHBondContact OD1-N 3.3Å; I55-Q57 HydrophobicContact CB-CG 4.24Å; I55-Q57 HydrophobicContact CD1-CB 3.9Å; I55-Q57 HydrophobicContact CD1-CG 3.98Å; I55-Q57 HydrophobicContact CG1-CB 3.81Å; I55-Q57 HydrophobicContact CG1-CG 3.83Å; I55-Q57 PolarHBondContact O-N 3.09Å; I55-F59 HydrophobicContact CD1-CE2 4.17Å; I55-F59 HydrophobicContact CD1-CZ 4.2Å
56	N	66.9	Low	65.4	Low	34 Å²	34	34.7 Å²	34.7	18%	0.182	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	38.8	-174.3	-83.7	-8.3	0	0	0	113.1	N52 Q53 P85	N52-N56 VanDerWaalsContact O-CA 3.31Å; N52-N56 WeakPolarHBondContact O-CA 3.48Å; N52-N56 PolarHBondContact O-N 3.4Å; Q53-N56 PolarHBondContact O-OD1 3.25Å; N56-P85 HydrophobicContact CB-CG 4.01Å; N56-P85 PolarHBondContact ND2-O 3.26Å
57	Q	71.4	Confident	64.2	Low	64 Å²	64	37.1 Å²	37.1	30%	0.299	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	130.9	177.5	-64.2	-177.4	-2.8	0	0	110.6	N52 I55 F59	N52-Q57 PolarHBondContact N-O 3.46Å; N52-Q57 PolarHBondContact O-N 3.02Å; I55-Q57 HydrophobicContact CB-CG 4.24Å; I55-Q57 HydrophobicContact CD1-CB 3.9Å; I55-Q57 HydrophobicContact CD1-CG 3.98Å; I55-Q57 HydrophobicContact CG1-CB 3.81Å; I55-Q57 HydrophobicContact CG1-CG 3.83Å; I55-Q57 PolarHBondContact O-N 3.09Å; Q57-F59 HydrophobicContact CB-CE2 3.85Å; Q57-F59 HydrophobicContact CB-CZ 4.03Å
58	L	78.8	Confident	62.4	Low	1 Å²	1	42.8 Å²	42.8	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	135.8	170.8	179.7	68.9	0	0	0	108	F49 F50 L51 V79 L81 L92 L101 V112	F49-L58 HydrophobicContact CB-CD1 4.29Å; F49-L58 HydrophobicContact CD1-CD1 4.44Å; F49-L58 HydrophobicContact CD1-CD2 4.48Å; F50-L58 CarbonylContact O-C 3.52Å; F50-L58 WeakPolarHBondContact O-CA 3.47Å; L51-L58 HydrophobicContact CB-CD1 4.46Å; L51-L58 HydrophobicContact CD1-CB 4.41Å; L58-V79 HydrophobicContact CB-CB 4.14Å; L58-V79 HydrophobicContact CD2-CB 4.14Å; L58-V79 HydrophobicContact CD2-CG1 4.16Å; L58-V79 HydrophobicContact CG-CB 4.22Å; L58-V79 WeakPolarHBondContact O-CA 3.46Å; L58-V79 PolarHBondContact O-N 3.47Å; L58-L81 HydrophobicContact CB-CD1 4.21Å; L58-L81 HydrophobicContact CB-CG 4.47Å; L58-L81 HydrophobicContact CD2-CD2 4.33Å; L58-L92 HydrophobicContact CD1-CD1 4.38Å; L58-L101 HydrophobicContact CD1-CD2 4.11Å; L58-L101 HydrophobicContact CD2-CD2 3.83Å; L58-V112 HydrophobicContact CD2-CG1 4.43Å
59	F	75.5	Confident	60.8	Low	15 Å²	15	47.7 Å²	47.7	7%	0.066	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.6	172	-61.3	-88.9	0	0	0	109.4	L13 F49 F50 N52 I55 Q57 K76 I77 P78	L13-F59 HydrophobicContact CD2-CB 3.9Å; L13-F59 HydrophobicContact CD2-CD1 3.63Å; L13-F59 HydrophobicContact CD2-CD2 3.68Å; L13-F59 HydrophobicContact CD2-CE1 4.02Å; L13-F59 HydrophobicContact CD2-CE2 4.08Å; L13-F59 HydrophobicContact CD2-CG 3.44Å; L13-F59 VanDerWaalsContact CD2-CG 3.44Å; L13-F59 HydrophobicContact CD2-CZ 4.23Å; F49-F59 CarbonylContact C-O 3.28Å; F49-F59 WeakPolarHBondContact CA-O 3.48Å; F50-F59 HydrophobicContact CB-CB 4.32Å; F50-F59 PolarHBondContact N-O 3.45Å; F50-F59 PolarHBondContact O-N 3.32Å; N52-F59 HydrophobicContact CB-CE2 4.29Å; I55-F59 HydrophobicContact CD1-CE2 4.17Å; I55-F59 HydrophobicContact CD1-CZ 4.2Å; Q57-F59 HydrophobicContact CB-CE2 3.85Å; Q57-F59 HydrophobicContact CB-CZ 4.03Å; F59-K76 HydrophobicContact CD1-CD 4.46Å; F59-K76 HydrophobicContact CD1-CG 4.16Å; F59-K76 VanDerWaalsContact CE1-CE 3.49Å; F59-I77 WeakPolarHBondContact CA-O 3.47Å; F59-P78 HydrophobicContact CD1-CB 4.02Å; F59-P78 HydrophobicContact CE1-CB 3.8Å
60	V	74.6	Confident	59	Low	2 Å²	2	55.2 Å²	55.2	1%	0.012	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.4	171.9	172	0	0	0	0	109.1	I48 F49 V62 I77 V79 F116	I48-V60 WeakPolarHBondContact O-CA 3.18Å; F49-V60 HydrophobicContact CD1-CG2 3.33Å; F49-V60 HydrophobicContact CE1-CG2 3.37Å; F49-V60 HydrophobicContact CG-CG2 4.29Å; F49-V60 HydrophobicContact CZ-CG2 4.36Å; V60-V62 HydrophobicContact CG1-CG2 3.68Å; V60-I77 PolarHBondContact N-O 3.14Å; V60-I77 PolarHBondContact O-N 3.14Å; V60-I77 VanDerWaalsContact O-N 3.08Å; V60-V79 HydrophobicContact CB-CG2 4.38Å; V60-V79 HydrophobicContact CG2-CG2 3.86Å; V60-F116 HydrophobicContact CB-CE2 4.37Å; V60-F116 HydrophobicContact CB-CZ 4.43Å; V60-F116 HydrophobicContact CG1-CD2 4.39Å; V60-F116 HydrophobicContact CG1-CE2 4.03Å; V60-F116 HydrophobicContact CG2-CE2 3.75Å; V60-F116 HydrophobicContact CG2-CZ 3.68Å
61	L	69.2	Low	57.5	Low	1 Å²	1	61.7 Å²	61.7	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123	167.7	-173.6	74.5	0	0	0	108	V6 I10 R47 I48 F50 V63	V6-L61 HydrophobicContact CG1-CD2 4.44Å; I10-L61 HydrophobicContact CD1-CD2 4.43Å; I10-L61 HydrophobicContact CG1-CD2 4.34Å; R47-L61 WeakPolarHBondContact CA-O 3.45Å; I48-L61 HydrophobicContact CB-CB 4.29Å; I48-L61 HydrophobicContact CD1-CD2 4.37Å; I48-L61 PolarHBondContact N-O 2.99Å; I48-L61 PolarHBondContact O-N 3.43Å; F50-L61 HydrophobicContact CE2-CB 3.96Å; F50-L61 HydrophobicContact CE2-CD2 4.42Å; L61-V63 HydrophobicContact CD2-CG2 4.09Å; L61-V63 HydrophobicContact CG-CG2 4.17Å
62	V	65.9	Low	56.2	Low	8 Å²	8	67.4 Å²	67.4	5%	0.048	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.1	175.6	-177.6	0	0	0	0	109.9	H45 R47 V60 F121	H45-V62 HydrophobicContact CB-CG1 4.41Å; R47-V62 HydrophobicContact CG-CG2 4Å; V60-V62 HydrophobicContact CG1-CG2 3.68Å; V62-F121 HydrophobicContact CB-CD1 4.49Å; V62-F121 HydrophobicContact CB-CE1 4.09Å; V62-F121 HydrophobicContact CB-CZ 4.46Å; V62-F121 HydrophobicContact CG1-CZ 4.44Å; V62-F121 HydrophobicContact CG2-CD1 3.89Å; V62-F121 HydrophobicContact CG2-CE1 3.14Å; V62-F121 HydrophobicContact CG2-CZ 3.6Å
63	V	59.6	Low	55.2	Low	5 Å²	5	70.3 Å²	70.3	3%	0.03	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	102.9	-179.9	-172.7	0	0	0	0	107	L46 I48 L61 Y74 F541	L46-V63 HydrophobicContact CB-CB 4.15Å; L46-V63 PolarHBondContact N-O 3.4Å; L46-V63 PolarHBondContact O-N 3.41Å; I48-V63 HydrophobicContact CD1-CG2 4.47Å; L61-V63 HydrophobicContact CD2-CG2 4.09Å; L61-V63 HydrophobicContact CG-CG2 4.17Å; V63-Y74 HydrophobicContact CG1-CD1 4.46Å; V63-Y74 HydrophobicContact CG1-CE1 4.01Å; V63-Y74 HydrophobicContact CG2-CD1 4.49Å; V63-F541 HydrophobicContact CG1-CE2 3.35Å; V63-F541 HydrophobicContact CG1-CZ 3.49Å; V63-F541 VanDerWaalsContact CG1-CZ 3.49Å
64	K	56.5	Low	54.9	Low	112 Å²	112	71.9 Å²	71.9	49%	0.487	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	129.5	176.6	-71	-169.3	171.9	173.3	0	109.8
65	D	49.1	Very low	55.1	Low	58 Å²	58	65.8 Å²	65.8	31%	0.31	38%	0.377	S	S	.	.			trans	-67.1	141.6	171.7	-146.9	-10.3	0	0	0	110.1	E44 G67	E44-D65 HydrophobicContact CB-CB 4.32Å; E44-D65 WeakPolarHBondContact O-CB 3.5Å; E44-D65 PolarHBondContact O-N 3.39Å; E44-D65 VanDerWaalsContact O-N 3.1Å; D65-G67 PolarHBondContact O-N 2.88Å
66	C	39.3	Very low	55.1	Low	82 Å²	82	66.3 Å²	66.3	55%	0.554	38%	0.376	S	S	*	.	S	Bend	trans	-66.6	90.4	-159.6	-63.2	0	0	0	0	113.9
67	G	36.2	Very low	55.4	Low	57 Å²	57	64.9 Å²	64.9	59%	0.588	37%	0.368	S	S	*	.	S	Bend	trans	-142.9	103.1	166.6	0	0	0	0	0	111.5	D65	D65-G67 PolarHBondContact O-N 2.88Å
68	V	31.1	Very low	55.7	Low	142 Å²	142	63 Å²	63	86%	0.861	36%	0.362	S	S	*	.	S	Bend	trans	53	79.4	158.1	-161.3	0	0	0	0	116
69	T	34.8	Very low	55.9	Low	108 Å²	108	63 Å²	63	66%	0.663	36%	0.362	S	S	*	.			trans	-167.6	129	138.9	29.3	0	0	0	0	108.4	D71	T69-D71 PolarHBondContact O-N 2.98Å
70	N	36.6	Very low	56.4	Low	159 Å²	159	65.4 Å²	65.4	85%	0.85	38%	0.375	S	S	*	.			trans	-79.3	19.2	-178.2	-82	-17.9	0	0	0	113.2
71	D	40.7	Very low	56.9	Low	146 Å²	146	65.6 Å²	65.6	78%	0.781	38%	0.376	S	S	*	.			trans	-93.7	117.7	-177.5	-73	-26.6	0	0	0	111.3	T69 S73	T69-D71 PolarHBondContact O-N 2.98Å; D71-S73 PolarHBondContact O-N 3.32Å
72	L	42.7	Very low	57.8	Low	121 Å²	121	68.6 Å²	68.6	63%	0.634	39%	0.394	S	S	*	.			trans	-91.3	26.8	-149.5	-101.6	139.1	0	0	0	116.1	M1	M1-L72 HydrophobicContact SD-CD2 4.06Å
73	S	48.5	Very low	58.7	Low	93 Å²	93	72.3 Å²	72.3	65%	0.65	42%	0.419	S	S	*	.			trans	-128.4	118.8	-178.7	56.6	0	0	0	0	111.7	D71 P75	D71-S73 PolarHBondContact O-N 3.32Å; S73-P75 WeakPolarHBondContact O-CD 3.47Å
74	Y	55.3	Low	59.7	Low	53 Å²	53	76.5 Å²	76.5	21%	0.208	45%	0.446	C	S	.	.			trans	-77.6	106.2	163.3	-61	-84.4	0	0	0	105.9	A2 T5 V6 V63 K76	A2-Y74 WeakPolarHBondContact CA-OH 3.35Å; A2-Y74 WeakPolarHBondContact CB-OH 3.19Å; T5-Y74 HydrophobicContact CG2-CD2 3.58Å; T5-Y74 HydrophobicContact CG2-CE2 4.06Å; V6-Y74 HydrophobicContact CG2-CE2 4.48Å; V63-Y74 HydrophobicContact CG1-CD1 4.46Å; V63-Y74 HydrophobicContact CG1-CE1 4.01Å; V63-Y74 HydrophobicContact CG2-CD1 4.49Å; Y74-K76 PolarHBondContact O-N 3.34Å
75	P	59.5	Low	60.6	Low	45 Å²	45	71.4 Å²	71.4	29%	0.292	43%	0.425	S	S	.	.			trans	-68.5	109.3	-175.5	27.9	-32.4	0	0	0	108.2	S73 I77 F121	S73-P75 WeakPolarHBondContact O-CD 3.47Å; P75-I77 HydrophobicContact CB-CD1 4.07Å; P75-I77 HydrophobicContact CB-CG1 3.93Å; P75-I77 HydrophobicContact CG-CD1 4.38Å; P75-I77 PolarHBondContact O-N 3.39Å; P75-F121 HydrophobicContact CG-CB 4.46Å
76	K	63.8	Low	61.8	Low	87 Å²	87	70.4 Å²	70.4	38%	0.378	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	118.3	158.6	165.1	-173.9	163	169.9	0	106.1	L13 F59 Y74	L13-K76 HydrophobicContact CD1-CD 4.21Å; L13-K76 HydrophobicContact CD1-CG 4.44Å; L13-K76 HydrophobicContact CD2-CD 3.6Å; L13-K76 HydrophobicContact CD2-CG 4.12Å; L13-K76 VanDerWaalsContact CD2-NZ 3.33Å; L13-K76 HydrophobicContact CG-CD 3.83Å; F59-K76 HydrophobicContact CD1-CD 4.46Å; F59-K76 HydrophobicContact CD1-CG 4.16Å; F59-K76 VanDerWaalsContact CE1-CE 3.49Å; Y74-K76 PolarHBondContact O-N 3.34Å
77	I	73.7	Confident	63.4	Low	3 Å²	3	71.2 Å²	71.2	2%	0.015	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.7	179.8	-50.1	-176.4	0	0	0	109.5	F59 V60 P75 V79 F121 I126	F59-I77 WeakPolarHBondContact CA-O 3.47Å; V60-I77 PolarHBondContact N-O 3.14Å; V60-I77 PolarHBondContact O-N 3.14Å; V60-I77 VanDerWaalsContact O-N 3.08Å; P75-I77 HydrophobicContact CB-CD1 4.07Å; P75-I77 HydrophobicContact CB-CG1 3.93Å; P75-I77 HydrophobicContact CG-CD1 4.38Å; P75-I77 PolarHBondContact O-N 3.39Å; I77-V79 PolarHBondContact O-N 3.48Å; I77-F121 VanDerWaalsContact CD1-CA 3.42Å; I77-F121 HydrophobicContact CD1-CB 4.13Å; I77-F121 HydrophobicContact CD1-CD1 3.6Å; I77-F121 HydrophobicContact CD1-CG 4.33Å; I77-I126 HydrophobicContact CB-CD1 4.33Å; I77-I126 HydrophobicContact CD1-CD1 4.25Å; I77-I126 HydrophobicContact CG2-CB 4.38Å; I77-I126 HydrophobicContact CG2-CD1 3.53Å; I77-I126 HydrophobicContact CG2-CG1 3.61Å
78	P	78.4	Confident	65.3	Low	25 Å²	25	70.3 Å²	70.3	16%	0.162	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	128.6	168.3	25.2	-27.8	0	0	0	109.5	F59 D124 Q125 I126	F59-P78 HydrophobicContact CD1-CB 4.02Å; F59-P78 HydrophobicContact CE1-CB 3.8Å; P78-D124 VanDerWaalsContact CD-O 3.22Å; P78-D124 WeakPolarHBondContact CD-O 3.23Å; P78-D124 VanDerWaalsContact CG-O 3.26Å; P78-D124 WeakPolarHBondContact CG-O 3.46Å; P78-Q125 HydrophobicContact CB-CG 4.33Å; P78-Q125 HydrophobicContact CG-CB 4.03Å; P78-Q125 HydrophobicContact CG-CG 4.05Å; P78-Q125 WeakPolarHBondContact O-CA 3.42Å; P78-Q125 WeakPolarHBondContact O-CG 3.28Å; P78-I126 PolarHBondContact O-N 3.41Å
79	V	83.2	Confident	67.5	Low	2 Å²	2	63.6 Å²	63.6	1%	0.012	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	104.6	172.5	-175.4	0	0	0	0	107.8	L58 V60 I77 L81 F116 I126 R128	L58-V79 HydrophobicContact CB-CB 4.14Å; L58-V79 HydrophobicContact CD2-CB 4.14Å; L58-V79 HydrophobicContact CD2-CG1 4.16Å; L58-V79 HydrophobicContact CG-CB 4.22Å; L58-V79 WeakPolarHBondContact O-CA 3.46Å; L58-V79 PolarHBondContact O-N 3.47Å; V60-V79 HydrophobicContact CB-CG2 4.38Å; V60-V79 HydrophobicContact CG2-CG2 3.86Å; I77-V79 PolarHBondContact O-N 3.48Å; V79-L81 HydrophobicContact CG1-CD2 4.21Å; V79-F116 HydrophobicContact CG2-CE1 4.12Å; V79-F116 HydrophobicContact CG2-CZ 4.1Å; V79-I126 CarbonylContact C-O 3.52Å; V79-I126 VanDerWaalsContact CA-O 3.24Å; V79-I126 WeakPolarHBondContact CA-O 3.48Å; V79-R128 HydrophobicContact CG1-CB 4.06Å; V79-R128 HydrophobicContact CG1-CG 3.93Å
80	L	85.8	Confident	69.4	Low	65 Å²	65	61.1 Å²	61.1	34%	0.34	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	120.4	174.8	-168.3	72.2	0	0	0	109.5	Q125 I126 V127 R128	L80-Q125 HydrophobicContact CB-CG 4.31Å; L80-I126 PolarHBondContact N-O 3.47Å; L80-V127 HydrophobicContact CB-CG2 4.27Å; L80-V127 HydrophobicContact CD2-CG2 4.24Å; L80-V127 CarbonylContact O-C 3.58Å; L80-V127 WeakPolarHBondContact O-CA 3.37Å; L80-R128 PolarHBondContact O-N 2.89Å
81	L	85.9	Confident	71.3	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.026	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	134.3	179.6	-62	174.9	0	0	0	110.6	L58 V79 P83 P84 P85 L103 V112 R128 L130	L58-L81 HydrophobicContact CB-CD1 4.21Å; L58-L81 HydrophobicContact CB-CG 4.47Å; L58-L81 HydrophobicContact CD2-CD2 4.33Å; V79-L81 HydrophobicContact CG1-CD2 4.21Å; L81-P83 CarbonylContact C-O 3.41Å; L81-P83 CarbonylContact O-C 3.57Å; L81-P83 VanDerWaalsContact O-C 3.28Å; L81-P84 WeakPolarHBondContact O-CA 3.48Å; L81-P85 HydrophobicContact CD1-CG 4.05Å; L81-L103 HydrophobicContact CD1-CD2 3.68Å; L81-V112 HydrophobicContact CD2-CB 4.26Å; L81-V112 HydrophobicContact CD2-CG2 3.75Å; L81-R128 WeakPolarHBondContact CA-O 3.21Å; L81-R128 HydrophobicContact CD2-CB 4.42Å; L81-L130 HydrophobicContact CB-CB 4.47Å; L81-L130 HydrophobicContact CD1-CD1 4.34Å
82	T	86.4	Confident	73.3	Confident	64 Å²	64	48.9 Å²	48.9	39%	0.393	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	116.9	178.5	51.1	0	0	0	0	111.4	V127 R128 P129 L130	T82-V127 HydrophobicContact CG2-CG1 3.84Å; T82-R128 PolarHBondContact N-O 2.91Å; T82-P129 CarbonylContact O-C 3.6Å; T82-P129 VanDerWaalsContact O-CA 3.31Å; T82-P129 WeakPolarHBondContact O-CA 3.42Å; T82-L130 PolarHBondContact O-N 2.98Å
83	P	86.4	Confident	75.2	Confident	86 Å²	86	45.3 Å²	45.3	56%	0.558	28%	0.282	S	S	*	.	S	Bend	cis	-64.1	159.7	-7.1	30.3	-35.9	0	0	0	112	L81	L81-P83 CarbonylContact C-O 3.41Å; L81-P83 CarbonylContact O-C 3.57Å; L81-P83 VanDerWaalsContact O-C 3.28Å
84	P	79.9	Confident	76.9	Confident	94 Å²	94	41.7 Å²	41.7	61%	0.61	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-57.9	139.2	171.8	24.8	-32.8	0	0	0	109.1	L81	L81-P84 WeakPolarHBondContact O-CA 3.48Å
85	P	75.2	Confident	78.1	Confident	5 Å²	5	39.1 Å²	39.1	3%	0.032	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-61	152.3	-178.7	22.5	-31.7	0	0	0	111.4	N56 L81 I89 L130	N56-P85 HydrophobicContact CB-CG 4.01Å; N56-P85 PolarHBondContact ND2-O 3.26Å; L81-P85 HydrophobicContact CD1-CG 4.05Å; P85-I89 HydrophobicContact CB-CD1 3.27Å; P85-I89 HydrophobicContact CB-CG1 4.39Å; P85-I89 HydrophobicContact CG-CD1 3.87Å; P85-L130 HydrophobicContact CB-CD2 3.91Å
86	S	75	Confident	78.9	Confident	36 Å²	36	42.8 Å²	42.8	25%	0.252	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-61.7	144	170.2	54.4	0	0	0	0	110.4
87	P	71.9	Confident	79.4	Confident	100 Å²	100	40.6 Å²	40.6	65%	0.649	26%	0.255	S	S	*	.	S	Bend	trans	-58.2	149.4	170.9	26.7	-33.5	0	0	0	110.3
88	G	75.7	Confident	79.5	Confident	37 Å²	37	40.5 Å²	40.5	38%	0.381	25%	0.254	S	S	.	.			trans	93.4	22.6	179	0	0	0	0	0	115.4	S90 S105	G88-S90 PolarHBondContact O-N 3.39Å; G88-S105 WeakPolarHBondContact O-CA 3.31Å; G88-S105 VanDerWaalsContact O-CB 3.29Å; G88-S105 WeakPolarHBondContact O-CB 3.31Å
89	I	78.8	Confident	79.8	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	113.7	165	-66.3	166.7	0	0	0	108	L51 Q53 P85 S91 L103 I104	L51-I89 HydrophobicContact CD2-CB 3.64Å; L51-I89 HydrophobicContact CD2-CD1 3.79Å; L51-I89 HydrophobicContact CD2-CG1 4.35Å; L51-I89 HydrophobicContact CD2-CG2 3.39Å; Q53-I89 PolarHBondContact NE2-O 3.43Å; P85-I89 HydrophobicContact CB-CD1 3.27Å; P85-I89 HydrophobicContact CB-CG1 4.39Å; P85-I89 HydrophobicContact CG-CD1 3.87Å; I89-S91 WeakPolarHBondContact CG2-O 3.43Å; I89-L103 HydrophobicContact CD1-CB 3.91Å; I89-L103 HydrophobicContact CD1-CD2 3.7Å; I89-L103 HydrophobicContact CD1-CG 4.43Å; I89-L103 HydrophobicContact CG1-CB 4.44Å; I89-L103 HydrophobicContact CG2-CB 4.19Å; I89-I104 CarbonylContact C-O 3.54Å; I89-I104 WeakPolarHBondContact CA-O 3.44Å; I89-I104 WeakPolarHBondContact CG2-O 3.38Å
90	S	73.5	Confident	80	Confident	56 Å²	56	40 Å²	40	39%	0.392	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-26.3	-178.3	58.6	0	0	0	0	112.8	T29 G88 I104	T29-S90 PolarHBondContact OG1-O 3.37Å; G88-S90 PolarHBondContact O-N 3.39Å; S90-I104 PolarHBondContact N-O 3.34Å; S90-I104 PolarHBondContact OG-O 3.23Å
91	S	77.7	Confident	80.2	Confident	38 Å²	38	36.9 Å²	36.9	27%	0.266	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	161.6	-177.7	63.9	0	0	0	0	115.5	I89 I104	I89-S91 WeakPolarHBondContact CG2-O 3.43Å; S91-I104 PolarHBondContact N-O 3.45Å; S91-I104 PolarHBondContact O-N 3.17Å; S91-I104 WeakPolarHBondContact OG-CB 3.31Å; S91-I104 WeakPolarHBondContact OG-CD1 3.48Å
92	L	82.9	Confident	80.4	Confident	10 Å²	10	36.7 Å²	36.7	5%	0.052	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145.2	176.7	-68.9	-177.5	0	0	0	108.8	T31 V33 F49 L51 L58 L101 A102 L103	T31-L92 HydrophobicContact CG2-CB 4.36Å; T31-L92 WeakPolarHBondContact O-CD1 3.47Å; V33-L92 HydrophobicContact CG2-CB 3.65Å; V33-L92 WeakPolarHBondContact CG2-O 3.33Å; F49-L92 HydrophobicContact CB-CD1 4.39Å; L51-L92 HydrophobicContact CB-CD1 3.89Å; L51-L92 HydrophobicContact CB-CD2 4.37Å; L51-L92 HydrophobicContact CB-CG 4.34Å; L51-L92 HydrophobicContact CD2-CD2 4.28Å; L58-L92 HydrophobicContact CD1-CD1 4.38Å; L92-L101 HydrophobicContact CB-CD1 4.41Å; L92-A102 CarbonylContact C-O 3.57Å; L92-A102 WeakPolarHBondContact CA-O 3.41Å; L92-L103 HydrophobicContact CD2-CB 4.14Å; L92-L103 HydrophobicContact CD2-CD2 4.14Å; L92-L103 HydrophobicContact CD2-CG 3.58Å
93	L	82.7	Confident	80.6	Confident	47 Å²	47	33.6 Å²	33.6	25%	0.246	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	118.4	176.7	-171.9	75.8	0	0	0	112.2	A102 I104 W154	L93-A102 HydrophobicContact CB-CB 4.35Å; L93-A102 PolarHBondContact N-O 3.03Å; L93-A102 PolarHBondContact O-N 2.61Å; L93-I104 HydrophobicContact CB-CD1 4.02Å; L93-W154 HydrophobicContact CD2-CG 4.1Å; L93-W154 VanDerWaalsContact CG-CD1 3.48Å; L93-W154 PolarHBondContact O-NE1 3.3Å
94	C	83.3	Confident	80.7	Confident	16 Å²	16	29.9 Å²	29.9	11%	0.108	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	137.5	177.1	-162.6	0	0	0	0	111.4	V33 Q35 L101 W154	V33-C94 HydrophobicContact CG1-CB 3.5Å; Q35-C94 HydrophobicContact CB-CB 4.43Å; Q35-C94 VanDerWaalsContact CD-SG 3.52Å; Q35-C94 HydrophobicContact CG-CB 4.43Å; Q35-C94 PolarHBondContact OE1-SG 3.17Å; C94-L101 HydrophobicContact CB-CD1 4.2Å; C94-W154 VanDerWaalsContact O-CD1 3.27Å
95	S	81.6	Confident	81.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.162	C	C	.	.			trans	-65.2	148.5	173.7	58	0	0	0	0	111.6	Q35 C97 G98 Q99 F100	Q35-S95 PolarHBondContact NE2-O 3.37Å; S95-C97 PolarHBondContact O-N 2.91Å; S95-C97 VanDerWaalsContact O-N 3.15Å; S95-C97 PolarHBondContact OG-SG 3.47Å; S95-G98 PolarHBondContact O-N 3.12Å; S95-G98 PolarHBondContact OG-N 2.98Å; S95-Q99 PolarHBondContact OG-N 3.24Å; S95-F100 WeakPolarHBondContact CB-O 3.37Å; S95-F100 PolarHBondContact N-O 2.98Å; S95-F100 PolarHBondContact OG-N 3.29Å; S95-F100 PolarHBondContact OG-O 3.45Å
96	Q	75.3	Confident	81.7	Confident	121 Å²	121	31.4 Å²	31.4	57%	0.565	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.7	176.8	-80	178.2	-21.3	0	0	113.2	G98 P156 N159	Q96-G98 VanDerWaalsContact C-N 3.34Å; Q96-P156 PolarHBondContact OE1-O 3.22Å; Q96-P156 VanDerWaalsContact OE1-O 3.12Å; Q96-N159 HydrophobicContact CB-CB 4.33Å
97	C	74.6	Confident	82.3	Confident	42 Å²	42	31.4 Å²	31.4	28%	0.284	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-13.3	177.2	63.7	0	0	0	0	113.8	S95 Q99 N159	S95-C97 PolarHBondContact O-N 2.91Å; S95-C97 VanDerWaalsContact O-N 3.15Å; S95-C97 PolarHBondContact OG-SG 3.47Å; C97-Q99 VanDerWaalsContact C-N 3.26Å; C97-Q99 PolarHBondContact O-N 3.43Å; C97-N159 HydrophobicContact CB-CB 4.2Å
98	G	75.8	Confident	83.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	71.7	17.8	178.4	0	0	0	0	0	117.8	R47 S95 Q96	R47-G98 PolarHBondContact NH1-O 2.91Å; R47-G98 PolarHBondContact NH2-O 3.04Å; S95-G98 PolarHBondContact O-N 3.12Å; S95-G98 PolarHBondContact OG-N 2.98Å; Q96-G98 VanDerWaalsContact C-N 3.34Å
99	Q	84.1	Confident	84	Confident	17 Å²	17	24.9 Å²	24.9	8%	0.079	14%	0.137	C	C	.	.	S	Bend	trans	-91.6	-31.8	176.9	-172	168.8	12.6	0	0	111.6	S95 C97 D113 A114 Q115	S95-Q99 PolarHBondContact OG-N 3.24Å; C97-Q99 VanDerWaalsContact C-N 3.26Å; C97-Q99 PolarHBondContact O-N 3.43Å; Q99-D113 CarbonylContact O-C 3.54Å; Q99-D113 WeakPolarHBondContact O-CA 3.38Å; Q99-A114 PolarHBondContact O-N 2.88Å; Q99-Q115 HydrophobicContact CB-CG 4.39Å; Q99-Q115 HydrophobicContact CG-CG 4.36Å
100	F	88.6	Confident	84.6	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.6	-175.2	-52.9	-66.3	0	0	0	110.7	S95 V111 W154 R160 C176 K178 I185	S95-F100 WeakPolarHBondContact CB-O 3.37Å; S95-F100 PolarHBondContact N-O 2.98Å; S95-F100 PolarHBondContact OG-N 3.29Å; S95-F100 PolarHBondContact OG-O 3.45Å; F100-V111 HydrophobicContact CB-CG1 3.82Å; F100-V111 HydrophobicContact CD1-CG1 4.01Å; F100-V111 HydrophobicContact CG-CG1 4.27Å; F100-W154 HydrophobicContact CB-CH2 3.53Å; F100-W154 HydrophobicContact CB-CZ2 3.66Å; F100-W154 HydrophobicContact CB-CZ3 4.5Å; F100-W154 HydrophobicContact CD2-CH2 4.28Å; F100-W154 HydrophobicContact CG-CH2 4.13Å; F100-R160 HydrophobicContact CE2-CB 4.17Å; F100-R160 HydrophobicContact CE2-CG 3.85Å; F100-C176 HydrophobicContact CD2-CB 4.41Å; F100-C176 HydrophobicContact CE1-CB 4.45Å; F100-C176 HydrophobicContact CE2-CB 4.24Å; F100-C176 HydrophobicContact CZ-CB 4.25Å; F100-K178 HydrophobicContact CE1-CB 4.19Å; F100-K178 HydrophobicContact CZ-CB 4.13Å; F100-I185 HydrophobicContact CD1-CD1 3.89Å; F100-I185 HydrophobicContact CE1-CD1 3.96Å; F100-I185 HydrophobicContact CE1-CG1 4.18Å; F100-I185 HydrophobicContact CE1-CG2 4.3Å
101	L	89.8	Confident	85.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.2	166.1	174.9	74.3	0	0	0	107.9	F49 L58 L92 C94 L103 V111 V112 A114	F49-L101 HydrophobicContact CB-CD2 4.26Å; F49-L101 HydrophobicContact CD1-CD2 3.55Å; F49-L101 HydrophobicContact CD2-CD1 4.41Å; F49-L101 HydrophobicContact CE1-CD2 4.01Å; F49-L101 HydrophobicContact CG-CD1 4.31Å; F49-L101 HydrophobicContact CG-CD2 3.94Å; L58-L101 HydrophobicContact CD1-CD2 4.11Å; L58-L101 HydrophobicContact CD2-CD2 3.83Å; L92-L101 HydrophobicContact CB-CD1 4.41Å; C94-L101 HydrophobicContact CB-CD1 4.2Å; L101-L103 HydrophobicContact CG-CD1 4.49Å; L101-V111 WeakPolarHBondContact O-CA 3.44Å; L101-V112 HydrophobicContact CB-CG1 3.78Å; L101-V112 HydrophobicContact CD2-CG1 3.93Å; L101-V112 HydrophobicContact CG-CG1 4.21Å; L101-V112 PolarHBondContact N-O 3.46Å; L101-V112 PolarHBondContact O-N 2.85Å; L101-A114 HydrophobicContact CB-CB 3.9Å
102	A	90.1	Very high	86.2	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	137.4	173.1	0	0	0	0	0	110.2	L92 L93 I104 V109 F110 V111 W154 L162	L92-A102 CarbonylContact C-O 3.57Å; L92-A102 WeakPolarHBondContact CA-O 3.41Å; L93-A102 HydrophobicContact CB-CB 4.35Å; L93-A102 PolarHBondContact N-O 3.03Å; L93-A102 PolarHBondContact O-N 2.61Å; A102-I104 HydrophobicContact CB-CG1 4.45Å; A102-V109 HydrophobicContact CB-CG1 4.14Å; A102-F110 CarbonylContact C-O 3.57Å; A102-F110 VanDerWaalsContact CA-O 3.23Å; A102-F110 WeakPolarHBondContact CA-O 3.43Å; A102-V111 HydrophobicContact CB-CG2 4.41Å; A102-W154 HydrophobicContact CB-CZ2 4.19Å; A102-L162 HydrophobicContact CB-CD1 4.21Å
103	L	90.4	Very high	86.5	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.6	171.3	-61.1	82.8	0	0	0	107	L51 L81 I89 L92 L101 F110 V112 L130	L51-L103 HydrophobicContact CD1-CD2 4.45Å; L51-L103 HydrophobicContact CD2-CD2 4.49Å; L81-L103 HydrophobicContact CD1-CD2 3.68Å; I89-L103 HydrophobicContact CD1-CB 3.91Å; I89-L103 HydrophobicContact CD1-CD2 3.7Å; I89-L103 HydrophobicContact CD1-CG 4.43Å; I89-L103 HydrophobicContact CG1-CB 4.44Å; I89-L103 HydrophobicContact CG2-CB 4.19Å; L92-L103 HydrophobicContact CD2-CB 4.14Å; L92-L103 HydrophobicContact CD2-CD2 4.14Å; L92-L103 HydrophobicContact CD2-CG 3.58Å; L101-L103 HydrophobicContact CG-CD1 4.49Å; L103-F110 HydrophobicContact CB-CB 4.35Å; L103-F110 PolarHBondContact N-O 3.06Å; L103-F110 PolarHBondContact O-N 3.2Å; L103-V112 HydrophobicContact CD1-CB 4.33Å; L103-V112 HydrophobicContact CD1-CG1 3.78Å; L103-L130 HydrophobicContact CD1-CD1 3.96Å
104	I	88.2	Confident	86.6	Confident	8 Å²	8	19.6 Å²	19.6	4%	0.041	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.1	-166.3	-57.6	148.8	0	0	0	108.5	I89 S90 S91 L93 A102 V109 I149 V152	I89-I104 CarbonylContact C-O 3.54Å; I89-I104 WeakPolarHBondContact CA-O 3.44Å; I89-I104 WeakPolarHBondContact CG2-O 3.38Å; S90-I104 PolarHBondContact N-O 3.34Å; S90-I104 PolarHBondContact OG-O 3.23Å; S91-I104 PolarHBondContact N-O 3.45Å; S91-I104 PolarHBondContact O-N 3.17Å; S91-I104 WeakPolarHBondContact OG-CB 3.31Å; S91-I104 WeakPolarHBondContact OG-CD1 3.48Å; L93-I104 HydrophobicContact CB-CD1 4.02Å; A102-I104 HydrophobicContact CB-CG1 4.45Å; I104-V109 HydrophobicContact CG1-CG1 4.1Å; I104-V109 HydrophobicContact CG1-CG2 4.49Å; I104-V109 HydrophobicContact CG2-CG2 4.49Å; I104-I149 HydrophobicContact CG2-CG2 4.33Å; I104-V152 HydrophobicContact CD1-CB 3.7Å; I104-V152 HydrophobicContact CD1-CG1 4.14Å; I104-V152 HydrophobicContact CD1-CG2 4.13Å; I104-V152 HydrophobicContact CG1-CB 4.06Å; I104-V152 HydrophobicContact CG1-CG1 4.34Å; I104-V152 HydrophobicContact CG1-CG2 3.99Å; I104-V152 HydrophobicContact CG2-CG2 3.77Å
105	S	87.7	Confident	86.5	Confident	6 Å²	6	22.6 Å²	22.6	4%	0.042	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-179.8	166.5	70.2	0	0	0	0	110.1	G88 T107 C108	G88-S105 WeakPolarHBondContact O-CA 3.31Å; G88-S105 VanDerWaalsContact O-CB 3.29Å; G88-S105 WeakPolarHBondContact O-CB 3.31Å; S105-T107 PolarHBondContact O-N 3.47Å; S105-T107 PolarHBondContact OG-N 3.3Å; S105-C108 PolarHBondContact N-O 3.42Å; S105-C108 WeakPolarHBondContact OG-CB 3.41Å; S105-C108 PolarHBondContact OG-N 3Å; S105-C108 PolarHBondContact OG-O 3.2Å
106	E	87.4	Confident	86.2	Confident	125 Å²	125	24 Å²	24	58%	0.584	12%	0.119	S	C	*	.	S	Bend	trans	-60.1	-25.4	175.9	-68.5	177.5	-176.2	0	0	113.7	V148 I149	E106-V148 HydrophobicContact CB-CG1 4.18Å; E106-V148 CarbonylContact O-C 3.59Å; E106-V148 WeakPolarHBondContact O-CA 3.41Å; E106-I149 PolarHBondContact O-N 2.85Å
107	T	88	Confident	85.9	Confident	35 Å²	35	19.9 Å²	19.9	22%	0.215	11%	0.11	C	C	.	.	S	Bend	trans	-128.6	-10.7	-174.2	62	0	0	0	0	114.2	S105 L136	S105-T107 PolarHBondContact O-N 3.47Å; S105-T107 PolarHBondContact OG-N 3.3Å; T107-L136 WeakPolarHBondContact O-CB 3.42Å; T107-L136 WeakPolarHBondContact O-CG 3.49Å; T107-L136 PolarHBondContact O-N 3.34Å
108	C	90.7	Very high	85.5	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	147.9	-172	-45.5	0	0	0	0	111.2	S105 F110 I134 D135 R137	S105-C108 PolarHBondContact N-O 3.42Å; S105-C108 WeakPolarHBondContact OG-CB 3.41Å; S105-C108 PolarHBondContact OG-N 3Å; S105-C108 PolarHBondContact OG-O 3.2Å; C108-F110 HydrophobicContact CB-CD2 4.45Å; C108-F110 HydrophobicContact CB-CE2 3.71Å; C108-F110 HydrophobicContact CB-CZ 3.82Å; C108-I134 WeakPolarHBondContact CA-O 3.46Å; C108-D135 PolarHBondContact SG-OD1 2.97Å; C108-D135 VanDerWaalsContact SG-OD1 3.34Å; C108-D135 PolarHBondContact SG-OD2 3.15Å; C108-D135 VanDerWaalsContact SG-OD2 3.35Å; C108-R137 PolarHBondContact SG-NH2 3.06Å
109	V	92.2	Very high	85	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124.2	165.5	-170.7	0	0	0	0	109.5	A102 I104 A133 I134 I149 V152 L162 I164	A102-V109 HydrophobicContact CB-CG1 4.14Å; I104-V109 HydrophobicContact CG1-CG1 4.1Å; I104-V109 HydrophobicContact CG1-CG2 4.49Å; I104-V109 HydrophobicContact CG2-CG2 4.49Å; V109-A133 WeakPolarHBondContact O-CB 3.46Å; V109-A133 PolarHBondContact O-N 3.41Å; V109-I134 HydrophobicContact CB-CG2 4.02Å; V109-I134 HydrophobicContact CG2-CG2 3.93Å; V109-I134 PolarHBondContact N-O 3.13Å; V109-I134 PolarHBondContact O-N 3.34Å; V109-I149 HydrophobicContact CG2-CD1 3.68Å; V109-V152 HydrophobicContact CG2-CG2 3.82Å; V109-L162 HydrophobicContact CB-CD2 4.43Å; V109-L162 HydrophobicContact CG1-CD2 3.78Å; V109-I164 HydrophobicContact CB-CD1 4.26Å; V109-I164 HydrophobicContact CG2-CD1 3.7Å; V109-I164 HydrophobicContact CG2-CG1 4.35Å
110	F	92.5	Very high	84.3	Confident	26 Å²	26	34 Å²	34	11%	0.114	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	150.8	171.7	-54.2	-80.5	0	0	0	110.1	A102 L103 C108 L130 Y131 C132	A102-F110 CarbonylContact C-O 3.57Å; A102-F110 VanDerWaalsContact CA-O 3.23Å; A102-F110 WeakPolarHBondContact CA-O 3.43Å; L103-F110 HydrophobicContact CB-CB 4.35Å; L103-F110 PolarHBondContact N-O 3.06Å; L103-F110 PolarHBondContact O-N 3.2Å; C108-F110 HydrophobicContact CB-CD2 4.45Å; C108-F110 HydrophobicContact CB-CE2 3.71Å; C108-F110 HydrophobicContact CB-CZ 3.82Å; F110-L130 HydrophobicContact CB-CD1 3.53Å; F110-L130 HydrophobicContact CB-CD2 4.05Å; F110-L130 HydrophobicContact CB-CG 3.75Å; F110-L130 HydrophobicContact CD1-CD2 3.98Å; F110-L130 HydrophobicContact CD1-CG 4.09Å; F110-L130 HydrophobicContact CD2-CD2 4.46Å; F110-L130 HydrophobicContact CG-CD1 4.31Å; F110-L130 HydrophobicContact CG-CD2 3.91Å; F110-L130 HydrophobicContact CG-CG 4.06Å; F110-Y131 CarbonylContact C-O 3.44Å; F110-Y131 VanDerWaalsContact CA-O 3.26Å; F110-Y131 WeakPolarHBondContact CA-O 3.17Å; F110-C132 HydrophobicContact CD1-CB 3.93Å; F110-C132 HydrophobicContact CE1-CB 3.94Å
111	V	92.6	Very high	83.3	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.3	175.2	-178.8	0	0	0	0	109.3	F100 L101 A102 Y131 A133 I185 F187	F100-V111 HydrophobicContact CB-CG1 3.82Å; F100-V111 HydrophobicContact CD1-CG1 4.01Å; F100-V111 HydrophobicContact CG-CG1 4.27Å; L101-V111 WeakPolarHBondContact O-CA 3.44Å; A102-V111 HydrophobicContact CB-CG2 4.41Å; V111-Y131 PolarHBondContact N-O 2.94Å; V111-Y131 PolarHBondContact O-N 2.94Å; V111-A133 HydrophobicContact CG2-CB 4.06Å; V111-I185 HydrophobicContact CG1-CD1 4.31Å; V111-F187 HydrophobicContact CB-CE1 3.87Å; V111-F187 HydrophobicContact CB-CZ 3.84Å; V111-F187 HydrophobicContact CG1-CE1 4.5Å; V111-F187 HydrophobicContact CG2-CE1 3.81Å; V111-F187 HydrophobicContact CG2-CZ 4.11Å
112	V	91.4	Very high	82.1	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	149.7	173.1	67.9	0	0	0	0	110	L58 L81 L101 L103 A114 R128 L130	L58-V112 HydrophobicContact CD2-CG1 4.43Å; L81-V112 HydrophobicContact CD2-CB 4.26Å; L81-V112 HydrophobicContact CD2-CG2 3.75Å; L101-V112 HydrophobicContact CB-CG1 3.78Å; L101-V112 HydrophobicContact CD2-CG1 3.93Å; L101-V112 HydrophobicContact CG-CG1 4.21Å; L101-V112 PolarHBondContact N-O 3.46Å; L101-V112 PolarHBondContact O-N 2.85Å; L103-V112 HydrophobicContact CD1-CB 4.33Å; L103-V112 HydrophobicContact CD1-CG1 3.78Å; V112-A114 PolarHBondContact O-N 3.14Å; V112-R128 HydrophobicContact CG2-CB 3.6Å; V112-R128 HydrophobicContact CG2-CG 4.35Å; V112-L130 HydrophobicContact CB-CD1 4.41Å
113	D	89.3	Confident	81.1	Confident	11 Å²	11	45.8 Å²	45.8	6%	0.059	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	113.2	170.4	-176.3	17.9	0	0	0	109.7	Q99 Q115 R128 K178 I185	Q99-D113 CarbonylContact O-C 3.54Å; Q99-D113 WeakPolarHBondContact O-CA 3.38Å; D113-Q115 WeakPolarHBondContact OD1-CB 3.44Å; D113-Q115 PolarHBondContact OD1-N 3.36Å; D113-R128 IonicContact OD2-CZ 2.74Å; D113-R128 IonicContact OD2-NH1 3.86Å; D113-R128 PolarHBondContact OD2-NH1 2.94Å; D113-K178 IonicContact OD1-NZ 2.99Å; D113-K178 WeakPolarHBondContact OD2-CE 3.49Å; D113-K178 IonicContact OD2-NZ 3.97Å; D113-K178 PolarHBondContact OD2-NZ 2.78Å; D113-I185 HydrophobicContact CB-CD1 4.15Å
114	A	84.2	Confident	80.2	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.008	28%	0.279	C	S	.	.			trans	-88.4	-8.6	178.6	0	0	0	0	0	112.6	R47 F49 Q99 L101 V112 F116	R47-A114 PolarHBondContact NH1-O 2.95Å; F49-A114 HydrophobicContact CE1-CB 4.2Å; F49-A114 HydrophobicContact CZ-CB 3.77Å; Q99-A114 PolarHBondContact O-N 2.88Å; L101-A114 HydrophobicContact CB-CB 3.9Å; V112-A114 PolarHBondContact O-N 3.14Å; A114-F116 WeakPolarHBondContact O-CD2 3.44Å; A114-F116 WeakPolarHBondContact O-CE2 3.5Å; A114-F116 PolarHBondContact O-N 3.13Å
115	Q	81.7	Confident	79.7	Confident	80 Å²	80	57 Å²	57	37%	0.374	30%	0.296	S	S	.	.			trans	-73.2	121.5	176.3	-92.4	170.5	8	0	0	111.4	Q99 D113 R128	Q99-Q115 HydrophobicContact CB-CG 4.39Å; Q99-Q115 HydrophobicContact CG-CG 4.36Å; D113-Q115 WeakPolarHBondContact OD1-CB 3.44Å; D113-Q115 PolarHBondContact OD1-N 3.36Å; Q115-R128 PolarHBondContact O-NH2 3.34Å
116	F	75.3	Confident	79.5	Confident	28 Å²	28	56.8 Å²	56.8	12%	0.123	29%	0.294	C	S	.	.			trans	-112	131.3	175.9	-59.6	-77	0	0	0	110.4	F49 V60 V79 A114 E120 F121 I126	F49-F116 AromaticContact CE1-CE2 3.69Å; F49-F116 HydrophobicContact CE1-CE2 3.69Å; F49-F116 HydrophobicContact CE1-CZ 4.14Å; F49-F116 AromaticContact CZ-CE2 3.96Å; F49-F116 HydrophobicContact CZ-CE2 3.96Å; V60-F116 HydrophobicContact CB-CE2 4.37Å; V60-F116 HydrophobicContact CB-CZ 4.43Å; V60-F116 HydrophobicContact CG1-CD2 4.39Å; V60-F116 HydrophobicContact CG1-CE2 4.03Å; V60-F116 HydrophobicContact CG2-CE2 3.75Å; V60-F116 HydrophobicContact CG2-CZ 3.68Å; V79-F116 HydrophobicContact CG2-CE1 4.12Å; V79-F116 HydrophobicContact CG2-CZ 4.1Å; A114-F116 WeakPolarHBondContact O-CD2 3.44Å; A114-F116 WeakPolarHBondContact O-CE2 3.5Å; A114-F116 PolarHBondContact O-N 3.13Å; F116-E120 WeakPolarHBondContact CA-OE2 3.39Å; F116-F121 HydrophobicContact CB-CE1 3.79Å; F116-F121 HydrophobicContact CB-CE2 3.76Å; F116-F121 HydrophobicContact CB-CZ 3.25Å; F116-F121 HydrophobicContact CD2-CE1 4.46Å; F116-F121 HydrophobicContact CD2-CZ 4.31Å; F116-F121 HydrophobicContact CG-CE1 4.15Å; F116-F121 HydrophobicContact CG-CZ 4.02Å; F116-I126 HydrophobicContact CD1-CD1 3.73Å; F116-I126 HydrophobicContact CE1-CD1 3.92Å; F116-I126 HydrophobicContact CE1-CG2 4.33Å
117	G	69.4	Low	79.4	Confident	36 Å²	36	54.8 Å²	54.8	37%	0.371	29%	0.29	S	S	.	.			trans	-78.9	155.3	172.1	0	0	0	0	0	111.8	K119 E120 F121	G117-K119 PolarHBondContact O-N 3.07Å; G117-E120 PolarHBondContact N-OE2 3.38Å; G117-E120 WeakPolarHBondContact O-CB 3.32Å; G117-E120 PolarHBondContact O-N 3.43Å; G117-F121 WeakPolarHBondContact O-CD2 3.39Å
118	L	65.6	Low	79.4	Confident	132 Å²	132	54.5 Å²	54.5	69%	0.691	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-32.9	178.2	-73.1	167.2	0	0	0	113.6
119	K	66.2	Low	79.4	Confident	182 Å²	182	56.9 Å²	56.9	79%	0.791	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-26.4	-179.8	-63	-176.7	-179.9	-178.4	0	113.7	G117 F121 C122	G117-K119 PolarHBondContact O-N 3.07Å; K119-F121 PolarHBondContact O-N 3.22Å; K119-C122 PolarHBondContact O-N 3.43Å
120	E	69.7	Low	79.3	Confident	40 Å²	40	57.6 Å²	57.6	19%	0.187	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-72.2	-25	179.2	-65.9	-179.9	116.1	0	0	110.9	F116 G117 C122 Q123 I126 R128	F116-E120 WeakPolarHBondContact CA-OE2 3.39Å; G117-E120 PolarHBondContact N-OE2 3.38Å; G117-E120 WeakPolarHBondContact O-CB 3.32Å; G117-E120 PolarHBondContact O-N 3.43Å; E120-C122 PolarHBondContact O-N 2.94Å; E120-Q123 WeakPolarHBondContact O-CB 3.41Å; E120-Q123 PolarHBondContact O-N 3.4Å; E120-Q123 VanDerWaalsContact O-N 3.13Å; E120-I126 HydrophobicContact CB-CD1 3.88Å; E120-I126 HydrophobicContact CB-CG1 4.28Å; E120-R128 IonicContact OE1-CZ 2.66Å; E120-R128 IonicContact OE1-NE 2.75Å; E120-R128 PolarHBondContact OE1-NE 2.82Å; E120-R128 IonicContact OE1-NH2 3.8Å; E120-R128 PolarHBondContact OE1-NH2 2.98Å; E120-R128 IonicContact OE2-NH2 2.85Å; E120-R128 PolarHBondContact OE2-NH2 3.01Å
121	F	66.5	Low	79.3	Confident	38 Å²	38	58.8 Å²	58.8	17%	0.167	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-70.6	-8.1	176.5	-62.8	-64	0	0	0	114.9	V62 P75 I77 F116 G117 K119	V62-F121 HydrophobicContact CB-CD1 4.49Å; V62-F121 HydrophobicContact CB-CE1 4.09Å; V62-F121 HydrophobicContact CB-CZ 4.46Å; V62-F121 HydrophobicContact CG1-CZ 4.44Å; V62-F121 HydrophobicContact CG2-CD1 3.89Å; V62-F121 HydrophobicContact CG2-CE1 3.14Å; V62-F121 HydrophobicContact CG2-CZ 3.6Å; P75-F121 HydrophobicContact CG-CB 4.46Å; I77-F121 VanDerWaalsContact CD1-CA 3.42Å; I77-F121 HydrophobicContact CD1-CB 4.13Å; I77-F121 HydrophobicContact CD1-CD1 3.6Å; I77-F121 HydrophobicContact CD1-CG 4.33Å; F116-F121 HydrophobicContact CB-CE1 3.79Å; F116-F121 HydrophobicContact CB-CE2 3.76Å; F116-F121 HydrophobicContact CB-CZ 3.25Å; F116-F121 HydrophobicContact CD2-CE1 4.46Å; F116-F121 HydrophobicContact CD2-CZ 4.31Å; F116-F121 HydrophobicContact CG-CE1 4.15Å; F116-F121 HydrophobicContact CG-CZ 4.02Å; G117-F121 WeakPolarHBondContact O-CD2 3.39Å; K119-F121 PolarHBondContact O-N 3.22Å
122	C	65	Low	79.3	Confident	115 Å²	115	61.6 Å²	61.6	78%	0.777	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-98.5	2.8	174.4	-57.1	0	0	0	0	112.8	K119 E120	K119-C122 PolarHBondContact O-N 3.43Å; E120-C122 PolarHBondContact O-N 2.94Å
123	Q	70.1	Confident	79.3	Confident	95 Å²	95	62.3 Å²	62.3	44%	0.444	33%	0.333	S	S	.	.	S	Bend	trans	-93.3	143.7	-179.7	-63	178.4	-9.8	0	0	110.7	E120 Q125	E120-Q123 WeakPolarHBondContact O-CB 3.41Å; E120-Q123 PolarHBondContact O-N 3.4Å; E120-Q123 VanDerWaalsContact O-N 3.13Å; Q123-Q125 PolarHBondContact O-N 3.34Å
124	D	70.3	Confident	79.3	Confident	159 Å²	159	62.5 Å²	62.5	85%	0.85	33%	0.334	S	S	*	.	S	Bend	trans	-66.9	-27.9	177.2	-66.1	-31.4	0	0	0	112.6	P78	P78-D124 VanDerWaalsContact CD-O 3.22Å; P78-D124 WeakPolarHBondContact CD-O 3.23Å; P78-D124 VanDerWaalsContact CG-O 3.26Å; P78-D124 WeakPolarHBondContact CG-O 3.46Å
125	Q	78.6	Confident	79.6	Confident	85 Å²	85	63.4 Å²	63.4	40%	0.397	34%	0.339	S	S	.	.			trans	-153.3	141.7	177.6	-176	172.8	41.6	0	0	109.6	P78 L80 Q123	P78-Q125 HydrophobicContact CB-CG 4.33Å; P78-Q125 HydrophobicContact CG-CB 4.03Å; P78-Q125 HydrophobicContact CG-CG 4.05Å; P78-Q125 WeakPolarHBondContact O-CA 3.42Å; P78-Q125 WeakPolarHBondContact O-CG 3.28Å; L80-Q125 HydrophobicContact CB-CG 4.31Å; Q123-Q125 PolarHBondContact O-N 3.34Å
126	I	82.9	Confident	79.7	Confident	2 Å²	2	61 Å²	61	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	131	175.1	-60.9	166.4	0	0	0	108	I77 P78 V79 L80 F116 E120 R128	I77-I126 HydrophobicContact CB-CD1 4.33Å; I77-I126 HydrophobicContact CD1-CD1 4.25Å; I77-I126 HydrophobicContact CG2-CB 4.38Å; I77-I126 HydrophobicContact CG2-CD1 3.53Å; I77-I126 HydrophobicContact CG2-CG1 3.61Å; P78-I126 PolarHBondContact O-N 3.41Å; V79-I126 CarbonylContact C-O 3.52Å; V79-I126 VanDerWaalsContact CA-O 3.24Å; V79-I126 WeakPolarHBondContact CA-O 3.48Å; L80-I126 PolarHBondContact N-O 3.47Å; F116-I126 HydrophobicContact CD1-CD1 3.73Å; F116-I126 HydrophobicContact CE1-CD1 3.92Å; F116-I126 HydrophobicContact CE1-CG2 4.33Å; E120-I126 HydrophobicContact CB-CD1 3.88Å; E120-I126 HydrophobicContact CB-CG1 4.28Å; I126-R128 HydrophobicContact CG2-CG 3.95Å
127	V	86.2	Confident	80	Confident	82 Å²	82	67.1 Å²	67.1	50%	0.497	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.6	173.2	-175.4	0	0	0	0	108.9	L80 T82	L80-V127 HydrophobicContact CB-CG2 4.27Å; L80-V127 HydrophobicContact CD2-CG2 4.24Å; L80-V127 CarbonylContact O-C 3.58Å; L80-V127 WeakPolarHBondContact O-CA 3.37Å; T82-V127 HydrophobicContact CG2-CG1 3.84Å
128	R	88.1	Confident	80.4	Confident	29 Å²	29	71.2 Å²	71.2	11%	0.109	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.8	177.4	-70	-57.7	-174.5	128.8	1.5	112.5	V79 L80 L81 T82 V112 D113 Q115 E120 I126	V79-R128 HydrophobicContact CG1-CB 4.06Å; V79-R128 HydrophobicContact CG1-CG 3.93Å; L80-R128 PolarHBondContact O-N 2.89Å; L81-R128 WeakPolarHBondContact CA-O 3.21Å; L81-R128 HydrophobicContact CD2-CB 4.42Å; T82-R128 PolarHBondContact N-O 2.91Å; V112-R128 HydrophobicContact CG2-CB 3.6Å; V112-R128 HydrophobicContact CG2-CG 4.35Å; D113-R128 IonicContact OD2-CZ 2.74Å; D113-R128 IonicContact OD2-NH1 3.86Å; D113-R128 PolarHBondContact OD2-NH1 2.94Å; Q115-R128 PolarHBondContact O-NH2 3.34Å; E120-R128 IonicContact OE1-CZ 2.66Å; E120-R128 IonicContact OE1-NE 2.75Å; E120-R128 PolarHBondContact OE1-NE 2.82Å; E120-R128 IonicContact OE1-NH2 3.8Å; E120-R128 PolarHBondContact OE1-NH2 2.98Å; E120-R128 IonicContact OE2-NH2 2.85Å; E120-R128 PolarHBondContact OE2-NH2 3.01Å; I126-R128 HydrophobicContact CG2-CG 3.95Å
129	P	89.8	Confident	80.7	Confident	52 Å²	52	67.5 Å²	67.5	34%	0.338	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	135.1	174.4	25.8	-30.7	0	0	0	111	T82 Y131	T82-P129 CarbonylContact O-C 3.6Å; T82-P129 VanDerWaalsContact O-CA 3.31Å; T82-P129 WeakPolarHBondContact O-CA 3.42Å; P129-Y131 HydrophobicContact CB-CE2 3.79Å; P129-Y131 HydrophobicContact CG-CE2 3.61Å; P129-Y131 WeakPolarHBondContact CG-OH 3.48Å; P129-Y131 WeakPolarHBondContact O-CD2 3.39Å; P129-Y131 WeakPolarHBondContact O-CE2 3.38Å
130	L	89.9	Confident	79.9	Confident	14 Å²	14	64.4 Å²	64.4	7%	0.073	35%	0.346	C	S	.	.			trans	-96.5	122.5	175.5	-171.6	68.7	0	0	0	109.1	L81 T82 P85 L103 F110 V112	L81-L130 HydrophobicContact CB-CB 4.47Å; L81-L130 HydrophobicContact CD1-CD1 4.34Å; T82-L130 PolarHBondContact O-N 2.98Å; P85-L130 HydrophobicContact CB-CD2 3.91Å; L103-L130 HydrophobicContact CD1-CD1 3.96Å; F110-L130 HydrophobicContact CB-CD1 3.53Å; F110-L130 HydrophobicContact CB-CD2 4.05Å; F110-L130 HydrophobicContact CB-CG 3.75Å; F110-L130 HydrophobicContact CD1-CD2 3.98Å; F110-L130 HydrophobicContact CD1-CG 4.09Å; F110-L130 HydrophobicContact CD2-CD2 4.46Å; F110-L130 HydrophobicContact CG-CD1 4.31Å; F110-L130 HydrophobicContact CG-CD2 3.91Å; F110-L130 HydrophobicContact CG-CG 4.06Å; V112-L130 HydrophobicContact CB-CD1 4.41Å
131	Y	92.5	Very high	78.9	Confident	52 Å²	52	67.5 Å²	67.5	20%	0.204	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.5	-178.1	-59.3	-89.7	0	0	0	110.2	F110 V111 P129 A133 S184 I185	F110-Y131 CarbonylContact C-O 3.44Å; F110-Y131 VanDerWaalsContact CA-O 3.26Å; F110-Y131 WeakPolarHBondContact CA-O 3.17Å; V111-Y131 PolarHBondContact N-O 2.94Å; V111-Y131 PolarHBondContact O-N 2.94Å; P129-Y131 HydrophobicContact CB-CE2 3.79Å; P129-Y131 HydrophobicContact CG-CE2 3.61Å; P129-Y131 WeakPolarHBondContact CG-OH 3.48Å; P129-Y131 WeakPolarHBondContact O-CD2 3.39Å; P129-Y131 WeakPolarHBondContact O-CE2 3.38Å; Y131-A133 PolarHBondContact O-N 2.9Å; Y131-S184 WeakPolarHBondContact OH-CA 3.42Å; Y131-I185 HydrophobicContact CD1-CB 4.38Å; Y131-I185 WeakPolarHBondContact CD1-O 3.46Å; Y131-I185 HydrophobicContact CD2-CB 3.73Å; Y131-I185 HydrophobicContact CD2-CD1 3.85Å; Y131-I185 HydrophobicContact CD2-CG1 3.95Å; Y131-I185 HydrophobicContact CE2-CB 3.98Å; Y131-I185 HydrophobicContact CE2-CD1 4.05Å; Y131-I185 HydrophobicContact CE2-CG1 3.89Å; Y131-I185 HydrophobicContact CG-CB 3.94Å
132	C	91.7	Very high	78.1	Confident	59 Å²	59	75.4 Å²	75.4	40%	0.399	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	114.5	175.7	-174	0	0	0	0	110	F110 I134 F187	F110-C132 HydrophobicContact CD1-CB 3.93Å; F110-C132 HydrophobicContact CE1-CB 3.94Å; C132-I134 VanDerWaalsContact SG-C 3.56Å; C132-I134 PolarHBondContact SG-O 3.3Å; C132-F187 VanDerWaalsContact O-CD2 3.25Å; C132-F187 WeakPolarHBondContact O-CD2 3.4Å; C132-F187 WeakPolarHBondContact O-CE2 3.46Å
133	A	91.7	Very high	77.3	Confident	16 Å²	16	71.5 Å²	71.5	13%	0.132	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-41.5	176	0	0	0	0	0	111.4	V109 V111 Y131 F187	V109-A133 WeakPolarHBondContact O-CB 3.46Å; V109-A133 PolarHBondContact O-N 3.41Å; V111-A133 HydrophobicContact CG2-CB 4.06Å; Y131-A133 PolarHBondContact O-N 2.9Å; A133-F187 HydrophobicContact CB-CD1 3.8Å; A133-F187 HydrophobicContact CB-CD2 4.26Å; A133-F187 HydrophobicContact CB-CE1 3.65Å; A133-F187 HydrophobicContact CB-CE2 4.1Å; A133-F187 HydrophobicContact CB-CG 4.1Å; A133-F187 HydrophobicContact CB-CZ 3.79Å
134	I	90.7	Very high	76.3	Confident	15 Å²	15	77 Å²	77	8%	0.077	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	142.4	174.4	-163.3	160.5	0	0	0	109.4	C108 V109 C132 L136 L139 I164 Y172 I174	C108-I134 WeakPolarHBondContact CA-O 3.46Å; V109-I134 HydrophobicContact CB-CG2 4.02Å; V109-I134 HydrophobicContact CG2-CG2 3.93Å; V109-I134 PolarHBondContact N-O 3.13Å; V109-I134 PolarHBondContact O-N 3.34Å; C132-I134 VanDerWaalsContact SG-C 3.56Å; C132-I134 PolarHBondContact SG-O 3.3Å; I134-L136 HydrophobicContact CD1-CD2 4.12Å; I134-L136 HydrophobicContact CG1-CD2 4.29Å; I134-L139 HydrophobicContact CD1-CD1 3.73Å; I134-L139 HydrophobicContact CG1-CD1 3.59Å; I134-I164 HydrophobicContact CB-CD1 4.28Å; I134-I164 HydrophobicContact CG2-CD1 3.37Å; I134-Y172 HydrophobicContact CD1-CD1 3.71Å; I134-Y172 HydrophobicContact CD1-CD2 3.97Å; I134-Y172 HydrophobicContact CD1-CE1 4.01Å; I134-Y172 HydrophobicContact CD1-CE2 4.25Å; I134-Y172 HydrophobicContact CD1-CG 3.69Å; I134-I174 HydrophobicContact CB-CD1 3.83Å; I134-I174 HydrophobicContact CD1-CD1 4.05Å; I134-I174 HydrophobicContact CG1-CD1 4.48Å; I134-I174 HydrophobicContact CG2-CD1 4.32Å
135	D	88.9	Confident	75.5	Confident	20 Å²	20	72.5 Å²	72.5	11%	0.107	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	112.8	163.3	-170.1	-23.3	0	0	0	107.2	C108 R137 D138	C108-D135 PolarHBondContact SG-OD1 2.97Å; C108-D135 VanDerWaalsContact SG-OD1 3.34Å; C108-D135 PolarHBondContact SG-OD2 3.15Å; C108-D135 VanDerWaalsContact SG-OD2 3.35Å; D135-R137 PolarHBondContact O-N 2.99Å; D135-R137 VanDerWaalsContact O-N 3.1Å; D135-R137 WeakPolarHBondContact OD1-CB 3.14Å; D135-R137 IonicContact OD1-CZ 3.47Å; D135-R137 PolarHBondContact OD1-N 3.02Å; D135-R137 IonicContact OD1-NE 2.91Å; D135-R137 PolarHBondContact OD1-NE 2.88Å; D135-R137 IonicContact OD1-NH2 3.41Å; D135-R137 IonicContact OD2-CZ 2.68Å; D135-R137 IonicContact OD2-NE 3.69Å; D135-R137 PolarHBondContact OD2-NE 3.33Å; D135-R137 IonicContact OD2-NH2 3.3Å; D135-R137 PolarHBondContact OD2-NH2 3.48Å; D135-D138 HydrophobicContact CB-CB 4.26Å; D135-D138 PolarHBondContact O-N 2.97Å
136	L	85.1	Confident	74.8	Confident	29 Å²	29	75.9 Å²	75.9	15%	0.152	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.8	-177.8	-64.9	-177.7	0	0	0	112.5	T107 I134 L139 G147 I149 T166 Y172	T107-L136 WeakPolarHBondContact O-CB 3.42Å; T107-L136 WeakPolarHBondContact O-CG 3.49Å; T107-L136 PolarHBondContact O-N 3.34Å; I134-L136 HydrophobicContact CD1-CD2 4.12Å; I134-L136 HydrophobicContact CG1-CD2 4.29Å; L136-L139 HydrophobicContact CD2-CD1 3.9Å; L136-G147 WeakPolarHBondContact CD1-O 3.23Å; L136-I149 HydrophobicContact CD1-CD1 4.33Å; L136-I149 HydrophobicContact CD1-CG1 3.54Å; L136-I149 HydrophobicContact CG-CG1 4.27Å; L136-T166 HydrophobicContact CD1-CG2 3.83Å; L136-T166 HydrophobicContact CD2-CG2 4.22Å; L136-Y172 HydrophobicContact CD2-CE2 4.01Å
137	R	80.4	Confident	74.3	Confident	158 Å²	158	76.2 Å²	76.2	60%	0.596	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-25.6	178.3	-58.4	169.7	-65.1	-175.2	6.1	112.6	C108 D135	C108-R137 PolarHBondContact SG-NH2 3.06Å; D135-R137 PolarHBondContact O-N 2.99Å; D135-R137 VanDerWaalsContact O-N 3.1Å; D135-R137 WeakPolarHBondContact OD1-CB 3.14Å; D135-R137 IonicContact OD1-CZ 3.47Å; D135-R137 PolarHBondContact OD1-N 3.02Å; D135-R137 IonicContact OD1-NE 2.91Å; D135-R137 PolarHBondContact OD1-NE 2.88Å; D135-R137 IonicContact OD1-NH2 3.41Å; D135-R137 IonicContact OD2-CZ 2.68Å; D135-R137 IonicContact OD2-NE 3.69Å; D135-R137 PolarHBondContact OD2-NE 3.33Å; D135-R137 IonicContact OD2-NH2 3.3Å; D135-R137 PolarHBondContact OD2-NH2 3.48Å
138	D	78.6	Confident	74.4	Confident	121 Å²	121	74.6 Å²	74.6	65%	0.647	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-9.9	-176.7	-70.3	-12.9	0	0	0	112.8	D135 S140	D135-D138 HydrophobicContact CB-CB 4.26Å; D135-D138 PolarHBondContact O-N 2.97Å; D138-S140 PolarHBondContact O-N 3.12Å
139	L	72.2	Confident	74.5	Confident	55 Å²	55	73.9 Å²	73.9	29%	0.288	39%	0.391	S	S	.	.			trans	-70.1	94	176.9	-87.5	137	0	0	0	110.8	I134 L136 S141 Y172	I134-L139 HydrophobicContact CD1-CD1 3.73Å; I134-L139 HydrophobicContact CG1-CD1 3.59Å; L136-L139 HydrophobicContact CD2-CD1 3.9Å; L139-S141 PolarHBondContact O-N 3.3Å; L139-Y172 HydrophobicContact CD2-CE1 4.38Å
140	S	49.3	Very low	74.5	Confident	117 Å²	117	73.3 Å²	73.3	82%	0.818	39%	0.387	S	S	*	.			trans	-91.7	18.2	-156.7	57.5	0	0	0	0	117.7	D138	D138-S140 PolarHBondContact O-N 3.12Å
141	S	48.9	Very low	74.4	Confident	105 Å²	105	74.4 Å²	74.4	73%	0.734	39%	0.391	S	S	*	.	S	Bend	trans	-137.3	-19.7	-168.4	64.1	0	0	0	0	121.9	L139	L139-S141 PolarHBondContact O-N 3.3Å
142	K	50	Low	74.4	Confident	204 Å²	204	72.4 Å²	72.4	89%	0.887	38%	0.384	S	S	*	.	S	Bend	trans	-143.3	-17.2	-179.4	-68.7	-172	179.7	179.7	0	117.6
143	S	47.2	Very low	74.4	Confident	32 Å²	32	71.3 Å²	71.3	22%	0.224	37%	0.372	C	S	.	.			trans	-128.7	87.3	179.5	49.4	0	0	0	0	110.8	L145	S143-L145 PolarHBondContact O-N 3.44Å
144	K	49	Very low	74.3	Confident	210 Å²	210	71.5 Å²	71.5	91%	0.913	37%	0.369	S	S	*	.			trans	-69.8	30	165.7	-78.4	-172.9	175.9	-178.6	0	112.6
145	L	54.1	Low	74.3	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.346	37%	0.365	S	S	.	.	S	Bend	trans	-90.7	121.8	171.9	-76.7	154.4	0	0	0	105.4	S143 G147 N168	S143-L145 PolarHBondContact O-N 3.44Å; L145-G147 PolarHBondContact O-N 3.29Å; L145-N168 WeakPolarHBondContact CB-ND2 3.32Å
146	N	63.7	Low	74.1	Confident	156 Å²	156	70.9 Å²	70.9	83%	0.834	37%	0.367	S	S	*	.			trans	-60.9	79.5	166.9	-75.9	-9.5	0	0	0	107.7
147	G	72.3	Confident	74	Confident	8 Å²	8	72.3 Å²	72.3	8%	0.082	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-77.6	132.9	-178	0	0	0	0	0	109.6	L136 L145	L136-G147 WeakPolarHBondContact CD1-O 3.23Å; L145-G147 PolarHBondContact O-N 3.29Å
148	V	88.3	Confident	74.3	Confident	49 Å²	49	65.3 Å²	65.3	30%	0.297	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-91	136.5	169.7	-179.1	0	0	0	0	109.7	E106 V150 T166 E167	E106-V148 HydrophobicContact CB-CG1 4.18Å; E106-V148 CarbonylContact O-C 3.59Å; E106-V148 WeakPolarHBondContact O-CA 3.41Å; V148-V150 PolarHBondContact O-N 2.79Å; V148-T166 CarbonylContact O-C 3.52Å; V148-T166 VanDerWaalsContact O-CA 3.29Å; V148-T166 WeakPolarHBondContact O-CA 3.22Å; V148-T166 WeakPolarHBondContact O-CB 3.47Å; V148-E167 HydrophobicContact CB-CG 4.23Å; V148-E167 WeakPolarHBondContact CG2-OE1 3.4Å; V148-E167 PolarHBondContact N-OE1 3.43Å; V148-E167 VanDerWaalsContact N-OE1 3.07Å; V148-E167 PolarHBondContact O-N 2.98Å
149	I	90.6	Very high	74.5	Confident	13 Å²	13	63 Å²	63	7%	0.067	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	119.4	169.1	-62.3	178.1	0	0	0	107.6	I104 E106 V109 L136 V152 I164	I104-I149 HydrophobicContact CG2-CG2 4.33Å; E106-I149 PolarHBondContact O-N 2.85Å; V109-I149 HydrophobicContact CG2-CD1 3.68Å; L136-I149 HydrophobicContact CD1-CD1 4.33Å; L136-I149 HydrophobicContact CD1-CG1 3.54Å; L136-I149 HydrophobicContact CG-CG1 4.27Å; I149-V152 HydrophobicContact CG2-CG2 3.6Å; I149-I164 HydrophobicContact CD1-CG2 4.4Å; I149-I164 HydrophobicContact CG1-CG2 4.27Å; I149-I164 HydrophobicContact CG2-CG2 4Å
150	V	88.8	Confident	75.3	Confident	41 Å²	41	64.3 Å²	64.3	25%	0.248	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-51.2	178.1	166.1	0	0	0	0	110	V148 V165 E167 C243 V244	V148-V150 PolarHBondContact O-N 2.79Å; V150-V165 PolarHBondContact N-O 3.46Å; V150-E167 HydrophobicContact CG2-CB 3.66Å; V150-C243 WeakPolarHBondContact CG2-O 3.37Å; V150-V244 WeakPolarHBondContact CG1-O 3.38Å
151	K	89.4	Confident	77.4	Confident	37 Å²	37	59 Å²	59	16%	0.161	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	156.8	179.8	-158.6	166.1	-171.1	178.1	0	111.2	V165 D245 F246	K151-V165 PolarHBondContact N-O 3.08Å; K151-V165 PolarHBondContact O-N 3.45Å; K151-V165 VanDerWaalsContact O-N 3.1Å; K151-D245 WeakPolarHBondContact CD-OD1 3.45Å; K151-D245 VanDerWaalsContact CE-OD1 3.28Å; K151-D245 WeakPolarHBondContact CE-OD1 3.28Å; K151-D245 IonicContact NZ-OD1 3.36Å; K151-D245 PolarHBondContact NZ-OD1 3.33Å; K151-D245 IonicContact NZ-OD2 2.92Å; K151-D245 PolarHBondContact NZ-OD2 3.46Å; K151-F246 HydrophobicContact CB-CD1 3.87Å; K151-F246 HydrophobicContact CB-CE1 3.76Å; K151-F246 HydrophobicContact CG-CE1 4.27Å; K151-F246 WeakPolarHBondContact O-CE1 3.44Å
152	V	91.7	Very high	79.5	Confident	9 Å²	9	54 Å²	54	6%	0.055	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.9	176.3	-178.8	0	0	0	0	107.9	I104 V109 I149 L162 V163 I164	I104-V152 HydrophobicContact CD1-CB 3.7Å; I104-V152 HydrophobicContact CD1-CG1 4.14Å; I104-V152 HydrophobicContact CD1-CG2 4.13Å; I104-V152 HydrophobicContact CG1-CB 4.06Å; I104-V152 HydrophobicContact CG1-CG1 4.34Å; I104-V152 HydrophobicContact CG1-CG2 3.99Å; I104-V152 HydrophobicContact CG2-CG2 3.77Å; V109-V152 HydrophobicContact CG2-CG2 3.82Å; I149-V152 HydrophobicContact CG2-CG2 3.6Å; V152-L162 HydrophobicContact CG1-CD1 3.67Å; V152-L162 HydrophobicContact CG1-CD2 3.74Å; V152-L162 HydrophobicContact CG1-CG 3.66Å; V152-V163 WeakPolarHBondContact CA-O 3.37Å; V152-I164 HydrophobicContact CG1-CG1 4.16Å; V152-I164 HydrophobicContact CG2-CG1 4.18Å; V152-I164 HydrophobicContact CG2-CG2 4.2Å
153	R	90.9	Very high	81.6	Confident	37 Å²	37	44.3 Å²	44.3	14%	0.14	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	147.3	174	-70.8	-165	162.8	-170.6	2.1	111.6	V163 F246 D247 F248	R153-V163 PolarHBondContact N-O 3.15Å; R153-V163 PolarHBondContact O-N 3.27Å; R153-F246 HydrophobicContact CB-CE2 4.23Å; R153-F246 HydrophobicContact CB-CZ 3.86Å; R153-F246 HydrophobicContact CG-CZ 4.14Å; R153-D247 IonicContact CZ-OD1 2.65Å; R153-D247 IonicContact CZ-OD2 3.64Å; R153-D247 IonicContact NH1-OD1 3.93Å; R153-D247 PolarHBondContact NH1-OD1 2.63Å; R153-D247 IonicContact NH1-OD2 2.76Å; R153-D247 PolarHBondContact NH1-OD2 2.96Å; R153-F248 HydrophobicContact CB-CD2 4.47Å; R153-F248 HydrophobicContact CB-CE2 3.7Å
154	W	89.9	Confident	83.9	Confident	20 Å²	20	42.8 Å²	42.8	8%	0.076	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	137.9	168.1	-67.9	103.1	0	0	0	109.7	L93 C94 F100 A102 L162 F248	L93-W154 HydrophobicContact CD2-CG 4.1Å; L93-W154 VanDerWaalsContact CG-CD1 3.48Å; L93-W154 PolarHBondContact O-NE1 3.3Å; C94-W154 VanDerWaalsContact O-CD1 3.27Å; F100-W154 HydrophobicContact CB-CH2 3.53Å; F100-W154 HydrophobicContact CB-CZ2 3.66Å; F100-W154 HydrophobicContact CB-CZ3 4.5Å; F100-W154 HydrophobicContact CD2-CH2 4.28Å; F100-W154 HydrophobicContact CG-CH2 4.13Å; A102-W154 HydrophobicContact CB-CZ2 4.19Å; W154-L162 HydrophobicContact CD2-CD1 3.67Å; W154-L162 HydrophobicContact CE3-CB 4.23Å; W154-L162 HydrophobicContact CE3-CD1 3.83Å; W154-L162 HydrophobicContact CG-CD1 4.34Å; W154-L162 HydrophobicContact CH2-CD1 3.83Å; W154-L162 HydrophobicContact CZ2-CD1 3.66Å; W154-L162 HydrophobicContact CZ3-CB 4.06Å; W154-L162 HydrophobicContact CZ3-CD1 3.91Å; W154-F248 WeakPolarHBondContact O-CE2 3.47Å
155	H	90.8	Very high	86	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.167	C	C	.	.			trans	-64.2	128.5	178.6	-168.2	-76.4	0	0	0	110.7	K157 S158 T161 V163 Y173 F248 Q265	H155-K157 VanDerWaalsContact C-N 3.31Å; H155-K157 PolarHBondContact ND1-N 3.39Å; H155-K157 PolarHBondContact O-N 3.11Å; H155-S158 PolarHBondContact ND1-N 3.33Å; H155-S158 CarbonylContact O-C 3.56Å; H155-S158 PolarHBondContact O-N 3.11Å; H155-T161 HydrophobicContact CB-CG2 4.31Å; H155-T161 WeakPolarHBondContact CB-O 3.33Å; H155-T161 PolarHBondContact N-O 3.09Å; H155-V163 HydrophobicContact CB-CG2 4.44Å; H155-Y173 AromaticContact CD2-CE1 3.68Å; H155-F248 HydrophobicContact CB-CZ 4.35Å; H155-F248 AromaticContact CD2-CE1 3.48Å; H155-F248 VanDerWaalsContact CD2-CE1 3.48Å; H155-F248 WeakPolarHBondContact CD2-CE1 3.47Å; H155-F248 AromaticContact NE2-CE1 3.94Å; H155-Q265 PolarHBondContact CE1-O 3.42Å
156	P	84.5	Confident	87.8	Confident	22 Å²	22	29.8 Å²	29.8	14%	0.143	15%	0.152	C	C	.	.	S	Bend	trans	-69.3	-24.8	-168.5	25.6	-35.8	0	0	0	114.4	Q96 F248	Q96-P156 PolarHBondContact OE1-O 3.22Å; Q96-P156 VanDerWaalsContact OE1-O 3.12Å; P156-F248 HydrophobicContact CG-CB 3.93Å; P156-F248 HydrophobicContact CG-CD1 4.16Å; P156-F248 HydrophobicContact CG-CD2 4.23Å; P156-F248 HydrophobicContact CG-CG 3.87Å
157	K	83.6	Confident	89	Confident	59 Å²	59	23.3 Å²	23.3	26%	0.257	12%	0.116	S	C	.	.	S	Bend	trans	-104.4	-11.9	176.1	-65.7	-172.7	174	-170.5	0	114.1	H155 Q265 D322	H155-K157 VanDerWaalsContact C-N 3.31Å; H155-K157 PolarHBondContact ND1-N 3.39Å; H155-K157 PolarHBondContact O-N 3.11Å; K157-Q265 HydrophobicContact CB-CB 4.27Å; K157-Q265 WeakPolarHBondContact CB-O 3.49Å; K157-D322 WeakPolarHBondContact CE-OD2 3.35Å; K157-D322 IonicContact NZ-OD2 2.73Å; K157-D322 PolarHBondContact NZ-OD2 2.74Å
158	S	86.9	Confident	89.5	Confident	10 Å²	10	23.9 Å²	23.9	7%	0.07	12%	0.118	C	C	.	.			trans	-126.2	81	-176.1	-169	0	0	0	0	107.2	H155 R160 T161 Q265	H155-S158 PolarHBondContact ND1-N 3.33Å; H155-S158 CarbonylContact O-C 3.56Å; H155-S158 PolarHBondContact O-N 3.11Å; S158-R160 PolarHBondContact O-N 3.14Å; S158-T161 PolarHBondContact O-N 3.15Å; S158-T161 PolarHBondContact OG-OG1 3.06Å; S158-Q265 PolarHBondContact OG-OE1 3.48Å
159	N	82.1	Confident	89.5	Confident	72 Å²	72	21.7 Å²	21.7	39%	0.385	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-4.4	-169	60.8	1.2	0	0	0	116	Q96 C97	Q96-N159 HydrophobicContact CB-CB 4.33Å; C97-N159 HydrophobicContact CB-CB 4.2Å
160	R	90.2	Very high	89.5	Confident	84 Å²	84	21.8 Å²	21.8	32%	0.317	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.2	5.7	175.6	-53	-166.9	167	-178.3	-3.7	113.7	F100 S158 C176	F100-R160 HydrophobicContact CE2-CB 4.17Å; F100-R160 HydrophobicContact CE2-CG 3.85Å; S158-R160 PolarHBondContact O-N 3.14Å; R160-C176 WeakPolarHBondContact O-CB 3.28Å; R160-C176 PolarHBondContact O-N 3.38Å
161	T	92.1	Very high	89.6	Confident	5 Å²	5	19.9 Å²	19.9	3%	0.031	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.3	-178.6	-57.8	0	0	0	0	108.9	H155 S158 Y173 I174 H175	H155-T161 HydrophobicContact CB-CG2 4.31Å; H155-T161 WeakPolarHBondContact CB-O 3.33Å; H155-T161 PolarHBondContact N-O 3.09Å; S158-T161 PolarHBondContact O-N 3.15Å; S158-T161 PolarHBondContact OG-OG1 3.06Å; T161-Y173 HydrophobicContact CG2-CD1 3.9Å; T161-I174 WeakPolarHBondContact CA-O 3.46Å; T161-H175 PolarHBondContact OG1-ND1 3.3Å
162	L	93.6	Very high	89.7	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133.7	176.9	-163.1	87.7	0	0	0	108.6	A102 V109 V152 W154 I164 I174	A102-L162 HydrophobicContact CB-CD1 4.21Å; V109-L162 HydrophobicContact CB-CD2 4.43Å; V109-L162 HydrophobicContact CG1-CD2 3.78Å; V152-L162 HydrophobicContact CG1-CD1 3.67Å; V152-L162 HydrophobicContact CG1-CD2 3.74Å; V152-L162 HydrophobicContact CG1-CG 3.66Å; W154-L162 HydrophobicContact CD2-CD1 3.67Å; W154-L162 HydrophobicContact CE3-CB 4.23Å; W154-L162 HydrophobicContact CE3-CD1 3.83Å; W154-L162 HydrophobicContact CG-CD1 4.34Å; W154-L162 HydrophobicContact CH2-CD1 3.83Å; W154-L162 HydrophobicContact CZ2-CD1 3.66Å; W154-L162 HydrophobicContact CZ3-CB 4.06Å; W154-L162 HydrophobicContact CZ3-CD1 3.91Å; L162-I164 HydrophobicContact CD2-CD1 3.83Å; L162-I164 HydrophobicContact CD2-CG1 3.88Å; L162-I164 HydrophobicContact CG-CG1 4.4Å; L162-I174 PolarHBondContact N-O 3.34Å; L162-I174 PolarHBondContact O-N 3.29Å
163	V	94.8	Very high	89.8	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	128.3	175.3	-177.9	0	0	0	0	108.6	V152 R153 H155 I171 Y172 Y173 F246 F248 L269	V152-V163 WeakPolarHBondContact CA-O 3.37Å; R153-V163 PolarHBondContact N-O 3.15Å; R153-V163 PolarHBondContact O-N 3.27Å; H155-V163 HydrophobicContact CB-CG2 4.44Å; V163-I171 HydrophobicContact CG1-CG2 4.17Å; V163-Y172 WeakPolarHBondContact CA-O 3.47Å; V163-Y173 HydrophobicContact CB-CE2 4.36Å; V163-Y173 HydrophobicContact CG1-CD2 4.09Å; V163-Y173 HydrophobicContact CG1-CE2 3.64Å; V163-Y173 HydrophobicContact CG2-CD1 3.81Å; V163-Y173 HydrophobicContact CG2-CD2 4.02Å; V163-Y173 HydrophobicContact CG2-CE1 3.58Å; V163-Y173 HydrophobicContact CG2-CE2 3.77Å; V163-Y173 HydrophobicContact CG2-CG 4.02Å; V163-F246 HydrophobicContact CB-CE2 4.46Å; V163-F246 HydrophobicContact CB-CZ 4.33Å; V163-F246 HydrophobicContact CG1-CE2 4.03Å; V163-F246 HydrophobicContact CG1-CZ 4.06Å; V163-F248 HydrophobicContact CB-CZ 3.84Å; V163-F248 HydrophobicContact CG1-CZ 4.38Å; V163-F248 HydrophobicContact CG2-CE1 4.03Å; V163-F248 HydrophobicContact CG2-CZ 3.61Å; V163-L269 HydrophobicContact CG1-CD1 4.4Å; V163-L269 HydrophobicContact CG1-CD2 4.46Å
164	I	94.6	Very high	89.9	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.5	-176.6	-53.4	174.4	0	0	0	107.4	V109 I134 I149 V152 L162 I171 Y172 I174	V109-I164 HydrophobicContact CB-CD1 4.26Å; V109-I164 HydrophobicContact CG2-CD1 3.7Å; V109-I164 HydrophobicContact CG2-CG1 4.35Å; I134-I164 HydrophobicContact CB-CD1 4.28Å; I134-I164 HydrophobicContact CG2-CD1 3.37Å; I149-I164 HydrophobicContact CD1-CG2 4.4Å; I149-I164 HydrophobicContact CG1-CG2 4.27Å; I149-I164 HydrophobicContact CG2-CG2 4Å; V152-I164 HydrophobicContact CG1-CG1 4.16Å; V152-I164 HydrophobicContact CG2-CG1 4.18Å; V152-I164 HydrophobicContact CG2-CG2 4.2Å; L162-I164 HydrophobicContact CD2-CD1 3.83Å; L162-I164 HydrophobicContact CD2-CG1 3.88Å; L162-I164 HydrophobicContact CG-CG1 4.4Å; I164-I171 WeakPolarHBondContact O-CA 3.26Å; I164-Y172 HydrophobicContact CB-CD2 4.42Å; I164-Y172 HydrophobicContact CG2-CD2 4.48Å; I164-Y172 PolarHBondContact N-O 3.2Å; I164-Y172 PolarHBondContact O-N 3.37Å; I164-I174 HydrophobicContact CD1-CD1 3.7Å
165	V	92.9	Very high	90	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	135.1	173.6	-179.8	0	0	0	0	108.9	V150 K151 F170 I171 F246 L271	V150-V165 PolarHBondContact N-O 3.46Å; K151-V165 PolarHBondContact N-O 3.08Å; K151-V165 PolarHBondContact O-N 3.45Å; K151-V165 VanDerWaalsContact O-N 3.1Å; V165-F170 WeakPolarHBondContact CA-O 3.43Å; V165-I171 HydrophobicContact CG2-CG1 4.26Å; V165-F246 HydrophobicContact CB-CD1 3.58Å; V165-F246 HydrophobicContact CB-CE1 3.88Å; V165-F246 HydrophobicContact CB-CG 4.28Å; V165-F246 HydrophobicContact CG1-CD1 4.45Å; V165-F246 HydrophobicContact CG2-CB 4.25Å; V165-F246 HydrophobicContact CG2-CD1 3.35Å; V165-F246 HydrophobicContact CG2-CD2 4.16Å; V165-F246 HydrophobicContact CG2-CE1 3.58Å; V165-F246 HydrophobicContact CG2-CE2 4.35Å; V165-F246 HydrophobicContact CG2-CG 3.66Å; V165-F246 HydrophobicContact CG2-CZ 4.07Å; V165-L271 HydrophobicContact CG1-CD2 4.03Å
166	T	91.2	Very high	90.1	Very high	4 Å²	4	18.2 Å²	18.2	3%	0.025	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	163.5	176.7	72.9	0	0	0	0	111.2	L136 V148 N168 S169 F170 Y172	L136-T166 HydrophobicContact CD1-CG2 3.83Å; L136-T166 HydrophobicContact CD2-CG2 4.22Å; V148-T166 CarbonylContact O-C 3.52Å; V148-T166 VanDerWaalsContact O-CA 3.29Å; V148-T166 WeakPolarHBondContact O-CA 3.22Å; V148-T166 WeakPolarHBondContact O-CB 3.47Å; T166-N168 PolarHBondContact O-N 2.87Å; T166-S169 PolarHBondContact O-N 3.44Å; T166-F170 HydrophobicContact CG2-CB 4.28Å; T166-F170 PolarHBondContact N-O 2.96Å; T166-F170 WeakPolarHBondContact OG1-CB 3.41Å; T166-F170 PolarHBondContact OG1-N 3.29Å; T166-Y172 HydrophobicContact CG2-CD2 4.45Å; T166-Y172 HydrophobicContact CG2-CE2 3.88Å
167	E	88.9	Confident	90.4	Very high	20 Å²	20	19.6 Å²	19.6	9%	0.093	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.7	179.6	66.4	-177.6	170.2	0	0	113	V148 V150 S169 F237 K242 C243	V148-E167 HydrophobicContact CB-CG 4.23Å; V148-E167 WeakPolarHBondContact CG2-OE1 3.4Å; V148-E167 PolarHBondContact N-OE1 3.43Å; V148-E167 VanDerWaalsContact N-OE1 3.07Å; V148-E167 PolarHBondContact O-N 2.98Å; V150-E167 HydrophobicContact CG2-CB 3.66Å; E167-S169 PolarHBondContact O-N 2.92Å; E167-F237 HydrophobicContact CB-CE2 4.03Å; E167-F237 HydrophobicContact CB-CZ 3.8Å; E167-F237 HydrophobicContact CG-CE2 3.91Å; E167-F237 HydrophobicContact CG-CZ 3.69Å; E167-F237 WeakPolarHBondContact O-CE2 3.43Å; E167-F237 WeakPolarHBondContact OE2-CZ 3.29Å; E167-K242 HydrophobicContact CB-CG 4.15Å; E167-K242 VanDerWaalsContact OE2-CE 3.25Å; E167-K242 WeakPolarHBondContact OE2-CE 3.49Å; E167-K242 IonicContact OE2-NZ 2.73Å; E167-K242 PolarHBondContact OE2-NZ 3.33Å; E167-C243 PolarHBondContact O-N 3.44Å
168	N	84.5	Confident	90.7	Very high	20 Å²	20	18.2 Å²	18.2	11%	0.107	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	15.6	176.9	-60.3	-31.8	0	0	0	112.5	L145 T166 F170 F237	L145-N168 WeakPolarHBondContact CB-ND2 3.32Å; T166-N168 PolarHBondContact O-N 2.87Å; N168-F170 VanDerWaalsContact C-N 3.27Å; N168-F170 HydrophobicContact CB-CD2 4.06Å; N168-F170 HydrophobicContact CB-CE2 4.35Å; N168-F170 PolarHBondContact O-N 2.93Å; N168-F237 WeakPolarHBondContact OD1-CE2 3.35Å
169	S	87.6	Confident	90.6	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.014	9%	0.092	C	C	.	.			trans	64.9	25.5	177.8	-44.5	0	0	0	0	114.5	T166 E167 L195 Y273	T166-S169 PolarHBondContact O-N 3.44Å; E167-S169 PolarHBondContact O-N 2.92Å; S169-L195 WeakPolarHBondContact O-CB 3.39Å; S169-L195 PolarHBondContact O-N 3.15Å; S169-Y273 WeakPolarHBondContact CB-OH 3.12Å; S169-Y273 VanDerWaalsContact OG-CE1 3.27Å; S169-Y273 WeakPolarHBondContact OG-CE1 3.48Å; S169-Y273 PolarHBondContact OG-OH 3.41Å; S169-Y273 VanDerWaalsContact OG-OH 3.09Å
170	F	89.6	Confident	90.5	Very high	15 Å²	15	20.1 Å²	20.1	7%	0.066	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	138.5	167.5	-76.4	-107.7	0	0	0	109.8	V165 T166 N168 Y172 A193 D194	V165-F170 WeakPolarHBondContact CA-O 3.43Å; T166-F170 HydrophobicContact CG2-CB 4.28Å; T166-F170 PolarHBondContact N-O 2.96Å; T166-F170 WeakPolarHBondContact OG1-CB 3.41Å; T166-F170 PolarHBondContact OG1-N 3.29Å; N168-F170 VanDerWaalsContact C-N 3.27Å; N168-F170 HydrophobicContact CB-CD2 4.06Å; N168-F170 HydrophobicContact CB-CE2 4.35Å; N168-F170 PolarHBondContact O-N 2.93Å; F170-Y172 HydrophobicContact CB-CD2 4.47Å; F170-Y172 HydrophobicContact CB-CE2 3.65Å; F170-Y172 WeakPolarHBondContact CD1-OH 3.33Å; F170-A193 CarbonylContact C-O 3.49Å; F170-A193 WeakPolarHBondContact CA-O 3.41Å; F170-D194 HydrophobicContact CD1-CB 4Å; F170-D194 HydrophobicContact CE1-CB 3.5Å; F170-D194 HydrophobicContact CE2-CB 4.25Å; F170-D194 WeakPolarHBondContact CE2-OD1 3.11Å; F170-D194 HydrophobicContact CZ-CB 3.64Å; F170-D194 WeakPolarHBondContact CZ-OD2 3.48Å
171	I	91.6	Very high	90	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.2	173.9	-52	-172.9	0	0	0	109.1	V163 I164 V165 Y173 E192 A193 L195 L269 L271 V281	V163-I171 HydrophobicContact CG1-CG2 4.17Å; I164-I171 WeakPolarHBondContact O-CA 3.26Å; V165-I171 HydrophobicContact CG2-CG1 4.26Å; I171-Y173 HydrophobicContact CG2-CD2 3.88Å; I171-Y173 HydrophobicContact CG2-CE2 3.7Å; I171-E192 WeakPolarHBondContact O-CA 3.35Å; I171-A193 PolarHBondContact N-O 3.15Å; I171-A193 PolarHBondContact O-N 2.96Å; I171-L195 HydrophobicContact CD1-CD1 3.31Å; I171-L195 HydrophobicContact CD1-CG 4.42Å; I171-L195 HydrophobicContact CG1-CD1 3.82Å; I171-L269 HydrophobicContact CD1-CD1 3.81Å; I171-L269 HydrophobicContact CG2-CD1 4.04Å; I171-L271 HydrophobicContact CD1-CD1 4.02Å; I171-L271 HydrophobicContact CD1-CD2 4.02Å; I171-L271 HydrophobicContact CG1-CD2 4.35Å; I171-V281 HydrophobicContact CD1-CG2 4.47Å
172	Y	92	Very high	89.4	Confident	5 Å²	5	29.1 Å²	29.1	2%	0.02	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.7	173.3	-55.3	-88.8	0	0	0	110.3	I134 L136 L139 V163 I164 T166 F170 L189 L191 E192	I134-Y172 HydrophobicContact CD1-CD1 3.71Å; I134-Y172 HydrophobicContact CD1-CD2 3.97Å; I134-Y172 HydrophobicContact CD1-CE1 4.01Å; I134-Y172 HydrophobicContact CD1-CE2 4.25Å; I134-Y172 HydrophobicContact CD1-CG 3.69Å; L136-Y172 HydrophobicContact CD2-CE2 4.01Å; L139-Y172 HydrophobicContact CD2-CE1 4.38Å; V163-Y172 WeakPolarHBondContact CA-O 3.47Å; I164-Y172 HydrophobicContact CB-CD2 4.42Å; I164-Y172 HydrophobicContact CG2-CD2 4.48Å; I164-Y172 PolarHBondContact N-O 3.2Å; I164-Y172 PolarHBondContact O-N 3.37Å; T166-Y172 HydrophobicContact CG2-CD2 4.45Å; T166-Y172 HydrophobicContact CG2-CE2 3.88Å; F170-Y172 HydrophobicContact CB-CD2 4.47Å; F170-Y172 HydrophobicContact CB-CE2 3.65Å; F170-Y172 WeakPolarHBondContact CD1-OH 3.33Å; Y172-L189 HydrophobicContact CD1-CD1 4.06Å; Y172-L191 WeakPolarHBondContact CA-O 3.46Å; Y172-E192 HydrophobicContact CD1-CB 4.17Å; Y172-E192 HydrophobicContact CD1-CG 4.03Å; Y172-E192 HydrophobicContact CE1-CB 4.25Å; Y172-E192 HydrophobicContact CE1-CG 3.61Å
173	Y	93.1	Very high	88.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	117.2	166.5	-82.9	-122.1	0	0	0	108.5	H155 T161 V163 I171 W190 L191 L269 C284 L285	H155-Y173 AromaticContact CD2-CE1 3.68Å; T161-Y173 HydrophobicContact CG2-CD1 3.9Å; V163-Y173 HydrophobicContact CB-CE2 4.36Å; V163-Y173 HydrophobicContact CG1-CD2 4.09Å; V163-Y173 HydrophobicContact CG1-CE2 3.64Å; V163-Y173 HydrophobicContact CG2-CD1 3.81Å; V163-Y173 HydrophobicContact CG2-CD2 4.02Å; V163-Y173 HydrophobicContact CG2-CE1 3.58Å; V163-Y173 HydrophobicContact CG2-CE2 3.77Å; V163-Y173 HydrophobicContact CG2-CG 4.02Å; I171-Y173 HydrophobicContact CG2-CD2 3.88Å; I171-Y173 HydrophobicContact CG2-CE2 3.7Å; Y173-W190 WeakPolarHBondContact O-CB 3.22Å; Y173-W190 PolarHBondContact O-N 3.05Å; Y173-L191 HydrophobicContact CD2-CB 4.49Å; Y173-L191 HydrophobicContact CD2-CD2 4.3Å; Y173-L191 HydrophobicContact CG-CB 4.46Å; Y173-L191 PolarHBondContact N-O 3.26Å; Y173-L191 PolarHBondContact O-N 3.38Å; Y173-L269 HydrophobicContact CE2-CD1 3.96Å; Y173-L269 WeakPolarHBondContact OH-CD1 3.49Å; Y173-C284 HydrophobicContact CD2-CB 4.33Å; Y173-C284 HydrophobicContact CE1-CB 3.88Å; Y173-C284 HydrophobicContact CE2-CB 3.56Å; Y173-C284 VanDerWaalsContact OH-CB 3.25Å; Y173-C284 WeakPolarHBondContact OH-CB 3.4Å; Y173-L285 HydrophobicContact CD1-CD2 3.57Å; Y173-L285 HydrophobicContact CD1-CG 4.18Å; Y173-L285 HydrophobicContact CE1-CD2 3.84Å; Y173-L285 HydrophobicContact CE1-CG 3.92Å
174	I	93.6	Very high	88.5	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.021	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	116.8	-176.5	-56.2	-179.9	0	0	0	108.6	I134 T161 L162 I164 F187 L189	I134-I174 HydrophobicContact CB-CD1 3.83Å; I134-I174 HydrophobicContact CD1-CD1 4.05Å; I134-I174 HydrophobicContact CG1-CD1 4.48Å; I134-I174 HydrophobicContact CG2-CD1 4.32Å; T161-I174 WeakPolarHBondContact CA-O 3.46Å; L162-I174 PolarHBondContact N-O 3.34Å; L162-I174 PolarHBondContact O-N 3.29Å; I164-I174 HydrophobicContact CD1-CD1 3.7Å; I174-F187 HydrophobicContact CG2-CB 3.71Å; I174-F187 HydrophobicContact CG2-CD1 4.07Å; I174-F187 HydrophobicContact CG2-CG 4.23Å; I174-L189 HydrophobicContact CG1-CD1 4.1Å
175	H	92.3	Very high	88.3	Confident	59 Å²	59	35.5 Å²	35.5	27%	0.273	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.6	177.3	-168	60.2	0	0	0	111	T161 F187 N188	T161-H175 PolarHBondContact OG1-ND1 3.3Å; H175-F187 WeakPolarHBondContact O-CA 3.48Å; H175-N188 HydrophobicContact CB-CB 4.45Å; H175-N188 PolarHBondContact N-O 3.08Å; H175-N188 PolarHBondContact O-N 3.42Å
176	C	92.6	Very high	88.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	118.2	180	-61.6	0	0	0	0	110.6	F100 R160 F187	F100-C176 HydrophobicContact CD2-CB 4.41Å; F100-C176 HydrophobicContact CE1-CB 4.45Å; F100-C176 HydrophobicContact CE2-CB 4.24Å; F100-C176 HydrophobicContact CZ-CB 4.25Å; R160-C176 WeakPolarHBondContact O-CB 3.28Å; R160-C176 PolarHBondContact O-N 3.38Å; C176-F187 HydrophobicContact CB-CD1 4.46Å
177	V	91.2	Very high	88.3	Confident	51 Å²	51	44.9 Å²	44.9	31%	0.309	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.5	179.1	-175.5	0	0	0	0	109.2	R186	V177-R186 PolarHBondContact N-O 3.3Å; V177-R186 PolarHBondContact O-N 3.11Å
178	K	88.5	Confident	88.4	Confident	30 Å²	30	48.3 Å²	48.3	13%	0.13	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	120.4	170.1	-166.6	-178.9	-179.1	-173.1	0	109.4	F100 D113 I185	F100-K178 HydrophobicContact CE1-CB 4.19Å; F100-K178 HydrophobicContact CZ-CB 4.13Å; D113-K178 IonicContact OD1-NZ 2.99Å; D113-K178 WeakPolarHBondContact OD2-CE 3.49Å; D113-K178 IonicContact OD2-NZ 3.97Å; D113-K178 PolarHBondContact OD2-NZ 2.78Å; K178-I185 HydrophobicContact CG-CG1 4.45Å
179	S	85.7	Confident	88.6	Confident	21 Å²	21	51.7 Å²	51.7	15%	0.147	26%	0.262	C	S	.	.			trans	-70.1	131.5	173	170.5	0	0	0	0	110	E181 N182 Q183 S184	S179-E181 PolarHBondContact OG-N 3.33Å; S179-N182 PolarHBondContact OG-N 3.05Å; S179-Q183 WeakPolarHBondContact O-CA 3.25Å; S179-Q183 PolarHBondContact O-N 3.11Å; S179-Q183 VanDerWaalsContact O-N 3.12Å; S179-S184 PolarHBondContact N-O 3.05Å
180	S	80.9	Confident	88.6	Confident	101 Å²	101	56.1 Å²	56.1	71%	0.706	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-36.6	174.5	44.6	0	0	0	0	112.5	Q183	S180-Q183 PolarHBondContact O-NE2 2.9Å; S180-Q183 VanDerWaalsContact O-NE2 3.13Å
181	E	78	Confident	88.5	Confident	164 Å²	164	55.6 Å²	55.6	77%	0.766	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-54.4	-175	-65	174.7	176.5	0	0	111.9	S179	S179-E181 PolarHBondContact OG-N 3.33Å
182	N	79.5	Confident	88.3	Confident	114 Å²	114	59.9 Å²	59.9	61%	0.61	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	-0.1	-171	-64	-1.9	0	0	0	113	S179 S184	S179-N182 PolarHBondContact OG-N 3.05Å; N182-S184 PolarHBondContact O-N 2.81Å
183	Q	81.3	Confident	88.1	Confident	106 Å²	106	59.7 Å²	59.7	50%	0.495	30%	0.296	S	S	.	.			trans	55.3	8.1	-170.3	-59.2	-67.5	-50.8	0	0	114.3	S179 S180	S179-Q183 WeakPolarHBondContact O-CA 3.25Å; S179-Q183 PolarHBondContact O-N 3.11Å; S179-Q183 VanDerWaalsContact O-N 3.12Å; S180-Q183 PolarHBondContact O-NE2 2.9Å; S180-Q183 VanDerWaalsContact O-NE2 3.13Å
184	S	88.6	Confident	87.7	Confident	23 Å²	23	61.8 Å²	61.8	16%	0.161	31%	0.307	C	S	.	.			trans	-71.2	145.5	179.3	63.3	0	0	0	0	111.7	Y131 S179 N182	Y131-S184 WeakPolarHBondContact OH-CA 3.42Å; S179-S184 PolarHBondContact N-O 3.05Å; N182-S184 PolarHBondContact O-N 2.81Å
185	I	90.8	Very high	87.2	Confident	6 Å²	6	61.8 Å²	61.8	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.4	174	-56.2	175.1	0	0	0	107.7	F100 V111 D113 Y131 K178 F187	F100-I185 HydrophobicContact CD1-CD1 3.89Å; F100-I185 HydrophobicContact CE1-CD1 3.96Å; F100-I185 HydrophobicContact CE1-CG1 4.18Å; F100-I185 HydrophobicContact CE1-CG2 4.3Å; V111-I185 HydrophobicContact CG1-CD1 4.31Å; D113-I185 HydrophobicContact CB-CD1 4.15Å; Y131-I185 HydrophobicContact CD1-CB 4.38Å; Y131-I185 WeakPolarHBondContact CD1-O 3.46Å; Y131-I185 HydrophobicContact CD2-CB 3.73Å; Y131-I185 HydrophobicContact CD2-CD1 3.85Å; Y131-I185 HydrophobicContact CD2-CG1 3.95Å; Y131-I185 HydrophobicContact CE2-CB 3.98Å; Y131-I185 HydrophobicContact CE2-CD1 4.05Å; Y131-I185 HydrophobicContact CE2-CG1 3.89Å; Y131-I185 HydrophobicContact CG-CB 3.94Å; K178-I185 HydrophobicContact CG-CG1 4.45Å; I185-F187 HydrophobicContact CG2-CD1 4.41Å; I185-F187 HydrophobicContact CG2-CE1 3.73Å; I185-F187 HydrophobicContact CG2-CZ 3.85Å
186	R	92.2	Very high	86.4	Confident	153 Å²	153	60.4 Å²	60.4	58%	0.577	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	153.2	172	-62.6	-174.5	-170	162.3	3.1	109.4	V177	V177-R186 PolarHBondContact N-O 3.3Å; V177-R186 PolarHBondContact O-N 3.11Å
187	F	92.7	Very high	85.2	Confident	48 Å²	48	64.9 Å²	64.9	21%	0.211	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.9	-179.4	-52.8	-73	0	0	0	109.8	V111 C132 A133 I174 H175 C176 I185	V111-F187 HydrophobicContact CB-CE1 3.87Å; V111-F187 HydrophobicContact CB-CZ 3.84Å; V111-F187 HydrophobicContact CG1-CE1 4.5Å; V111-F187 HydrophobicContact CG2-CE1 3.81Å; V111-F187 HydrophobicContact CG2-CZ 4.11Å; C132-F187 VanDerWaalsContact O-CD2 3.25Å; C132-F187 WeakPolarHBondContact O-CD2 3.4Å; C132-F187 WeakPolarHBondContact O-CE2 3.46Å; A133-F187 HydrophobicContact CB-CD1 3.8Å; A133-F187 HydrophobicContact CB-CD2 4.26Å; A133-F187 HydrophobicContact CB-CE1 3.65Å; A133-F187 HydrophobicContact CB-CE2 4.1Å; A133-F187 HydrophobicContact CB-CG 4.1Å; A133-F187 HydrophobicContact CB-CZ 3.79Å; I174-F187 HydrophobicContact CG2-CB 3.71Å; I174-F187 HydrophobicContact CG2-CD1 4.07Å; I174-F187 HydrophobicContact CG2-CG 4.23Å; H175-F187 WeakPolarHBondContact O-CA 3.48Å; C176-F187 HydrophobicContact CB-CD1 4.46Å; I185-F187 HydrophobicContact CG2-CD1 4.41Å; I185-F187 HydrophobicContact CG2-CE1 3.73Å; I185-F187 HydrophobicContact CG2-CZ 3.85Å
188	N	90.5	Very high	84	Confident	92 Å²	92	65.6 Å²	65.6	49%	0.492	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	115.5	171.9	-66.2	-24.2	0	0	0	108.1	H175 W190	H175-N188 HydrophobicContact CB-CB 4.45Å; H175-N188 PolarHBondContact N-O 3.08Å; H175-N188 PolarHBondContact O-N 3.42Å; N188-W190 PolarHBondContact O-N 3.32Å
189	L	89.2	Confident	82.7	Confident	91 Å²	91	64.6 Å²	64.6	48%	0.476	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	110.7	170.8	-178.8	64.5	0	0	0	108.6	Y172 I174 L191 E192	Y172-L189 HydrophobicContact CD1-CD1 4.06Å; I174-L189 HydrophobicContact CG1-CD1 4.1Å; L189-L191 WeakPolarHBondContact CD1-O 3.42Å; L189-E192 HydrophobicContact CD2-CB 4.15Å
190	W	85.9	Confident	81.5	Confident	95 Å²	95	67.5 Å²	67.5	36%	0.36	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-44.8	-178.4	-178.2	-91.2	0	0	0	112	Y173 N188 L285	Y173-W190 WeakPolarHBondContact O-CB 3.22Å; Y173-W190 PolarHBondContact O-N 3.05Å; N188-W190 PolarHBondContact O-N 3.32Å; W190-L285 PolarHBondContact NE1-O 2.92Å
191	L	87.9	Confident	80.2	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	135.5	179.9	179.2	70	0	0	0	108.9	Y172 Y173 L189 A193 C284 L293	Y172-L191 WeakPolarHBondContact CA-O 3.46Å; Y173-L191 HydrophobicContact CD2-CB 4.49Å; Y173-L191 HydrophobicContact CD2-CD2 4.3Å; Y173-L191 HydrophobicContact CG-CB 4.46Å; Y173-L191 PolarHBondContact N-O 3.26Å; Y173-L191 PolarHBondContact O-N 3.38Å; L189-L191 WeakPolarHBondContact CD1-O 3.42Å; L191-A193 HydrophobicContact CD1-CB 4.44Å; L191-A193 HydrophobicContact CD2-CB 4.37Å; L191-A193 HydrophobicContact CG-CB 4.26Å; L191-C284 HydrophobicContact CD2-CB 4.04Å; L191-L293 HydrophobicContact CD2-CD1 4.39Å; L191-L293 HydrophobicContact CD2-CD2 4.34Å
192	E	88.6	Confident	78.9	Confident	90 Å²	90	59.8 Å²	59.8	42%	0.421	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120	162.2	172.5	175.6	-164.8	0	0	106.5	I171 Y172 L189	I171-E192 WeakPolarHBondContact O-CA 3.35Å; Y172-E192 HydrophobicContact CD1-CB 4.17Å; Y172-E192 HydrophobicContact CD1-CG 4.03Å; Y172-E192 HydrophobicContact CE1-CB 4.25Å; Y172-E192 HydrophobicContact CE1-CG 3.61Å; L189-E192 HydrophobicContact CD2-CB 4.15Å
193	A	86.8	Confident	77.3	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.008	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	128.8	-178.2	0	0	0	0	0	110.2	F170 I171 L191 M290 L293	F170-A193 CarbonylContact C-O 3.49Å; F170-A193 WeakPolarHBondContact CA-O 3.41Å; I171-A193 PolarHBondContact N-O 3.15Å; I171-A193 PolarHBondContact O-N 2.96Å; L191-A193 HydrophobicContact CD1-CB 4.44Å; L191-A193 HydrophobicContact CD2-CB 4.37Å; L191-A193 HydrophobicContact CG-CB 4.26Å; A193-M290 HydrophobicContact CB-CB 4.36Å; A193-M290 HydrophobicContact CB-CG 4.22Å; A193-L293 HydrophobicContact CB-CD1 3.77Å
194	D	86	Confident	75.5	Confident	45 Å²	45	57.5 Å²	57.5	24%	0.241	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	100.4	176.2	-179.8	-2.7	0	0	0	109.5	F170 S196 M290	F170-D194 HydrophobicContact CD1-CB 4Å; F170-D194 HydrophobicContact CE1-CB 3.5Å; F170-D194 HydrophobicContact CE2-CB 4.25Å; F170-D194 WeakPolarHBondContact CE2-OD1 3.11Å; F170-D194 HydrophobicContact CZ-CB 3.64Å; F170-D194 WeakPolarHBondContact CZ-OD2 3.48Å; D194-S196 VanDerWaalsContact C-N 3.28Å; D194-S196 VanDerWaalsContact CG-OG 3.3Å; D194-S196 PolarHBondContact O-N 3.43Å; D194-S196 WeakPolarHBondContact OD1-CB 3.47Å; D194-S196 PolarHBondContact OD1-N 2.95Å; D194-S196 PolarHBondContact OD1-OG 3.48Å; D194-S196 PolarHBondContact OD2-OG 3.12Å; D194-M290 HydrophobicContact CB-SD 4.46Å; D194-M290 WeakPolarHBondContact O-CE 3.13Å
195	L	83	Confident	73.2	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.021	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	1.4	-178.9	-65.3	167.6	0	0	0	113.8	S169 I171 V197 F198 T199 L271 V281	S169-L195 WeakPolarHBondContact O-CB 3.39Å; S169-L195 PolarHBondContact O-N 3.15Å; I171-L195 HydrophobicContact CD1-CD1 3.31Å; I171-L195 HydrophobicContact CD1-CG 4.42Å; I171-L195 HydrophobicContact CG1-CD1 3.82Å; L195-V197 PolarHBondContact O-N 3.2Å; L195-F198 WeakPolarHBondContact O-CB 3.37Å; L195-F198 PolarHBondContact O-N 2.93Å; L195-T199 PolarHBondContact O-N 2.95Å; L195-T199 VanDerWaalsContact O-N 3.13Å; L195-L271 HydrophobicContact CD1-CD2 4.08Å; L195-V281 HydrophobicContact CD1-CG2 3.7Å
196	S	75.1	Confident	70.8	Confident	29 Å²	29	63.6 Å²	63.6	20%	0.203	34%	0.336	C	S	.	.	H	α-helix	trans	-58.7	-35.5	-180	65.7	0	0	0	0	112.3	D194 F198 T199 H200	D194-S196 VanDerWaalsContact C-N 3.28Å; D194-S196 VanDerWaalsContact CG-OG 3.3Å; D194-S196 PolarHBondContact O-N 3.43Å; D194-S196 WeakPolarHBondContact OD1-CB 3.47Å; D194-S196 PolarHBondContact OD1-N 2.95Å; D194-S196 PolarHBondContact OD1-OG 3.48Å; D194-S196 PolarHBondContact OD2-OG 3.12Å; S196-F198 VanDerWaalsContact C-N 3.27Å; S196-F198 PolarHBondContact O-N 3.28Å; S196-T199 WeakPolarHBondContact CA-OG1 3.49Å; S196-T199 PolarHBondContact O-N 3.42Å; S196-T199 PolarHBondContact O-OG1 3.48Å; S196-H200 PolarHBondContact O-CD2 2.96Å; S196-H200 PolarHBondContact O-N 3.15Å; S196-H200 VanDerWaalsContact O-N 3.14Å
197	V	67.5	Low	68.1	Low	95 Å²	95	65.8 Å²	65.8	58%	0.576	35%	0.346	S	S	*	.	H	α-helix	trans	-63.4	-36	177	-173.5	0	0	0	0	111.7	L195 S201	L195-V197 PolarHBondContact O-N 3.2Å; V197-S201 PolarHBondContact O-N 2.85Å
198	F	65.2	Low	65.2	Low	66 Å²	66	70.1 Å²	70.1	29%	0.289	37%	0.367	S	S	.	.	H	α-helix	trans	-74.3	-39.6	179.7	-170.7	-91.5	0	0	0	111.6	L195 S196 H200 S201 A202 I279 C295 V297	L195-F198 WeakPolarHBondContact O-CB 3.37Å; L195-F198 PolarHBondContact O-N 2.93Å; S196-F198 VanDerWaalsContact C-N 3.27Å; S196-F198 PolarHBondContact O-N 3.28Å; F198-H200 VanDerWaalsContact C-N 3.34Å; F198-H200 PolarHBondContact O-N 2.81Å; F198-S201 PolarHBondContact O-N 3.42Å; F198-A202 HydrophobicContact CE1-CB 4.3Å; F198-A202 WeakPolarHBondContact O-CB 3.43Å; F198-A202 PolarHBondContact O-N 3.32Å; F198-I279 HydrophobicContact CD1-CD1 4.19Å; F198-I279 HydrophobicContact CD1-CG2 4.49Å; F198-I279 HydrophobicContact CE1-CD1 4.46Å; F198-I279 HydrophobicContact CE1-CG2 4.3Å; F198-C295 HydrophobicContact CD1-CB 4.02Å; F198-C295 HydrophobicContact CD2-CB 4Å; F198-C295 HydrophobicContact CE1-CB 3.71Å; F198-C295 HydrophobicContact CE2-CB 3.68Å; F198-C295 HydrophobicContact CG-CB 4.16Å; F198-C295 HydrophobicContact CZ-CB 3.53Å; F198-V297 HydrophobicContact CE1-CG2 4.14Å
199	T	62.4	Low	62.5	Low	9 Å²	9	73.2 Å²	73.2	6%	0.055	38%	0.383	C	S	.	.	H	α-helix	trans	-63.9	-41.1	178.1	54.8	0	0	0	0	111.5	L195 S196 A202 L203 Y273 I279	L195-T199 PolarHBondContact O-N 2.95Å; L195-T199 VanDerWaalsContact O-N 3.13Å; S196-T199 WeakPolarHBondContact CA-OG1 3.49Å; S196-T199 PolarHBondContact O-N 3.42Å; S196-T199 PolarHBondContact O-OG1 3.48Å; T199-A202 PolarHBondContact O-N 2.85Å; T199-L203 WeakPolarHBondContact O-CB 3.17Å; T199-L203 WeakPolarHBondContact O-CD1 3.49Å; T199-L203 WeakPolarHBondContact O-CG 3.46Å; T199-L203 PolarHBondContact O-N 3Å; T199-L203 VanDerWaalsContact O-N 3.1Å; T199-Y273 HydrophobicContact CG2-CE1 3.6Å; T199-Y273 HydrophobicContact CG2-CE2 4.32Å; T199-Y273 VanDerWaalsContact CG2-CZ 3.43Å; T199-Y273 WeakPolarHBondContact CG2-OH 3.23Å; T199-I279 HydrophobicContact CG2-CD1 3.78Å
200	H	59.2	Low	59.9	Low	82 Å²	82	77 Å²	77	38%	0.38	40%	0.401	S	S	.	.	H	α-helix	trans	-60.1	-46.5	173.8	-72	-59.8	0	0	0	112.5	S196 F198 D204 S236	S196-H200 PolarHBondContact O-CD2 2.96Å; S196-H200 PolarHBondContact O-N 3.15Å; S196-H200 VanDerWaalsContact O-N 3.14Å; F198-H200 VanDerWaalsContact C-N 3.34Å; F198-H200 PolarHBondContact O-N 2.81Å; H200-D204 PolarHBondContact O-N 3.44Å; H200-S236 VanDerWaalsContact CE1-CB 3.4Å; H200-S236 WeakPolarHBondContact CE1-CB 3.44Å; H200-S236 PolarHBondContact CE1-OG 3.03Å; H200-S236 VanDerWaalsContact CE1-OG 3.25Å
201	S	52.9	Low	57.2	Low	78 Å²	78	79.1 Å²	79.1	55%	0.545	42%	0.419	S	S	.	.	H	α-helix	trans	-68.4	-35.6	179.6	178.9	0	0	0	0	113.3	V197 F198 A205	V197-S201 PolarHBondContact O-N 2.85Å; F198-S201 PolarHBondContact O-N 3.42Å; S201-A205 PolarHBondContact O-N 3Å
202	A	51.5	Low	54.4	Low	24 Å²	24	86.5 Å²	86.5	20%	0.198	46%	0.458	C	S	.	.	H	α-helix	trans	-72.4	-40	-178.3	0	0	0	0	0	111.9	F198 T199 A205 T206 V297	F198-A202 HydrophobicContact CE1-CB 4.3Å; F198-A202 WeakPolarHBondContact O-CB 3.43Å; F198-A202 PolarHBondContact O-N 3.32Å; T199-A202 PolarHBondContact O-N 2.85Å; A202-A205 PolarHBondContact O-N 3.07Å; A202-T206 PolarHBondContact O-OG1 3.1Å; A202-T206 VanDerWaalsContact O-OG1 3.08Å; A202-V297 HydrophobicContact CB-CG2 3.89Å
203	L	46.4	Very low	51.6	Low	61 Å²	61	87.2 Å²	87.2	32%	0.319	47%	0.473	S	S	.	.	H	α-helix	trans	-66.7	-35.8	177.1	-75.7	162.5	0	0	0	112.4	T199	T199-L203 WeakPolarHBondContact O-CB 3.17Å; T199-L203 WeakPolarHBondContact O-CD1 3.49Å; T199-L203 WeakPolarHBondContact O-CG 3.46Å; T199-L203 PolarHBondContact O-N 3Å; T199-L203 VanDerWaalsContact O-N 3.1Å
204	D	43.4	Very low	48.8	Very low	111 Å²	111	94.6 Å²	94.6	59%	0.594	51%	0.512	S	S	*	.	H	α-helix	trans	-72	-32.8	176.7	-81.1	-19.6	0	0	0	112.6	H200 T206 Y207 Q208	H200-D204 PolarHBondContact O-N 3.44Å; D204-T206 PolarHBondContact O-N 3.22Å; D204-Y207 PolarHBondContact O-N 2.9Å; D204-Q208 PolarHBondContact O-N 3.36Å
205	A	40.5	Very low	46.2	Very low	48 Å²	48	102.4 Å²	102.4	40%	0.397	55%	0.547	S	S	.	.	H	α-helix	trans	-65.9	-35.5	-179.5	0	0	0	0	0	112.7	S201 A202 Y207 Q208	S201-A205 PolarHBondContact O-N 3Å; A202-A205 PolarHBondContact O-N 3.07Å; A205-Y207 PolarHBondContact O-N 2.91Å; A205-Y207 VanDerWaalsContact O-N 3.15Å; A205-Q208 PolarHBondContact O-N 3.01Å; A205-Q208 VanDerWaalsContact O-N 3.09Å
206	T	40.8	Very low	43.5	Very low	109 Å²	109	105 Å²	105	67%	0.669	58%	0.576	S	S	*	*	H	α-helix	trans	-64.1	-20.4	179.6	-23.7	0	0	0	0	113.1	A202 D204	A202-T206 PolarHBondContact O-OG1 3.1Å; A202-T206 VanDerWaalsContact O-OG1 3.08Å; D204-T206 PolarHBondContact O-N 3.22Å
207	Y	35.4	Very low	41.2	Very low	200 Å²	200	108.9 Å²	108.9	78%	0.784	60%	0.603	S	S	*	*	H	α-helix	trans	-98.1	-13.4	176	-78.2	-82.6	0	0	0	114	D204 A205	D204-Y207 PolarHBondContact O-N 2.9Å; A205-Y207 PolarHBondContact O-N 2.91Å; A205-Y207 VanDerWaalsContact O-N 3.15Å
208	Q	31	Very low	39.4	Very low	139 Å²	139	114.3 Å²	114.3	65%	0.65	61%	0.614	S	S	*	*	H	α-helix	trans	-86.1	-16.6	-178.9	-86.7	179.6	-13	0	0	114.5	D204 A205 M210 N211	D204-Q208 PolarHBondContact O-N 3.36Å; A205-Q208 PolarHBondContact O-N 3.01Å; A205-Q208 VanDerWaalsContact O-N 3.09Å; Q208-M210 PolarHBondContact O-N 3.18Å; Q208-N211 PolarHBondContact O-N 3.43Å; Q208-N211 VanDerWaalsContact O-N 3.09Å
209	D	34.1	Very low	37.6	Very low	156 Å²	156	118.8 Å²	118.8	83%	0.834	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	5.7	176.3	-88.1	-8	0	0	0	114.8
210	M	35	Very low	36.1	Very low	172 Å²	172	126 Å²	126	85%	0.847	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	0.5	172.8	-78.2	-72.9	-148.4	0	0	114.7	Q208	Q208-M210 PolarHBondContact O-N 3.18Å
211	N	29.3	Very low	34.5	Very low	138 Å²	138	129.3 Å²	129.3	74%	0.738	70%	0.695	S	S	*	*			trans	-125.8	83	175.9	-74.7	-32.9	0	0	0	111	Q208	Q208-N211 PolarHBondContact O-N 3.43Å; Q208-N211 VanDerWaalsContact O-N 3.09Å
212	D	28.9	Very low	33.3	Very low	160 Å²	160	132.2 Å²	132.2	86%	0.856	70%	0.704	S	S	*	*			trans	-63	143	155.4	-88.2	-33.1	0	0	0	109.6
213	S	29.5	Very low	32.2	Very low	104 Å²	104	137.9 Å²	137.9	73%	0.727	73%	0.731	S	S	*	*			trans	71	119.8	179.2	44.3	0	0	0	0	115.9
214	D	28.8	Very low	31.3	Very low	157 Å²	157	142.7 Å²	142.7	84%	0.84	76%	0.757	S	S	*	*			cis	-150.4	148.4	43.9	-85.3	-40.8	0	0	0	113.3	G216	D214-G216 PolarHBondContact O-N 2.86Å
215	E	29.4	Very low	30.5	Very low	208 Å²	208	142.8 Å²	142.8	97%	0.972	77%	0.767	S	S	*	*			trans	-53.8	124	164.2	-70.5	-175.3	147.5	0	0	111
216	G	26.8	Very low	29.9	Very low	60 Å²	60	146.6 Å²	146.6	62%	0.619	79%	0.79	S	S	*	*			trans	-158.7	100.7	175.8	0	0	0	0	0	111	D214 Y218	D214-G216 PolarHBondContact O-N 2.86Å; G216-Y218 PolarHBondContact O-N 2.83Å
217	S	28	Very low	29.3	Very low	110 Å²	110	146 Å²	146	77%	0.769	79%	0.791	S	S	*	*			trans	-58.2	129.6	177	73.6	0	0	0	0	111.8
218	Y	28.8	Very low	28.9	Very low	209 Å²	209	144.1 Å²	144.1	82%	0.82	79%	0.793	S	S	*	*			trans	-137.8	101.7	155.5	-74.8	-74.1	0	0	0	109.8	G216 E220	G216-Y218 PolarHBondContact O-N 2.83Å; Y218-E220 PolarHBondContact O-N 3.38Å
219	N	27.6	Very low	28.9	Very low	160 Å²	160	142.1 Å²	142.1	86%	0.856	80%	0.795	S	S	*	*			trans	-61	114.5	145.8	-78	-33.6	0	0	0	107
220	E	29.9	Very low	29.1	Very low	160 Å²	160	140.9 Å²	140.9	75%	0.748	79%	0.788	S	S	*	*			trans	-133.2	109.7	151.5	-75	-166	158.5	0	0	108.7	Y218 D222	Y218-E220 PolarHBondContact O-N 3.38Å; E220-D222 PolarHBondContact O-N 3.02Å
221	N	26	Very low	29.4	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	79%	0.79	S	S	*	*			trans	-64.1	111.5	156.5	-62.7	-49	0	0	0	106.5
222	D	28.8	Very low	30.3	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	79%	0.791	S	S	*	*			trans	-134.4	72.1	156.8	-101.8	-12.4	0	0	0	108.2	E220	E220-D222 PolarHBondContact O-N 3.02Å
223	D	27.8	Very low	31.4	Very low	143 Å²	143	142.4 Å²	142.4	77%	0.765	79%	0.793	S	S	*	*			trans	-64.3	121.7	151.4	-71.9	-42.1	0	0	0	107.7
224	N	27.6	Very low	32.9	Very low	162 Å²	162	140.8 Å²	140.8	87%	0.866	78%	0.776	S	S	*	*			trans	99.9	73.9	171.5	-57	-43.4	0	0	0	118.2
225	S	26.7	Very low	34.5	Very low	113 Å²	113	139.3 Å²	139.3	79%	0.79	77%	0.767	S	S	*	*			trans	-151.6	36.7	149.9	76	0	0	0	0	115.5
226	S	27.7	Very low	36.1	Very low	128 Å²	128	130.2 Å²	130.2	90%	0.895	73%	0.727	S	S	*	*			trans	-111.2	34.1	172.1	60.9	0	0	0	0	113.4
227	S	27.7	Very low	37.9	Very low	97 Å²	97	129.8 Å²	129.8	68%	0.678	71%	0.708	S	S	*	*			trans	-131.9	130.2	173.3	72.7	0	0	0	0	111.5
228	L	28.1	Very low	39.5	Very low	160 Å²	160	128 Å²	128	84%	0.838	70%	0.7	S	S	*	*	S	Bend	trans	94	108.9	174.4	-65	88.1	0	0	0	118
229	S	31.2	Very low	41.1	Very low	97 Å²	97	124 Å²	124	68%	0.678	69%	0.692	S	S	*	*			trans	89.8	69.7	163.1	75.3	0	0	0	0	120	T231	S229-T231 PolarHBondContact O-N 2.98Å
230	N	36.6	Very low	42.9	Very low	130 Å²	130	116.8 Å²	116.8	70%	0.695	66%	0.656	S	S	*	*			trans	-98	58	168.1	-84.5	3.5	0	0	0	113.3
231	T	43	Very low	45	Very low	143 Å²	143	109.8 Å²	109.8	88%	0.877	63%	0.625	S	S	*	*			trans	-96.3	8.7	158	41.1	0	0	0	0	112.4	S229	S229-T231 PolarHBondContact O-N 2.98Å
232	K	47.8	Very low	47.8	Very low	177 Å²	177	105.1 Å²	105.1	77%	0.77	60%	0.597	S	S	*	*	S	Bend	trans	-85.1	137.2	173.4	-78.2	-179.9	176.1	174.6	0	110.4	N234	K232-N234 PolarHBondContact O-N 3.26Å
233	M	50.6	Low	50.7	Low	181 Å²	181	98.4 Å²	98.4	89%	0.892	56%	0.561	S	S	*	*			trans	-45.9	121.6	172	-118.1	179.2	-174	0	0	109.8	L235	M233-L235 PolarHBondContact O-N 3.24Å; M233-L235 VanDerWaalsContact O-N 3.1Å
234	N	61.4	Low	53.6	Low	71 Å²	71	92.9 Å²	92.9	38%	0.38	53%	0.533	S	S	.	.			trans	-75.8	100.1	176.4	-169	-5.7	0	0	0	108.6	K232 S236 F237 A238	K232-N234 PolarHBondContact O-N 3.26Å; N234-S236 VanDerWaalsContact C-N 3.29Å; N234-S236 PolarHBondContact O-N 3.41Å; N234-S236 PolarHBondContact OD1-OG 3.39Å; N234-F237 HydrophobicContact CB-CB 3.9Å; N234-F237 VanDerWaalsContact O-CB 3.27Å; N234-F237 WeakPolarHBondContact O-CB 3.41Å; N234-F237 PolarHBondContact O-N 2.86Å; N234-F237 VanDerWaalsContact O-N 3.11Å; N234-A238 PolarHBondContact O-N 3.4Å
235	L	62.1	Low	56.7	Low	125 Å²	125	85.6 Å²	85.6	65%	0.654	49%	0.494	S	S	*	.	H	α-helix	trans	-61.8	-36.3	-171	-160	88.2	0	0	0	112.1	M233 F237 A238 L239	M233-L235 PolarHBondContact O-N 3.24Å; M233-L235 VanDerWaalsContact O-N 3.1Å; L235-F237 VanDerWaalsContact C-N 3.31Å; L235-F237 PolarHBondContact O-N 3.09Å; L235-A238 CarbonylContact O-C 3.59Å; L235-A238 PolarHBondContact O-N 3.33Å; L235-L239 HydrophobicContact CD2-CD1 4.1Å; L235-L239 HydrophobicContact CG-CD1 4.18Å; L235-L239 WeakPolarHBondContact O-CB 3.45Å; L235-L239 WeakPolarHBondContact O-CG 3.49Å; L235-L239 PolarHBondContact O-N 3.19Å
236	S	64.7	Low	60	Low	18 Å²	18	80.2 Å²	80.2	13%	0.126	46%	0.456	C	S	.	.	H	α-helix	trans	-62.5	-42.4	176.3	56.1	0	0	0	0	111.1	H200 N234 A238 L239 G240 S241	H200-S236 VanDerWaalsContact CE1-CB 3.4Å; H200-S236 WeakPolarHBondContact CE1-CB 3.44Å; H200-S236 PolarHBondContact CE1-OG 3.03Å; H200-S236 VanDerWaalsContact CE1-OG 3.25Å; N234-S236 VanDerWaalsContact C-N 3.29Å; N234-S236 PolarHBondContact O-N 3.41Å; N234-S236 PolarHBondContact OD1-OG 3.39Å; S236-A238 VanDerWaalsContact C-N 3.34Å; S236-A238 PolarHBondContact O-N 3.44Å; S236-L239 CarbonylContact O-C 3.59Å; S236-L239 WeakPolarHBondContact O-CA 3.28Å; S236-L239 PolarHBondContact O-N 3.36Å; S236-G240 PolarHBondContact O-N 3.41Å; S236-S241 WeakPolarHBondContact CB-OG 3.35Å; S236-S241 WeakPolarHBondContact O-CB 3.28Å; S236-S241 PolarHBondContact O-N 3.28Å; S236-S241 PolarHBondContact O-OG 3.17Å
237	F	64.5	Low	63.1	Low	50 Å²	50	74.5 Å²	74.5	22%	0.219	42%	0.416	C	S	.	.	H	α-helix	trans	-61.7	-42.9	174.9	-150.3	-94.7	0	0	0	111.8	E167 N168 N234 L235 L239 G240 K242	E167-F237 HydrophobicContact CB-CE2 4.03Å; E167-F237 HydrophobicContact CB-CZ 3.8Å; E167-F237 HydrophobicContact CG-CE2 3.91Å; E167-F237 HydrophobicContact CG-CZ 3.69Å; E167-F237 WeakPolarHBondContact O-CE2 3.43Å; E167-F237 WeakPolarHBondContact OE2-CZ 3.29Å; N168-F237 WeakPolarHBondContact OD1-CE2 3.35Å; N234-F237 HydrophobicContact CB-CB 3.9Å; N234-F237 VanDerWaalsContact O-CB 3.27Å; N234-F237 WeakPolarHBondContact O-CB 3.41Å; N234-F237 PolarHBondContact O-N 2.86Å; N234-F237 VanDerWaalsContact O-N 3.11Å; L235-F237 VanDerWaalsContact C-N 3.31Å; L235-F237 PolarHBondContact O-N 3.09Å; F237-L239 PolarHBondContact O-N 2.66Å; F237-G240 PolarHBondContact O-N 3.41Å; F237-G240 VanDerWaalsContact O-N 3.13Å; F237-K242 HydrophobicContact CD1-CB 4.34Å; F237-K242 HydrophobicContact CD1-CD 4.47Å; F237-K242 HydrophobicContact CD2-CB 4.11Å; F237-K242 HydrophobicContact CE1-CB 4.01Å; F237-K242 HydrophobicContact CE1-CD 3.5Å; F237-K242 VanDerWaalsContact CE1-CD 3.5Å; F237-K242 HydrophobicContact CE1-CG 3.9Å; F237-K242 HydrophobicContact CE2-CB 3.74Å; F237-K242 HydrophobicContact CE2-CD 4.26Å; F237-K242 HydrophobicContact CE2-CG 3.74Å; F237-K242 HydrophobicContact CG-CB 4.4Å; F237-K242 HydrophobicContact CZ-CB 3.69Å; F237-K242 HydrophobicContact CZ-CD 3.37Å; F237-K242 HydrophobicContact CZ-CG 3.35Å
238	A	60.1	Low	66.2	Low	73 Å²	73	70.2 Å²	70.2	60%	0.603	39%	0.385	S	S	*	.	H	α-helix	trans	-66.6	-20	174.2	0	0	0	0	0	113.7	N234 L235 S236	N234-A238 PolarHBondContact O-N 3.4Å; L235-A238 CarbonylContact O-C 3.59Å; L235-A238 PolarHBondContact O-N 3.33Å; S236-A238 VanDerWaalsContact C-N 3.34Å; S236-A238 PolarHBondContact O-N 3.44Å
239	L	63.7	Low	69.1	Low	125 Å²	125	62.6 Å²	62.6	65%	0.654	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	10.2	175.1	-68.7	167.9	0	0	0	112.8	L235 S236 F237	L235-L239 HydrophobicContact CD2-CD1 4.1Å; L235-L239 HydrophobicContact CG-CD1 4.18Å; L235-L239 WeakPolarHBondContact O-CB 3.45Å; L235-L239 WeakPolarHBondContact O-CG 3.49Å; L235-L239 PolarHBondContact O-N 3.19Å; S236-L239 CarbonylContact O-C 3.59Å; S236-L239 WeakPolarHBondContact O-CA 3.28Å; S236-L239 PolarHBondContact O-N 3.36Å; F237-L239 PolarHBondContact O-N 2.66Å
240	G	64.5	Low	71.7	Confident	9 Å²	9	58.3 Å²	58.3	9%	0.093	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	11	176	0	0	0	0	0	115.1	S236 F237 K242 E274	S236-G240 PolarHBondContact O-N 3.41Å; F237-G240 PolarHBondContact O-N 3.41Å; F237-G240 VanDerWaalsContact O-N 3.13Å; G240-K242 PolarHBondContact O-N 2.88Å; G240-E274 PolarHBondContact O-N 3.06Å
241	S	75.2	Confident	73.7	Confident	13 Å²	13	53.3 Å²	53.3	9%	0.091	29%	0.29	C	S	.	.			trans	-70.3	13	173.3	-45.1	0	0	0	0	113.4	S236 Y273	S236-S241 WeakPolarHBondContact CB-OG 3.35Å; S236-S241 WeakPolarHBondContact O-CB 3.28Å; S236-S241 PolarHBondContact O-N 3.28Å; S236-S241 PolarHBondContact O-OG 3.17Å; S241-Y273 WeakPolarHBondContact O-CD1 3.34Å
242	K	84.3	Confident	74.9	Confident	52 Å²	52	47.4 Å²	47.4	23%	0.226	25%	0.252	C	S	.	.			trans	-78.8	123.5	177.6	177.9	172.9	-170	148	0	109.1	E167 F237 G240 V244 Y273 E274	E167-K242 HydrophobicContact CB-CG 4.15Å; E167-K242 VanDerWaalsContact OE2-CE 3.25Å; E167-K242 WeakPolarHBondContact OE2-CE 3.49Å; E167-K242 IonicContact OE2-NZ 2.73Å; E167-K242 PolarHBondContact OE2-NZ 3.33Å; F237-K242 HydrophobicContact CD1-CB 4.34Å; F237-K242 HydrophobicContact CD1-CD 4.47Å; F237-K242 HydrophobicContact CD2-CB 4.11Å; F237-K242 HydrophobicContact CE1-CB 4.01Å; F237-K242 HydrophobicContact CE1-CD 3.5Å; F237-K242 VanDerWaalsContact CE1-CD 3.5Å; F237-K242 HydrophobicContact CE1-CG 3.9Å; F237-K242 HydrophobicContact CE2-CB 3.74Å; F237-K242 HydrophobicContact CE2-CD 4.26Å; F237-K242 HydrophobicContact CE2-CG 3.74Å; F237-K242 HydrophobicContact CG-CB 4.4Å; F237-K242 HydrophobicContact CZ-CB 3.69Å; F237-K242 HydrophobicContact CZ-CD 3.37Å; F237-K242 HydrophobicContact CZ-CG 3.35Å; G240-K242 PolarHBondContact O-N 2.88Å; K242-V244 PolarHBondContact O-N 3.21Å; K242-Y273 VanDerWaalsContact O-CA 3.32Å; K242-Y273 WeakPolarHBondContact O-CA 3.25Å; K242-E274 HydrophobicContact CB-CG 4.15Å; K242-E274 PolarHBondContact O-N 2.67Å
243	C	89.6	Confident	75.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	129.2	168.2	-174.1	0	0	0	0	108.6	V150 E167 L272 Y273	V150-C243 WeakPolarHBondContact CG2-O 3.37Å; E167-C243 PolarHBondContact O-N 3.44Å; C243-L272 WeakPolarHBondContact CA-O 3.47Å; C243-Y273 HydrophobicContact CB-CD1 4.42Å; C243-Y273 HydrophobicContact CB-CE1 4.11Å
244	V	89.5	Confident	75.2	Confident	26 Å²	26	42.8 Å²	42.8	16%	0.158	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-27.1	-177.1	-66.4	0	0	0	0	113.9	V150 K242 L272 E274	V150-V244 WeakPolarHBondContact CG1-O 3.38Å; K242-V244 PolarHBondContact O-N 3.21Å; V244-L272 HydrophobicContact CG2-CB 4.03Å; V244-L272 HydrophobicContact CG2-CD2 3.79Å; V244-L272 HydrophobicContact CG2-CG 3.56Å; V244-L272 WeakPolarHBondContact CG2-O 3.5Å; V244-L272 PolarHBondContact N-O 3.26Å; V244-E274 HydrophobicContact CG1-CB 4.21Å; V244-E274 HydrophobicContact CG1-CG 3.17Å
245	D	92	Very high	74.3	Confident	9 Å²	9	43.6 Å²	43.6	5%	0.048	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	162.1	-179.4	-157.6	-8.9	0	0	0	110.8	K151 L272 A314 I315	K151-D245 WeakPolarHBondContact CD-OD1 3.45Å; K151-D245 VanDerWaalsContact CE-OD1 3.28Å; K151-D245 WeakPolarHBondContact CE-OD1 3.28Å; K151-D245 IonicContact NZ-OD1 3.36Å; K151-D245 PolarHBondContact NZ-OD1 3.33Å; K151-D245 IonicContact NZ-OD2 2.92Å; K151-D245 PolarHBondContact NZ-OD2 3.46Å; D245-L272 HydrophobicContact CB-CB 4.48Å; D245-L272 HydrophobicContact CB-CD2 4.45Å; D245-L272 PolarHBondContact O-N 2.93Å; D245-A314 VanDerWaalsContact OD2-CA 3.27Å; D245-A314 WeakPolarHBondContact OD2-CA 3.37Å; D245-I315 HydrophobicContact CB-CB 4.37Å; D245-I315 HydrophobicContact CB-CG2 3.67Å; D245-I315 PolarHBondContact OD2-N 2.85Å
246	F	94.7	Very high	73.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.5	167.7	84.1	-83.9	0	0	0	112.8	K151 R153 V163 V165 F248 L269 F270 L271 I315	K151-F246 HydrophobicContact CB-CD1 3.87Å; K151-F246 HydrophobicContact CB-CE1 3.76Å; K151-F246 HydrophobicContact CG-CE1 4.27Å; K151-F246 WeakPolarHBondContact O-CE1 3.44Å; R153-F246 HydrophobicContact CB-CE2 4.23Å; R153-F246 HydrophobicContact CB-CZ 3.86Å; R153-F246 HydrophobicContact CG-CZ 4.14Å; V163-F246 HydrophobicContact CB-CE2 4.46Å; V163-F246 HydrophobicContact CB-CZ 4.33Å; V163-F246 HydrophobicContact CG1-CE2 4.03Å; V163-F246 HydrophobicContact CG1-CZ 4.06Å; V165-F246 HydrophobicContact CB-CD1 3.58Å; V165-F246 HydrophobicContact CB-CE1 3.88Å; V165-F246 HydrophobicContact CB-CG 4.28Å; V165-F246 HydrophobicContact CG1-CD1 4.45Å; V165-F246 HydrophobicContact CG2-CB 4.25Å; V165-F246 HydrophobicContact CG2-CD1 3.35Å; V165-F246 HydrophobicContact CG2-CD2 4.16Å; V165-F246 HydrophobicContact CG2-CE1 3.58Å; V165-F246 HydrophobicContact CG2-CE2 4.35Å; V165-F246 HydrophobicContact CG2-CG 3.66Å; V165-F246 HydrophobicContact CG2-CZ 4.07Å; F246-F248 HydrophobicContact CE2-CE2 4.11Å; F246-F248 HydrophobicContact CE2-CZ 4.24Å; F246-L269 HydrophobicContact CD2-CD2 3.87Å; F246-L269 HydrophobicContact CE2-CD2 3.99Å; F246-F270 CarbonylContact C-O 3.42Å; F246-F270 WeakPolarHBondContact CA-O 3.47Å; F246-F270 WeakPolarHBondContact CB-O 3.42Å; F246-L271 HydrophobicContact CB-CG 4.28Å; F246-I315 VanDerWaalsContact C-CG2 3.49Å
247	D	93.5	Very high	72.6	Confident	9 Å²	9	55 Å²	55	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	162.9	167.8	-151.4	-7.6	0	0	0	112.8	R153 F270 I315 H316 C317	R153-D247 IonicContact CZ-OD1 2.65Å; R153-D247 IonicContact CZ-OD2 3.64Å; R153-D247 IonicContact NH1-OD1 3.93Å; R153-D247 PolarHBondContact NH1-OD1 2.63Å; R153-D247 IonicContact NH1-OD2 2.76Å; R153-D247 PolarHBondContact NH1-OD2 2.96Å; D247-F270 PolarHBondContact N-O 3.46Å; D247-F270 PolarHBondContact O-N 2.91Å; D247-I315 HydrophobicContact CB-CG2 4.33Å; D247-H316 WeakPolarHBondContact OD2-CA 3.39Å; D247-H316 IonicContact OD2-CE1 3.71Å; D247-H316 IonicContact OD2-CG 2.85Å; D247-H316 IonicContact OD2-ND1 2.61Å; D247-H316 PolarHBondContact OD2-ND1 2.97Å; D247-C317 HydrophobicContact CB-CB 3.99Å; D247-C317 PolarHBondContact OD2-N 2.93Å
248	F	92.7	Very high	72.1	Confident	7 Å²	7	56.6 Å²	56.6	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.9	177.7	-67.5	-82	0	0	0	111.7	R153 W154 H155 P156 V163 F246 C267 C268 L269 C317 R319	R153-F248 HydrophobicContact CB-CD2 4.47Å; R153-F248 HydrophobicContact CB-CE2 3.7Å; W154-F248 WeakPolarHBondContact O-CE2 3.47Å; H155-F248 HydrophobicContact CB-CZ 4.35Å; H155-F248 AromaticContact CD2-CE1 3.48Å; H155-F248 VanDerWaalsContact CD2-CE1 3.48Å; H155-F248 WeakPolarHBondContact CD2-CE1 3.47Å; H155-F248 AromaticContact NE2-CE1 3.94Å; P156-F248 HydrophobicContact CG-CB 3.93Å; P156-F248 HydrophobicContact CG-CD1 4.16Å; P156-F248 HydrophobicContact CG-CD2 4.23Å; P156-F248 HydrophobicContact CG-CG 3.87Å; V163-F248 HydrophobicContact CB-CZ 3.84Å; V163-F248 HydrophobicContact CG1-CZ 4.38Å; V163-F248 HydrophobicContact CG2-CE1 4.03Å; V163-F248 HydrophobicContact CG2-CZ 3.61Å; F246-F248 HydrophobicContact CE2-CE2 4.11Å; F246-F248 HydrophobicContact CE2-CZ 4.24Å; F248-C267 HydrophobicContact CD1-CB 4.04Å; F248-C268 CarbonylContact C-O 3.49Å; F248-C268 WeakPolarHBondContact CA-O 3.43Å; F248-L269 HydrophobicContact CD1-CD2 3.44Å; F248-L269 VanDerWaalsContact CD1-CD2 3.44Å; F248-L269 HydrophobicContact CE1-CD2 3.37Å; F248-L269 HydrophobicContact CG-CD2 4.2Å; F248-L269 HydrophobicContact CZ-CD2 4.1Å; F248-C317 WeakPolarHBondContact O-CB 3.39Å; F248-C317 PolarHBondContact O-SG 3.35Å; F248-R319 VanDerWaalsContact O-CD 3.29Å; F248-R319 WeakPolarHBondContact O-CD 3.49Å
249	G	90.1	Very high	72	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-173.5	169.4	0	0	0	0	0	113.9	C268	G249-C268 WeakPolarHBondContact CA-SG 3.44Å; G249-C268 PolarHBondContact N-O 3.14Å; G249-C268 PolarHBondContact O-N 2.89Å
250	S	85.5	Confident	72.2	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.042	28%	0.281	C	S	.	.			trans	-74.7	148.1	178.3	-70.2	0	0	0	0	112.6	C268 P320 K331 D334	S250-C268 PolarHBondContact O-SG 2.85Å; S250-P320 WeakPolarHBondContact OG-CD 3.28Å; S250-K331 PolarHBondContact OG-NZ 2.92Å; S250-D334 WeakPolarHBondContact CB-OD1 3.22Å; S250-D334 WeakPolarHBondContact CB-OD2 3.4Å; S250-D334 PolarHBondContact N-OD1 3.33Å; S250-D334 PolarHBondContact N-OD2 2.88Å; S250-D334 PolarHBondContact OG-OD1 3.48Å
251	P	78.8	Confident	72.4	Confident	26 Å²	26	59.1 Å²	59.1	17%	0.169	31%	0.31	C	S	.	.			trans	-61.2	148.3	177.7	22	-31.3	0	0	0	112.9	D266	P251-D266 WeakPolarHBondContact CB-O 3.3Å
252	L	67.1	Low	72.2	Confident	18 Å²	18	59.9 Å²	59.9	9%	0.094	32%	0.317	C	S	.	.	S	Bend	trans	-74.4	-35.9	-169.8	-137.3	152.7	0	0	0	112.9	C282 K294 R352	L252-C282 HydrophobicContact CB-CB 4.4Å; L252-C282 HydrophobicContact CD1-CB 3.93Å; L252-C282 WeakPolarHBondContact CD1-SG 3.35Å; L252-K294 HydrophobicContact CD1-CD 4.28Å; L252-R352 PolarHBondContact O-NH1 3.47Å
253	F	56.2	Low	71.5	Confident	153 Å²	153	61.1 Å²	61.1	67%	0.671	32%	0.324	S	S	*	.			trans	-154.9	130.6	173.8	-78.8	-81.8	0	0	0	111.7
254	I	48.5	Very low	70.7	Confident	109 Å²	109	66 Å²	66	56%	0.559	35%	0.349	S	S	*	.			trans	-101.3	86.7	166.7	-53.9	170.2	0	0	0	106.5	K256 L259	I254-K256 PolarHBondContact O-N 3.49Å; I254-L259 HydrophobicContact CG2-CD1 3.75Å
255	S	43.8	Very low	70.1	Confident	87 Å²	87	67.4 Å²	67.4	61%	0.608	35%	0.354	S	S	*	.			trans	-65.5	132.9	168.2	177.5	0	0	0	0	109.3	R257 L259	S255-R257 PolarHBondContact O-N 2.87Å; S255-L259 WeakPolarHBondContact O-CD1 3.26Å
256	K	45.6	Very low	69.6	Low	140 Å²	140	67.6 Å²	67.6	61%	0.609	36%	0.355	S	S	*	.	S	Bend	trans	-74	115.1	-176.1	-71.3	177.6	177.1	173.8	0	110	I254	I254-K256 PolarHBondContact O-N 3.49Å
257	R	44.4	Very low	69.2	Low	244 Å²	244	67.7 Å²	67.7	92%	0.921	36%	0.356	S	S	*	.	S	Bend	trans	96.4	127.6	169.6	-57.7	-175.9	-167.8	-174.3	4.3	116.2	S255	S255-R257 PolarHBondContact O-N 2.87Å
258	G	53.6	Low	69.1	Low	83 Å²	83	67.3 Å²	67.3	86%	0.856	35%	0.353	S	S	*	.			trans	92.1	12.2	168.8	0	0	0	0	0	116.4
259	L	58.8	Low	69.1	Low	53 Å²	53	67 Å²	67	28%	0.277	35%	0.352	S	S	.	.			trans	-67.8	135.6	-179.8	-67.2	167.7	0	0	0	111.2	I254 S255 Q263 L264	I254-L259 HydrophobicContact CG2-CD1 3.75Å; S255-L259 WeakPolarHBondContact O-CD1 3.26Å; L259-Q263 HydrophobicContact CB-CB 4.19Å; L259-Q263 HydrophobicContact CD2-CB 3.98Å; L259-Q263 HydrophobicContact CD2-CG 4.47Å; L259-L264 HydrophobicContact CB-CD1 4.5Å; L259-L264 HydrophobicContact CB-CG 4.11Å
260	S	67.6	Low	69.3	Low	58 Å²	58	67 Å²	67	41%	0.406	35%	0.352	S	S	.	.			trans	-68	159.5	171.7	74	0	0	0	0	110.7	A262 Q263 L264	S260-A262 PolarHBondContact O-N 2.85Å; S260-Q263 WeakPolarHBondContact O-CB 3.37Å; S260-Q263 PolarHBondContact O-N 2.9Å; S260-Q263 WeakPolarHBondContact OG-CG 3.11Å; S260-Q263 PolarHBondContact OG-N 3.31Å; S260-L264 PolarHBondContact O-N 3.02Å
261	E	69.7	Low	69.7	Low	148 Å²	148	66.7 Å²	66.7	69%	0.692	35%	0.35	S	S	*	.	H	α-helix	trans	-56.4	-36.8	176.3	-168.9	175.5	-179.8	0	0	112.1	Q263 L264 Q265	E261-Q263 PolarHBondContact O-N 3.47Å; E261-L264 PolarHBondContact O-N 2.84Å; E261-Q265 WeakPolarHBondContact O-CG 3.31Å; E261-Q265 PolarHBondContact O-N 3.01Å; E261-Q265 VanDerWaalsContact O-N 3.09Å
262	A	69.7	Low	70.4	Confident	29 Å²	29	65.4 Å²	65.4	24%	0.24	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-38.6	175.6	0	0	0	0	0	112.7	S260 Q265 D266	S260-A262 PolarHBondContact O-N 2.85Å; A262-Q265 PolarHBondContact O-N 3.09Å; A262-D266 PolarHBondContact O-N 2.89Å; A262-D266 VanDerWaalsContact O-N 3.12Å
263	Q	71	Confident	71.4	Confident	79 Å²	79	64.8 Å²	64.8	37%	0.369	34%	0.338	S	S	.	.	H	α-helix	trans	-70.3	-35.5	177.1	-74.8	171.1	-26.1	0	0	112.4	L259 S260 E261 Q265 D266 S286	L259-Q263 HydrophobicContact CB-CB 4.19Å; L259-Q263 HydrophobicContact CD2-CB 3.98Å; L259-Q263 HydrophobicContact CD2-CG 4.47Å; S260-Q263 WeakPolarHBondContact O-CB 3.37Å; S260-Q263 PolarHBondContact O-N 2.9Å; S260-Q263 WeakPolarHBondContact OG-CG 3.11Å; S260-Q263 PolarHBondContact OG-N 3.31Å; E261-Q263 PolarHBondContact O-N 3.47Å; Q263-Q265 VanDerWaalsContact C-N 3.28Å; Q263-Q265 PolarHBondContact O-N 3.38Å; Q263-D266 WeakPolarHBondContact O-CB 3.44Å; Q263-D266 PolarHBondContact O-N 3.49Å; Q263-S286 VanDerWaalsContact CG-OG 3.3Å; Q263-S286 WeakPolarHBondContact CG-OG 3.48Å
264	L	71.1	Confident	72.8	Confident	101 Å²	101	60 Å²	60	53%	0.529	32%	0.318	S	S	.	.	H	α-helix	trans	-66.5	-33.6	175.1	-78.4	156	0	0	0	112.2	L259 S260 E261	L259-L264 HydrophobicContact CB-CD1 4.5Å; L259-L264 HydrophobicContact CB-CG 4.11Å; S260-L264 PolarHBondContact O-N 3.02Å; E261-L264 PolarHBondContact O-N 2.84Å
265	Q	77	Confident	74.3	Confident	56 Å²	56	57.3 Å²	57.3	26%	0.262	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-8.7	176.9	-69.3	-177.7	15.5	0	0	113.3	H155 K157 S158 E261 A262 Q263 L285	H155-Q265 PolarHBondContact CE1-O 3.42Å; K157-Q265 HydrophobicContact CB-CB 4.27Å; K157-Q265 WeakPolarHBondContact CB-O 3.49Å; S158-Q265 PolarHBondContact OG-OE1 3.48Å; E261-Q265 WeakPolarHBondContact O-CG 3.31Å; E261-Q265 PolarHBondContact O-N 3.01Å; E261-Q265 VanDerWaalsContact O-N 3.09Å; A262-Q265 PolarHBondContact O-N 3.09Å; Q263-Q265 VanDerWaalsContact C-N 3.28Å; Q263-Q265 PolarHBondContact O-N 3.38Å; Q265-L285 HydrophobicContact CB-CD1 4.14Å
266	D	81.9	Confident	76.2	Confident	13 Å²	13	53.4 Å²	53.4	7%	0.07	28%	0.28	C	S	.	.			trans	-67.1	145.2	-173.9	-143	-1.8	0	0	0	112.2	P251 A262 Q263 G283 C284 L285 S286	P251-D266 WeakPolarHBondContact CB-O 3.3Å; A262-D266 PolarHBondContact O-N 2.89Å; A262-D266 VanDerWaalsContact O-N 3.12Å; Q263-D266 WeakPolarHBondContact O-CB 3.44Å; Q263-D266 PolarHBondContact O-N 3.49Å; D266-G283 VanDerWaalsContact OD2-C 3.26Å; D266-G283 WeakPolarHBondContact OD2-CA 3.24Å; D266-C284 PolarHBondContact OD1-N 2.86Å; D266-L285 HydrophobicContact CB-CB 4.41Å; D266-L285 WeakPolarHBondContact OD1-CB 3.39Å; D266-L285 PolarHBondContact OD1-N 3.27Å; D266-S286 VanDerWaalsContact OD2-CB 3.25Å; D266-S286 WeakPolarHBondContact OD2-CB 3.47Å; D266-S286 PolarHBondContact OD2-N 3.24Å; D266-S286 PolarHBondContact OD2-OG 2.95Å
267	C	87.3	Confident	78.1	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.02	27%	0.266	C	S	.	.			trans	-133.3	151.9	176.1	-76.4	0	0	0	0	108.6	F248	F248-C267 HydrophobicContact CD1-CB 4.04Å
268	C	89.8	Confident	80.3	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	154.6	168	74.3	0	0	0	0	110.4	F248 G249 S250 Q280 V281 C282	F248-C268 CarbonylContact C-O 3.49Å; F248-C268 WeakPolarHBondContact CA-O 3.43Å; G249-C268 WeakPolarHBondContact CA-SG 3.44Å; G249-C268 PolarHBondContact N-O 3.14Å; G249-C268 PolarHBondContact O-N 2.89Å; S250-C268 PolarHBondContact O-SG 2.85Å; C268-Q280 HydrophobicContact CB-CG 4.02Å; C268-Q280 PolarHBondContact SG-NE2 3.07Å; C268-Q280 VanDerWaalsContact SG-NE2 3.43Å; C268-V281 CarbonylContact C-O 3.59Å; C268-V281 VanDerWaalsContact CA-O 3.3Å; C268-V281 WeakPolarHBondContact CA-O 3.36Å; C268-C282 WeakPolarHBondContact CB-SG 3.33Å
269	L	94.1	Very high	82.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136	169.1	-63.6	173.4	0	0	0	108.5	V163 I171 Y173 F246 F248 L271 Q280 V281	V163-L269 HydrophobicContact CG1-CD1 4.4Å; V163-L269 HydrophobicContact CG1-CD2 4.46Å; I171-L269 HydrophobicContact CD1-CD1 3.81Å; I171-L269 HydrophobicContact CG2-CD1 4.04Å; Y173-L269 HydrophobicContact CE2-CD1 3.96Å; Y173-L269 WeakPolarHBondContact OH-CD1 3.49Å; F246-L269 HydrophobicContact CD2-CD2 3.87Å; F246-L269 HydrophobicContact CE2-CD2 3.99Å; F248-L269 HydrophobicContact CD1-CD2 3.44Å; F248-L269 VanDerWaalsContact CD1-CD2 3.44Å; F248-L269 HydrophobicContact CE1-CD2 3.37Å; F248-L269 HydrophobicContact CG-CD2 4.2Å; F248-L269 HydrophobicContact CZ-CD2 4.1Å; L269-L271 HydrophobicContact CB-CD1 3.92Å; L269-Q280 CarbonylContact O-C 3.47Å; L269-Q280 VanDerWaalsContact O-CA 3.25Å; L269-Q280 WeakPolarHBondContact O-CA 3.25Å; L269-V281 HydrophobicContact CB-CB 4.33Å; L269-V281 PolarHBondContact N-O 3.44Å; L269-V281 PolarHBondContact O-N 3Å
270	F	94.5	Very high	83.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	118.2	164.2	-64.4	-69	0	0	0	107.9	F246 D247 V278 I279 Q280 L298 I315 C317 D334 L336 V350	F246-F270 CarbonylContact C-O 3.42Å; F246-F270 WeakPolarHBondContact CA-O 3.47Å; F246-F270 WeakPolarHBondContact CB-O 3.42Å; D247-F270 PolarHBondContact N-O 3.46Å; D247-F270 PolarHBondContact O-N 2.91Å; F270-V278 HydrophobicContact CB-CG1 4.08Å; F270-V278 HydrophobicContact CD1-CG1 4.15Å; F270-I279 WeakPolarHBondContact CA-O 3.46Å; F270-Q280 HydrophobicContact CD1-CB 3.93Å; F270-Q280 HydrophobicContact CD1-CG 4.24Å; F270-Q280 HydrophobicContact CE1-CB 3.8Å; F270-Q280 HydrophobicContact CE1-CG 3.84Å; F270-L298 HydrophobicContact CD1-CD1 4.09Å; F270-L298 HydrophobicContact CD1-CD2 4.16Å; F270-L298 HydrophobicContact CE1-CD1 4.07Å; F270-L298 HydrophobicContact CE1-CD2 3.92Å; F270-I315 HydrophobicContact CB-CD1 3.91Å; F270-C317 HydrophobicContact CD2-CB 4.38Å; F270-D334 HydrophobicContact CE2-CB 4.4Å; F270-L336 HydrophobicContact CB-CD1 4.45Å; F270-L336 HydrophobicContact CB-CD2 4.3Å; F270-L336 HydrophobicContact CD1-CD1 3.77Å; F270-L336 HydrophobicContact CD2-CD1 3.92Å; F270-L336 HydrophobicContact CD2-CD2 4.23Å; F270-L336 HydrophobicContact CD2-CG 4.25Å; F270-L336 HydrophobicContact CE1-CD1 3.87Å; F270-L336 HydrophobicContact CE2-CD1 4Å; F270-L336 HydrophobicContact CE2-CG 4.42Å; F270-L336 HydrophobicContact CG-CD1 3.79Å; F270-L336 HydrophobicContact CG-CD2 4.3Å; F270-L336 HydrophobicContact CG-CG 4.46Å; F270-L336 HydrophobicContact CZ-CD1 3.99Å; F270-V350 HydrophobicContact CE1-CG1 4.41Å; F270-V350 HydrophobicContact CZ-CG1 4.18Å; F270-V350 HydrophobicContact CZ-CG2 4.07Å
271	L	94.1	Very high	84.8	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.3	174.5	-70.2	84	0	0	0	108.6	V165 I171 L195 F246 L269 Y273 V278 I279 V281	V165-L271 HydrophobicContact CG1-CD2 4.03Å; I171-L271 HydrophobicContact CD1-CD1 4.02Å; I171-L271 HydrophobicContact CD1-CD2 4.02Å; I171-L271 HydrophobicContact CG1-CD2 4.35Å; L195-L271 HydrophobicContact CD1-CD2 4.08Å; F246-L271 HydrophobicContact CB-CG 4.28Å; L269-L271 HydrophobicContact CB-CD1 3.92Å; L271-Y273 HydrophobicContact CB-CE2 4.07Å; L271-V278 CarbonylContact O-C 3.58Å; L271-V278 VanDerWaalsContact O-CA 3.29Å; L271-V278 WeakPolarHBondContact O-CA 3.28Å; L271-I279 PolarHBondContact N-O 3.38Å; L271-I279 PolarHBondContact O-N 2.85Å; L271-V281 HydrophobicContact CD1-CB 4.32Å; L271-V281 HydrophobicContact CD1-CG2 3.57Å
272	L	92.7	Very high	85.6	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	136.9	176.6	177.9	62.9	0	0	0	109.9	C243 V244 D245 V278 F312 A314 I315 L338	C243-L272 WeakPolarHBondContact CA-O 3.47Å; V244-L272 HydrophobicContact CG2-CB 4.03Å; V244-L272 HydrophobicContact CG2-CD2 3.79Å; V244-L272 HydrophobicContact CG2-CG 3.56Å; V244-L272 WeakPolarHBondContact CG2-O 3.5Å; V244-L272 PolarHBondContact N-O 3.26Å; D245-L272 HydrophobicContact CB-CB 4.48Å; D245-L272 HydrophobicContact CB-CD2 4.45Å; D245-L272 PolarHBondContact O-N 2.93Å; L272-V278 HydrophobicContact CD1-CG2 3.96Å; L272-F312 HydrophobicContact CD1-CB 3.98Å; L272-F312 HydrophobicContact CD1-CD1 4.49Å; L272-F312 HydrophobicContact CD1-CG 4.3Å; L272-F312 HydrophobicContact CD2-CB 4.06Å; L272-F312 HydrophobicContact CG-CB 4.19Å; L272-A314 VanDerWaalsContact CD2-C 3.45Å; L272-A314 VanDerWaalsContact CD2-O 3.31Å; L272-A314 WeakPolarHBondContact CD2-O 3.35Å; L272-I315 HydrophobicContact CB-CB 4Å; L272-I315 HydrophobicContact CB-CD1 3.97Å; L272-I315 HydrophobicContact CB-CG2 4.16Å; L272-I315 HydrophobicContact CD2-CB 3.85Å; L272-L338 HydrophobicContact CD1-CD2 4.24Å
273	Y	89.1	Confident	86.3	Confident	5 Å²	5	21.8 Å²	21.8	2%	0.02	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	159.1	175.4	-67.7	-96.4	0	0	0	111.2	S169 T199 S241 K242 C243 L271 T275 G276 D277 I279	S169-Y273 WeakPolarHBondContact CB-OH 3.12Å; S169-Y273 VanDerWaalsContact OG-CE1 3.27Å; S169-Y273 WeakPolarHBondContact OG-CE1 3.48Å; S169-Y273 PolarHBondContact OG-OH 3.41Å; S169-Y273 VanDerWaalsContact OG-OH 3.09Å; T199-Y273 HydrophobicContact CG2-CE1 3.6Å; T199-Y273 HydrophobicContact CG2-CE2 4.32Å; T199-Y273 VanDerWaalsContact CG2-CZ 3.43Å; T199-Y273 WeakPolarHBondContact CG2-OH 3.23Å; S241-Y273 WeakPolarHBondContact O-CD1 3.34Å; K242-Y273 VanDerWaalsContact O-CA 3.32Å; K242-Y273 WeakPolarHBondContact O-CA 3.25Å; C243-Y273 HydrophobicContact CB-CD1 4.42Å; C243-Y273 HydrophobicContact CB-CE1 4.11Å; L271-Y273 HydrophobicContact CB-CE2 4.07Å; Y273-T275 PolarHBondContact O-N 3Å; Y273-T275 VanDerWaalsContact O-N 3.17Å; Y273-G276 PolarHBondContact O-N 3.14Å; Y273-D277 PolarHBondContact N-O 3.45Å; Y273-I279 HydrophobicContact CD2-CD1 4.35Å; Y273-I279 HydrophobicContact CD2-CG1 4.32Å; Y273-I279 HydrophobicContact CE2-CB 4.24Å; Y273-I279 HydrophobicContact CE2-CD1 3.51Å; Y273-I279 HydrophobicContact CE2-CG1 3.72Å
274	E	84.2	Confident	87	Confident	53 Å²	53	18 Å²	18	25%	0.248	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.5	177.6	-76.4	-170.6	145.5	0	0	112.9	G240 K242 V244 G276 E311 F312 K341	G240-E274 PolarHBondContact O-N 3.06Å; K242-E274 HydrophobicContact CB-CG 4.15Å; K242-E274 PolarHBondContact O-N 2.67Å; V244-E274 HydrophobicContact CG1-CB 4.21Å; V244-E274 HydrophobicContact CG1-CG 3.17Å; E274-G276 PolarHBondContact O-N 3.2Å; E274-E311 PolarHBondContact O-N 3.26Å; E274-F312 PolarHBondContact O-N 2.92Å; E274-K341 IonicContact OE1-NZ 3.47Å
275	T	80.4	Confident	87.6	Confident	52 Å²	52	13.8 Å²	13.8	32%	0.319	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-13.1	174.7	54.9	0	0	0	0	113.9	Y273 D277	Y273-T275 PolarHBondContact O-N 3Å; Y273-T275 VanDerWaalsContact O-N 3.17Å; T275-D277 VanDerWaalsContact C-N 3.31Å; T275-D277 PolarHBondContact OG1-N 2.93Å; T275-D277 PolarHBondContact OG1-OD2 3.4Å
276	G	84.1	Confident	87.7	Confident	4 Å²	4	13.4 Å²	13.4	4%	0.041	8%	0.08	C	C	.	.	S	Bend	trans	86.6	-2.2	-170.3	0	0	0	0	0	114.4	Y273 E274	Y273-G276 PolarHBondContact O-N 3.14Å; E274-G276 PolarHBondContact O-N 3.2Å
277	D	85.7	Confident	87.4	Confident	60 Å²	60	14.2 Å²	14.2	32%	0.321	9%	0.086	S	C	.	.			trans	-64.6	138.1	172.8	-66	-49.1	0	0	0	110.6	Y273 T275	Y273-D277 PolarHBondContact N-O 3.45Å; T275-D277 VanDerWaalsContact C-N 3.31Å; T275-D277 PolarHBondContact OG1-N 2.93Å; T275-D277 PolarHBondContact OG1-OD2 3.4Å
278	V	90.6	Very high	86.6	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125	175.8	-175.3	0	0	0	0	109.4	F270 L271 L272 L298 I315 L338	F270-V278 HydrophobicContact CB-CG1 4.08Å; F270-V278 HydrophobicContact CD1-CG1 4.15Å; L271-V278 CarbonylContact O-C 3.58Å; L271-V278 VanDerWaalsContact O-CA 3.29Å; L271-V278 WeakPolarHBondContact O-CA 3.28Å; L272-V278 HydrophobicContact CD1-CG2 3.96Å; V278-L298 HydrophobicContact CB-CB 4.23Å; V278-L298 HydrophobicContact CB-CD1 4.48Å; V278-L298 HydrophobicContact CB-CD2 4.47Å; V278-L298 HydrophobicContact CG1-CD1 4.14Å; V278-L298 HydrophobicContact CG1-CD2 4.13Å; V278-L298 WeakPolarHBondContact O-CD1 3.13Å; V278-L298 PolarHBondContact O-N 3.32Å; V278-I315 HydrophobicContact CG1-CD1 4.04Å; V278-I315 HydrophobicContact CG2-CD1 4.45Å; V278-L338 HydrophobicContact CG2-CD1 3.98Å; V278-L338 HydrophobicContact CG2-CD2 3.9Å
279	I	90.4	Very high	85.9	Confident	7 Å²	7	29.2 Å²	29.2	4%	0.036	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.2	176.7	-57.5	-175.9	0	0	0	109.4	F198 T199 F270 L271 Y273 V281 C295 V297	F198-I279 HydrophobicContact CD1-CD1 4.19Å; F198-I279 HydrophobicContact CD1-CG2 4.49Å; F198-I279 HydrophobicContact CE1-CD1 4.46Å; F198-I279 HydrophobicContact CE1-CG2 4.3Å; T199-I279 HydrophobicContact CG2-CD1 3.78Å; F270-I279 WeakPolarHBondContact CA-O 3.46Å; L271-I279 PolarHBondContact N-O 3.38Å; L271-I279 PolarHBondContact O-N 2.85Å; Y273-I279 HydrophobicContact CD2-CD1 4.35Å; Y273-I279 HydrophobicContact CD2-CG1 4.32Å; Y273-I279 HydrophobicContact CE2-CB 4.24Å; Y273-I279 HydrophobicContact CE2-CD1 3.51Å; Y273-I279 HydrophobicContact CE2-CG1 3.72Å; I279-V281 HydrophobicContact CG2-CG2 4.09Å; I279-C295 HydrophobicContact CG2-CB 4.42Å; I279-V297 HydrophobicContact CG1-CG2 4.42Å
280	Q	91.6	Very high	85.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	123.5	167.4	-178.1	176.5	56	0	0	110.6	C268 L269 F270 C295 N296 L298	C268-Q280 HydrophobicContact CB-CG 4.02Å; C268-Q280 PolarHBondContact SG-NE2 3.07Å; C268-Q280 VanDerWaalsContact SG-NE2 3.43Å; L269-Q280 CarbonylContact O-C 3.47Å; L269-Q280 VanDerWaalsContact O-CA 3.25Å; L269-Q280 WeakPolarHBondContact O-CA 3.25Å; F270-Q280 HydrophobicContact CD1-CB 3.93Å; F270-Q280 HydrophobicContact CD1-CG 4.24Å; F270-Q280 HydrophobicContact CE1-CB 3.8Å; F270-Q280 HydrophobicContact CE1-CG 3.84Å; Q280-C295 CarbonylContact O-C 3.56Å; Q280-C295 VanDerWaalsContact O-CA 3.25Å; Q280-C295 WeakPolarHBondContact O-CA 3.32Å; Q280-N296 PolarHBondContact N-O 3.33Å; Q280-N296 PolarHBondContact O-N 3.39Å; Q280-N296 PolarHBondContact OE1-ND2 2.9Å; Q280-L298 HydrophobicContact CB-CD1 3.66Å
281	V	91.1	Very high	84.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131	173.9	-173.9	0	0	0	0	109.2	I171 L195 C268 L269 L271 I279 L293	I171-V281 HydrophobicContact CD1-CG2 4.47Å; L195-V281 HydrophobicContact CD1-CG2 3.7Å; C268-V281 CarbonylContact C-O 3.59Å; C268-V281 VanDerWaalsContact CA-O 3.3Å; C268-V281 WeakPolarHBondContact CA-O 3.36Å; L269-V281 HydrophobicContact CB-CB 4.33Å; L269-V281 PolarHBondContact N-O 3.44Å; L269-V281 PolarHBondContact O-N 3Å; L271-V281 HydrophobicContact CD1-CB 4.32Å; L271-V281 HydrophobicContact CD1-CG2 3.57Å; I279-V281 HydrophobicContact CG2-CG2 4.09Å; V281-L293 HydrophobicContact CG1-CB 4.41Å; V281-L293 HydrophobicContact CG1-CD1 4.33Å; V281-L293 HydrophobicContact CG1-CD2 4.44Å
282	C	88.3	Confident	83.5	Confident	10 Å²	10	44.5 Å²	44.5	7%	0.068	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.1	-177.1	-72.1	0	0	0	0	112.1	L252 C268 K294	L252-C282 HydrophobicContact CB-CB 4.4Å; L252-C282 HydrophobicContact CD1-CB 3.93Å; L252-C282 WeakPolarHBondContact CD1-SG 3.35Å; C268-C282 WeakPolarHBondContact CB-SG 3.33Å; C282-K294 HydrophobicContact CB-CB 4.24Å; C282-K294 PolarHBondContact N-O 3.27Å; C282-K294 PolarHBondContact O-N 3.02Å
283	G	84.2	Confident	83.1	Confident	15 Å²	15	45.4 Å²	45.4	16%	0.155	23%	0.227	C	C	.	.			trans	97.2	6	178.4	0	0	0	0	0	114	D266 L285 S286 V287	D266-G283 VanDerWaalsContact OD2-C 3.26Å; D266-G283 WeakPolarHBondContact OD2-CA 3.24Å; G283-L285 PolarHBondContact O-N 3.38Å; G283-L285 VanDerWaalsContact O-N 3.09Å; G283-S286 PolarHBondContact O-N 3.34Å; G283-V287 WeakPolarHBondContact O-CG2 3.4Å; G283-V287 PolarHBondContact O-N 3.02Å
284	C	85.5	Confident	82.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-29.2	-168.2	-58.4	0	0	0	0	114.5	Y173 L191 D266	Y173-C284 HydrophobicContact CD2-CB 4.33Å; Y173-C284 HydrophobicContact CE1-CB 3.88Å; Y173-C284 HydrophobicContact CE2-CB 3.56Å; Y173-C284 VanDerWaalsContact OH-CB 3.25Å; Y173-C284 WeakPolarHBondContact OH-CB 3.4Å; L191-C284 HydrophobicContact CD2-CB 4.04Å; D266-C284 PolarHBondContact OD1-N 2.86Å
285	L	82.7	Confident	83	Confident	11 Å²	11	46.4 Å²	46.4	6%	0.058	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-29	171	-68.7	177.1	0	0	0	112.9	Y173 W190 Q265 D266 G283	Y173-L285 HydrophobicContact CD1-CD2 3.57Å; Y173-L285 HydrophobicContact CD1-CG 4.18Å; Y173-L285 HydrophobicContact CE1-CD2 3.84Å; Y173-L285 HydrophobicContact CE1-CG 3.92Å; W190-L285 PolarHBondContact NE1-O 2.92Å; Q265-L285 HydrophobicContact CB-CD1 4.14Å; D266-L285 HydrophobicContact CB-CB 4.41Å; D266-L285 WeakPolarHBondContact OD1-CB 3.39Å; D266-L285 PolarHBondContact OD1-N 3.27Å; G283-L285 PolarHBondContact O-N 3.38Å; G283-L285 VanDerWaalsContact O-N 3.09Å
286	S	78.9	Confident	83.3	Confident	48 Å²	48	44.8 Å²	44.8	34%	0.336	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-30.5	-176.9	-60.6	0	0	0	0	114	Q263 D266 G283	Q263-S286 VanDerWaalsContact CG-OG 3.3Å; Q263-S286 WeakPolarHBondContact CG-OG 3.48Å; D266-S286 VanDerWaalsContact OD2-CB 3.25Å; D266-S286 WeakPolarHBondContact OD2-CB 3.47Å; D266-S286 PolarHBondContact OD2-N 3.24Å; D266-S286 PolarHBondContact OD2-OG 2.95Å; G283-S286 PolarHBondContact O-N 3.34Å
287	V	76	Confident	83.4	Confident	30 Å²	30	46.7 Å²	46.7	18%	0.182	23%	0.233	C	C	.	.			trans	-120.4	144.8	-178.7	-83.6	0	0	0	0	111.5	G283 Q292 L293	G283-V287 WeakPolarHBondContact O-CG2 3.4Å; G283-V287 PolarHBondContact O-N 3.02Å; V287-Q292 HydrophobicContact CB-CB 3.87Å; V287-Q292 HydrophobicContact CG1-CB 3.6Å; V287-Q292 HydrophobicContact CG1-CG 4.45Å; V287-Q292 VanDerWaalsContact CG1-OE1 3.31Å; V287-Q292 HydrophobicContact CG2-CB 4.18Å; V287-L293 HydrophobicContact CG2-CD2 3.79Å; V287-L293 HydrophobicContact CG2-CG 4.45Å
288	R	71.5	Confident	83.6	Confident	185 Å²	185	44 Å²	44	70%	0.698	22%	0.219	S	C	*	.	S	Bend	trans	-99.5	-10.9	-179.3	-70.2	-171.7	178.9	173.3	0.4	113.7
289	K	74.8	Confident	83.3	Confident	134 Å²	134	48.8 Å²	48.8	58%	0.583	24%	0.241	S	C	*	.	S	Bend	trans	-118.2	135.5	-176.9	-63.3	-173.6	178.5	-176.8	0	110	N291 Q292	K289-N291 VanDerWaalsContact C-N 3.29Å; K289-N291 VanDerWaalsContact CB-OD1 3.26Å; K289-N291 WeakPolarHBondContact CB-OD1 3.5Å; K289-N291 PolarHBondContact O-N 3.19Å; K289-Q292 HydrophobicContact CB-CG 4.34Å; K289-Q292 PolarHBondContact O-N 3.18Å; K289-Q292 VanDerWaalsContact O-N 3.08Å
290	M	76.5	Confident	83.1	Confident	70 Å²	70	50 Å²	50	35%	0.345	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-54.8	-42.3	-178.9	178.4	-163.1	155	0	0	112.8	A193 D194 Q292 L293	A193-M290 HydrophobicContact CB-CB 4.36Å; A193-M290 HydrophobicContact CB-CG 4.22Å; D194-M290 HydrophobicContact CB-SD 4.46Å; D194-M290 WeakPolarHBondContact O-CE 3.13Å; M290-Q292 PolarHBondContact O-N 3.24Å; M290-L293 HydrophobicContact CG-CD1 4.43Å; M290-L293 WeakPolarHBondContact O-CB 3.31Å; M290-L293 PolarHBondContact O-N 3.38Å
291	N	75.6	Confident	82.8	Confident	139 Å²	139	54.1 Å²	54.1	74%	0.743	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-66.3	-4.8	-178.5	66.8	-21.6	0	0	0	114.6	K289	K289-N291 VanDerWaalsContact C-N 3.29Å; K289-N291 VanDerWaalsContact CB-OD1 3.26Å; K289-N291 WeakPolarHBondContact CB-OD1 3.5Å; K289-N291 PolarHBondContact O-N 3.19Å
292	Q	80.6	Confident	82.3	Confident	111 Å²	111	57.8 Å²	57.8	52%	0.519	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-104.7	-6.1	175.3	-56.8	177.3	-28	0	0	112.5	V287 K289 M290	V287-Q292 HydrophobicContact CB-CB 3.87Å; V287-Q292 HydrophobicContact CG1-CB 3.6Å; V287-Q292 HydrophobicContact CG1-CG 4.45Å; V287-Q292 VanDerWaalsContact CG1-OE1 3.31Å; V287-Q292 HydrophobicContact CG2-CB 4.18Å; K289-Q292 HydrophobicContact CB-CG 4.34Å; K289-Q292 PolarHBondContact O-N 3.18Å; K289-Q292 VanDerWaalsContact O-N 3.08Å; M290-Q292 PolarHBondContact O-N 3.24Å
293	L	83.7	Confident	81.5	Confident	19 Å²	19	62 Å²	62	10%	0.099	32%	0.316	C	S	.	.			trans	-68	136.1	175.2	-66.4	170.7	0	0	0	109.4	L191 A193 V281 V287 M290	L191-L293 HydrophobicContact CD2-CD1 4.39Å; L191-L293 HydrophobicContact CD2-CD2 4.34Å; A193-L293 HydrophobicContact CB-CD1 3.77Å; V281-L293 HydrophobicContact CG1-CB 4.41Å; V281-L293 HydrophobicContact CG1-CD1 4.33Å; V281-L293 HydrophobicContact CG1-CD2 4.44Å; V287-L293 HydrophobicContact CG2-CD2 3.79Å; V287-L293 HydrophobicContact CG2-CG 4.45Å; M290-L293 HydrophobicContact CG-CD1 4.43Å; M290-L293 WeakPolarHBondContact O-CB 3.31Å; M290-L293 PolarHBondContact O-N 3.38Å
294	K	84.4	Confident	80.6	Confident	58 Å²	58	62.8 Å²	62.8	25%	0.252	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	112.4	173	-176.6	177.8	177.9	-179	0	108.5	L252 C282 N296 T367	L252-K294 HydrophobicContact CD1-CD 4.28Å; C282-K294 HydrophobicContact CB-CB 4.24Å; C282-K294 PolarHBondContact N-O 3.27Å; C282-K294 PolarHBondContact O-N 3.02Å; K294-N296 WeakPolarHBondContact CE-OD1 3.37Å; K294-T367 HydrophobicContact CD-CG2 4.41Å; K294-T367 VanDerWaalsContact CE-CG2 3.46Å
295	C	86.6	Confident	79.2	Confident	22 Å²	22	69.7 Å²	69.7	15%	0.149	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.1	177.8	-56.3	0	0	0	0	109.6	F198 I279 Q280	F198-C295 HydrophobicContact CD1-CB 4.02Å; F198-C295 HydrophobicContact CD2-CB 4Å; F198-C295 HydrophobicContact CE1-CB 3.71Å; F198-C295 HydrophobicContact CE2-CB 3.68Å; F198-C295 HydrophobicContact CG-CB 4.16Å; F198-C295 HydrophobicContact CZ-CB 3.53Å; I279-C295 HydrophobicContact CG2-CB 4.42Å; Q280-C295 CarbonylContact O-C 3.56Å; Q280-C295 VanDerWaalsContact O-CA 3.25Å; Q280-C295 WeakPolarHBondContact O-CA 3.32Å
296	N	85.9	Confident	78	Confident	17 Å²	17	76.3 Å²	76.3	9%	0.091	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.6	174.3	-43	-62.5	0	0	0	109	Q280 K294 V370	Q280-N296 PolarHBondContact N-O 3.33Å; Q280-N296 PolarHBondContact O-N 3.39Å; Q280-N296 PolarHBondContact OE1-ND2 2.9Å; K294-N296 WeakPolarHBondContact CE-OD1 3.37Å; N296-V370 HydrophobicContact CB-CG2 3.95Å
297	V	87.2	Confident	76.9	Confident	44 Å²	44	78.5 Å²	78.5	27%	0.267	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	132.7	167.1	-175.4	0	0	0	0	108.1	F198 A202 I279	F198-V297 HydrophobicContact CE1-CG2 4.14Å; A202-V297 HydrophobicContact CB-CG2 3.89Å; I279-V297 HydrophobicContact CG1-CG2 4.42Å
298	L	88.7	Confident	76.5	Confident	5 Å²	5	77.9 Å²	77.9	3%	0.026	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	126.8	174.8	-79.2	70.7	0	0	0	109.1	F270 V278 Q280 L336 V350 V370 L372	F270-L298 HydrophobicContact CD1-CD1 4.09Å; F270-L298 HydrophobicContact CD1-CD2 4.16Å; F270-L298 HydrophobicContact CE1-CD1 4.07Å; F270-L298 HydrophobicContact CE1-CD2 3.92Å; V278-L298 HydrophobicContact CB-CB 4.23Å; V278-L298 HydrophobicContact CB-CD1 4.48Å; V278-L298 HydrophobicContact CB-CD2 4.47Å; V278-L298 HydrophobicContact CG1-CD1 4.14Å; V278-L298 HydrophobicContact CG1-CD2 4.13Å; V278-L298 WeakPolarHBondContact O-CD1 3.13Å; V278-L298 PolarHBondContact O-N 3.32Å; Q280-L298 HydrophobicContact CB-CD1 3.66Å; L298-L336 HydrophobicContact CD2-CD1 3.75Å; L298-V350 HydrophobicContact CD2-CG1 4.3Å; L298-V350 HydrophobicContact CD2-CG2 4.34Å; L298-V370 WeakPolarHBondContact CA-O 3.12Å; L298-V370 HydrophobicContact CD1-CG1 4.33Å; L298-V370 HydrophobicContact CD2-CG1 4.41Å; L298-V370 HydrophobicContact CG-CB 4.31Å; L298-V370 HydrophobicContact CG-CG1 3.92Å; L298-L372 HydrophobicContact CB-CB 4.44Å; L298-L372 HydrophobicContact CD2-CB 4.11Å
299	H	86.1	Confident	76.1	Confident	99 Å²	99	70.4 Å²	70.4	46%	0.458	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.1	169.4	-62.8	-75.9	0	0	0	109.6	F301 V370 L371 L372	H299-F301 HydrophobicContact CB-CD2 4.35Å; H299-F301 HydrophobicContact CB-CE2 3.89Å; H299-V370 PolarHBondContact N-O 3Å; H299-V370 VanDerWaalsContact N-O 3.09Å; H299-L371 HydrophobicContact CB-CD2 3.91Å; H299-L371 CarbonylContact O-C 3.57Å; H299-L371 WeakPolarHBondContact O-CA 3.33Å; H299-L372 PolarHBondContact O-N 3.39Å
300	I	86.2	Confident	75.6	Confident	32 Å²	32	69.7 Å²	69.7	16%	0.164	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	130.7	178.3	-56.9	177.8	0	0	0	109.3	Y308 L338 L372 L374	I300-Y308 HydrophobicContact CG2-CD2 4.26Å; I300-Y308 HydrophobicContact CG2-CE2 3.81Å; I300-L338 HydrophobicContact CD1-CD1 4.18Å; I300-L372 CarbonylContact C-O 3.52Å; I300-L372 WeakPolarHBondContact CA-O 3.16Å; I300-L372 HydrophobicContact CG1-CB 4.37Å; I300-L372 HydrophobicContact CG1-CD2 4.27Å; I300-L374 HydrophobicContact CG2-CD1 3.74Å; I300-L374 HydrophobicContact CG2-CD2 4.37Å; I300-L374 HydrophobicContact CG2-CG 3.88Å
301	F	83.8	Confident	75.8	Confident	88 Å²	88	70.5 Å²	70.5	39%	0.386	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	135.4	176.6	-85	-94.5	0	0	0	110.5	H299 P303 L371 L372 L374	H299-F301 HydrophobicContact CB-CD2 4.35Å; H299-F301 HydrophobicContact CB-CE2 3.89Å; F301-P303 HydrophobicContact CE1-CG 4.35Å; F301-L371 HydrophobicContact CD2-CB 4.49Å; F301-L371 HydrophobicContact CD2-CD2 4.1Å; F301-L371 HydrophobicContact CE2-CD2 3.71Å; F301-L372 PolarHBondContact N-O 3.04Å; F301-L374 WeakPolarHBondContact O-CB 3.21Å; F301-L374 PolarHBondContact O-N 3.25Å
302	P	82.2	Confident	76.3	Confident	76 Å²	76	64 Å²	64	49%	0.494	34%	0.344	S	S	.	.	S	Bend	cis	-67.7	149.7	-1	23.7	-28.7	0	0	0	113.1	S304 Y308	P302-S304 PolarHBondContact O-N 3.43Å; P302-Y308 VanDerWaalsContact CD-OH 3.24Å; P302-Y308 WeakPolarHBondContact CD-OH 3.38Å; P302-Y308 VanDerWaalsContact CG-OH 3.3Å; P302-Y308 WeakPolarHBondContact CG-OH 3.39Å; P302-Y308 WeakPolarHBondContact O-CE2 3.46Å; P302-Y308 VanDerWaalsContact O-CZ 3.24Å; P302-Y308 PolarHBondContact O-OH 3.37Å
303	P	71.1	Confident	76.7	Confident	99 Å²	99	59.9 Å²	59.9	64%	0.643	33%	0.327	S	S	*	.			trans	-76.3	114.2	177.5	28.1	-31.5	0	0	0	109.9	F301	F301-P303 HydrophobicContact CE1-CG 4.35Å
304	S	64.1	Low	77.1	Confident	31 Å²	31	59 Å²	59	22%	0.217	32%	0.323	C	S	.	.			trans	-160.7	110	167.2	173.2	0	0	0	0	108.8	P302 D306 N307 Y308	P302-S304 PolarHBondContact O-N 3.43Å; S304-D306 PolarHBondContact O-N 3.19Å; S304-D306 PolarHBondContact OG-N 3.36Å; S304-N307 WeakPolarHBondContact CB-ND2 2.96Å; S304-N307 PolarHBondContact O-N 3.46Å; S304-N307 PolarHBondContact OG-N 2.89Å; S304-N307 PolarHBondContact OG-ND2 3.02Å; S304-N307 PolarHBondContact OG-OD1 2.96Å; S304-Y308 WeakPolarHBondContact O-CD2 3.3Å; S304-Y308 WeakPolarHBondContact O-CE2 3.49Å
305	I	56.2	Low	77.5	Confident	146 Å²	146	56.3 Å²	56.3	75%	0.749	31%	0.311	S	S	*	.	H	α-helix	trans	-62.4	-32.7	175.6	-113.7	158.4	0	0	0	110.7	N307	I305-N307 VanDerWaalsContact C-N 3.26Å; I305-N307 PolarHBondContact O-N 3.16Å
306	D	58.8	Low	77.8	Confident	149 Å²	149	55.6 Å²	55.6	80%	0.797	31%	0.305	S	S	*	.	H	α-helix	trans	-71	-21.8	-177.7	-58.8	-32	0	0	0	112.6	S304	S304-D306 PolarHBondContact O-N 3.19Å; S304-D306 PolarHBondContact OG-N 3.36Å
307	N	55.3	Low	78.2	Confident	94 Å²	94	55 Å²	55	50%	0.503	30%	0.303	S	S	.	.	H	α-helix	trans	-87.7	-22.6	-173.2	-72.5	-1.4	0	0	0	114.4	S304 I305	S304-N307 WeakPolarHBondContact CB-ND2 2.96Å; S304-N307 PolarHBondContact O-N 3.46Å; S304-N307 PolarHBondContact OG-N 2.89Å; S304-N307 PolarHBondContact OG-ND2 3.02Å; S304-N307 PolarHBondContact OG-OD1 2.96Å; I305-N307 VanDerWaalsContact C-N 3.26Å; I305-N307 PolarHBondContact O-N 3.16Å
308	Y	66.7	Low	78.3	Confident	18 Å²	18	53 Å²	53	7%	0.071	29%	0.29	C	S	.	.	H	α-helix	trans	-102.3	-10.5	-167.2	-57.8	-45.8	0	0	0	114.1	I300 P302 S304 F312 H346 L374 I377	I300-Y308 HydrophobicContact CG2-CD2 4.26Å; I300-Y308 HydrophobicContact CG2-CE2 3.81Å; P302-Y308 VanDerWaalsContact CD-OH 3.24Å; P302-Y308 WeakPolarHBondContact CD-OH 3.38Å; P302-Y308 VanDerWaalsContact CG-OH 3.3Å; P302-Y308 WeakPolarHBondContact CG-OH 3.39Å; P302-Y308 WeakPolarHBondContact O-CE2 3.46Å; P302-Y308 VanDerWaalsContact O-CZ 3.24Å; P302-Y308 PolarHBondContact O-OH 3.37Å; S304-Y308 WeakPolarHBondContact O-CD2 3.3Å; S304-Y308 WeakPolarHBondContact O-CE2 3.49Å; Y308-F312 WeakPolarHBondContact O-CZ 3.24Å; Y308-H346 AromaticContact CD1-CD2 3.72Å; Y308-H346 AromaticContact CD1-NE2 3.83Å; Y308-L374 HydrophobicContact CD1-CD1 3.79Å; Y308-L374 HydrophobicContact CE1-CD1 3.16Å; Y308-L374 HydrophobicContact CE2-CD1 4.41Å; Y308-I377 HydrophobicContact CE1-CD1 4.37Å
309	G	63.8	Low	78.2	Confident	27 Å²	27	55.5 Å²	55.5	28%	0.278	30%	0.299	S	S	.	.			trans	71.3	165.9	-176.5	0	0	0	0	0	112.4	F312	G309-F312 WeakPolarHBondContact O-CE2 3.33Å
310	D	64.4	Low	78	Confident	119 Å²	119	50.9 Å²	50.9	64%	0.636	28%	0.278	S	S	*	.	S	Bend	trans	-103.6	156.1	171	-47	-26.6	0	0	0	106.1
311	E	79.6	Confident	77.5	Confident	87 Å²	87	52.4 Å²	52.4	41%	0.407	29%	0.286	S	S	.	.			trans	87	44.2	-178.8	-43.6	-178.1	170.4	0	0	116.5	E274 K341	E274-E311 PolarHBondContact O-N 3.26Å; E311-K341 HydrophobicContact CB-CD 3.91Å; E311-K341 HydrophobicContact CB-CG 4.28Å; E311-K341 WeakPolarHBondContact O-CG 3.3Å; E311-K341 PolarHBondContact O-N 3.37Å
312	F	87.2	Confident	76.6	Confident	3 Å²	3	51.6 Å²	51.6	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	141.3	163	-74.5	-86.3	0	0	0	111.4	L272 E274 Y308 G309 L338 H346	L272-F312 HydrophobicContact CD1-CB 3.98Å; L272-F312 HydrophobicContact CD1-CD1 4.49Å; L272-F312 HydrophobicContact CD1-CG 4.3Å; L272-F312 HydrophobicContact CD2-CB 4.06Å; L272-F312 HydrophobicContact CG-CB 4.19Å; E274-F312 PolarHBondContact O-N 2.92Å; Y308-F312 WeakPolarHBondContact O-CZ 3.24Å; G309-F312 WeakPolarHBondContact O-CE2 3.33Å; F312-L338 HydrophobicContact CD1-CB 3.81Å; F312-L338 HydrophobicContact CE1-CB 3.64Å; F312-L338 HydrophobicContact CE1-CD1 4.25Å; F312-H346 AromaticContact CE1-CE1 3.89Å; F312-H346 AromaticContact CE1-ND1 3.62Å; F312-H346 AromaticContact CZ-CE1 3.98Å
313	C	88.9	Confident	75.2	Confident	25 Å²	25	51.4 Å²	51.4	17%	0.169	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	-19.4	-176.8	69.6	0	0	0	0	115.4	A339 K341	C313-A339 PolarHBondContact N-O 2.95Å; C313-K341 HydrophobicContact CB-CG 3.72Å
314	A	91.4	Very high	73.9	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.4	179.5	0	0	0	0	0	113.1	D245 L272 A339 L416 L418	D245-A314 VanDerWaalsContact OD2-CA 3.27Å; D245-A314 WeakPolarHBondContact OD2-CA 3.37Å; L272-A314 VanDerWaalsContact CD2-C 3.45Å; L272-A314 VanDerWaalsContact CD2-O 3.31Å; L272-A314 WeakPolarHBondContact CD2-O 3.35Å; A314-A339 HydrophobicContact CB-CB 4.24Å; A314-A339 PolarHBondContact N-O 3.06Å; A314-A339 PolarHBondContact O-N 3.24Å; A314-L416 HydrophobicContact CB-CD2 4.13Å; A314-L418 HydrophobicContact CB-CD1 4.04Å; A314-L418 HydrophobicContact CB-CG 4.02Å
315	I	94	Very high	72.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.1	176.8	-168.1	162.7	0	0	0	110.3	D245 F246 D247 F270 L272 V278 L336 V337 L338	D245-I315 HydrophobicContact CB-CB 4.37Å; D245-I315 HydrophobicContact CB-CG2 3.67Å; D245-I315 PolarHBondContact OD2-N 2.85Å; F246-I315 VanDerWaalsContact C-CG2 3.49Å; D247-I315 HydrophobicContact CB-CG2 4.33Å; F270-I315 HydrophobicContact CB-CD1 3.91Å; L272-I315 HydrophobicContact CB-CB 4Å; L272-I315 HydrophobicContact CB-CD1 3.97Å; L272-I315 HydrophobicContact CB-CG2 4.16Å; L272-I315 HydrophobicContact CD2-CB 3.85Å; V278-I315 HydrophobicContact CG1-CD1 4.04Å; V278-I315 HydrophobicContact CG2-CD1 4.45Å; I315-L336 HydrophobicContact CD1-CD2 3.46Å; I315-L336 VanDerWaalsContact CD1-CD2 3.46Å; I315-L336 HydrophobicContact CG1-CD2 3.42Å; I315-L336 VanDerWaalsContact CG1-CD2 3.42Å; I315-V337 CarbonylContact C-O 3.46Å; I315-V337 WeakPolarHBondContact CA-O 2.98Å; I315-L338 HydrophobicContact CB-CD2 4.42Å; I315-L338 HydrophobicContact CD1-CD2 3.71Å; I315-L338 HydrophobicContact CG1-CD2 3.74Å
316	H	92.8	Very high	71.8	Confident	7 Å²	7	55.4 Å²	55.4	3%	0.032	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	135.6	170.2	-175	44.1	0	0	0	111.3	D247 V337 L418	D247-H316 WeakPolarHBondContact OD2-CA 3.39Å; D247-H316 IonicContact OD2-CE1 3.71Å; D247-H316 IonicContact OD2-CG 2.85Å; D247-H316 IonicContact OD2-ND1 2.61Å; D247-H316 PolarHBondContact OD2-ND1 2.97Å; H316-V337 HydrophobicContact CB-CB 4.26Å; H316-V337 PolarHBondContact N-O 2.86Å; H316-V337 PolarHBondContact O-N 3Å; H316-L418 HydrophobicContact CB-CB 3.83Å; H316-L418 HydrophobicContact CB-CD1 3.88Å
317	C	93.5	Very high	70.7	Confident	6 Å²	6	57.1 Å²	57.1	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.7	176.6	-172.3	0	0	0	0	110.7	D247 F248 F270 I335 L336	D247-C317 HydrophobicContact CB-CB 3.99Å; D247-C317 PolarHBondContact OD2-N 2.93Å; F248-C317 WeakPolarHBondContact O-CB 3.39Å; F248-C317 PolarHBondContact O-SG 3.35Å; F270-C317 HydrophobicContact CD2-CB 4.38Å; C317-I335 CarbonylContact C-O 3.52Å; C317-I335 WeakPolarHBondContact CA-O 3.47Å; C317-L336 HydrophobicContact CB-CD2 4.47Å
318	I	90.7	Very high	69.9	Low	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116.2	170.8	-55	170.2	0	0	0	107.9	I335 Y451 Y456 L469 I472	I318-I335 HydrophobicContact CB-CB 4.17Å; I318-I335 PolarHBondContact N-O 3.42Å; I318-I335 PolarHBondContact O-N 3.21Å; I318-Y451 HydrophobicContact CG2-CD1 4.15Å; I318-Y456 HydrophobicContact CD1-CD1 4.21Å; I318-L469 HydrophobicContact CD1-CD1 3.43Å; I318-L469 VanDerWaalsContact CD1-CD1 3.43Å; I318-I472 HydrophobicContact CD1-CD1 4.34Å
319	R	86.5	Confident	68.9	Low	59 Å²	59	61.7 Å²	61.7	22%	0.223	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-97	148.7	-174.2	-66.5	-177.9	-66.8	110.5	4.2	111.9	F248 S452	F248-R319 VanDerWaalsContact O-CD 3.29Å; F248-R319 WeakPolarHBondContact O-CD 3.49Å; R319-S452 PolarHBondContact O-N 2.9Å; R319-S452 VanDerWaalsContact O-N 3.11Å; R319-S452 PolarHBondContact O-OG 2.97Å
320	P	81.5	Confident	68.6	Low	2 Å²	2	67.8 Å²	67.8	1%	0.013	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-63.9	143.8	164.2	-3.6	15.7	0	0	0	110.4	S250 D322 K331 P332 D334 Y451	S250-P320 WeakPolarHBondContact OG-CD 3.28Å; P320-D322 PolarHBondContact O-N 2.68Å; P320-K331 HydrophobicContact CB-CG 4.43Å; P320-K331 HydrophobicContact CG-CG 4.3Å; P320-P332 HydrophobicContact CB-CB 4.01Å; P320-P332 HydrophobicContact CB-CG 3.85Å; P320-P332 HydrophobicContact CG-CB 3.92Å; P320-P332 HydrophobicContact CG-CG 4.26Å; P320-P332 WeakPolarHBondContact CG-O 3.33Å; P320-D334 VanDerWaalsContact CD-OD1 3.28Å; P320-D334 WeakPolarHBondContact CD-OD1 3.2Å; P320-Y451 HydrophobicContact CG-CE1 4.24Å
321	I	76	Confident	68.7	Low	64 Å²	64	65.6 Å²	65.6	33%	0.328	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-70.5	128.1	173.1	-61.2	173.5	0	0	0	108.4	S323 K450 Y451	I321-S323 PolarHBondContact O-N 2.73Å; I321-K450 WeakPolarHBondContact CB-O 3.48Å; I321-K450 HydrophobicContact CD1-CB 3.99Å; I321-K450 PolarHBondContact N-O 3.3Å; I321-Y451 WeakPolarHBondContact CD1-O 3.47Å
322	D	63.1	Low	68.7	Low	70 Å²	70	62 Å²	62	37%	0.374	32%	0.317	S	S	.	.			trans	-70.8	91.2	173.2	-73	-17.7	0	0	0	108.8	K157 P320 S324 K331	K157-D322 WeakPolarHBondContact CE-OD2 3.35Å; K157-D322 IonicContact NZ-OD2 2.73Å; K157-D322 PolarHBondContact NZ-OD2 2.74Å; P320-D322 PolarHBondContact O-N 2.68Å; D322-S324 PolarHBondContact O-N 3.23Å; D322-K331 WeakPolarHBondContact OD1-CE 3.33Å; D322-K331 IonicContact OD1-NZ 3.39Å; D322-K331 PolarHBondContact OD1-NZ 3.2Å
323	S	53.7	Low	68.7	Low	72 Å²	72	63 Å²	63	50%	0.503	32%	0.324	S	S	.	.			trans	-76	113.5	168.5	56.6	0	0	0	0	108.6	I321 E325	I321-S323 PolarHBondContact O-N 2.73Å; S323-E325 PolarHBondContact O-N 3.03Å
324	S	44.9	Very low	68.7	Low	121 Å²	121	62.1 Å²	62.1	85%	0.846	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	1.4	-171.5	54.3	0	0	0	0	115.5	D322	D322-S324 PolarHBondContact O-N 3.23Å
325	E	37.2	Very low	68.8	Low	167 Å²	167	62 Å²	62	78%	0.78	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	4.6	-168.2	-66.7	-165.6	163.2	0	0	115.9	S323 F327	S323-E325 PolarHBondContact O-N 3.03Å; E325-F327 PolarHBondContact O-N 3.47Å
326	M	37.3	Very low	68.9	Low	73 Å²	73	62 Å²	62	36%	0.36	32%	0.317	S	S	.	.			trans	-93.8	107.9	-178	-123	154.1	83.9	0	0	112.1	S328 F447 L449	M326-S328 PolarHBondContact O-N 3.27Å; M326-F447 HydrophobicContact SD-CD1 3.69Å; M326-F447 HydrophobicContact SD-CE1 4.07Å; M326-L449 HydrophobicContact CE-CD2 4.2Å; M326-L449 HydrophobicContact CE-CG 4.49Å
327	F	36.5	Very low	69	Low	184 Å²	184	61.7 Å²	61.7	81%	0.807	32%	0.315	S	S	*	.			trans	-60.9	15.7	167.6	-73.9	-86.9	0	0	0	114.1	E325	E325-F327 PolarHBondContact O-N 3.47Å
328	S	38.5	Very low	69	Low	50 Å²	50	61.5 Å²	61.5	35%	0.35	31%	0.314	S	S	.	.			trans	-78.1	127.3	-178.6	52.6	0	0	0	0	111	M326	M326-S328 PolarHBondContact O-N 3.27Å
329	F	46.2	Very low	69	Low	158 Å²	158	61.5 Å²	61.5	69%	0.693	31%	0.314	S	S	*	.	S	Bend	trans	-61.8	131.7	168	-67.4	-97.8	0	0	0	108	N483	F329-N483 PolarHBondContact O-ND2 3.13Å; F329-N483 PolarHBondContact O-OD1 2.89Å
330	E	57.6	Low	69	Low	155 Å²	155	58.8 Å²	58.8	72%	0.724	30%	0.304	S	S	*	.	S	Bend	trans	67.8	108.7	-178.3	-65	-175.5	156	0	0	117.4
331	K	66.7	Low	69.1	Low	74 Å²	74	61 Å²	61	32%	0.322	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-65.8	146.7	168.1	-170.5	-178.3	-175.2	-166.9	0	109.1	S250 P320 D322	S250-K331 PolarHBondContact OG-NZ 2.92Å; P320-K331 HydrophobicContact CB-CG 4.43Å; P320-K331 HydrophobicContact CG-CG 4.3Å; D322-K331 WeakPolarHBondContact OD1-CE 3.33Å; D322-K331 IonicContact OD1-NZ 3.39Å; D322-K331 PolarHBondContact OD1-NZ 3.2Å
332	P	77.8	Confident	69.3	Low	10 Å²	10	61.2 Å²	61.2	7%	0.065	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-56.5	151.3	175	-16.1	25.4	0	0	0	111	P320 L449 Y451	P320-P332 HydrophobicContact CB-CB 4.01Å; P320-P332 HydrophobicContact CB-CG 3.85Å; P320-P332 HydrophobicContact CG-CB 3.92Å; P320-P332 HydrophobicContact CG-CG 4.26Å; P320-P332 WeakPolarHBondContact CG-O 3.33Å; P332-L449 HydrophobicContact CG-CB 3.75Å; P332-L449 HydrophobicContact CG-CD1 3.99Å; P332-L449 HydrophobicContact CG-CD2 3.45Å; P332-L449 VanDerWaalsContact CG-CD2 3.45Å; P332-L449 HydrophobicContact CG-CG 3.88Å; P332-Y451 HydrophobicContact CB-CE2 4.47Å
333	P	87.2	Confident	70.3	Confident	24 Å²	24	57.9 Å²	57.9	16%	0.156	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-66.6	155.7	177.9	28.8	-34.7	0	0	0	111.5	I349 V350 L351 Y451 L475	P333-I349 HydrophobicContact CB-CG2 3.44Å; P333-I349 VanDerWaalsContact CB-CG2 3.44Å; P333-I349 HydrophobicContact CG-CG2 3.29Å; P333-V350 WeakPolarHBondContact CB-O 3.44Å; P333-L351 HydrophobicContact CB-CD2 4.17Å; P333-L351 HydrophobicContact CG-CD2 4.37Å; P333-Y451 WeakPolarHBondContact O-CE1 3.47Å; P333-Y451 PolarHBondContact O-OH 2.91Å; P333-Y451 VanDerWaalsContact O-OH 3.13Å; P333-L475 HydrophobicContact CG-CD2 4.47Å
334	D	90.8	Very high	71.9	Confident	7 Å²	7	58.9 Å²	58.9	4%	0.037	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-72.9	146.5	168.7	-67.8	-38.3	0	0	0	109.6	S250 F270 P320 V350	S250-D334 WeakPolarHBondContact CB-OD1 3.22Å; S250-D334 WeakPolarHBondContact CB-OD2 3.4Å; S250-D334 PolarHBondContact N-OD1 3.33Å; S250-D334 PolarHBondContact N-OD2 2.88Å; S250-D334 PolarHBondContact OG-OD1 3.48Å; F270-D334 HydrophobicContact CE2-CB 4.4Å; P320-D334 VanDerWaalsContact CD-OD1 3.28Å; P320-D334 WeakPolarHBondContact CD-OD1 3.2Å; D334-V350 HydrophobicContact CB-CB 4.29Å; D334-V350 HydrophobicContact CB-CG2 4.18Å; D334-V350 PolarHBondContact O-N 3.15Å
335	I	93.3	Very high	74.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.1	172.1	-62.7	166.5	0	0	0	107.6	C317 I318 G348 Y451 L469 W471 I472 L475	C317-I335 CarbonylContact C-O 3.52Å; C317-I335 WeakPolarHBondContact CA-O 3.47Å; I318-I335 HydrophobicContact CB-CB 4.17Å; I318-I335 PolarHBondContact N-O 3.42Å; I318-I335 PolarHBondContact O-N 3.21Å; I335-G348 CarbonylContact C-O 3.58Å; I335-G348 WeakPolarHBondContact CA-O 3.46Å; I335-Y451 HydrophobicContact CD1-CD1 3.98Å; I335-Y451 HydrophobicContact CD1-CE1 3.63Å; I335-Y451 HydrophobicContact CD1-CE2 4.47Å; I335-Y451 HydrophobicContact CG1-CE1 3.95Å; I335-L469 HydrophobicContact CG2-CD1 4.37Å; I335-W471 HydrophobicContact CD1-CH2 3.95Å; I335-W471 HydrophobicContact CD1-CZ3 3.89Å; I335-W471 HydrophobicContact CG1-CH2 4.19Å; I335-W471 HydrophobicContact CG1-CZ3 4.32Å; I335-W471 HydrophobicContact CG2-CH2 3.85Å; I335-I472 HydrophobicContact CD1-CD1 3.46Å; I335-I472 VanDerWaalsContact CD1-CD1 3.46Å; I335-I472 HydrophobicContact CD1-CG1 3.52Å; I335-L475 HydrophobicContact CD1-CD2 4.11Å; I335-L475 HydrophobicContact CG1-CD2 4.28Å
336	L	94.9	Very high	76.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.8	179.7	-101	165.7	0	0	0	109.9	F270 L298 I315 C317 L338 G348 V350 L372	F270-L336 HydrophobicContact CB-CD1 4.45Å; F270-L336 HydrophobicContact CB-CD2 4.3Å; F270-L336 HydrophobicContact CD1-CD1 3.77Å; F270-L336 HydrophobicContact CD2-CD1 3.92Å; F270-L336 HydrophobicContact CD2-CD2 4.23Å; F270-L336 HydrophobicContact CD2-CG 4.25Å; F270-L336 HydrophobicContact CE1-CD1 3.87Å; F270-L336 HydrophobicContact CE2-CD1 4Å; F270-L336 HydrophobicContact CE2-CG 4.42Å; F270-L336 HydrophobicContact CG-CD1 3.79Å; F270-L336 HydrophobicContact CG-CD2 4.3Å; F270-L336 HydrophobicContact CG-CG 4.46Å; F270-L336 HydrophobicContact CZ-CD1 3.99Å; L298-L336 HydrophobicContact CD2-CD1 3.75Å; I315-L336 HydrophobicContact CD1-CD2 3.46Å; I315-L336 VanDerWaalsContact CD1-CD2 3.46Å; I315-L336 HydrophobicContact CG1-CD2 3.42Å; I315-L336 VanDerWaalsContact CG1-CD2 3.42Å; C317-L336 HydrophobicContact CB-CD2 4.47Å; L336-L338 HydrophobicContact CD2-CD2 4.42Å; L336-G348 PolarHBondContact N-O 2.99Å; L336-G348 PolarHBondContact O-N 3.37Å; L336-V350 HydrophobicContact CB-CG2 4.11Å; L336-V350 HydrophobicContact CD1-CG2 3.31Å; L336-V350 HydrophobicContact CG-CG2 3.89Å; L336-L372 HydrophobicContact CB-CD1 3.75Å; L336-L372 HydrophobicContact CB-CD2 4.43Å; L336-L372 HydrophobicContact CD1-CD1 4.49Å
337	V	94.4	Very high	79.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.3	175.3	-177.8	0	0	0	0	107.4	I315 H316 H346 L418 Y456	I315-V337 CarbonylContact C-O 3.46Å; I315-V337 WeakPolarHBondContact CA-O 2.98Å; H316-V337 HydrophobicContact CB-CB 4.26Å; H316-V337 PolarHBondContact N-O 2.86Å; H316-V337 PolarHBondContact O-N 3Å; V337-H346 WeakPolarHBondContact CA-O 3.11Å; V337-L418 HydrophobicContact CB-CD1 4.4Å; V337-L418 HydrophobicContact CG1-CD1 3.92Å; V337-Y456 HydrophobicContact CB-CE1 4.34Å; V337-Y456 HydrophobicContact CG1-CE1 3.94Å; V337-Y456 HydrophobicContact CG1-CE2 3.89Å; V337-Y456 VanDerWaalsContact CG1-CZ 3.48Å; V337-Y456 WeakPolarHBondContact CG1-OH 3.49Å; V337-Y456 HydrophobicContact CG2-CD1 3.99Å; V337-Y456 HydrophobicContact CG2-CE1 3.51Å
338	L	93.5	Very high	82.1	Confident	1 Å²	1	33 Å²	33	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.9	174.6	-47	-178.3	0	0	0	109.3	L272 V278 I300 F312 I315 L336 L345 H346 L372	L272-L338 HydrophobicContact CD1-CD2 4.24Å; V278-L338 HydrophobicContact CG2-CD1 3.98Å; V278-L338 HydrophobicContact CG2-CD2 3.9Å; I300-L338 HydrophobicContact CD1-CD1 4.18Å; F312-L338 HydrophobicContact CD1-CB 3.81Å; F312-L338 HydrophobicContact CE1-CB 3.64Å; F312-L338 HydrophobicContact CE1-CD1 4.25Å; I315-L338 HydrophobicContact CB-CD2 4.42Å; I315-L338 HydrophobicContact CD1-CD2 3.71Å; I315-L338 HydrophobicContact CG1-CD2 3.74Å; L336-L338 HydrophobicContact CD2-CD2 4.42Å; L338-L345 CarbonylContact O-C 3.58Å; L338-L345 WeakPolarHBondContact O-CA 3.25Å; L338-H346 HydrophobicContact CB-CB 4.22Å; L338-H346 PolarHBondContact N-O 3.41Å; L338-H346 PolarHBondContact O-N 3.37Å; L338-H346 PolarHBondContact O-ND1 3.1Å; L338-L372 HydrophobicContact CD1-CD2 3.74Å; L338-L372 HydrophobicContact CG-CD2 4.21Å
339	A	91.4	Very high	84.7	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	138.4	177.7	0	0	0	0	0	111.6	C313 A314 R344 L345 L416 L418	C313-A339 PolarHBondContact N-O 2.95Å; A314-A339 HydrophobicContact CB-CB 4.24Å; A314-A339 PolarHBondContact N-O 3.06Å; A314-A339 PolarHBondContact O-N 3.24Å; A339-R344 VanDerWaalsContact CA-O 3.31Å; A339-R344 WeakPolarHBondContact CA-O 3.09Å; A339-L345 HydrophobicContact CB-CD2 3.55Å; A339-L416 HydrophobicContact CB-CD2 3.6Å; A339-L418 HydrophobicContact CB-CD1 4Å; A339-L418 HydrophobicContact CB-CD2 4.34Å; A339-L418 HydrophobicContact CB-CG 4.39Å
340	D	87.8	Confident	86.8	Confident	2 Å²	2	24 Å²	24	1%	0.011	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	169.7	170	75.9	16.1	0	0	0	112.1	I342 G343 R344	D340-I342 PolarHBondContact O-N 2.83Å; D340-I342 WeakPolarHBondContact OD1-CA 3.23Å; D340-I342 PolarHBondContact OD1-N 3.19Å; D340-G343 PolarHBondContact O-N 3.04Å; D340-G343 PolarHBondContact OD1-N 2.97Å; D340-R344 PolarHBondContact N-O 3.26Å; D340-R344 PolarHBondContact OD1-N 3.26Å; D340-R344 VanDerWaalsContact OD2-CB 3.3Å; D340-R344 WeakPolarHBondContact OD2-CB 3.42Å
341	K	82.6	Confident	88.3	Confident	49 Å²	49	20.3 Å²	20.3	21%	0.213	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.9	178.4	-67.6	177.8	-163.5	165.3	0	113.9	E274 E311 C313	E274-K341 IonicContact OE1-NZ 3.47Å; E311-K341 HydrophobicContact CB-CD 3.91Å; E311-K341 HydrophobicContact CB-CG 4.28Å; E311-K341 WeakPolarHBondContact O-CG 3.3Å; E311-K341 PolarHBondContact O-N 3.37Å; C313-K341 HydrophobicContact CB-CG 3.72Å
342	I	80.1	Confident	88.8	Confident	68 Å²	68	21.2 Å²	21.2	35%	0.349	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-16.6	-176.5	-48.4	174.7	0	0	0	110.7	D340 L382	D340-I342 PolarHBondContact O-N 2.83Å; D340-I342 WeakPolarHBondContact OD1-CA 3.23Å; D340-I342 PolarHBondContact OD1-N 3.19Å; I342-L382 WeakPolarHBondContact O-CB 3.15Å
343	G	83.5	Confident	88.1	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	103.7	17	178.6	0	0	0	0	0	114.1	D340 L380	D340-G343 PolarHBondContact O-N 3.04Å; D340-G343 PolarHBondContact OD1-N 2.97Å; G343-L380 WeakPolarHBondContact O-CB 3.39Å; G343-L380 WeakPolarHBondContact O-CG 3.2Å; G343-L380 PolarHBondContact O-N 3.21Å
344	R	88.7	Confident	86.4	Confident	93 Å²	93	27.4 Å²	27.4	35%	0.351	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	136	169	-61.1	177.3	177.9	170.8	4.1	110.9	A339 D340 V378 D379	A339-R344 VanDerWaalsContact CA-O 3.31Å; A339-R344 WeakPolarHBondContact CA-O 3.09Å; D340-R344 PolarHBondContact N-O 3.26Å; D340-R344 PolarHBondContact OD1-N 3.26Å; D340-R344 VanDerWaalsContact OD2-CB 3.3Å; D340-R344 WeakPolarHBondContact OD2-CB 3.42Å; R344-V378 CarbonylContact C-O 3.56Å; R344-V378 WeakPolarHBondContact CA-O 3.44Å; R344-D379 HydrophobicContact CG-CB 4.19Å; R344-D379 VanDerWaalsContact CG-OD2 3.31Å; R344-D379 WeakPolarHBondContact CG-OD2 3.45Å; R344-D379 IonicContact CZ-OD2 3.99Å; R344-D379 IonicContact NE-OD2 3.12Å; R344-D379 PolarHBondContact NE-OD2 2.98Å; R344-D379 IonicContact NH2-OD2 3.24Å
345	L	91.8	Very high	84.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	113.5	-175.2	-45.5	165.2	0	0	0	108.3	L338 A339 I377 V378 L380 L418 Y456 V458 V467	L338-L345 CarbonylContact O-C 3.58Å; L338-L345 WeakPolarHBondContact O-CA 3.25Å; A339-L345 HydrophobicContact CB-CD2 3.55Å; L345-I377 WeakPolarHBondContact O-CA 3.5Å; L345-V378 HydrophobicContact CB-CB 4.19Å; L345-V378 HydrophobicContact CD1-CB 4.22Å; L345-V378 HydrophobicContact CD1-CG1 3.94Å; L345-V378 PolarHBondContact N-O 3Å; L345-V378 PolarHBondContact O-N 2.7Å; L345-L380 HydrophobicContact CD1-CD1 4.09Å; L345-L380 HydrophobicContact CD1-CD2 4.35Å; L345-L380 HydrophobicContact CD1-CG 4.1Å; L345-L418 HydrophobicContact CD2-CD2 4.19Å; L345-Y456 HydrophobicContact CD1-CE2 4.13Å; L345-V458 HydrophobicContact CD1-CG2 3.65Å; L345-V458 HydrophobicContact CD2-CG1 4.41Å; L345-V458 HydrophobicContact CD2-CG2 4.11Å; L345-V467 HydrophobicContact CD1-CG2 3.69Å
346	H	92.1	Very high	81.3	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.009	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	108.3	-179.5	-54.4	82.6	0	0	0	108.4	Y308 F312 V337 L338 L374	Y308-H346 AromaticContact CD1-CD2 3.72Å; Y308-H346 AromaticContact CD1-NE2 3.83Å; F312-H346 AromaticContact CE1-CE1 3.89Å; F312-H346 AromaticContact CE1-ND1 3.62Å; F312-H346 AromaticContact CZ-CE1 3.98Å; V337-H346 WeakPolarHBondContact CA-O 3.11Å; L338-H346 HydrophobicContact CB-CB 4.22Å; L338-H346 PolarHBondContact N-O 3.41Å; L338-H346 PolarHBondContact O-N 3.37Å; L338-H346 PolarHBondContact O-ND1 3.1Å; H346-L374 HydrophobicContact CB-CD1 4.46Å; H346-L374 HydrophobicContact CB-CD2 4Å
347	N	93.2	Very high	78.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	121.5	179.4	-56.5	-66.9	0	0	0	109.3	I375 D376 Y456 L469 W471	N347-I375 PolarHBondContact O-N 3.44Å; N347-D376 PolarHBondContact N-O 2.87Å; N347-D376 PolarHBondContact O-N 3.45Å; N347-Y456 WeakPolarHBondContact OD1-CE1 3.46Å; N347-Y456 PolarHBondContact OD1-OH 2.99Å; N347-L469 HydrophobicContact CB-CD2 4.4Å; N347-W471 HydrophobicContact CB-CZ2 4.15Å
348	G	92.4	Very high	76	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	164	-177.4	0	0	0	0	0	114.3	I335 L336 C373	I335-G348 CarbonylContact C-O 3.58Å; I335-G348 WeakPolarHBondContact CA-O 3.46Å; L336-G348 PolarHBondContact N-O 2.99Å; L336-G348 PolarHBondContact O-N 3.37Å; G348-C373 CarbonylContact C-O 3.57Å; G348-C373 WeakPolarHBondContact CA-O 3.22Å
349	I	92.6	Very high	73	Confident	9 Å²	9	52.5 Å²	52.5	5%	0.046	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.4	-179.9	-58.5	172.6	0	0	0	108.9	P333 L351 C373 I375 W471 L475 W501	P333-I349 HydrophobicContact CB-CG2 3.44Å; P333-I349 VanDerWaalsContact CB-CG2 3.44Å; P333-I349 HydrophobicContact CG-CG2 3.29Å; I349-L351 HydrophobicContact CG2-CD2 3.81Å; I349-L351 HydrophobicContact CG2-CG 4.21Å; I349-L351 PolarHBondContact O-N 3.44Å; I349-C373 PolarHBondContact N-O 3.09Å; I349-C373 PolarHBondContact O-N 3.05Å; I349-I375 HydrophobicContact CD1-CD1 3.75Å; I349-I375 HydrophobicContact CD1-CG1 3.64Å; I349-I375 HydrophobicContact CG1-CD1 4.23Å; I349-I375 HydrophobicContact CG1-CG1 3.72Å; I349-W471 HydrophobicContact CD1-CZ3 4.12Å; I349-W471 HydrophobicContact CG1-CH2 4.34Å; I349-W471 HydrophobicContact CG1-CZ3 4.14Å; I349-L475 HydrophobicContact CD1-CD1 3.79Å; I349-L475 HydrophobicContact CD1-CD2 3.64Å; I349-L475 HydrophobicContact CD1-CG 4.32Å; I349-L475 HydrophobicContact CG1-CD2 4.1Å; I349-W501 HydrophobicContact CD1-CZ3 4Å
350	V	91.6	Very high	70.5	Confident	10 Å²	10	61.6 Å²	61.6	6%	0.061	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	108.8	176.8	-173.9	0	0	0	0	109.6	F270 L298 P333 D334 L336 V370 L371 L372	F270-V350 HydrophobicContact CE1-CG1 4.41Å; F270-V350 HydrophobicContact CZ-CG1 4.18Å; F270-V350 HydrophobicContact CZ-CG2 4.07Å; L298-V350 HydrophobicContact CD2-CG1 4.3Å; L298-V350 HydrophobicContact CD2-CG2 4.34Å; P333-V350 WeakPolarHBondContact CB-O 3.44Å; D334-V350 HydrophobicContact CB-CB 4.29Å; D334-V350 HydrophobicContact CB-CG2 4.18Å; D334-V350 PolarHBondContact O-N 3.15Å; L336-V350 HydrophobicContact CB-CG2 4.11Å; L336-V350 HydrophobicContact CD1-CG2 3.31Å; L336-V350 HydrophobicContact CG-CG2 3.89Å; V350-V370 HydrophobicContact CG1-CG1 3.57Å; V350-L371 CarbonylContact C-O 3.45Å; V350-L371 WeakPolarHBondContact CA-O 3.33Å; V350-L372 HydrophobicContact CG2-CD1 4.35Å
351	L	87.6	Confident	68.1	Low	77 Å²	77	67.4 Å²	67.4	40%	0.403	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	157.5	176.9	-60.2	-178.6	0	0	0	110.7	P333 I349 L371 C373	P333-L351 HydrophobicContact CB-CD2 4.17Å; P333-L351 HydrophobicContact CG-CD2 4.37Å; I349-L351 HydrophobicContact CG2-CD2 3.81Å; I349-L351 HydrophobicContact CG2-CG 4.21Å; I349-L351 PolarHBondContact O-N 3.44Å; L351-L371 PolarHBondContact N-O 2.9Å; L351-L371 PolarHBondContact O-N 3.39Å; L351-C373 HydrophobicContact CD1-CB 4.31Å
352	R	78.4	Confident	66.1	Low	94 Å²	94	75.1 Å²	75.1	36%	0.355	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.4	172.5	-62.4	-175.1	-167	151.3	9	108.3	L252 V370	L252-R352 PolarHBondContact O-NH1 3.47Å; R352-V370 HydrophobicContact CG-CG1 4.47Å; R352-V370 HydrophobicContact CG-CG2 4.44Å
353	A	62.3	Low	64	Low	28 Å²	28	79.5 Å²	79.5	23%	0.231	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.4	179.2	0	0	0	0	0	109.7	I355 S369 L371	A353-I355 VanDerWaalsContact C-N 3.31Å; A353-I355 HydrophobicContact CB-CG1 4.01Å; A353-I355 PolarHBondContact O-N 3.43Å; A353-S369 PolarHBondContact N-O 2.86Å; A353-S369 PolarHBondContact O-N 3.5Å; A353-L371 HydrophobicContact CB-CD1 3.6Å; A353-L371 HydrophobicContact CB-CG 4.27Å
354	N	52.2	Low	61.7	Low	136 Å²	136	86.5 Å²	86.5	73%	0.727	44%	0.444	S	S	*	.			trans	-78.5	89.1	155.9	-75.6	-27.8	0	0	0	106.5	P356 P368	N354-P356 VanDerWaalsContact O-CD 3.23Å; N354-P356 WeakPolarHBondContact O-CD 3.45Å; N354-P368 WeakPolarHBondContact OD1-CB 3.31Å
355	I	42.6	Very low	59.3	Low	89 Å²	89	90.2 Å²	90.2	46%	0.456	47%	0.47	S	S	.	.			trans	-66.1	116.4	-179	-55.4	173.8	0	0	0	108.2	A353 G357	A353-I355 VanDerWaalsContact C-N 3.31Å; A353-I355 HydrophobicContact CB-CG1 4.01Å; A353-I355 PolarHBondContact O-N 3.43Å; I355-G357 PolarHBondContact O-N 2.8Å
356	P	32.9	Very low	57.1	Low	133 Å²	133	93 Å²	93	86%	0.864	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	99.2	179.5	23.4	-20.2	0	0	0	109	N354	N354-P356 VanDerWaalsContact O-CD 3.23Å; N354-P356 WeakPolarHBondContact O-CD 3.45Å
357	G	38.6	Very low	55.2	Low	58 Å²	58	96.5 Å²	96.5	60%	0.598	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	166	-24.7	178.7	0	0	0	0	0	115.7	I355 N359	I355-G357 PolarHBondContact O-N 2.8Å; G357-N359 VanDerWaalsContact C-N 3.28Å; G357-N359 PolarHBondContact O-N 2.94Å
358	Q	40.2	Very low	53.7	Low	120 Å²	120	97.9 Å²	97.9	56%	0.561	52%	0.517	S	S	*	.			trans	-79.2	-6.4	178.4	-75.6	-165	-20	0	0	114.5	K360	Q358-K360 VanDerWaalsContact C-N 3.34Å; Q358-K360 PolarHBondContact O-N 3.46Å
359	N	30.7	Very low	52.8	Low	134 Å²	134	99 Å²	99	72%	0.717	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	74.6	175.3	-84.6	-26	0	0	0	111.8	G357	G357-N359 VanDerWaalsContact C-N 3.28Å; G357-N359 PolarHBondContact O-N 2.94Å
360	K	39.2	Very low	52.5	Low	191 Å²	191	98.7 Å²	98.7	83%	0.83	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	-16.1	159.3	-74.4	-172.1	-179.1	174.9	0	114.1	Q358	Q358-K360 VanDerWaalsContact C-N 3.34Å; Q358-K360 PolarHBondContact O-N 3.46Å
361	N	37	Very low	52.4	Low	125 Å²	125	99.4 Å²	99.4	67%	0.668	53%	0.527	S	S	*	.			trans	-112.6	106.6	176.2	-72.8	-17	0	0	0	111.1	N363	N361-N363 PolarHBondContact O-N 2.86Å
362	K	39.7	Very low	52.6	Low	210 Å²	210	95.7 Å²	95.7	91%	0.913	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	2	-175.7	-76.6	-178.4	175.3	176.5	0	116
363	N	36.2	Very low	53.1	Low	160 Å²	160	92.7 Å²	92.7	86%	0.856	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	4.4	-171.9	-70.5	-7.3	0	0	0	115.4	N361	N361-N363 PolarHBondContact O-N 2.86Å
364	Q	36.7	Very low	54.4	Low	147 Å²	147	92.6 Å²	92.6	69%	0.687	50%	0.496	S	S	*	.			trans	-124.1	116.7	170.9	-80.3	176.8	-1.8	0	0	109.4	T366	Q364-T366 PolarHBondContact O-N 2.82Å
365	I	38	Very low	56.2	Low	172 Å²	172	88.3 Å²	88.3	88%	0.882	47%	0.473	S	S	*	.			trans	-68.6	88.8	167.9	-60.9	167.6	0	0	0	105.7	T367	I365-T367 PolarHBondContact O-N 3.45Å
366	T	44.4	Very low	58.4	Low	58 Å²	58	85.4 Å²	85.4	36%	0.356	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-62.7	119.6	176.3	44.5	0	0	0	0	108.3	Q364	Q364-T366 PolarHBondContact O-N 2.82Å
367	T	53.8	Low	61.1	Low	75 Å²	75	82.9 Å²	82.9	46%	0.46	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-62.6	133.2	178.6	41.2	0	0	0	0	109.8	K294 I365 S369	K294-T367 HydrophobicContact CD-CG2 4.41Å; K294-T367 VanDerWaalsContact CE-CG2 3.46Å; I365-T367 PolarHBondContact O-N 3.45Å; T367-S369 PolarHBondContact O-N 2.75Å
368	P	61.5	Low	63.5	Low	29 Å²	29	80.6 Å²	80.6	19%	0.188	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-54.8	132.5	-178.1	15.5	-27.7	0	0	0	111.2	N354	N354-P368 WeakPolarHBondContact OD1-CB 3.31Å
369	S	72.8	Confident	65.8	Low	24 Å²	24	77.9 Å²	77.9	17%	0.168	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	136	173.7	-56.1	0	0	0	0	109.6	A353 T367	A353-S369 PolarHBondContact N-O 2.86Å; A353-S369 PolarHBondContact O-N 3.5Å; T367-S369 PolarHBondContact O-N 2.75Å
370	V	85.5	Confident	68.3	Low	2 Å²	2	72 Å²	72	1%	0.012	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.3	176.8	-169.3	0	0	0	0	107.3	N296 L298 H299 V350 R352	N296-V370 HydrophobicContact CB-CG2 3.95Å; L298-V370 WeakPolarHBondContact CA-O 3.12Å; L298-V370 HydrophobicContact CD1-CG1 4.33Å; L298-V370 HydrophobicContact CD2-CG1 4.41Å; L298-V370 HydrophobicContact CG-CB 4.31Å; L298-V370 HydrophobicContact CG-CG1 3.92Å; H299-V370 PolarHBondContact N-O 3Å; H299-V370 VanDerWaalsContact N-O 3.09Å; V350-V370 HydrophobicContact CG1-CG1 3.57Å; R352-V370 HydrophobicContact CG-CG1 4.47Å; R352-V370 HydrophobicContact CG-CG2 4.44Å
371	L	89.6	Confident	70	Confident	25 Å²	25	69.1 Å²	69.1	13%	0.131	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137.4	-174.3	-53.2	179.1	0	0	0	108.7	H299 F301 V350 L351 A353	H299-L371 HydrophobicContact CB-CD2 3.91Å; H299-L371 CarbonylContact O-C 3.57Å; H299-L371 WeakPolarHBondContact O-CA 3.33Å; F301-L371 HydrophobicContact CD2-CB 4.49Å; F301-L371 HydrophobicContact CD2-CD2 4.1Å; F301-L371 HydrophobicContact CE2-CD2 3.71Å; V350-L371 CarbonylContact C-O 3.45Å; V350-L371 WeakPolarHBondContact CA-O 3.33Å; L351-L371 PolarHBondContact N-O 2.9Å; L351-L371 PolarHBondContact O-N 3.39Å; A353-L371 HydrophobicContact CB-CD1 3.6Å; A353-L371 HydrophobicContact CB-CG 4.27Å
372	L	91.4	Very high	71.4	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	103.1	165.9	177.3	55.5	0	0	0	108.2	L298 H299 I300 F301 L336 L338 V350 L374	L298-L372 HydrophobicContact CB-CB 4.44Å; L298-L372 HydrophobicContact CD2-CB 4.11Å; H299-L372 PolarHBondContact O-N 3.39Å; I300-L372 CarbonylContact C-O 3.52Å; I300-L372 WeakPolarHBondContact CA-O 3.16Å; I300-L372 HydrophobicContact CG1-CB 4.37Å; I300-L372 HydrophobicContact CG1-CD2 4.27Å; F301-L372 PolarHBondContact N-O 3.04Å; L336-L372 HydrophobicContact CB-CD1 3.75Å; L336-L372 HydrophobicContact CB-CD2 4.43Å; L336-L372 HydrophobicContact CD1-CD1 4.49Å; L338-L372 HydrophobicContact CD1-CD2 3.74Å; L338-L372 HydrophobicContact CG-CD2 4.21Å; V350-L372 HydrophobicContact CG2-CD1 4.35Å; L372-L374 HydrophobicContact CD2-CD2 4.32Å; L372-L374 HydrophobicContact CG-CD2 4.13Å
373	C	90.5	Very high	72.4	Confident	31 Å²	31	61.8 Å²	61.8	21%	0.209	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	108.7	177.1	-66.9	0	0	0	0	109.4	G348 I349 L351 I375	G348-C373 CarbonylContact C-O 3.57Å; G348-C373 WeakPolarHBondContact CA-O 3.22Å; I349-C373 PolarHBondContact N-O 3.09Å; I349-C373 PolarHBondContact O-N 3.05Å; L351-C373 HydrophobicContact CD1-CB 4.31Å; C373-I375 PolarHBondContact O-N 2.96Å
374	L	90	Very high	72.6	Confident	25 Å²	25	58.9 Å²	58.9	13%	0.131	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	130.7	175.8	-58.9	-177.8	0	0	0	109.8	I300 F301 Y308 H346 L372	I300-L374 HydrophobicContact CG2-CD1 3.74Å; I300-L374 HydrophobicContact CG2-CD2 4.37Å; I300-L374 HydrophobicContact CG2-CG 3.88Å; F301-L374 WeakPolarHBondContact O-CB 3.21Å; F301-L374 PolarHBondContact O-N 3.25Å; Y308-L374 HydrophobicContact CD1-CD1 3.79Å; Y308-L374 HydrophobicContact CE1-CD1 3.16Å; Y308-L374 HydrophobicContact CE2-CD1 4.41Å; H346-L374 HydrophobicContact CB-CD1 4.46Å; H346-L374 HydrophobicContact CB-CD2 4Å; L372-L374 HydrophobicContact CD2-CD2 4.32Å; L372-L374 HydrophobicContact CG-CD2 4.13Å
375	I	89.3	Confident	72.3	Confident	47 Å²	47	56.9 Å²	56.9	24%	0.241	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-43.9	179.2	-60.6	-56.2	0	0	0	109.6	N347 I349 C373 W471 W501	N347-I375 PolarHBondContact O-N 3.44Å; I349-I375 HydrophobicContact CD1-CD1 3.75Å; I349-I375 HydrophobicContact CD1-CG1 3.64Å; I349-I375 HydrophobicContact CG1-CD1 4.23Å; I349-I375 HydrophobicContact CG1-CG1 3.72Å; C373-I375 PolarHBondContact O-N 2.96Å; I375-W471 HydrophobicContact CG2-CD2 4.26Å; I375-W501 HydrophobicContact CD1-CE3 4.49Å; I375-W501 HydrophobicContact CG2-CB 3.81Å; I375-W501 HydrophobicContact CG2-CE3 3.92Å
376	D	89.2	Confident	71.8	Confident	28 Å²	28	54.9 Å²	54.9	15%	0.15	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	148.8	-172.2	-176.2	33	0	0	0	111.3	N347 S503	N347-D376 PolarHBondContact N-O 2.87Å; N347-D376 PolarHBondContact O-N 3.45Å; D376-S503 WeakPolarHBondContact OD2-CA 3.43Å; D376-S503 WeakPolarHBondContact OD2-CB 3.41Å; D376-S503 PolarHBondContact OD2-N 3.1Å; D376-S503 PolarHBondContact OD2-OG 2.87Å
377	I	89.5	Confident	71.2	Confident	79 Å²	79	58.6 Å²	58.6	41%	0.405	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.2	176.5	-56.5	175.6	0	0	0	107.9	Y308 L345	Y308-I377 HydrophobicContact CE1-CD1 4.37Å; L345-I377 WeakPolarHBondContact O-CA 3.5Å
378	V	89.2	Confident	69.9	Low	11 Å²	11	61 Å²	61	7%	0.067	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.1	179.3	170.3	0	0	0	0	108.7	R344 L345 L380 V467 V505	R344-V378 CarbonylContact C-O 3.56Å; R344-V378 WeakPolarHBondContact CA-O 3.44Å; L345-V378 HydrophobicContact CB-CB 4.19Å; L345-V378 HydrophobicContact CD1-CB 4.22Å; L345-V378 HydrophobicContact CD1-CG1 3.94Å; L345-V378 PolarHBondContact N-O 3Å; L345-V378 PolarHBondContact O-N 2.7Å; V378-L380 HydrophobicContact CG1-CD2 4.29Å; V378-V467 HydrophobicContact CG2-CG1 4.43Å; V378-V505 HydrophobicContact CB-CG2 4.39Å; V378-V505 HydrophobicContact CG1-CG2 3.14Å; V378-V505 HydrophobicContact CG2-CG2 4.39Å
379	D	88.1	Confident	68.4	Low	63 Å²	63	65.6 Å²	65.6	34%	0.337	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.8	171.9	-156	-29.1	0	0	0	110	R344 D381	R344-D379 HydrophobicContact CG-CB 4.19Å; R344-D379 VanDerWaalsContact CG-OD2 3.31Å; R344-D379 WeakPolarHBondContact CG-OD2 3.45Å; R344-D379 IonicContact CZ-OD2 3.99Å; R344-D379 IonicContact NE-OD2 3.12Å; R344-D379 PolarHBondContact NE-OD2 2.98Å; R344-D379 IonicContact NH2-OD2 3.24Å; D379-D381 PolarHBondContact OD1-N 3.29Å
380	L	82.6	Confident	66.2	Low	10 Å²	10	69.7 Å²	69.7	5%	0.052	41%	0.41	C	S	.	.			trans	-94.4	-5	176.9	-63.8	-178	0	0	0	113.3	G343 L345 V378 L382 V458 H465 V505	G343-L380 WeakPolarHBondContact O-CB 3.39Å; G343-L380 WeakPolarHBondContact O-CG 3.2Å; G343-L380 PolarHBondContact O-N 3.21Å; L345-L380 HydrophobicContact CD1-CD1 4.09Å; L345-L380 HydrophobicContact CD1-CD2 4.35Å; L345-L380 HydrophobicContact CD1-CG 4.1Å; V378-L380 HydrophobicContact CG1-CD2 4.29Å; L380-L382 VanDerWaalsContact C-N 3.3Å; L380-L382 HydrophobicContact CB-CD1 4.38Å; L380-L382 HydrophobicContact CB-CD2 3.96Å; L380-L382 HydrophobicContact CB-CG 3.82Å; L380-L382 HydrophobicContact CD1-CD1 4.42Å; L380-L382 PolarHBondContact O-N 2.87Å; L380-V458 HydrophobicContact CD1-CB 4Å; L380-V458 HydrophobicContact CD1-CG1 3.6Å; L380-V458 HydrophobicContact CD1-CG2 4.28Å; L380-H465 HydrophobicContact CD1-CB 4.4Å; L380-H465 HydrophobicContact CD2-CB 4.15Å; L380-V505 HydrophobicContact CD2-CG1 3.78Å; L380-V505 HydrophobicContact CD2-CG2 4.38Å
381	D	74.2	Confident	63.6	Low	131 Å²	131	78.6 Å²	78.6	70%	0.701	45%	0.451	S	S	*	.			trans	52.1	41.3	179.4	-71.7	-35.6	0	0	0	113.5	D379 M383	D379-D381 PolarHBondContact OD1-N 3.29Å; D381-M383 VanDerWaalsContact C-N 3.26Å; D381-M383 PolarHBondContact O-N 3.13Å
382	L	67.4	Low	60.6	Low	43 Å²	43	85 Å²	85	23%	0.225	48%	0.481	C	S	.	.			trans	-70	-18.5	-172.3	-60.1	-179.5	0	0	0	114.1	I342 L380 L416 H460	I342-L382 WeakPolarHBondContact O-CB 3.15Å; L380-L382 VanDerWaalsContact C-N 3.3Å; L380-L382 HydrophobicContact CB-CD1 4.38Å; L380-L382 HydrophobicContact CB-CD2 3.96Å; L380-L382 HydrophobicContact CB-CG 3.82Å; L380-L382 HydrophobicContact CD1-CD1 4.42Å; L380-L382 PolarHBondContact O-N 2.87Å; L382-L416 HydrophobicContact CD1-CD1 4.22Å; L382-H460 WeakPolarHBondContact CD2-CE1 2.96Å; L382-H460 WeakPolarHBondContact CD2-NE2 3.34Å
383	M	60.4	Low	57.4	Low	137 Å²	137	91 Å²	91	68%	0.675	52%	0.521	S	S	*	.			trans	-110.5	94.9	175.2	-65	-162.1	101.6	0	0	111	D381 S385	D381-M383 VanDerWaalsContact C-N 3.26Å; D381-M383 PolarHBondContact O-N 3.13Å; M383-S385 PolarHBondContact O-N 2.99Å
384	S	41.4	Very low	54.5	Low	99 Å²	99	97.3 Å²	97.3	69%	0.692	55%	0.547	S	S	*	.			trans	-74.4	116.6	166.2	52.6	0	0	0	0	109.8	N386	S384-N386 PolarHBondContact O-N 2.79Å
385	S	30.1	Very low	51.7	Low	105 Å²	105	101.1 Å²	101.1	73%	0.734	57%	0.574	S	S	*	*			trans	-70.4	51.4	172.8	54.8	0	0	0	0	112.4	M383	M383-S385 PolarHBondContact O-N 2.99Å
386	N	27.3	Very low	48.8	Very low	130 Å²	130	106.7 Å²	106.7	70%	0.695	60%	0.604	S	S	*	*			trans	-132.9	67.8	-179.3	-79.9	-18.6	0	0	0	111.3	S384	S384-N386 PolarHBondContact O-N 2.79Å
387	T	32.5	Very low	45.9	Very low	136 Å²	136	109.2 Å²	109.2	83%	0.834	64%	0.637	S	S	*	*			trans	-121	53.8	150.1	17.9	0	0	0	0	109.5
388	T	24.9	Very low	43	Very low	127 Å²	127	110.5 Å²	110.5	78%	0.779	65%	0.652	S	S	*	*			trans	-101.4	71.3	152.6	47.6	0	0	0	0	108.3
389	T	31.4	Very low	40.2	Very low	124 Å²	124	117.7 Å²	117.7	76%	0.761	69%	0.689	S	S	*	*			trans	-91.7	103.5	153.9	31.2	0	0	0	0	107.5	Q391	T389-Q391 PolarHBondContact O-N 3.35Å
390	S	26.1	Very low	37.5	Very low	111 Å²	111	122.1 Å²	122.1	78%	0.776	71%	0.712	S	S	*	*			trans	-41.9	100.8	158.3	49.2	0	0	0	0	111.5
391	Q	29.7	Very low	34.8	Very low	189 Å²	189	130.5 Å²	130.5	88%	0.883	75%	0.75	S	S	*	*			trans	-83	105.7	149	-87.3	-174.7	-15.8	0	0	107.1	T389 C393	T389-Q391 PolarHBondContact O-N 3.35Å; Q391-C393 PolarHBondContact O-N 3.4Å
392	Q	27.3	Very low	32.6	Very low	159 Å²	159	128.6 Å²	128.6	74%	0.743	75%	0.747	S	S	*	*			trans	-53	117.2	165.9	-75.8	173.2	-27.9	0	0	108.9	H394	Q392-H394 PolarHBondContact O-N 2.95Å
393	C	25.4	Very low	30.6	Very low	126 Å²	126	131.5 Å²	131.5	85%	0.851	77%	0.771	S	S	*	*			trans	-63.1	111.9	160.3	-72.8	0	0	0	0	108.5	Q391	Q391-C393 PolarHBondContact O-N 3.4Å
394	H	28.6	Very low	28.9	Very low	163 Å²	163	132.1 Å²	132.1	76%	0.755	78%	0.777	S	S	*	*			trans	-78.4	130.4	156.1	-74.1	-63.3	0	0	0	109	Q392	Q392-H394 PolarHBondContact O-N 2.95Å
395	P	31	Very low	28.3	Very low	106 Å²	106	137.8 Å²	137.8	69%	0.688	79%	0.785	S	S	*	*			trans	-85.6	135.1	169.3	32.7	-27.2	0	0	0	109.9
396	N	28.8	Very low	28.1	Very low	163 Å²	163	137.4 Å²	137.4	87%	0.872	78%	0.782	S	S	*	*			trans	100.9	116.1	162.5	-57.7	-20.1	0	0	0	119.6
397	G	27.6	Very low	28.1	Very low	82 Å²	82	139.2 Å²	139.2	85%	0.845	79%	0.787	S	S	*	*			trans	78.5	131.1	153.9	0	0	0	0	0	115.3
398	S	29.6	Very low	27.9	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	78%	0.779	S	S	*	*			cis	-157.7	152.3	20.1	58.3	0	0	0	0	110.4	L400	S398-L400 PolarHBondContact O-N 3.05Å
399	I	30.1	Very low	27.9	Very low	163 Å²	163	140.2 Å²	140.2	84%	0.836	77%	0.771	S	S	*	*			trans	-61.7	119.5	171	-64.4	158.9	0	0	0	109.9
400	L	30.7	Very low	27.6	Very low	156 Å²	156	142.4 Å²	142.4	82%	0.817	77%	0.772	S	S	*	*			trans	-142.5	120.6	158	-100.6	156	0	0	0	108.9	S398 S402	S398-L400 PolarHBondContact O-N 3.05Å; L400-S402 PolarHBondContact O-N 2.96Å
401	H	26.4	Very low	27.7	Very low	185 Å²	185	143.5 Å²	143.5	86%	0.856	76%	0.763	S	S	*	*			trans	-54.2	119.3	173.2	-94.3	-93.6	0	0	0	111.4
402	S	28.3	Very low	28	Very low	92 Å²	92	143.1 Å²	143.1	64%	0.643	76%	0.761	S	S	*	*			trans	-141.3	100.7	150.3	69.2	0	0	0	0	109.5	L400 N404	L400-S402 PolarHBondContact O-N 2.96Å; S402-N404 PolarHBondContact O-N 2.85Å
403	S	25.2	Very low	28.5	Very low	103 Å²	103	139.5 Å²	139.5	72%	0.72	75%	0.753	S	S	*	*			trans	-57.1	122.7	161.4	46.7	0	0	0	0	109.8
404	N	24.7	Very low	29.4	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	73%	0.726	S	S	*	*			trans	136.5	75.8	161.8	-72.5	-10.9	0	0	0	110.5	S402	S402-N404 PolarHBondContact O-N 2.85Å
405	Y	28.6	Very low	31.3	Very low	217 Å²	217	133 Å²	133	85%	0.851	73%	0.726	S	S	*	*			trans	-123.5	123.2	157.6	-89.9	-80.6	0	0	0	109.4
406	S	26.9	Very low	33.5	Very low	97 Å²	97	128.6 Å²	128.6	68%	0.678	70%	0.697	S	S	*	*			trans	-70.6	125.5	-165.4	33	0	0	0	0	113.6
407	E	26.6	Very low	36	Very low	168 Å²	168	122.8 Å²	122.8	79%	0.785	67%	0.669	S	S	*	*			trans	4.3	119.2	140.5	-117.3	164.9	-171.9	0	0	117	K23	K23-E407 PolarHBondContact NZ-O 3.37Å
408	Y	27.2	Very low	38.8	Very low	171 Å²	171	118.9 Å²	118.9	67%	0.671	63%	0.629	S	S	*	*			trans	-47.8	132.9	178.8	-76	-94.1	0	0	0	113.7	H410	Y408-H410 PolarHBondContact O-N 2.84Å
409	N	25.7	Very low	41.3	Very low	114 Å²	114	117.5 Å²	117.5	61%	0.61	61%	0.611	S	S	*	*			trans	-76.2	103.5	169.2	-71.2	-37.9	0	0	0	109.5	F411	N409-F411 VanDerWaalsContact C-N 3.29Å; N409-F411 HydrophobicContact CB-CD2 3.72Å; N409-F411 HydrophobicContact CB-CE2 3.81Å; N409-F411 PolarHBondContact O-N 3.43Å
410	H	25.2	Very low	43.6	Very low	170 Å²	170	111.9 Å²	111.9	79%	0.787	59%	0.585	S	S	*	*			trans	-65.9	90.6	156.2	-76.6	-69.6	0	0	0	108.5	Y408 E412	Y408-H410 PolarHBondContact O-N 2.84Å; H410-E412 PolarHBondContact O-N 3.43Å
411	F	29	Very low	45.7	Very low	134 Å²	134	104.4 Å²	104.4	59%	0.588	55%	0.546	S	S	*	.			trans	-76.5	96.2	164.5	-89.7	-90.4	0	0	0	107.6	N409	N409-F411 VanDerWaalsContact C-N 3.29Å; N409-F411 HydrophobicContact CB-CD2 3.72Å; N409-F411 HydrophobicContact CB-CE2 3.81Å; N409-F411 PolarHBondContact O-N 3.43Å
412	E	35.3	Very low	47.5	Very low	181 Å²	181	97.8 Å²	97.8	85%	0.846	52%	0.517	S	S	*	.			trans	-51.1	138.5	159	-96.6	177.9	153.9	0	0	109.7	H410	H410-E412 PolarHBondContact O-N 3.43Å
413	S	36.9	Very low	48.7	Very low	83 Å²	83	95.5 Å²	95.5	58%	0.58	50%	0.497	S	S	*	.			trans	-51.3	140.5	-179.8	-1.6	0	0	0	0	111.1	S415	S413-S415 PolarHBondContact O-N 3.35Å
414	P	46	Very low	49.8	Very low	43 Å²	43	91.5 Å²	91.5	28%	0.279	47%	0.468	S	S	.	.			trans	-53.9	114.5	-179.1	-20.1	29.9	0	0	0	111	L416 H461	P414-L416 PolarHBondContact O-N 2.81Å; P414-H461 VanDerWaalsContact CB-CE1 3.45Å; P414-H461 WeakPolarHBondContact CB-CE1 3.34Å
415	S	66.6	Low	50.5	Low	108 Å²	108	88.7 Å²	88.7	76%	0.755	45%	0.448	S	S	*	.			trans	-76.6	109.7	167.7	47.5	0	0	0	0	108.5	S413	S413-S415 PolarHBondContact O-N 3.35Å
416	L	78.1	Confident	50.9	Low	14 Å²	14	81 Å²	81	7%	0.073	42%	0.422	C	S	.	.			trans	-90.2	131.3	171.6	-179.3	152.7	0	0	0	108.4	A314 A339 L382 P414 L418 V458 I459	A314-L416 HydrophobicContact CB-CD2 4.13Å; A339-L416 HydrophobicContact CB-CD2 3.6Å; L382-L416 HydrophobicContact CD1-CD1 4.22Å; P414-L416 PolarHBondContact O-N 2.81Å; L416-L418 HydrophobicContact CD2-CD2 3.75Å; L416-L418 HydrophobicContact CD2-CG 3.98Å; L416-V458 HydrophobicContact CD1-CG1 3.48Å; L416-V458 VanDerWaalsContact CD1-CG1 3.48Å; L416-V458 HydrophobicContact CD2-CG1 3.87Å; L416-V458 HydrophobicContact CG-CG1 3.6Å; L416-I459 WeakPolarHBondContact CA-O 3.29Å
417	S	82	Confident	51.3	Low	42 Å²	42	79.3 Å²	79.3	29%	0.294	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139.5	174.6	-169.1	0	0	0	0	110.8	I459	S417-I459 PolarHBondContact N-O 2.96Å; S417-I459 PolarHBondContact O-N 2.91Å
418	L	86.1	Confident	51.6	Low	0 Å²	0	74.7 Å²	74.7	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.1	175	-60.5	177.5	0	0	0	109.6	A314 H316 V337 A339 L345 L416 Y456 Y457 V458	A314-L418 HydrophobicContact CB-CD1 4.04Å; A314-L418 HydrophobicContact CB-CG 4.02Å; H316-L418 HydrophobicContact CB-CB 3.83Å; H316-L418 HydrophobicContact CB-CD1 3.88Å; V337-L418 HydrophobicContact CB-CD1 4.4Å; V337-L418 HydrophobicContact CG1-CD1 3.92Å; A339-L418 HydrophobicContact CB-CD1 4Å; A339-L418 HydrophobicContact CB-CD2 4.34Å; A339-L418 HydrophobicContact CB-CG 4.39Å; L345-L418 HydrophobicContact CD2-CD2 4.19Å; L416-L418 HydrophobicContact CD2-CD2 3.75Å; L416-L418 HydrophobicContact CD2-CG 3.98Å; L418-Y456 HydrophobicContact CD2-CD2 4.02Å; L418-Y456 HydrophobicContact CD2-CE2 4.03Å; L418-Y457 WeakPolarHBondContact CA-O 3.23Å; L418-V458 HydrophobicContact CD2-CB 4.42Å; L418-V458 HydrophobicContact CD2-CG1 4.29Å; L418-V458 HydrophobicContact CD2-CG2 3.82Å
419	E	81.8	Confident	51.9	Low	75 Å²	75	71.1 Å²	71.1	35%	0.35	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142	179.7	-68.4	-61.9	156.5	0	0	111.1	A421 Y456 Y457 I459	E419-A421 PolarHBondContact O-N 3.32Å; E419-Y456 CarbonylContact O-C 3.49Å; E419-Y456 VanDerWaalsContact O-CA 3.31Å; E419-Y456 WeakPolarHBondContact O-CA 3.42Å; E419-Y456 WeakPolarHBondContact O-CB 3.32Å; E419-Y457 PolarHBondContact N-O 2.93Å; E419-Y457 PolarHBondContact O-N 3.4Å; E419-I459 HydrophobicContact CB-CD1 4.29Å; E419-I459 HydrophobicContact CG-CD1 3.95Å
420	P	78.8	Confident	52.3	Low	45 Å²	45	72.4 Å²	72.4	29%	0.292	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	134.8	-179.1	26.4	-33.3	0	0	0	111.4	H453	P420-H453 WeakPolarHBondContact CB-CD2 3.23Å
421	A	74	Confident	52.7	Low	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	119.1	175	0	0	0	0	0	110	E419 L423 G455 Y457 L466	E419-A421 PolarHBondContact O-N 3.32Å; A421-L423 HydrophobicContact CB-CD1 4.47Å; A421-L423 HydrophobicContact CB-CG 4.29Å; A421-L423 PolarHBondContact O-N 3.39Å; A421-G455 PolarHBondContact N-O 3.3Å; A421-Y457 VanDerWaalsContact CA-CE2 3.5Å; A421-Y457 HydrophobicContact CB-CD1 4.45Å; A421-Y457 HydrophobicContact CB-CD2 3.9Å; A421-Y457 HydrophobicContact CB-CE1 4.16Å; A421-Y457 HydrophobicContact CB-CE2 3.6Å; A421-Y457 HydrophobicContact CB-CG 4.32Å; A421-L466 HydrophobicContact CB-CD1 3.53Å
422	N	64.6	Low	52.6	Low	45 Å²	45	73.6 Å²	73.6	24%	0.241	39%	0.386	C	S	.	.			trans	-86.9	56.3	-173.1	-133.3	-21.3	0	0	0	112.5	N424 F425	N422-N424 PolarHBondContact O-N 2.9Å; N422-F425 HydrophobicContact CB-CD2 4.25Å; N422-F425 VanDerWaalsContact CG-CD2 3.49Å; N422-F425 VanDerWaalsContact ND2-CD2 3.27Å; N422-F425 WeakPolarHBondContact ND2-CD2 3.29Å; N422-F425 WeakPolarHBondContact ND2-CE2 3.21Å; N422-F425 PolarHBondContact O-N 3.42Å
423	L	54	Low	52.3	Low	45 Å²	45	68.2 Å²	68.2	24%	0.236	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.1	179.9	-66.7	167.1	0	0	0	113.7	A421 Q454 L466	A421-L423 HydrophobicContact CB-CD1 4.47Å; A421-L423 HydrophobicContact CB-CG 4.29Å; A421-L423 PolarHBondContact O-N 3.39Å; L423-Q454 HydrophobicContact CD1-CB 4.39Å; L423-L466 HydrophobicContact CD1-CD1 4.37Å; L423-L466 HydrophobicContact CD2-CD2 4.33Å
424	N	48.1	Very low	51.9	Low	19 Å²	19	73.5 Å²	73.5	10%	0.102	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	9.2	-173.8	-76.7	-13.8	0	0	0	114.8	N422 L426 D427 Q454 R596	N422-N424 PolarHBondContact O-N 2.9Å; N424-L426 PolarHBondContact O-N 3.37Å; N424-D427 PolarHBondContact O-N 3.47Å; N424-D427 VanDerWaalsContact O-N 3.09Å; N424-Q454 PolarHBondContact OD1-OE1 3.41Å; N424-R596 PolarHBondContact OD1-NH2 3.4Å
425	F	40	Very low	51	Low	91 Å²	91	76.7 Å²	76.7	40%	0.399	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-10.3	-170.9	-144.4	-101.1	0	0	0	115.2	N422 I429	N422-F425 HydrophobicContact CB-CD2 4.25Å; N422-F425 VanDerWaalsContact CG-CD2 3.49Å; N422-F425 VanDerWaalsContact ND2-CD2 3.27Å; N422-F425 WeakPolarHBondContact ND2-CD2 3.29Å; N422-F425 WeakPolarHBondContact ND2-CE2 3.21Å; N422-F425 PolarHBondContact O-N 3.42Å; F425-I429 HydrophobicContact CD1-CD1 4.41Å
426	L	35.3	Very low	49.3	Very low	56 Å²	56	78.5 Å²	78.5	29%	0.293	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-25.8	-179.6	-69.3	162.1	0	0	0	114.7	N424 K562	N424-L426 PolarHBondContact O-N 3.37Å; L426-K562 HydrophobicContact CD1-CB 3.38Å; L426-K562 HydrophobicContact CD1-CD 4.08Å; L426-K562 HydrophobicContact CD1-CG 4.38Å; L426-K562 HydrophobicContact CD2-CB 4.25Å; L426-K562 HydrophobicContact CD2-CD 3.47Å; L426-K562 VanDerWaalsContact CD2-CD 3.47Å; L426-K562 HydrophobicContact CG-CB 4.45Å; L426-K562 HydrophobicContact CG-CD 4.41Å
427	D	35.5	Very low	47	Very low	62 Å²	62	85.3 Å²	85.3	33%	0.332	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-16.5	-175.7	-62.3	-29.2	0	0	0	112.3	N424 R596	N424-D427 PolarHBondContact O-N 3.47Å; N424-D427 VanDerWaalsContact O-N 3.09Å; D427-R596 IonicContact OD1-NH1 3.93Å; D427-R596 IonicContact OD2-CZ 3.63Å; D427-R596 IonicContact OD2-NH1 2.78Å; D427-R596 PolarHBondContact OD2-NH1 3.23Å; D427-R596 IonicContact OD2-NH2 3.56Å; D427-R596 PolarHBondContact OD2-NH2 3.44Å
428	N	32.7	Very low	44.6	Very low	71 Å²	71	87 Å²	87	38%	0.38	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-14	179.5	-73.8	-19.2	0	0	0	114.1
429	I	34.3	Very low	41.9	Very low	96 Å²	96	92 Å²	92	49%	0.492	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-36	178.4	-63	176.1	0	0	0	110.7	F425 Y431 N432 S433	F425-I429 HydrophobicContact CD1-CD1 4.41Å; I429-Y431 PolarHBondContact O-N 2.84Å; I429-N432 PolarHBondContact O-N 3.38Å; I429-S433 PolarHBondContact O-OG 3.31Å
430	E	33.7	Very low	39.3	Very low	140 Å²	140	96 Å²	96	65%	0.654	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-66.9	-24.6	176.7	-80.7	-176.6	168.3	0	0	113.3	N432	E430-N432 VanDerWaalsContact C-N 3.33Å; E430-N432 PolarHBondContact O-N 3.32Å
431	Y	33	Very low	36.9	Very low	180 Å²	180	101.8 Å²	101.8	71%	0.706	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-76.5	-18.9	-178.7	-126.4	-88.2	0	0	0	114	I429	I429-Y431 PolarHBondContact O-N 2.84Å
432	N	28.2	Very low	34.7	Very low	149 Å²	149	107.7 Å²	107.7	80%	0.797	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-105.9	4.6	-179.6	-79.4	-38.9	0	0	0	113.7	I429 E430	I429-N432 PolarHBondContact O-N 3.38Å; E430-N432 VanDerWaalsContact C-N 3.33Å; E430-N432 PolarHBondContact O-N 3.32Å
433	S	28.1	Very low	33	Very low	68 Å²	68	114.8 Å²	114.8	48%	0.476	60%	0.604	S	S	.	*	S	Bend	trans	-116.3	0.7	-174.2	62	0	0	0	0	116.3	I429	I429-S433 PolarHBondContact O-OG 3.31Å
434	Y	29.4	Very low	31.7	Very low	195 Å²	195	120.2 Å²	120.2	77%	0.765	63%	0.634	S	S	*	*			trans	-126.5	74.6	177.5	-69.4	-77.6	0	0	0	112.5
435	S	27.9	Very low	30.9	Very low	110 Å²	110	124.8 Å²	124.8	77%	0.769	65%	0.652	S	S	*	*			trans	-108.3	105.8	145.8	160.7	0	0	0	0	105.5
436	I	30	Very low	30.6	Very low	146 Å²	146	127.4 Å²	127.4	75%	0.749	67%	0.669	S	S	*	*	S	Bend	trans	148.4	80.9	163.4	-72.9	149.4	0	0	0	105.9
437	D	29.2	Very low	30.8	Very low	157 Å²	157	130.5 Å²	130.5	84%	0.84	68%	0.68	S	S	*	*				158.2	124.2	125.5	-98.8	-20.2	0	0	0	110.4	S439	D437-S439 PolarHBondContact O-N 3.28Å
438	G	32.2	Very low	31.3	Very low	76 Å²	76	128.6 Å²	128.6	78%	0.784	68%	0.675	S	S	*	*			trans	-80.9	110	-178.8	0	0	0	0	0	111
439	S	29.2	Very low	32.5	Very low	105 Å²	105	126 Å²	126	73%	0.734	66%	0.661	S	S	*	*	S	Bend	trans	173.1	151	143.1	33.6	0	0	0	0	107.4	D437	D437-S439 PolarHBondContact O-N 3.28Å
440	D	28	Very low	34.1	Very low	160 Å²	160	126.5 Å²	126.5	86%	0.856	66%	0.66	S	S	*	*			trans	82.6	26.2	-179.3	-54.7	-14.9	0	0	0	118.3	V442	D440-V442 PolarHBondContact O-N 2.76Å
441	F	27.8	Very low	36.2	Very low	166 Å²	166	120.1 Å²	120.1	73%	0.728	63%	0.63	S	S	*	*			trans	-81.6	36.9	171.6	-135.3	-86.4	0	0	0	114.5	K445	F441-K445 HydrophobicContact CD1-CD 4.45Å; F441-K445 HydrophobicContact CE1-CD 3.94Å
442	V	28.4	Very low	37.9	Very low	124 Å²	124	112.8 Å²	112.8	75%	0.752	61%	0.605	S	S	*	*			trans	-141.8	86.1	-179.8	-171.7	0	0	0	0	109.4	D440	D440-V442 PolarHBondContact O-N 2.76Å
443	K	27.4	Very low	40.1	Very low	194 Å²	194	107.2 Å²	107.2	84%	0.843	57%	0.574	S	S	*	*	S	Bend	trans	177.6	-10.1	137.3	-97.1	160.4	-175.1	-178.5	0	118.7
444	N	26.9	Very low	42.5	Very low	160 Å²	160	105.7 Å²	105.7	86%	0.856	56%	0.559	S	S	*	*			trans	-129.1	50.2	177.6	-79.5	-17.1	0	0	0	113.6	I446	N444-I446 VanDerWaalsContact C-N 3.32Å; N444-I446 PolarHBondContact O-N 2.91Å; N444-I446 VanDerWaalsContact O-N 3.14Å
445	K	31.3	Very low	45.2	Very low	114 Å²	114	96.4 Å²	96.4	50%	0.496	52%	0.523	S	S	.	.			trans	-85.1	80.2	170.4	-141.7	163	173.5	-171.8	0	108	F441 F447	F441-K445 HydrophobicContact CD1-CD 4.45Å; F441-K445 HydrophobicContact CE1-CD 3.94Å; K445-F447 HydrophobicContact CB-CD2 3.82Å; K445-F447 HydrophobicContact CB-CE2 4.01Å; K445-F447 HydrophobicContact CD-CD2 3.84Å; K445-F447 HydrophobicContact CD-CE1 4.35Å; K445-F447 HydrophobicContact CD-CE2 3.2Å; K445-F447 HydrophobicContact CD-CZ 3.53Å; K445-F447 VanDerWaalsContact CE-CE2 3.42Å; K445-F447 HydrophobicContact CG-CD2 3.53Å; K445-F447 HydrophobicContact CG-CE2 3.49Å; K445-F447 VanDerWaalsContact CG-CE2 3.49Å; K445-F447 HydrophobicContact CG-CG 4.16Å; K445-F447 HydrophobicContact CG-CZ 4.05Å; K445-F447 VanDerWaalsContact NZ-CZ 3.28Å; K445-F447 PolarHBondContact O-N 2.99Å
446	I	35.2	Very low	48	Very low	147 Å²	147	91.1 Å²	91.1	75%	0.754	49%	0.486	S	S	*	.			trans	-67.4	84.8	161.2	-58.9	175.6	0	0	0	105.2	N444 G448	N444-I446 VanDerWaalsContact C-N 3.32Å; N444-I446 PolarHBondContact O-N 2.91Å; N444-I446 VanDerWaalsContact O-N 3.14Å; I446-G448 PolarHBondContact O-N 3.13Å
447	F	39.5	Very low	50.6	Low	120 Å²	120	84.3 Å²	84.3	53%	0.526	45%	0.451	S	S	.	.			trans	-69.5	63.7	167.6	-86.6	-78.1	0	0	0	108.6	M326 K445	M326-F447 HydrophobicContact SD-CD1 3.69Å; M326-F447 HydrophobicContact SD-CE1 4.07Å; K445-F447 HydrophobicContact CB-CD2 3.82Å; K445-F447 HydrophobicContact CB-CE2 4.01Å; K445-F447 HydrophobicContact CD-CD2 3.84Å; K445-F447 HydrophobicContact CD-CE1 4.35Å; K445-F447 HydrophobicContact CD-CE2 3.2Å; K445-F447 HydrophobicContact CD-CZ 3.53Å; K445-F447 VanDerWaalsContact CE-CE2 3.42Å; K445-F447 HydrophobicContact CG-CD2 3.53Å; K445-F447 HydrophobicContact CG-CE2 3.49Å; K445-F447 VanDerWaalsContact CG-CE2 3.49Å; K445-F447 HydrophobicContact CG-CG 4.16Å; K445-F447 HydrophobicContact CG-CZ 4.05Å; K445-F447 VanDerWaalsContact NZ-CZ 3.28Å; K445-F447 PolarHBondContact O-N 2.99Å
448	G	46.1	Very low	53.3	Low	22 Å²	22	76.8 Å²	76.8	23%	0.227	41%	0.411	C	S	.	.			trans	-90.7	131.2	169.4	0	0	0	0	0	109	I446 K450	I446-G448 PolarHBondContact O-N 3.13Å; G448-K450 PolarHBondContact O-N 3.33Å
449	L	56	Low	55.6	Low	16 Å²	16	74.8 Å²	74.8	8%	0.084	38%	0.382	C	S	.	.			trans	-52.4	134.3	163.5	-72.3	151.4	0	0	0	108.3	M326 P332 S476 C479	M326-L449 HydrophobicContact CE-CD2 4.2Å; M326-L449 HydrophobicContact CE-CG 4.49Å; P332-L449 HydrophobicContact CG-CB 3.75Å; P332-L449 HydrophobicContact CG-CD1 3.99Å; P332-L449 HydrophobicContact CG-CD2 3.45Å; P332-L449 VanDerWaalsContact CG-CD2 3.45Å; P332-L449 HydrophobicContact CG-CG 3.88Å; L449-S476 WeakPolarHBondContact O-CB 3.32Å; L449-S476 PolarHBondContact O-OG 3.5Å; L449-C479 HydrophobicContact CD1-CB 3.77Å
450	K	69.7	Low	57.8	Low	107 Å²	107	70.1 Å²	70.1	47%	0.465	35%	0.348	S	S	.	.			trans	-120.8	139	-176.8	-73.2	-171.7	177.9	-174.7	0	111.5	I321 G448	I321-K450 WeakPolarHBondContact CB-O 3.48Å; I321-K450 HydrophobicContact CD1-CB 3.99Å; I321-K450 PolarHBondContact N-O 3.3Å; G448-K450 PolarHBondContact O-N 3.33Å
451	Y	76.4	Confident	59.8	Low	7 Å²	7	66 Å²	66	3%	0.027	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-92.4	154.9	170.6	-72.5	-93.7	0	0	0	110.7	I318 P320 I321 P332 P333 I335 H453 I472 L475	I318-Y451 HydrophobicContact CG2-CD1 4.15Å; P320-Y451 HydrophobicContact CG-CE1 4.24Å; I321-Y451 WeakPolarHBondContact CD1-O 3.47Å; P332-Y451 HydrophobicContact CB-CE2 4.47Å; P333-Y451 WeakPolarHBondContact O-CE1 3.47Å; P333-Y451 PolarHBondContact O-OH 2.91Å; P333-Y451 VanDerWaalsContact O-OH 3.13Å; I335-Y451 HydrophobicContact CD1-CD1 3.98Å; I335-Y451 HydrophobicContact CD1-CE1 3.63Å; I335-Y451 HydrophobicContact CD1-CE2 4.47Å; I335-Y451 HydrophobicContact CG1-CE1 3.95Å; Y451-H453 VanDerWaalsContact C-N 3.27Å; Y451-H453 PolarHBondContact O-N 2.89Å; Y451-I472 HydrophobicContact CD2-CG2 3.27Å; Y451-I472 HydrophobicContact CE2-CG2 3.89Å; Y451-I472 HydrophobicContact CG-CG2 3.73Å; Y451-L475 HydrophobicContact CE2-CD2 4.33Å; Y451-L475 WeakPolarHBondContact OH-CD2 3.46Å
452	S	69.2	Low	61.6	Low	25 Å²	25	60.8 Å²	60.8	18%	0.175	30%	0.302	C	S	.	.	S	Bend	trans	-64.2	-33.6	-178.3	60.1	0	0	0	0	112.6	R319	R319-S452 PolarHBondContact O-N 2.9Å; R319-S452 VanDerWaalsContact O-N 3.11Å; R319-S452 PolarHBondContact O-OG 2.97Å
453	H	75.3	Confident	63.7	Low	33 Å²	33	54.9 Å²	54.9	15%	0.153	27%	0.267	C	S	.	.			trans	-140.3	153.3	-178.7	-46.5	-58.3	0	0	0	109.7	P420 Y451	P420-H453 WeakPolarHBondContact CB-CD2 3.23Å; Y451-H453 VanDerWaalsContact C-N 3.27Å; Y451-H453 PolarHBondContact O-N 2.89Å
454	Q	78.3	Confident	66.1	Low	35 Å²	35	45.8 Å²	45.8	16%	0.164	23%	0.227	C	C	.	.	S	Bend	trans	-99.4	-0.3	174.1	-76	180	-16.7	0	0	112.7	L423 N424 N468 L469 E473	L423-Q454 HydrophobicContact CD1-CB 4.39Å; N424-Q454 PolarHBondContact OD1-OE1 3.41Å; Q454-N468 PolarHBondContact O-OD1 3.03Å; Q454-N468 VanDerWaalsContact O-OD1 3.11Å; Q454-L469 WeakPolarHBondContact O-CB 3.49Å; Q454-L469 PolarHBondContact O-N 2.95Å; Q454-E473 PolarHBondContact NE2-OE1 3.3Å
455	G	85.1	Confident	68.8	Low	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.9	-177.1	-176.6	0	0	0	0	0	111.6	A421 V467	A421-G455 PolarHBondContact N-O 3.3Å; G455-V467 CarbonylContact C-O 3.57Å; G455-V467 WeakPolarHBondContact CA-O 3.29Å
456	Y	87.8	Confident	71.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.5	-177.7	56.7	-90.4	0	0	0	111	I318 V337 L345 N347 L418 E419 V458 V467 L469	I318-Y456 HydrophobicContact CD1-CD1 4.21Å; V337-Y456 HydrophobicContact CB-CE1 4.34Å; V337-Y456 HydrophobicContact CG1-CE1 3.94Å; V337-Y456 HydrophobicContact CG1-CE2 3.89Å; V337-Y456 VanDerWaalsContact CG1-CZ 3.48Å; V337-Y456 WeakPolarHBondContact CG1-OH 3.49Å; V337-Y456 HydrophobicContact CG2-CD1 3.99Å; V337-Y456 HydrophobicContact CG2-CE1 3.51Å; L345-Y456 HydrophobicContact CD1-CE2 4.13Å; N347-Y456 WeakPolarHBondContact OD1-CE1 3.46Å; N347-Y456 PolarHBondContact OD1-OH 2.99Å; L418-Y456 HydrophobicContact CD2-CD2 4.02Å; L418-Y456 HydrophobicContact CD2-CE2 4.03Å; E419-Y456 CarbonylContact O-C 3.49Å; E419-Y456 VanDerWaalsContact O-CA 3.31Å; E419-Y456 WeakPolarHBondContact O-CA 3.42Å; E419-Y456 WeakPolarHBondContact O-CB 3.32Å; Y456-V458 HydrophobicContact CD2-CG2 3.94Å; Y456-V458 HydrophobicContact CE2-CG2 3.71Å; Y456-V467 HydrophobicContact CD2-CB 4.21Å; Y456-V467 HydrophobicContact CD2-CG2 4.47Å; Y456-V467 HydrophobicContact CE1-CB 4.12Å; Y456-V467 HydrophobicContact CE1-CG1 4.04Å; Y456-V467 HydrophobicContact CE2-CB 3.76Å; Y456-V467 HydrophobicContact CE2-CG1 4.28Å; Y456-V467 HydrophobicContact CE2-CG2 3.85Å; Y456-V467 PolarHBondContact N-O 3.24Å; Y456-V467 PolarHBondContact O-N 3.01Å; Y456-L469 HydrophobicContact CD1-CD1 4.21Å; Y456-L469 HydrophobicContact CE1-CD1 4.01Å; Y456-L469 HydrophobicContact CE1-CD2 4.04Å; Y456-L469 HydrophobicContact CE1-CG 4.18Å
457	Y	83.9	Confident	74	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.008	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	141.9	169.7	-57.7	-69.8	0	0	0	110.2	L418 E419 A421 I464 H465 L466 L508 F534 E536 L566	L418-Y457 WeakPolarHBondContact CA-O 3.23Å; E419-Y457 PolarHBondContact N-O 2.93Å; E419-Y457 PolarHBondContact O-N 3.4Å; A421-Y457 VanDerWaalsContact CA-CE2 3.5Å; A421-Y457 HydrophobicContact CB-CD1 4.45Å; A421-Y457 HydrophobicContact CB-CD2 3.9Å; A421-Y457 HydrophobicContact CB-CE1 4.16Å; A421-Y457 HydrophobicContact CB-CE2 3.6Å; A421-Y457 HydrophobicContact CB-CG 4.32Å; Y457-I464 HydrophobicContact CD1-CG2 4.4Å; Y457-H465 CarbonylContact C-O 3.58Å; Y457-H465 VanDerWaalsContact CA-O 3.25Å; Y457-H465 WeakPolarHBondContact CA-O 3.36Å; Y457-L466 HydrophobicContact CD1-CB 4.13Å; Y457-L466 HydrophobicContact CD1-CD1 3.95Å; Y457-L466 HydrophobicContact CE1-CB 4.2Å; Y457-L466 HydrophobicContact CE1-CD1 3.75Å; Y457-L466 HydrophobicContact CE1-CG 4.41Å; Y457-L508 HydrophobicContact CD1-CD1 4.11Å; Y457-L508 HydrophobicContact CE1-CD1 3.97Å; Y457-F534 HydrophobicContact CD1-CZ 4.19Å; Y457-F534 AromaticContact CD2-CE1 3.9Å; Y457-F534 HydrophobicContact CD2-CE1 3.9Å; Y457-F534 AromaticContact CD2-CZ 3.88Å; Y457-F534 HydrophobicContact CD2-CZ 3.88Å; Y457-F534 HydrophobicContact CE1-CZ 4.1Å; Y457-F534 HydrophobicContact CE2-CE1 4.06Å; Y457-F534 AromaticContact CE2-CZ 3.77Å; Y457-F534 HydrophobicContact CE2-CZ 3.77Å; Y457-F534 HydrophobicContact CG-CE1 4.3Å; Y457-F534 HydrophobicContact CG-CZ 4.09Å; Y457-F534 AromaticContact CZ-CZ 3.9Å; Y457-E536 WeakPolarHBondContact CE2-OE2 3.42Å; Y457-E536 PolarHBondContact OH-OE2 2.94Å; Y457-L566 HydrophobicContact CE1-CD1 4.22Å
458	V	86.1	Confident	76.3	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.3	168.1	-173	0	0	0	0	107.4	L345 L380 L416 L418 Y456 I464 H465 V467	L345-V458 HydrophobicContact CD1-CG2 3.65Å; L345-V458 HydrophobicContact CD2-CG1 4.41Å; L345-V458 HydrophobicContact CD2-CG2 4.11Å; L380-V458 HydrophobicContact CD1-CB 4Å; L380-V458 HydrophobicContact CD1-CG1 3.6Å; L380-V458 HydrophobicContact CD1-CG2 4.28Å; L416-V458 HydrophobicContact CD1-CG1 3.48Å; L416-V458 VanDerWaalsContact CD1-CG1 3.48Å; L416-V458 HydrophobicContact CD2-CG1 3.87Å; L416-V458 HydrophobicContact CG-CG1 3.6Å; L418-V458 HydrophobicContact CD2-CB 4.42Å; L418-V458 HydrophobicContact CD2-CG1 4.29Å; L418-V458 HydrophobicContact CD2-CG2 3.82Å; Y456-V458 HydrophobicContact CD2-CG2 3.94Å; Y456-V458 HydrophobicContact CE2-CG2 3.71Å; V458-I464 WeakPolarHBondContact O-CA 3.38Å; V458-H465 HydrophobicContact CB-CB 4.23Å; V458-H465 PolarHBondContact N-O 2.91Å; V458-H465 PolarHBondContact O-N 3.09Å; V458-V467 HydrophobicContact CG2-CG2 3.92Å
459	I	79.5	Confident	78.3	Confident	33 Å²	33	22 Å²	22	17%	0.169	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.1	-173.5	-54.8	170.3	0	0	0	108.1	L416 S417 E419 I464 L531 F534	L416-I459 WeakPolarHBondContact CA-O 3.29Å; S417-I459 PolarHBondContact N-O 2.96Å; S417-I459 PolarHBondContact O-N 2.91Å; E419-I459 HydrophobicContact CB-CD1 4.29Å; E419-I459 HydrophobicContact CG-CD1 3.95Å; I459-I464 HydrophobicContact CG1-CG2 4.41Å; I459-L531 HydrophobicContact CG2-CD2 4.06Å; I459-F534 HydrophobicContact CD1-CD1 3.93Å; I459-F534 HydrophobicContact CD1-CE1 4.42Å
460	H	77	Confident	79.6	Confident	7 Å²	7	24 Å²	24	3%	0.032	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	169.7	173.8	58.5	96.4	0	0	0	109.4	L382 M462 G463 H465	L382-H460 WeakPolarHBondContact CD2-CE1 2.96Å; L382-H460 WeakPolarHBondContact CD2-NE2 3.34Å; H460-M462 VanDerWaalsContact CE1-C 3.49Å; H460-M462 WeakPolarHBondContact ND1-CB 3.4Å; H460-M462 PolarHBondContact ND1-N 3.34Å; H460-M462 PolarHBondContact O-N 3.06Å; H460-G463 PolarHBondContact CD2-O 3.45Å; H460-G463 PolarHBondContact CE1-N 3.34Å; H460-G463 VanDerWaalsContact CE1-N 3.26Å; H460-G463 PolarHBondContact N-O 3.24Å; H460-G463 VanDerWaalsContact N-O 3.08Å; H460-G463 PolarHBondContact O-N 3.39Å; H460-H465 AromaticContact CD2-CD2 3.94Å; H460-H465 AromaticContact CE1-NE2 3.67Å; H460-H465 AromaticContact NE2-CD2 3.14Å; H460-H465 PolarHBondContact NE2-CD2 3.27Å; H460-H465 AromaticContact NE2-NE2 2.97Å; H460-H465 PolarHBondContact NE2-NE2 3.48Å
461	H	68.6	Low	80.4	Confident	73 Å²	73	18.9 Å²	18.9	34%	0.338	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.2	-175.7	72.9	-66.5	0	0	0	115.5	P414	P414-H461 VanDerWaalsContact CB-CE1 3.45Å; P414-H461 WeakPolarHBondContact CB-CE1 3.34Å
462	M	66.6	Low	80.8	Confident	57 Å²	57	18.8 Å²	18.8	28%	0.281	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-6.5	177.9	-55.2	-80.1	73.7	0	0	113.6	H460 C510 G511	H460-M462 VanDerWaalsContact CE1-C 3.49Å; H460-M462 WeakPolarHBondContact ND1-CB 3.4Å; H460-M462 PolarHBondContact ND1-N 3.34Å; H460-M462 PolarHBondContact O-N 3.06Å; M462-C510 CarbonylContact O-C 3.49Å; M462-G511 PolarHBondContact O-N 3.09Å
463	G	72.3	Confident	81.3	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.01	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170	175.1	-174.1	0	0	0	0	0	116.9	H460 V509	H460-G463 PolarHBondContact CD2-O 3.45Å; H460-G463 PolarHBondContact CE1-N 3.34Å; H460-G463 VanDerWaalsContact CE1-N 3.26Å; H460-G463 PolarHBondContact N-O 3.24Å; H460-G463 VanDerWaalsContact N-O 3.08Å; H460-G463 PolarHBondContact O-N 3.39Å; G463-V509 CarbonylContact C-O 3.56Å; G463-V509 WeakPolarHBondContact CA-O 3.44Å
464	I	78.5	Confident	81.6	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.01	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	126.9	170	-52.2	177	0	0	0	107.4	Y457 V458 I459 L508 V509 L531 F534	Y457-I464 HydrophobicContact CD1-CG2 4.4Å; V458-I464 WeakPolarHBondContact O-CA 3.38Å; I459-I464 HydrophobicContact CG1-CG2 4.41Å; I464-L508 HydrophobicContact CG2-CD1 4.15Å; I464-L508 WeakPolarHBondContact O-CB 3.43Å; I464-L508 PolarHBondContact O-N 2.99Å; I464-V509 HydrophobicContact CB-CB 4.46Å; I464-V509 PolarHBondContact N-O 3.42Å; I464-V509 PolarHBondContact O-N 3.44Å; I464-L531 HydrophobicContact CD1-CD1 3.83Å; I464-L531 HydrophobicContact CD1-CD2 3.67Å; I464-L531 HydrophobicContact CD1-CG 4.41Å; I464-L531 HydrophobicContact CG1-CD1 4.34Å; I464-L531 HydrophobicContact CG1-CD2 3.45Å; I464-L531 VanDerWaalsContact CG1-CD2 3.45Å; I464-F534 HydrophobicContact CD1-CB 3.94Å; I464-F534 HydrophobicContact CD1-CD2 3.43Å; I464-F534 VanDerWaalsContact CD1-CD2 3.43Å; I464-F534 HydrophobicContact CD1-CE2 4.16Å; I464-F534 HydrophobicContact CD1-CG 3.9Å; I464-F534 HydrophobicContact CG2-CE2 4.41Å
465	H	83.3	Confident	81.9	Confident	3 Å²	3	23.4 Å²	23.4	1%	0.014	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	139.8	178	-53.6	-109.6	0	0	0	108.6	L380 Y457 V458 H460 V505 H507 C510	L380-H465 HydrophobicContact CD1-CB 4.4Å; L380-H465 HydrophobicContact CD2-CB 4.15Å; Y457-H465 CarbonylContact C-O 3.58Å; Y457-H465 VanDerWaalsContact CA-O 3.25Å; Y457-H465 WeakPolarHBondContact CA-O 3.36Å; V458-H465 HydrophobicContact CB-CB 4.23Å; V458-H465 PolarHBondContact N-O 2.91Å; V458-H465 PolarHBondContact O-N 3.09Å; H460-H465 AromaticContact CD2-CD2 3.94Å; H460-H465 AromaticContact CE1-NE2 3.67Å; H460-H465 AromaticContact NE2-CD2 3.14Å; H460-H465 PolarHBondContact NE2-CD2 3.27Å; H460-H465 AromaticContact NE2-NE2 2.97Å; H460-H465 PolarHBondContact NE2-NE2 3.48Å; H465-V505 HydrophobicContact CB-CG1 4.25Å; H465-H507 AromaticContact CE1-CE1 3.52Å; H465-H507 AromaticContact CE1-ND1 3.05Å; H465-H507 PolarHBondContact CE1-ND1 3.39Å; H465-H507 AromaticContact ND1-CE1 3.3Å; H465-H507 PolarHBondContact ND1-CE1 3.4Å; H465-H507 VanDerWaalsContact ND1-CE1 3.3Å; H465-H507 AromaticContact ND1-CG 3.71Å; H465-H507 AromaticContact ND1-ND1 2.91Å; H465-H507 PolarHBondContact ND1-ND1 3.38Å; H465-C510 PolarHBondContact CE1-SG 3.31Å
466	L	86.4	Confident	81.6	Confident	12 Å²	12	24 Å²	24	6%	0.063	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	118.3	170	169.8	63.7	0	0	0	108.1	A421 L423 Y457 K506 L508 L594	A421-L466 HydrophobicContact CB-CD1 3.53Å; L423-L466 HydrophobicContact CD1-CD1 4.37Å; L423-L466 HydrophobicContact CD2-CD2 4.33Å; Y457-L466 HydrophobicContact CD1-CB 4.13Å; Y457-L466 HydrophobicContact CD1-CD1 3.95Å; Y457-L466 HydrophobicContact CE1-CB 4.2Å; Y457-L466 HydrophobicContact CE1-CD1 3.75Å; Y457-L466 HydrophobicContact CE1-CG 4.41Å; L466-K506 HydrophobicContact CB-CB 4.39Å; L466-K506 PolarHBondContact N-O 3.09Å; L466-K506 PolarHBondContact O-N 2.88Å; L466-L508 HydrophobicContact CB-CD1 3.82Å; L466-L508 HydrophobicContact CB-CD2 4.37Å; L466-L508 HydrophobicContact CB-CG 4.05Å; L466-L594 HydrophobicContact CD2-CD1 4.17Å
467	V	89.6	Confident	81.1	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.8	173.2	-174.9	0	0	0	0	108.2	L345 V378 G455 Y456 V458 L469 C504 V505	L345-V467 HydrophobicContact CD1-CG2 3.69Å; V378-V467 HydrophobicContact CG2-CG1 4.43Å; G455-V467 CarbonylContact C-O 3.57Å; G455-V467 WeakPolarHBondContact CA-O 3.29Å; Y456-V467 HydrophobicContact CD2-CB 4.21Å; Y456-V467 HydrophobicContact CD2-CG2 4.47Å; Y456-V467 HydrophobicContact CE1-CB 4.12Å; Y456-V467 HydrophobicContact CE1-CG1 4.04Å; Y456-V467 HydrophobicContact CE2-CB 3.76Å; Y456-V467 HydrophobicContact CE2-CG1 4.28Å; Y456-V467 HydrophobicContact CE2-CG2 3.85Å; Y456-V467 PolarHBondContact N-O 3.24Å; Y456-V467 PolarHBondContact O-N 3.01Å; V458-V467 HydrophobicContact CG2-CG2 3.92Å; V467-L469 HydrophobicContact CG1-CD2 4.23Å; V467-C504 WeakPolarHBondContact CA-O 3.15Å; V467-V505 HydrophobicContact CG2-CG2 4.31Å
468	N	87.6	Confident	80.8	Confident	48 Å²	48	31.4 Å²	31.4	26%	0.257	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.1	178.7	-175.4	34.2	0	0	0	109.6	Q454 S470 S503 C504	Q454-N468 PolarHBondContact O-OD1 3.03Å; Q454-N468 VanDerWaalsContact O-OD1 3.11Å; N468-S470 PolarHBondContact O-N 3.42Å; N468-S503 WeakPolarHBondContact O-CA 3.36Å; N468-C504 PolarHBondContact N-O 2.68Å; N468-C504 PolarHBondContact O-N 3.08Å
469	L	88.3	Confident	80.3	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.166	C	C	.	.			trans	-99.3	72.6	-177.1	-55	176.4	0	0	0	108.4	I318 I335 N347 Q454 Y456 V467 W471 I472 S503	I318-L469 HydrophobicContact CD1-CD1 3.43Å; I318-L469 VanDerWaalsContact CD1-CD1 3.43Å; I335-L469 HydrophobicContact CG2-CD1 4.37Å; N347-L469 HydrophobicContact CB-CD2 4.4Å; Q454-L469 WeakPolarHBondContact O-CB 3.49Å; Q454-L469 PolarHBondContact O-N 2.95Å; Y456-L469 HydrophobicContact CD1-CD1 4.21Å; Y456-L469 HydrophobicContact CE1-CD1 4.01Å; Y456-L469 HydrophobicContact CE1-CD2 4.04Å; Y456-L469 HydrophobicContact CE1-CG 4.18Å; V467-L469 HydrophobicContact CG1-CD2 4.23Å; L469-W471 HydrophobicContact CB-CZ2 4.25Å; L469-W471 HydrophobicContact CD1-CZ2 4.26Å; L469-W471 HydrophobicContact CD2-CZ2 4.01Å; L469-W471 HydrophobicContact CG-CZ2 4.41Å; L469-W471 PolarHBondContact O-N 3.03Å; L469-W471 VanDerWaalsContact O-N 3.13Å; L469-I472 HydrophobicContact CB-CD1 3.61Å; L469-I472 HydrophobicContact CB-CG1 3.66Å; L469-I472 HydrophobicContact CD1-CD1 3.64Å; L469-I472 HydrophobicContact CD1-CG1 4.34Å; L469-I472 HydrophobicContact CG-CD1 4.26Å; L469-I472 WeakPolarHBondContact O-CB 3.5Å; L469-I472 WeakPolarHBondContact O-CG1 3.47Å; L469-I472 PolarHBondContact O-N 3.38Å; L469-S503 VanDerWaalsContact CD2-OG 3.22Å; L469-S503 WeakPolarHBondContact CD2-OG 3.21Å
470	S	81.6	Confident	79.9	Confident	57 Å²	57	32.5 Å²	32.5	40%	0.399	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-30.5	-177.3	48.4	0	0	0	0	113.1	N468 I472 Q502	N468-S470 PolarHBondContact O-N 3.42Å; S470-I472 PolarHBondContact O-N 3.05Å; S470-Q502 PolarHBondContact OG-O 2.8Å
471	W	87.2	Confident	79.6	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-69.9	-11.2	177.6	55.8	-98.4	0	0	0	114.3	I335 N347 I349 I375 L469 E473 N474 L475 W501 S503	I335-W471 HydrophobicContact CD1-CH2 3.95Å; I335-W471 HydrophobicContact CD1-CZ3 3.89Å; I335-W471 HydrophobicContact CG1-CH2 4.19Å; I335-W471 HydrophobicContact CG1-CZ3 4.32Å; I335-W471 HydrophobicContact CG2-CH2 3.85Å; N347-W471 HydrophobicContact CB-CZ2 4.15Å; I349-W471 HydrophobicContact CD1-CZ3 4.12Å; I349-W471 HydrophobicContact CG1-CH2 4.34Å; I349-W471 HydrophobicContact CG1-CZ3 4.14Å; I375-W471 HydrophobicContact CG2-CD2 4.26Å; L469-W471 HydrophobicContact CB-CZ2 4.25Å; L469-W471 HydrophobicContact CD1-CZ2 4.26Å; L469-W471 HydrophobicContact CD2-CZ2 4.01Å; L469-W471 HydrophobicContact CG-CZ2 4.41Å; L469-W471 PolarHBondContact O-N 3.03Å; L469-W471 VanDerWaalsContact O-N 3.13Å; W471-E473 VanDerWaalsContact C-N 3.26Å; W471-E473 PolarHBondContact O-N 3.35Å; W471-N474 CarbonylContact O-C 3.5Å; W471-N474 WeakPolarHBondContact O-CB 3.45Å; W471-N474 PolarHBondContact O-N 3.28Å; W471-N474 VanDerWaalsContact O-N 3.11Å; W471-L475 HydrophobicContact CE3-CB 4.37Å; W471-L475 HydrophobicContact CE3-CD2 4.49Å; W471-L475 HydrophobicContact CZ3-CD2 3.93Å; W471-L475 PolarHBondContact O-N 2.82Å; W471-W501 HydrophobicContact CB-CB 3.58Å; W471-W501 HydrophobicContact CB-CD2 3.78Å; W471-W501 HydrophobicContact CB-CE3 4.19Å; W471-W501 HydrophobicContact CB-CG 3.5Å; W471-W501 VanDerWaalsContact CB-CG 3.5Å; W471-W501 HydrophobicContact CD2-CE3 4.36Å; W471-W501 AromaticContact CE3-CE3 3.97Å; W471-W501 HydrophobicContact CE3-CE3 3.97Å; W471-W501 HydrophobicContact CE3-CZ3 4.3Å; W471-W501 HydrophobicContact CG-CB 3.94Å; W471-W501 HydrophobicContact CG-CD2 4.47Å; W471-W501 HydrophobicContact CG-CE3 4.48Å; W471-W501 HydrophobicContact CG-CG 4.27Å; W471-S503 PolarHBondContact NE1-OG 3.09Å
472	I	85.5	Confident	79.4	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-59.6	-37.8	176	-74.5	-172.5	0	0	0	111.9	I318 I335 Y451 L469 S470 N474 L475 S476	I318-I472 HydrophobicContact CD1-CD1 4.34Å; I335-I472 HydrophobicContact CD1-CD1 3.46Å; I335-I472 VanDerWaalsContact CD1-CD1 3.46Å; I335-I472 HydrophobicContact CD1-CG1 3.52Å; Y451-I472 HydrophobicContact CD2-CG2 3.27Å; Y451-I472 HydrophobicContact CE2-CG2 3.89Å; Y451-I472 HydrophobicContact CG-CG2 3.73Å; L469-I472 HydrophobicContact CB-CD1 3.61Å; L469-I472 HydrophobicContact CB-CG1 3.66Å; L469-I472 HydrophobicContact CD1-CD1 3.64Å; L469-I472 HydrophobicContact CD1-CG1 4.34Å; L469-I472 HydrophobicContact CG-CD1 4.26Å; L469-I472 WeakPolarHBondContact O-CB 3.5Å; L469-I472 WeakPolarHBondContact O-CG1 3.47Å; L469-I472 PolarHBondContact O-N 3.38Å; S470-I472 PolarHBondContact O-N 3.05Å; I472-N474 VanDerWaalsContact C-N 3.33Å; I472-L475 PolarHBondContact O-N 3.35Å; I472-S476 PolarHBondContact O-N 3.49Å; I472-S476 PolarHBondContact O-OG 3.12Å
473	E	79.1	Confident	79	Confident	105 Å²	105	37.3 Å²	37.3	49%	0.491	19%	0.193	S	C	.	.	H	α-helix	trans	-66.4	-38.7	176.7	-64.8	-174.1	168.4	0	0	111.1	Q454 W471 S476 L477	Q454-E473 PolarHBondContact NE2-OE1 3.3Å; W471-E473 VanDerWaalsContact C-N 3.26Å; W471-E473 PolarHBondContact O-N 3.35Å; E473-S476 PolarHBondContact O-N 3.09Å; E473-S476 PolarHBondContact O-OG 3.45Å; E473-L477 WeakPolarHBondContact O-CG 3.36Å; E473-L477 PolarHBondContact O-N 2.86Å
474	N	81.7	Confident	78.2	Confident	80 Å²	80	40.5 Å²	40.5	43%	0.428	22%	0.215	S	C	.	.	H	α-helix	trans	-67.9	-40.3	174.8	-63.1	-20.8	0	0	0	111.1	W471 I472 S476 L477 W478 W501	W471-N474 CarbonylContact O-C 3.5Å; W471-N474 WeakPolarHBondContact O-CB 3.45Å; W471-N474 PolarHBondContact O-N 3.28Å; W471-N474 VanDerWaalsContact O-N 3.11Å; I472-N474 VanDerWaalsContact C-N 3.33Å; N474-S476 VanDerWaalsContact C-N 3.33Å; N474-S476 PolarHBondContact O-N 3.35Å; N474-L477 PolarHBondContact O-N 2.49Å; N474-W478 WeakPolarHBondContact O-CB 3.19Å; N474-W478 PolarHBondContact O-N 3.19Å; N474-W501 HydrophobicContact CB-CZ2 3.99Å
475	L	83.7	Confident	76.8	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-41.9	175.4	175.5	62.6	0	0	0	111.6	P333 I335 I349 Y451 W471 I472 W478 C479 W501	P333-L475 HydrophobicContact CG-CD2 4.47Å; I335-L475 HydrophobicContact CD1-CD2 4.11Å; I335-L475 HydrophobicContact CG1-CD2 4.28Å; I349-L475 HydrophobicContact CD1-CD1 3.79Å; I349-L475 HydrophobicContact CD1-CD2 3.64Å; I349-L475 HydrophobicContact CD1-CG 4.32Å; I349-L475 HydrophobicContact CG1-CD2 4.1Å; Y451-L475 HydrophobicContact CE2-CD2 4.33Å; Y451-L475 WeakPolarHBondContact OH-CD2 3.46Å; W471-L475 HydrophobicContact CE3-CB 4.37Å; W471-L475 HydrophobicContact CE3-CD2 4.49Å; W471-L475 HydrophobicContact CZ3-CD2 3.93Å; W471-L475 PolarHBondContact O-N 2.82Å; I472-L475 PolarHBondContact O-N 3.35Å; L475-W478 HydrophobicContact CD1-CE3 4.45Å; L475-W478 PolarHBondContact O-N 3.38Å; L475-C479 WeakPolarHBondContact O-CB 3.27Å; L475-C479 PolarHBondContact O-N 2.97Å; L475-C479 PolarHBondContact O-SG 3.48Å; L475-W501 HydrophobicContact CB-CH2 3.81Å; L475-W501 HydrophobicContact CB-CZ3 4.03Å; L475-W501 HydrophobicContact CD1-CH2 3.82Å; L475-W501 HydrophobicContact CD1-CZ3 4Å; L475-W501 HydrophobicContact CG-CH2 4.42Å
476	S	79.7	Confident	75.2	Confident	14 Å²	14	50.5 Å²	50.5	10%	0.098	27%	0.265	C	S	.	.	H	α-helix	trans	-69.2	-38.5	179.7	68.1	0	0	0	0	112.6	L449 I472 E473 N474 S480	L449-S476 WeakPolarHBondContact O-CB 3.32Å; L449-S476 PolarHBondContact O-OG 3.5Å; I472-S476 PolarHBondContact O-N 3.49Å; I472-S476 PolarHBondContact O-OG 3.12Å; E473-S476 PolarHBondContact O-N 3.09Å; E473-S476 PolarHBondContact O-OG 3.45Å; N474-S476 VanDerWaalsContact C-N 3.33Å; N474-S476 PolarHBondContact O-N 3.35Å; S476-S480 PolarHBondContact O-N 3Å; S476-S480 VanDerWaalsContact O-N 3.13Å
477	L	76.5	Confident	73.2	Confident	84 Å²	84	57.6 Å²	57.6	44%	0.44	30%	0.302	S	S	.	.	H	α-helix	trans	-60.8	-49.4	169.9	-74.9	166.9	0	0	0	110.6	E473 N474 C479 S480 E481	E473-L477 WeakPolarHBondContact O-CG 3.36Å; E473-L477 PolarHBondContact O-N 2.86Å; N474-L477 PolarHBondContact O-N 2.49Å; L477-C479 PolarHBondContact O-N 3.1Å; L477-S480 CarbonylContact O-C 3.38Å; L477-S480 WeakPolarHBondContact O-CA 3.37Å; L477-S480 WeakPolarHBondContact O-CB 3.47Å; L477-S480 PolarHBondContact O-N 3.21Å; L477-S480 PolarHBondContact O-OG 3.1Å; L477-E481 PolarHBondContact O-N 3.3Å
478	W	77.3	Confident	70.8	Confident	73 Å²	73	60.5 Å²	60.5	28%	0.277	32%	0.323	S	S	.	.	H	α-helix	trans	-58	-44.9	179.3	-171.8	84.3	0	0	0	112.1	N474 L475 S480 E481 F482	N474-W478 WeakPolarHBondContact O-CB 3.19Å; N474-W478 PolarHBondContact O-N 3.19Å; L475-W478 HydrophobicContact CD1-CE3 4.45Å; L475-W478 PolarHBondContact O-N 3.38Å; W478-S480 VanDerWaalsContact C-N 3.28Å; W478-S480 PolarHBondContact O-N 3.16Å; W478-E481 PolarHBondContact O-N 3.3Å; W478-F482 AromaticContact CH2-CD2 3.78Å; W478-F482 HydrophobicContact CH2-CD2 3.78Å; W478-F482 HydrophobicContact CH2-CE2 4.03Å; W478-F482 HydrophobicContact CH2-CG 4.34Å; W478-F482 AromaticContact CZ2-CD2 3.64Å; W478-F482 HydrophobicContact CZ2-CD2 3.64Å; W478-F482 AromaticContact CZ2-CE2 3.96Å; W478-F482 HydrophobicContact CZ2-CE2 3.96Å; W478-F482 HydrophobicContact CZ3-CD2 4.42Å; W478-F482 VanDerWaalsContact O-CB 3.29Å; W478-F482 WeakPolarHBondContact O-CB 3.35Å; W478-F482 PolarHBondContact O-N 2.83Å
479	C	76.9	Confident	68.8	Low	17 Å²	17	66.4 Å²	66.4	12%	0.115	36%	0.355	C	S	.	.	H	α-helix	trans	-63.2	-33.6	174.9	-66	0	0	0	0	112.7	L449 L475 L477 N483	L449-C479 HydrophobicContact CD1-CB 3.77Å; L475-C479 WeakPolarHBondContact O-CB 3.27Å; L475-C479 PolarHBondContact O-N 2.97Å; L475-C479 PolarHBondContact O-SG 3.48Å; L477-C479 PolarHBondContact O-N 3.1Å; C479-N483 PolarHBondContact O-ND2 3.31Å
480	S	71.3	Confident	66.6	Low	39 Å²	39	70.2 Å²	70.2	27%	0.273	38%	0.381	S	S	.	.	H	α-helix	trans	-73.9	-35.6	177.2	73.6	0	0	0	0	112.6	S476 L477 W478	S476-S480 PolarHBondContact O-N 3Å; S476-S480 VanDerWaalsContact O-N 3.13Å; L477-S480 CarbonylContact O-C 3.38Å; L477-S480 WeakPolarHBondContact O-CA 3.37Å; L477-S480 WeakPolarHBondContact O-CB 3.47Å; L477-S480 PolarHBondContact O-N 3.21Å; L477-S480 PolarHBondContact O-OG 3.1Å; W478-S480 VanDerWaalsContact C-N 3.28Å; W478-S480 PolarHBondContact O-N 3.16Å
481	E	69.5	Low	64.9	Low	92 Å²	92	75 Å²	75	43%	0.43	40%	0.4	S	S	.	.	H	α-helix	trans	-77.8	-36.6	176.9	-71.1	-171.8	174.6	0	0	112.7	L477 W478 N483 S484 Q485	L477-E481 PolarHBondContact O-N 3.3Å; W478-E481 PolarHBondContact O-N 3.3Å; E481-N483 PolarHBondContact O-N 2.88Å; E481-S484 CarbonylContact O-C 3.59Å; E481-S484 WeakPolarHBondContact O-CA 3.25Å; E481-S484 PolarHBondContact O-N 2.61Å; E481-S484 PolarHBondContact O-OG 2.74Å; E481-Q485 PolarHBondContact O-N 2.8Å
482	F	64.5	Low	63.2	Low	91 Å²	91	83.8 Å²	83.8	40%	0.399	44%	0.439	S	S	.	.	H	α-helix	trans	-58.3	-37.1	176.4	-160.8	-92.7	0	0	0	111.2	W478 S484 L486	W478-F482 AromaticContact CH2-CD2 3.78Å; W478-F482 HydrophobicContact CH2-CD2 3.78Å; W478-F482 HydrophobicContact CH2-CE2 4.03Å; W478-F482 HydrophobicContact CH2-CG 4.34Å; W478-F482 AromaticContact CZ2-CD2 3.64Å; W478-F482 HydrophobicContact CZ2-CD2 3.64Å; W478-F482 AromaticContact CZ2-CE2 3.96Å; W478-F482 HydrophobicContact CZ2-CE2 3.96Å; W478-F482 HydrophobicContact CZ3-CD2 4.42Å; W478-F482 VanDerWaalsContact O-CB 3.29Å; W478-F482 WeakPolarHBondContact O-CB 3.35Å; W478-F482 PolarHBondContact O-N 2.83Å; F482-S484 VanDerWaalsContact C-N 3.28Å; F482-S484 PolarHBondContact O-N 2.96Å; F482-L486 HydrophobicContact CE1-CD1 4.38Å; F482-L486 PolarHBondContact O-N 2.78Å
483	N	58.1	Low	61.4	Low	54 Å²	54	86.9 Å²	86.9	29%	0.289	46%	0.461	S	S	.	.	H	α-helix	trans	-65.7	-25.8	173.5	-85.3	-40.4	0	0	0	113.9	F329 C479 E481	F329-N483 PolarHBondContact O-ND2 3.13Å; F329-N483 PolarHBondContact O-OD1 2.89Å; C479-N483 PolarHBondContact O-ND2 3.31Å; E481-N483 PolarHBondContact O-N 2.88Å
484	S	55.9	Low	60.2	Low	68 Å²	68	83.9 Å²	83.9	48%	0.476	45%	0.45	S	S	.	.	H	α-helix	trans	-93.6	-30.9	177.8	67	0	0	0	0	113.1	E481 F482 L487	E481-S484 CarbonylContact O-C 3.59Å; E481-S484 WeakPolarHBondContact O-CA 3.25Å; E481-S484 PolarHBondContact O-N 2.61Å; E481-S484 PolarHBondContact O-OG 2.74Å; F482-S484 VanDerWaalsContact C-N 3.28Å; F482-S484 PolarHBondContact O-N 2.96Å; S484-L487 PolarHBondContact O-N 3.42Å
485	Q	49.9	Very low	58.9	Low	78 Å²	78	85.4 Å²	85.4	36%	0.364	46%	0.458	S	S	.	.	H	α-helix	trans	-75.6	-20.5	180	-73.7	-177.5	6.9	0	0	114.4	E481 L487 S488	E481-Q485 PolarHBondContact O-N 2.8Å; Q485-L487 PolarHBondContact O-N 2.99Å; Q485-S488 PolarHBondContact O-N 2.76Å; Q485-S488 VanDerWaalsContact O-O 3.1Å
486	L	49	Very low	57.6	Low	137 Å²	137	92.4 Å²	92.4	72%	0.717	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-10.8	167.5	-90.7	162.8	0	0	0	113.3	F482	F482-L486 HydrophobicContact CE1-CD1 4.38Å; F482-L486 PolarHBondContact O-N 2.78Å
487	L	44.6	Very low	56.9	Low	161 Å²	161	98 Å²	98	84%	0.843	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-2.8	175.4	-66.4	163.6	0	0	0	114.1	S484 Q485	S484-L487 PolarHBondContact O-N 3.42Å; Q485-L487 PolarHBondContact O-N 2.99Å
488	S	39.8	Very low	56.5	Low	62 Å²	62	96.9 Å²	96.9	43%	0.434	51%	0.509	S	S	.	.			trans	-140.6	125.3	-178.5	62.3	0	0	0	0	113.9	Q485 S490	Q485-S488 PolarHBondContact O-N 2.76Å; Q485-S488 VanDerWaalsContact O-O 3.1Å; S488-S490 PolarHBondContact O-N 3.3Å
489	D	45.3	Very low	56.2	Low	172 Å²	172	103.1 Å²	103.1	92%	0.92	53%	0.532	S	S	*	.			trans	-69.2	16.1	-174.1	-72.6	-34.4	0	0	0	116	I491	D489-I491 PolarHBondContact O-N 3.27Å; D489-I491 VanDerWaalsContact O-N 3.14Å
490	S	42.8	Very low	56	Low	81 Å²	81	108.6 Å²	108.6	57%	0.566	56%	0.56	S	S	*	*			trans	-88.8	85.3	-178.3	78.8	0	0	0	0	111.8	S488 K492	S488-S490 PolarHBondContact O-N 3.3Å; S490-K492 PolarHBondContact O-N 2.8Å
491	I	45.8	Very low	56.7	Low	156 Å²	156	107.6 Å²	107.6	80%	0.8	55%	0.55	S	S	*	*			trans	-75.4	84.8	172.8	-52.6	170.3	0	0	0	108.8	D489	D489-I491 PolarHBondContact O-N 3.27Å; D489-I491 VanDerWaalsContact O-N 3.14Å
492	K	49.7	Very low	57.4	Low	186 Å²	186	109.5 Å²	109.5	81%	0.809	56%	0.559	S	S	*	*			trans	-83	120.7	148.2	-81	-173.2	176.7	-177.4	0	105.9	S490 P494	S490-K492 PolarHBondContact O-N 2.8Å; K492-P494 WeakPolarHBondContact O-CD 3.31Å; K492-P494 VanDerWaalsContact O-N 3.1Å
493	S	48.5	Very low	58.6	Low	69 Å²	69	106 Å²	106	48%	0.483	55%	0.546	S	S	.	.			trans	-61.5	110.6	-172.4	50.9	0	0	0	0	111	I495	S493-I495 PolarHBondContact O-N 3.29Å
494	P	53.6	Low	59.9	Low	42 Å²	42	106.5 Å²	106.5	27%	0.273	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.9	0.7	179.7	27.5	-33.4	0	0	0	113.5	K492 E496 E497	K492-P494 WeakPolarHBondContact O-CD 3.31Å; K492-P494 VanDerWaalsContact O-N 3.1Å; P494-E496 PolarHBondContact O-N 3.37Å; P494-E497 PolarHBondContact O-N 3.02Å
495	I	55.5	Low	61.3	Low	113 Å²	113	105.4 Å²	105.4	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-69.7	-31.8	-173.2	-62.1	167.5	0	0	0	112.1	S493	S493-I495 PolarHBondContact O-N 3.29Å
496	E	56.5	Low	62.8	Low	151 Å²	151	107.3 Å²	107.3	71%	0.706	55%	0.551	S	S	*	*	H	α-helix	trans	-70.3	-37.9	179.1	-72.1	-172.9	165.8	0	0	111.8	P494 I498 R499	P494-E496 PolarHBondContact O-N 3.37Å; E496-I498 VanDerWaalsContact C-N 3.32Å; E496-I498 PolarHBondContact O-N 3.05Å; E496-R499 PolarHBondContact O-N 2.99Å
497	E	63.7	Low	64.3	Low	132 Å²	132	105.8 Å²	105.8	62%	0.617	54%	0.54	S	S	*	.	H	α-helix	trans	-67.9	-29.8	-179.4	-70.7	-177.6	174.1	0	0	113.3	P494 W501	P494-E497 PolarHBondContact O-N 3.02Å; E497-W501 PolarHBondContact O-NE1 3.25Å; E497-W501 VanDerWaalsContact O-NE1 3.16Å
498	I	69	Low	65.6	Low	61 Å²	61	99.2 Å²	99.2	31%	0.313	51%	0.505	S	S	.	.	H	α-helix	trans	-73.5	-30.7	180	-62.2	169.2	0	0	0	111.4	E496 D500 W501	E496-I498 VanDerWaalsContact C-N 3.32Å; E496-I498 PolarHBondContact O-N 3.05Å; I498-D500 PolarHBondContact O-N 2.91Å; I498-W501 HydrophobicContact CG1-CH2 4.35Å; I498-W501 HydrophobicContact CG1-CZ2 4.13Å; I498-W501 HydrophobicContact CG2-CD2 4.37Å; I498-W501 HydrophobicContact CG2-CE3 4.29Å; I498-W501 WeakPolarHBondContact O-CB 3.33Å; I498-W501 PolarHBondContact O-N 2.81Å; I498-W501 VanDerWaalsContact O-N 3.1Å
499	R	69.5	Low	67	Low	203 Å²	203	97 Å²	97	77%	0.766	49%	0.489	S	S	*	.	H	α-helix	trans	-63.7	-23.2	-179.5	-76.3	-170.8	-176.6	-149.8	1.1	113.5	E496 W501	E496-R499 PolarHBondContact O-N 2.99Å; R499-W501 VanDerWaalsContact C-N 3.32Å
500	D	74.6	Confident	67.9	Low	132 Å²	132	92 Å²	92	71%	0.706	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	2.2	-179.9	-66.3	-19.2	0	0	0	112.7	I498 Q502	I498-D500 PolarHBondContact O-N 2.91Å; D500-Q502 PolarHBondContact O-N 2.89Å; D500-Q502 VanDerWaalsContact O-N 3.13Å
501	W	85.1	Confident	68.6	Low	19 Å²	19	89.9 Å²	89.9	7%	0.072	46%	0.458	C	S	.	.			trans	-73.9	106.7	178.6	-70.7	13.2	0	0	0	110.2	I349 I375 W471 N474 L475 E497 I498 R499	I349-W501 HydrophobicContact CD1-CZ3 4Å; I375-W501 HydrophobicContact CD1-CE3 4.49Å; I375-W501 HydrophobicContact CG2-CB 3.81Å; I375-W501 HydrophobicContact CG2-CE3 3.92Å; W471-W501 HydrophobicContact CB-CB 3.58Å; W471-W501 HydrophobicContact CB-CD2 3.78Å; W471-W501 HydrophobicContact CB-CE3 4.19Å; W471-W501 HydrophobicContact CB-CG 3.5Å; W471-W501 VanDerWaalsContact CB-CG 3.5Å; W471-W501 HydrophobicContact CD2-CE3 4.36Å; W471-W501 AromaticContact CE3-CE3 3.97Å; W471-W501 HydrophobicContact CE3-CE3 3.97Å; W471-W501 HydrophobicContact CE3-CZ3 4.3Å; W471-W501 HydrophobicContact CG-CB 3.94Å; W471-W501 HydrophobicContact CG-CD2 4.47Å; W471-W501 HydrophobicContact CG-CE3 4.48Å; W471-W501 HydrophobicContact CG-CG 4.27Å; N474-W501 HydrophobicContact CB-CZ2 3.99Å; L475-W501 HydrophobicContact CB-CH2 3.81Å; L475-W501 HydrophobicContact CB-CZ3 4.03Å; L475-W501 HydrophobicContact CD1-CH2 3.82Å; L475-W501 HydrophobicContact CD1-CZ3 4Å; L475-W501 HydrophobicContact CG-CH2 4.42Å; E497-W501 PolarHBondContact O-NE1 3.25Å; E497-W501 VanDerWaalsContact O-NE1 3.16Å; I498-W501 HydrophobicContact CG1-CH2 4.35Å; I498-W501 HydrophobicContact CG1-CZ2 4.13Å; I498-W501 HydrophobicContact CG2-CD2 4.37Å; I498-W501 HydrophobicContact CG2-CE3 4.29Å; I498-W501 WeakPolarHBondContact O-CB 3.33Å; I498-W501 PolarHBondContact O-N 2.81Å; I498-W501 VanDerWaalsContact O-N 3.1Å; R499-W501 VanDerWaalsContact C-N 3.32Å
502	Q	85	Confident	68.9	Low	132 Å²	132	86.1 Å²	86.1	62%	0.617	44%	0.437	S	S	*	.			trans	-132.8	142.1	177.8	-66.3	-175.9	-10.6	0	0	110.3	S470 D500	S470-Q502 PolarHBondContact OG-O 2.8Å; D500-Q502 PolarHBondContact O-N 2.89Å; D500-Q502 VanDerWaalsContact O-N 3.13Å
503	S	88.9	Confident	68.8	Low	18 Å²	18	78.1 Å²	78.1	13%	0.126	40%	0.403	C	S	.	.			trans	-83.8	154.6	172.6	-42.8	0	0	0	0	109.4	D376 N468 L469 W471	D376-S503 WeakPolarHBondContact OD2-CA 3.43Å; D376-S503 WeakPolarHBondContact OD2-CB 3.41Å; D376-S503 PolarHBondContact OD2-N 3.1Å; D376-S503 PolarHBondContact OD2-OG 2.87Å; N468-S503 WeakPolarHBondContact O-CA 3.36Å; L469-S503 VanDerWaalsContact CD2-OG 3.22Å; L469-S503 WeakPolarHBondContact CD2-OG 3.21Å; W471-S503 PolarHBondContact NE1-OG 3.09Å
504	C	85.3	Confident	68.4	Low	63 Å²	63	78.7 Å²	78.7	43%	0.426	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.8	174.5	67.1	0	0	0	0	111.5	V467 N468	V467-C504 WeakPolarHBondContact CA-O 3.15Å; N468-C504 PolarHBondContact N-O 2.68Å; N468-C504 PolarHBondContact O-N 3.08Å
505	V	85.8	Confident	67.8	Low	46 Å²	46	78.3 Å²	78.3	28%	0.279	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.4	178.6	-173	0	0	0	0	109.6	V378 L380 H465 V467	V378-V505 HydrophobicContact CB-CG2 4.39Å; V378-V505 HydrophobicContact CG1-CG2 3.14Å; V378-V505 HydrophobicContact CG2-CG2 4.39Å; L380-V505 HydrophobicContact CD2-CG1 3.78Å; L380-V505 HydrophobicContact CD2-CG2 4.38Å; H465-V505 HydrophobicContact CB-CG1 4.25Å; V467-V505 HydrophobicContact CG2-CG2 4.31Å
506	K	81.8	Confident	66.9	Low	118 Å²	118	77.8 Å²	77.8	51%	0.513	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	109.9	165.5	-165.6	176.3	-177.6	177	0	108.9	L466 L508	L466-K506 HydrophobicContact CB-CB 4.39Å; L466-K506 PolarHBondContact N-O 3.09Å; L466-K506 PolarHBondContact O-N 2.88Å; K506-L508 HydrophobicContact CD-CD2 4.1Å; K506-L508 HydrophobicContact CG-CD2 4.08Å; K506-L508 PolarHBondContact O-N 3.14Å; K506-L508 VanDerWaalsContact O-N 3.14Å
507	H	79.8	Confident	66.2	Low	105 Å²	105	74 Å²	74	49%	0.486	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	104.4	171.9	-67.3	-94.4	0	0	0	108.7	H465 C510	H465-H507 AromaticContact CE1-CE1 3.52Å; H465-H507 AromaticContact CE1-ND1 3.05Å; H465-H507 PolarHBondContact CE1-ND1 3.39Å; H465-H507 AromaticContact ND1-CE1 3.3Å; H465-H507 PolarHBondContact ND1-CE1 3.4Å; H465-H507 VanDerWaalsContact ND1-CE1 3.3Å; H465-H507 AromaticContact ND1-CG 3.71Å; H465-H507 AromaticContact ND1-ND1 2.91Å; H465-H507 PolarHBondContact ND1-ND1 3.38Å; H507-C510 VanDerWaalsContact CB-SG 3.52Å; H507-C510 PolarHBondContact ND1-SG 3.46Å
508	L	71.3	Confident	65	Low	23 Å²	23	74 Å²	74	12%	0.12	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-43.7	-177.4	-59.2	178.3	0	0	0	110.6	Y457 I464 L466 K506 L566 I592 L594	Y457-L508 HydrophobicContact CD1-CD1 4.11Å; Y457-L508 HydrophobicContact CE1-CD1 3.97Å; I464-L508 HydrophobicContact CG2-CD1 4.15Å; I464-L508 WeakPolarHBondContact O-CB 3.43Å; I464-L508 PolarHBondContact O-N 2.99Å; L466-L508 HydrophobicContact CB-CD1 3.82Å; L466-L508 HydrophobicContact CB-CD2 4.37Å; L466-L508 HydrophobicContact CB-CG 4.05Å; K506-L508 HydrophobicContact CD-CD2 4.1Å; K506-L508 HydrophobicContact CG-CD2 4.08Å; K506-L508 PolarHBondContact O-N 3.14Å; K506-L508 VanDerWaalsContact O-N 3.14Å; L508-L566 HydrophobicContact CD1-CD1 3.41Å; L508-L566 VanDerWaalsContact CD1-CD1 3.41Å; L508-I592 HydrophobicContact CB-CD1 4.34Å; L508-I592 WeakPolarHBondContact O-CD1 3.32Å; L508-L594 HydrophobicContact CD2-CD2 3.71Å
509	V	68.8	Low	63.7	Low	14 Å²	14	77.4 Å²	77.4	9%	0.085	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	123	178.2	-176.7	0	0	0	0	107.1	G463 I464 I513 F568 I592	G463-V509 CarbonylContact C-O 3.56Å; G463-V509 WeakPolarHBondContact CA-O 3.44Å; I464-V509 HydrophobicContact CB-CB 4.46Å; I464-V509 PolarHBondContact N-O 3.42Å; I464-V509 PolarHBondContact O-N 3.44Å; V509-I513 HydrophobicContact CG1-CD1 3.64Å; V509-I513 HydrophobicContact CG1-CG1 3.87Å; V509-F568 HydrophobicContact CG1-CE2 4.43Å; V509-F568 HydrophobicContact CG2-CD1 4.44Å; V509-F568 HydrophobicContact CG2-CD2 4.25Å; V509-F568 HydrophobicContact CG2-CE1 4.04Å; V509-F568 HydrophobicContact CG2-CE2 3.76Å; V509-F568 HydrophobicContact CG2-CZ 3.62Å; V509-I592 HydrophobicContact CG2-CD1 3.91Å
510	C	65.9	Low	62.2	Low	67 Å²	67	71.9 Å²	71.9	45%	0.453	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	139.8	177.4	-66.3	0	0	0	0	111.5	M462 H465 H507	M462-C510 CarbonylContact O-C 3.49Å; H465-C510 PolarHBondContact CE1-SG 3.31Å; H507-C510 VanDerWaalsContact CB-SG 3.52Å; H507-C510 PolarHBondContact ND1-SG 3.46Å
511	G	55.9	Low	60.1	Low	37 Å²	37	72.7 Å²	72.7	38%	0.381	43%	0.43	S	S	.	.	S	Bend	trans	86.3	175	173.9	0	0	0	0	0	114.9	M462 I513	M462-G511 PolarHBondContact O-N 3.09Å; G511-I513 PolarHBondContact O-N 3.15Å; G511-I513 VanDerWaalsContact O-N 3.1Å
512	Q	52.2	Low	57.9	Low	77 Å²	77	77.2 Å²	77.2	36%	0.36	46%	0.455	S	S	.	.	S	Bend	trans	-56.9	115.8	161.2	-76.4	-179.8	-27.5	0	0	107	T514 K528 F529 I573	Q512-T514 PolarHBondContact O-N 2.9Å; Q512-K528 HydrophobicContact CB-CB 4.36Å; Q512-F529 WeakPolarHBondContact CA-O 3.27Å; Q512-I573 HydrophobicContact CG-CD1 3.75Å; Q512-I573 VanDerWaalsContact NE2-CD1 3.27Å
513	I	48	Very low	55.8	Low	19 Å²	19	78.6 Å²	78.6	10%	0.097	47%	0.467	C	S	.	.			trans	-74.1	91.2	-172.5	-53.2	165.8	0	0	0	107.1	V509 G511 I515 F529 R570	V509-I513 HydrophobicContact CG1-CD1 3.64Å; V509-I513 HydrophobicContact CG1-CG1 3.87Å; G511-I513 PolarHBondContact O-N 3.15Å; G511-I513 VanDerWaalsContact O-N 3.1Å; I513-I515 HydrophobicContact CG2-CG1 4.2Å; I513-F529 HydrophobicContact CB-CB 4.23Å; I513-F529 PolarHBondContact N-O 3.49Å; I513-F529 WeakPolarHBondContact O-CD2 3.31Å; I513-F529 PolarHBondContact O-N 2.81Å; I513-R570 HydrophobicContact CD1-CG 3.96Å
514	T	41	Very low	53.5	Low	80 Å²	80	85.1 Å²	85.1	49%	0.491	50%	0.5	S	S	.	.			trans	-75.4	135.2	167.9	26.6	0	0	0	0	109	Q512 E526	Q512-T514 PolarHBondContact O-N 2.9Å; T514-E526 HydrophobicContact CG2-CG 4.05Å
515	I	40.3	Very low	51.5	Low	35 Å²	35	87.2 Å²	87.2	18%	0.179	51%	0.506	C	S	.	.			trans	-120.7	116.5	178.4	-54	162.9	0	0	0	107.3	I513 F529 C587	I513-I515 HydrophobicContact CG2-CG1 4.2Å; I515-F529 HydrophobicContact CD1-CD2 4.14Å; I515-F529 HydrophobicContact CD1-CE2 4.01Å; I515-F529 HydrophobicContact CD1-CZ 4.47Å; I515-C587 HydrophobicContact CD1-CB 4.48Å
516	S	35.9	Very low	49.5	Very low	102 Å²	102	91.2 Å²	91.2	71%	0.713	52%	0.522	S	S	*	.			trans	-77.6	125	155.1	35.6	0	0	0	0	108.2
517	T	41.4	Very low	47.9	Very low	72 Å²	72	86.6 Å²	86.6	44%	0.442	51%	0.508	S	S	.	.			trans	-64.2	143.9	177.2	38.2	0	0	0	0	110.1	D519	T517-D519 PolarHBondContact O-N 3.08Å; T517-D519 VanDerWaalsContact O-N 3.09Å
518	P	40.1	Very low	46.7	Very low	131 Å²	131	86 Å²	86	85%	0.851	50%	0.504	S	S	*	.	S	Bend	trans	-69.8	-5.2	-174.8	-16.4	30.3	0	0	0	115.1
519	D	40.4	Very low	45.9	Very low	133 Å²	133	85.5 Å²	85.5	71%	0.711	50%	0.501	S	S	*	.	S	Bend	trans	-128.3	120.2	176.8	-79.3	-42	0	0	0	107.8	T517 M521	T517-D519 PolarHBondContact O-N 3.08Å; T517-D519 VanDerWaalsContact O-N 3.09Å; D519-M521 PolarHBondContact O-N 2.85Å
520	G	37.7	Very low	45.2	Very low	86 Å²	86	87.6 Å²	87.6	89%	0.887	51%	0.507	S	S	*	.			trans	-62.2	65.6	-172.5	0	0	0	0	0	115.3
521	M	31.2	Very low	44.8	Very low	149 Å²	149	86 Å²	86	73%	0.734	49%	0.494	S	S	*	.			trans	-119.8	105	172.1	-74.3	-70.6	172.4	0	0	108.2	D519	D519-M521 PolarHBondContact O-N 2.85Å
522	N	38.3	Very low	44.7	Very low	114 Å²	114	86 Å²	86	61%	0.61	49%	0.49	S	S	*	.			trans	66.1	105.4	174.1	-65	-13.7	0	0	0	117.3	D524	N522-D524 PolarHBondContact O-N 2.88Å; N522-D524 VanDerWaalsContact O-N 3.08Å
523	D	40.8	Very low	44.9	Very low	162 Å²	162	83 Å²	83	87%	0.866	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-60.5	-8.6	166.7	-69.3	-32.5	0	0	0	113.3	I525	D523-I525 VanDerWaalsContact C-N 3.33Å; D523-I525 PolarHBondContact O-N 2.73Å
524	D	42.3	Very low	45.5	Very low	154 Å²	154	84.1 Å²	84.1	82%	0.824	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-80.1	-2.9	-176.7	-67.6	-31.2	0	0	0	114.8	N522	N522-D524 PolarHBondContact O-N 2.88Å; N522-D524 VanDerWaalsContact O-N 3.08Å
525	I	43.3	Very low	46.6	Very low	108 Å²	108	80.6 Å²	80.6	55%	0.554	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-109.5	30.1	179.9	-37.4	177.7	0	0	0	111.5	D523 G527	D523-I525 VanDerWaalsContact C-N 3.33Å; D523-I525 PolarHBondContact O-N 2.73Å; I525-G527 PolarHBondContact O-N 2.79Å
526	E	42.5	Very low	47.6	Very low	129 Å²	129	81 Å²	81	60%	0.603	46%	0.464	S	S	*	.			trans	-73.2	74.5	170.4	-139.7	-178.1	-166.8	0	0	109.9	T514	T514-E526 HydrophobicContact CG2-CG 4.05Å
527	G	49.2	Very low	48.8	Very low	21 Å²	21	76.5 Å²	76.5	22%	0.216	43%	0.431	C	S	.	.			trans	-75.2	139.6	-179.8	0	0	0	0	0	111.6	I525 F529	I525-G527 PolarHBondContact O-N 2.79Å; G527-F529 WeakPolarHBondContact O-CD2 3.49Å; G527-F529 VanDerWaalsContact O-CE2 3.25Å; G527-F529 WeakPolarHBondContact O-CE2 3.06Å
528	K	53.6	Low	49.4	Very low	93 Å²	93	74.8 Å²	74.8	40%	0.404	42%	0.421	S	S	.	.			trans	-82.3	125.9	168.7	-63.2	170.9	165.9	-167	0	108.6	Q512 I573	Q512-K528 HydrophobicContact CB-CB 4.36Å; K528-I573 HydrophobicContact CB-CB 4.13Å; K528-I573 HydrophobicContact CB-CD1 3.71Å; K528-I573 HydrophobicContact CB-CG1 4.26Å; K528-I573 VanDerWaalsContact O-CB 3.23Å; K528-I573 WeakPolarHBondContact O-CB 3.49Å; K528-I573 VanDerWaalsContact O-CG1 3.23Å; K528-I573 WeakPolarHBondContact O-CG1 3.41Å; K528-I573 PolarHBondContact O-N 2.87Å
529	F	54	Low	50.1	Low	12 Å²	12	69.6 Å²	69.6	5%	0.053	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	149.6	178.5	-61.3	-99.6	0	0	0	112.2	Q512 I513 I515 G527 R570 A571 P572 L588	Q512-F529 WeakPolarHBondContact CA-O 3.27Å; I513-F529 HydrophobicContact CB-CB 4.23Å; I513-F529 PolarHBondContact N-O 3.49Å; I513-F529 WeakPolarHBondContact O-CD2 3.31Å; I513-F529 PolarHBondContact O-N 2.81Å; I515-F529 HydrophobicContact CD1-CD2 4.14Å; I515-F529 HydrophobicContact CD1-CE2 4.01Å; I515-F529 HydrophobicContact CD1-CZ 4.47Å; G527-F529 WeakPolarHBondContact O-CD2 3.49Å; G527-F529 VanDerWaalsContact O-CE2 3.25Å; G527-F529 WeakPolarHBondContact O-CE2 3.06Å; F529-R570 HydrophobicContact CB-CB 4.26Å; F529-R570 HydrophobicContact CD1-CB 4.35Å; F529-A571 CarbonylContact C-O 3.57Å; F529-A571 VanDerWaalsContact CA-O 3.29Å; F529-A571 WeakPolarHBondContact CA-O 3.35Å; F529-P572 HydrophobicContact CD1-CB 3.97Å; F529-P572 HydrophobicContact CD1-CG 4.19Å; F529-P572 HydrophobicContact CE1-CB 3.82Å; F529-P572 HydrophobicContact CE1-CG 3.91Å; F529-L588 HydrophobicContact CD1-CD2 3.92Å; F529-L588 HydrophobicContact CE1-CD2 3.57Å
530	R	55.5	Low	50.6	Low	59 Å²	59	67.4 Å²	67.4	22%	0.223	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	158	171.9	-75.1	174.2	-173	-166.9	1.9	110.9	R570 A571 I573	R530-R570 CarbonylContact O-C 3.5Å; R530-R570 WeakPolarHBondContact O-CA 3.47Å; R530-A571 PolarHBondContact N-O 3.23Å; R530-A571 PolarHBondContact O-N 3.26Å; R530-I573 HydrophobicContact CB-CG1 4.47Å; R530-I573 HydrophobicContact CG-CD1 3.65Å; R530-I573 HydrophobicContact CG-CG1 3.69Å
531	L	56.2	Low	51.1	Low	32 Å²	32	65.1 Å²	65.1	17%	0.168	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	127.1	171.9	-177	72.7	0	0	0	110.5	I459 I464 F568	I459-L531 HydrophobicContact CG2-CD2 4.06Å; I464-L531 HydrophobicContact CD1-CD1 3.83Å; I464-L531 HydrophobicContact CD1-CD2 3.67Å; I464-L531 HydrophobicContact CD1-CG 4.41Å; I464-L531 HydrophobicContact CG1-CD1 4.34Å; I464-L531 HydrophobicContact CG1-CD2 3.45Å; I464-L531 VanDerWaalsContact CG1-CD2 3.45Å; L531-F568 HydrophobicContact CD1-CB 3.89Å; L531-F568 HydrophobicContact CD1-CD2 4.4Å
532	A	55.1	Low	51.9	Low	38 Å²	38	60.7 Å²	60.7	31%	0.314	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	-22.2	179.1	0	0	0	0	0	113.5	I569 A571	A532-I569 HydrophobicContact CB-CG2 4.25Å; A532-I569 PolarHBondContact N-O 3.01Å; A532-A571 HydrophobicContact CB-CB 4Å
533	G	55.9	Low	52.1	Low	14 Å²	14	59.6 Å²	59.6	14%	0.144	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.8	158.4	178.5	0	0	0	0	0	113.5	F568 I569	G533-F568 VanDerWaalsContact O-CA 3.25Å; G533-F568 WeakPolarHBondContact O-CA 3.43Å; G533-F568 WeakPolarHBondContact O-CB 3.46Å; G533-I569 PolarHBondContact N-O 3.47Å; G533-I569 PolarHBondContact O-N 3.46Å
534	F	61.5	Low	52.2	Low	43 Å²	43	59.3 Å²	59.3	19%	0.189	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	135.1	-176.8	169.1	-103.9	0	0	0	110.6	Y457 I459 I464 L566 L567	Y457-F534 HydrophobicContact CD1-CZ 4.19Å; Y457-F534 AromaticContact CD2-CE1 3.9Å; Y457-F534 HydrophobicContact CD2-CE1 3.9Å; Y457-F534 AromaticContact CD2-CZ 3.88Å; Y457-F534 HydrophobicContact CD2-CZ 3.88Å; Y457-F534 HydrophobicContact CE1-CZ 4.1Å; Y457-F534 HydrophobicContact CE2-CE1 4.06Å; Y457-F534 AromaticContact CE2-CZ 3.77Å; Y457-F534 HydrophobicContact CE2-CZ 3.77Å; Y457-F534 HydrophobicContact CG-CE1 4.3Å; Y457-F534 HydrophobicContact CG-CZ 4.09Å; Y457-F534 AromaticContact CZ-CZ 3.9Å; I459-F534 HydrophobicContact CD1-CD1 3.93Å; I459-F534 HydrophobicContact CD1-CE1 4.42Å; I464-F534 HydrophobicContact CD1-CB 3.94Å; I464-F534 HydrophobicContact CD1-CD2 3.43Å; I464-F534 VanDerWaalsContact CD1-CD2 3.43Å; I464-F534 HydrophobicContact CD1-CE2 4.16Å; I464-F534 HydrophobicContact CD1-CG 3.9Å; I464-F534 HydrophobicContact CG2-CE2 4.41Å; F534-L566 HydrophobicContact CE2-CB 4.12Å; F534-L566 HydrophobicContact CE2-CD1 3.96Å; F534-L566 HydrophobicContact CE2-CD2 3.65Å; F534-L566 HydrophobicContact CE2-CG 4.11Å; F534-L566 HydrophobicContact CZ-CD1 4.45Å; F534-L566 HydrophobicContact CZ-CD2 3.67Å; F534-L567 CarbonylContact C-O 3.56Å
535	I	63.5	Low	52.1	Low	5 Å²	5	58.3 Å²	58.3	3%	0.026	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	131.5	178.4	-53.3	176.9	0	0	0	109.6	C32 I48 L537 L567	C32-I535 WeakPolarHBondContact SG-CD1 3.47Å; I48-I535 HydrophobicContact CD1-CD1 4.23Å; I48-I535 HydrophobicContact CG2-CD1 4.23Å; I535-L537 HydrophobicContact CG2-CD2 4.15Å; I535-L537 HydrophobicContact CG2-CG 4.41Å; I535-L567 HydrophobicContact CB-CB 4.32Å; I535-L567 HydrophobicContact CD1-CD2 4.3Å; I535-L567 PolarHBondContact N-O 3.13Å; I535-L567 PolarHBondContact O-N 3.39Å
536	E	61.8	Low	51.8	Low	44 Å²	44	61.7 Å²	61.7	21%	0.206	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	124.1	169.8	-169.9	172.1	145.9	0	0	110.5	Y457 V564 L566	Y457-E536 WeakPolarHBondContact CE2-OE2 3.42Å; Y457-E536 PolarHBondContact OH-OE2 2.94Å; E536-V564 VanDerWaalsContact CD-CG1 3.48Å; E536-V564 HydrophobicContact CG-CG1 3.25Å; E536-V564 WeakPolarHBondContact OE1-CG1 3.32Å; E536-L566 HydrophobicContact CB-CD2 4.06Å; E536-L566 HydrophobicContact CG-CD2 3.87Å
537	L	61.2	Low	51.3	Low	7 Å²	7	61.4 Å²	61.4	4%	0.037	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.4	177.9	-61.2	169.4	0	0	0	110.4	L46 I535 F541 T565 L567 F591	L46-L537 HydrophobicContact CD2-CD2 3.68Å; I535-L537 HydrophobicContact CG2-CD2 4.15Å; I535-L537 HydrophobicContact CG2-CG 4.41Å; L537-F541 HydrophobicContact CD1-CD1 4.29Å; L537-T565 WeakPolarHBondContact CA-O 3.48Å; L537-T565 WeakPolarHBondContact CB-O 3.48Å; L537-T565 PolarHBondContact N-O 2.94Å; L537-T565 PolarHBondContact O-N 2.77Å; L537-T565 VanDerWaalsContact O-O 3.12Å; L537-L567 HydrophobicContact CD1-CB 3.86Å; L537-L567 HydrophobicContact CD1-CD2 4.17Å; L537-L567 HydrophobicContact CG-CB 4.42Å; L537-F591 HydrophobicContact CD1-CE1 4.34Å
538	P	54	Low	50.6	Low	36 Å²	36	70.2 Å²	70.2	23%	0.234	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	149.8	176.9	29.4	-35	0	0	0	112.2	Y36 N540 F541	Y36-P538 WeakPolarHBondContact OH-CD 3.33Å; Y36-P538 WeakPolarHBondContact OH-CG 3.25Å; P538-N540 PolarHBondContact O-N 3.3Å; P538-F541 WeakPolarHBondContact O-CB 3.38Å; P538-F541 PolarHBondContact O-N 3.13Å
539	S	53.7	Low	49.6	Very low	23 Å²	23	71.1 Å²	71.1	16%	0.161	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-48.4	-29.7	-178.5	40.2	0	0	0	0	115.7	F541 G563	S539-F541 PolarHBondContact O-N 3.31Å; S539-F541 VanDerWaalsContact O-N 3.13Å; S539-G563 WeakPolarHBondContact CA-O 3.29Å; S539-G563 WeakPolarHBondContact CB-O 3.36Å; S539-G563 PolarHBondContact N-O 3.26Å; S539-G563 PolarHBondContact OG-O 2.87Å
540	N	50.6	Low	48.7	Very low	87 Å²	87	79.6 Å²	79.6	47%	0.465	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-68	-12.8	-174.4	-62.2	-11	0	0	0	112.3	P538	P538-N540 PolarHBondContact O-N 3.3Å
541	F	48.4	Very low	47.4	Very low	38 Å²	38	83.7 Å²	83.7	17%	0.167	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-70.3	-32.9	-175.6	-151	-98.7	0	0	0	114.1	V63 L537 P538 S539	V63-F541 HydrophobicContact CG1-CE2 3.35Å; V63-F541 HydrophobicContact CG1-CZ 3.49Å; V63-F541 VanDerWaalsContact CG1-CZ 3.49Å; L537-F541 HydrophobicContact CD1-CD1 4.29Å; P538-F541 WeakPolarHBondContact O-CB 3.38Å; P538-F541 PolarHBondContact O-N 3.13Å; S539-F541 PolarHBondContact O-N 3.31Å; S539-F541 VanDerWaalsContact O-N 3.13Å
542	L	47.4	Very low	46.3	Very low	56 Å²	56	88.4 Å²	88.4	29%	0.293	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-17.8	-172.3	-74.4	173.6	0	0	0	114.8	L3 K544 T565	L3-L542 HydrophobicContact CD1-CD2 3.82Å; L3-L542 HydrophobicContact CD2-CD2 4.33Å; L542-K544 PolarHBondContact O-N 3.05Å; L542-T565 HydrophobicContact CD1-CG2 3.54Å
543	S	43.4	Very low	45	Very low	91 Å²	91	93.7 Å²	93.7	64%	0.636	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	14.7	-159.7	81.4	0	0	0	0	117
544	K	43.9	Very low	43.8	Very low	155 Å²	155	98.5 Å²	98.5	67%	0.674	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	12.6	-171.2	-84.6	-175.6	179.7	172.9	0	117.3	L542	L542-K544 PolarHBondContact O-N 3.05Å
545	N	40.1	Very low	42.1	Very low	134 Å²	134	105.6 Å²	105.6	72%	0.717	57%	0.569	S	S	*	*			trans	-100.2	33.8	179.4	-65.4	-25.7	0	0	0	115.1
546	Q	35.2	Very low	40.3	Very low	179 Å²	179	108.8 Å²	108.8	84%	0.836	60%	0.596	S	S	*	*	S	Bend	trans	-95.1	123.8	160.3	-81	-169.3	-4.2	0	0	109.6	K548	Q546-K548 PolarHBondContact O-N 3.37Å
547	P	32.9	Very low	38.6	Very low	122 Å²	122	114 Å²	114	79%	0.792	63%	0.626	S	S	*	*			trans	-63.3	125.6	176.2	25.6	-30.4	0	0	0	108.5	S549	P547-S549 PolarHBondContact O-N 3.17Å
548	K	34.3	Very low	37	Very low	207 Å²	207	119.4 Å²	119.4	90%	0.9	66%	0.663	S	S	*	*			trans	-62	96.5	173.9	-70.5	-178.7	176.7	-179.6	0	109.1	Q546 K550	Q546-K548 PolarHBondContact O-N 3.37Å; K548-K550 PolarHBondContact O-N 3.3Å
549	S	32.5	Very low	35.9	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	69%	0.692	S	S	*	*			trans	-68.5	118.4	160	59.5	0	0	0	0	107.8	P547	P547-S549 PolarHBondContact O-N 3.17Å
550	K	34.6	Very low	35.2	Very low	189 Å²	189	131.1 Å²	131.1	82%	0.822	71%	0.711	S	S	*	*			trans	-60.4	144.6	170.8	-72	176.8	175.2	176.8	0	109.3	K548	K548-K550 PolarHBondContact O-N 3.3Å
551	N	29.6	Very low	34.7	Very low	145 Å²	145	131.3 Å²	131.3	78%	0.775	72%	0.716	S	S	*	*			trans	94.5	88.3	167.4	-48.2	-16.2	0	0	0	115.7
552	T	32.5	Very low	34.7	Very low	132 Å²	132	134.3 Å²	134.3	81%	0.81	73%	0.729	S	S	*	*				177.9	126.1	110.2	20.6	0	0	0	0	110.3	T554	T552-T554 PolarHBondContact O-N 3.47Å; T552-T554 VanDerWaalsContact O-N 3.12Å
553	T	28.2	Very low	35	Very low	149 Å²	149	132.3 Å²	132.3	91%	0.914	72%	0.721	S	S	*	*			trans	-65	97	166.7	31.6	0	0	0	0	109.9
554	T	29.8	Very low	36	Very low	115 Å²	115	129 Å²	129	71%	0.706	70%	0.698	S	S	*	*			trans	-134.1	127	152.7	45.1	0	0	0	0	108.2	T552 A556	T552-T554 PolarHBondContact O-N 3.47Å; T552-T554 VanDerWaalsContact O-N 3.12Å; T554-A556 PolarHBondContact O-N 3.3Å
555	L	27	Very low	36.9	Very low	191 Å²	191	121.8 Å²	121.8	100%	1	67%	0.667	S	S	*	*			trans	-67	83.3	174.9	-138.2	95.3	0	0	0	107.2
556	A	26.2	Very low	38.2	Very low	72 Å²	72	115.5 Å²	115.5	60%	0.595	63%	0.633	S	S	*	*			trans	-103.5	118.4	179.4	0	0	0	0	0	109.9	T554 C558	T554-A556 PolarHBondContact O-N 3.3Å; A556-C558 PolarHBondContact O-N 2.92Å
557	D	25.8	Very low	39.7	Very low	155 Å²	155	107.2 Å²	107.2	83%	0.829	59%	0.594	S	S	*	*			trans	-42.7	88	167.9	-80.4	-51.3	0	0	0	112.6	R559	D557-R559 PolarHBondContact O-N 2.83Å; D557-R559 VanDerWaalsContact O-N 3.08Å
558	C	26.9	Very low	41.2	Very low	120 Å²	120	101.6 Å²	101.6	81%	0.811	56%	0.557	S	S	*	*			trans	-83.6	69.2	164	-74.5	0	0	0	0	109.2	A556 S560	A556-C558 PolarHBondContact O-N 2.92Å; C558-S560 PolarHBondContact O-N 2.88Å
559	R	31.5	Very low	42.6	Very low	223 Å²	223	92.1 Å²	92.1	84%	0.842	52%	0.516	S	S	*	.			trans	-68.6	72.2	152.2	-70.4	-173.9	-178.2	-167.7	0	107.3	D557 T561	D557-R559 PolarHBondContact O-N 2.83Å; D557-R559 VanDerWaalsContact O-N 3.08Å; R559-T561 PolarHBondContact O-N 2.84Å
560	S	38.5	Very low	43.9	Very low	82 Å²	82	87.9 Å²	87.9	57%	0.573	48%	0.483	S	S	*	.			trans	-61.8	122.7	170.7	82.5	0	0	0	0	106.8	C558 K562	C558-S560 PolarHBondContact O-N 2.88Å; S560-K562 PolarHBondContact O-N 3.17Å
561	T	40.3	Very low	44.9	Very low	90 Å²	90	80.2 Å²	80.2	55%	0.552	46%	0.455	S	S	*	.			trans	-66.9	89	173.4	46	0	0	0	0	107.3	R559 G563	R559-T561 PolarHBondContact O-N 2.84Å; T561-G563 PolarHBondContact O-N 3.01Å
562	K	49.1	Very low	46.1	Very low	101 Å²	101	73.8 Å²	73.8	44%	0.439	42%	0.422	S	S	.	.			trans	-64.9	113.9	178.3	-66.2	178	-175.6	174.6	0	108.3	L426 S560	L426-K562 HydrophobicContact CD1-CB 3.38Å; L426-K562 HydrophobicContact CD1-CD 4.08Å; L426-K562 HydrophobicContact CD1-CG 4.38Å; L426-K562 HydrophobicContact CD2-CB 4.25Å; L426-K562 HydrophobicContact CD2-CD 3.47Å; L426-K562 VanDerWaalsContact CD2-CD 3.47Å; L426-K562 HydrophobicContact CG-CB 4.45Å; L426-K562 HydrophobicContact CG-CD 4.41Å; S560-K562 PolarHBondContact O-N 3.17Å
563	G	53.2	Low	47.1	Very low	14 Å²	14	69 Å²	69	14%	0.144	39%	0.391	C	S	.	.			trans	-101.2	-175.8	176.8	0	0	0	0	0	112.9	S539 T561 L594	S539-G563 WeakPolarHBondContact CA-O 3.29Å; S539-G563 WeakPolarHBondContact CB-O 3.36Å; S539-G563 PolarHBondContact N-O 3.26Å; S539-G563 PolarHBondContact OG-O 2.87Å; T561-G563 PolarHBondContact O-N 3.01Å; G563-L594 CarbonylContact C-O 3.55Å; G563-L594 WeakPolarHBondContact CA-O 3.27Å
564	V	63	Low	48.2	Very low	22 Å²	22	68 Å²	68	13%	0.133	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	136.4	169.4	171.2	0	0	0	0	107.9	E536 L566 L594	E536-V564 VanDerWaalsContact CD-CG1 3.48Å; E536-V564 HydrophobicContact CG-CG1 3.25Å; E536-V564 WeakPolarHBondContact OE1-CG1 3.32Å; V564-L566 HydrophobicContact CG1-CD2 4.02Å; V564-L594 HydrophobicContact CB-CB 4.38Å; V564-L594 PolarHBondContact N-O 3.03Å; V564-L594 PolarHBondContact O-N 2.82Å
565	T	64.2	Low	49.1	Very low	4 Å²	4	67.1 Å²	67.1	3%	0.025	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120	174.4	-59.1	0	0	0	0	109	L537 L542 F591 I592 N593	L537-T565 WeakPolarHBondContact CA-O 3.48Å; L537-T565 WeakPolarHBondContact CB-O 3.48Å; L537-T565 PolarHBondContact N-O 2.94Å; L537-T565 PolarHBondContact O-N 2.77Å; L537-T565 VanDerWaalsContact O-O 3.12Å; L542-T565 HydrophobicContact CD1-CG2 3.54Å; T565-F591 HydrophobicContact CG2-CB 4.42Å; T565-F591 HydrophobicContact CG2-CD1 3.88Å; T565-I592 CarbonylContact C-O 3.6Å; T565-N593 WeakPolarHBondContact CB-OD1 3.15Å; T565-N593 WeakPolarHBondContact CG2-OD1 3.41Å; T565-N593 PolarHBondContact OG1-OD1 2.63Å
566	L	66.2	Low	50.3	Low	2 Å²	2	61.3 Å²	61.3	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128.8	172.9	-59	-179.7	0	0	0	109.7	Y457 L508 F534 E536 V564 F591 I592 L594	Y457-L566 HydrophobicContact CE1-CD1 4.22Å; L508-L566 HydrophobicContact CD1-CD1 3.41Å; L508-L566 VanDerWaalsContact CD1-CD1 3.41Å; F534-L566 HydrophobicContact CE2-CB 4.12Å; F534-L566 HydrophobicContact CE2-CD1 3.96Å; F534-L566 HydrophobicContact CE2-CD2 3.65Å; F534-L566 HydrophobicContact CE2-CG 4.11Å; F534-L566 HydrophobicContact CZ-CD1 4.45Å; F534-L566 HydrophobicContact CZ-CD2 3.67Å; E536-L566 HydrophobicContact CB-CD2 4.06Å; E536-L566 HydrophobicContact CG-CD2 3.87Å; V564-L566 HydrophobicContact CG1-CD2 4.02Å; L566-F591 CarbonylContact O-C 3.54Å; L566-F591 VanDerWaalsContact O-CA 3.22Å; L566-F591 WeakPolarHBondContact O-CA 3.39Å; L566-I592 HydrophobicContact CB-CB 4.31Å; L566-I592 PolarHBondContact N-O 3.1Å; L566-I592 PolarHBondContact O-N 3.18Å; L566-L594 HydrophobicContact CD1-CD1 3.5Å; L566-L594 HydrophobicContact CD1-CG 4.06Å; L566-L594 HydrophobicContact CD2-CD1 4.48Å; L566-L594 HydrophobicContact CG-CD1 3.92Å; L566-L594 HydrophobicContact CG-CG 4.32Å
567	L	66.6	Low	51.3	Low	4 Å²	4	64.4 Å²	64.4	2%	0.021	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	127.3	171.4	170.2	58.5	0	0	0	108.5	F534 I535 L537 V589 F591	F534-L567 CarbonylContact C-O 3.56Å; I535-L567 HydrophobicContact CB-CB 4.32Å; I535-L567 HydrophobicContact CD1-CD2 4.3Å; I535-L567 PolarHBondContact N-O 3.13Å; I535-L567 PolarHBondContact O-N 3.39Å; L537-L567 HydrophobicContact CD1-CB 3.86Å; L537-L567 HydrophobicContact CD1-CD2 4.17Å; L537-L567 HydrophobicContact CG-CB 4.42Å; L567-V589 HydrophobicContact CD1-CG1 3.15Å; L567-V589 HydrophobicContact CG-CG1 4.45Å; L567-F591 HydrophobicContact CB-CD1 4.31Å; L567-F591 HydrophobicContact CB-CE1 4.07Å; L567-F591 HydrophobicContact CD1-CD1 4.04Å; L567-F591 HydrophobicContact CD1-CE1 3.43Å; L567-F591 VanDerWaalsContact CD1-CE1 3.43Å; L567-F591 HydrophobicContact CD1-CE2 4.08Å; L567-F591 HydrophobicContact CD1-CZ 3.41Å; L567-F591 VanDerWaalsContact CD1-CZ 3.41Å; L567-F591 HydrophobicContact CD2-CE1 4.37Å; L567-F591 HydrophobicContact CG-CE1 4.16Å; L567-F591 HydrophobicContact CG-CZ 4.49Å
568	F	65.7	Low	52.3	Low	4 Å²	4	61.8 Å²	61.8	2%	0.018	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147.2	172.4	55.2	-80.6	0	0	0	112.2	V509 L531 G533 R570 V589 H590 I592	V509-F568 HydrophobicContact CG1-CE2 4.43Å; V509-F568 HydrophobicContact CG2-CD1 4.44Å; V509-F568 HydrophobicContact CG2-CD2 4.25Å; V509-F568 HydrophobicContact CG2-CE1 4.04Å; V509-F568 HydrophobicContact CG2-CE2 3.76Å; V509-F568 HydrophobicContact CG2-CZ 3.62Å; L531-F568 HydrophobicContact CD1-CB 3.89Å; L531-F568 HydrophobicContact CD1-CD2 4.4Å; G533-F568 VanDerWaalsContact O-CA 3.25Å; G533-F568 WeakPolarHBondContact O-CA 3.43Å; G533-F568 WeakPolarHBondContact O-CB 3.46Å; F568-R570 HydrophobicContact CD2-CG 4.36Å; F568-V589 WeakPolarHBondContact O-CA 3.47Å; F568-H590 HydrophobicContact CD1-CB 4.42Å; F568-H590 WeakPolarHBondContact CD1-O 3.49Å; F568-H590 HydrophobicContact CD2-CB 4.1Å; F568-H590 HydrophobicContact CE1-CB 3.87Å; F568-H590 AromaticContact CE1-CD2 3.52Å; F568-H590 HydrophobicContact CE2-CB 3.56Å; F568-H590 HydrophobicContact CZ-CB 3.45Å; F568-H590 VanDerWaalsContact CZ-CB 3.45Å; F568-H590 AromaticContact CZ-CD2 3.15Å; F568-H590 WeakPolarHBondContact CZ-CD2 3.5Å; F568-H590 AromaticContact CZ-CG 3.57Å; F568-H590 PolarHBondContact N-O 3.28Å; F568-H590 PolarHBondContact O-N 2.84Å; F568-I592 HydrophobicContact CD1-CD1 4.37Å; F568-I592 HydrophobicContact CE1-CB 4.38Å; F568-I592 HydrophobicContact CE1-CD1 3.36Å; F568-I592 HydrophobicContact CE1-CG1 3.65Å; F568-I592 HydrophobicContact CZ-CD1 3.72Å; F568-I592 HydrophobicContact CZ-CG1 4.18Å
569	I	62.7	Low	53.1	Low	8 Å²	8	62.8 Å²	62.8	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.4	-176.2	-54.9	172.9	0	0	0	107.5	I10 L14 A532 G533 L588	I10-I569 HydrophobicContact CG2-CD1 4.08Å; L14-I569 HydrophobicContact CD1-CG2 4.38Å; A532-I569 HydrophobicContact CB-CG2 4.25Å; A532-I569 PolarHBondContact N-O 3.01Å; G533-I569 PolarHBondContact N-O 3.47Å; G533-I569 PolarHBondContact O-N 3.46Å; I569-L588 CarbonylContact C-O 3.47Å
570	R	60.2	Low	53.6	Low	23 Å²	23	55.4 Å²	55.4	9%	0.087	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	145.4	-177.7	-55	174.6	177	169.9	-10.9	109.2	I513 F529 R530 F568 C587 L588 H590	I513-R570 HydrophobicContact CD1-CG 3.96Å; F529-R570 HydrophobicContact CB-CB 4.26Å; F529-R570 HydrophobicContact CD1-CB 4.35Å; R530-R570 CarbonylContact O-C 3.5Å; R530-R570 WeakPolarHBondContact O-CA 3.47Å; F568-R570 HydrophobicContact CD2-CG 4.36Å; R570-C587 PolarHBondContact NH1-O 3.14Å; R570-L588 WeakPolarHBondContact CB-O 3.2Å; R570-L588 PolarHBondContact N-O 2.91Å; R570-H590 VanDerWaalsContact NH2-CG 3.27Å; R570-H590 PolarHBondContact NH2-ND1 3.04Å
571	A	56.2	Low	53.7	Low	29 Å²	29	57 Å²	57	24%	0.24	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	132.6	171.4	0	0	0	0	0	110.1	F529 R530 A532	F529-A571 CarbonylContact C-O 3.57Å; F529-A571 VanDerWaalsContact CA-O 3.29Å; F529-A571 WeakPolarHBondContact CA-O 3.35Å; R530-A571 PolarHBondContact N-O 3.23Å; R530-A571 PolarHBondContact O-N 3.26Å; A532-A571 HydrophobicContact CB-CB 4Å
572	P	55.2	Low	53.7	Low	10 Å²	10	60.9 Å²	60.9	7%	0.065	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	141.7	176.5	-3.2	15.8	0	0	0	111.1	M16 Y22 F529 I576 L588	M16-P572 HydrophobicContact CE-CG 4.39Å; Y22-P572 WeakPolarHBondContact CD1-O 3.46Å; Y22-P572 HydrophobicContact CE1-CB 3.78Å; Y22-P572 HydrophobicContact CE1-CG 3.87Å; Y22-P572 WeakPolarHBondContact CE1-O 3.11Å; F529-P572 HydrophobicContact CD1-CB 3.97Å; F529-P572 HydrophobicContact CD1-CG 4.19Å; F529-P572 HydrophobicContact CE1-CB 3.82Å; F529-P572 HydrophobicContact CE1-CG 3.91Å; P572-I576 HydrophobicContact CB-CD1 4.26Å; P572-I576 HydrophobicContact CB-CG1 4.38Å; P572-I576 HydrophobicContact CG-CD1 3.9Å; P572-I576 HydrophobicContact CG-CG1 4.45Å; P572-L588 HydrophobicContact CG-CD2 4.01Å
573	I	53.5	Low	53.7	Low	31 Å²	31	58.7 Å²	58.7	16%	0.159	34%	0.342	C	S	.	.	S	Bend	trans	-84.9	-24.9	176.4	-59.7	176.4	0	0	0	111.3	Q512 K528 R530	Q512-I573 HydrophobicContact CG-CD1 3.75Å; Q512-I573 VanDerWaalsContact NE2-CD1 3.27Å; K528-I573 HydrophobicContact CB-CB 4.13Å; K528-I573 HydrophobicContact CB-CD1 3.71Å; K528-I573 HydrophobicContact CB-CG1 4.26Å; K528-I573 VanDerWaalsContact O-CB 3.23Å; K528-I573 WeakPolarHBondContact O-CB 3.49Å; K528-I573 VanDerWaalsContact O-CG1 3.23Å; K528-I573 WeakPolarHBondContact O-CG1 3.41Å; K528-I573 PolarHBondContact O-N 2.87Å; R530-I573 HydrophobicContact CB-CG1 4.47Å; R530-I573 HydrophobicContact CG-CD1 3.65Å; R530-I573 HydrophobicContact CG-CG1 3.69Å
574	Q	51.2	Low	53.6	Low	128 Å²	128	63.8 Å²	63.8	60%	0.598	37%	0.367	S	S	*	.	S	Bend	trans	-122.4	153.3	178.8	-69.5	179.5	-6.3	0	0	110.6	I576	Q574-I576 PolarHBondContact O-N 2.79Å
575	Q	49	Very low	53.2	Low	97 Å²	97	66 Å²	66	45%	0.453	37%	0.373	S	S	.	.			trans	-66.3	121.4	-178.9	-170.9	166.5	-5.3	0	0	110.2	Y22 D577	Y22-Q575 VanDerWaalsContact CD2-CA 3.5Å; Y22-Q575 HydrophobicContact CD2-CB 3.49Å; Y22-Q575 VanDerWaalsContact CD2-CB 3.49Å; Y22-Q575 HydrophobicContact CD2-CG 3.67Å; Y22-Q575 VanDerWaalsContact CE2-CA 3.43Å; Y22-Q575 HydrophobicContact CE2-CB 3.76Å; Y22-Q575 HydrophobicContact CE2-CG 3.67Å; Y22-Q575 HydrophobicContact CG-CB 4.22Å; Q575-D577 PolarHBondContact O-N 2.85Å
576	I	52.3	Low	52.7	Low	68 Å²	68	68.4 Å²	68.4	35%	0.349	39%	0.39	S	S	.	.			trans	-76.4	116	173.1	-58.1	172.6	0	0	0	106.8	P572 Q574 S578	P572-I576 HydrophobicContact CB-CD1 4.26Å; P572-I576 HydrophobicContact CB-CG1 4.38Å; P572-I576 HydrophobicContact CG-CD1 3.9Å; P572-I576 HydrophobicContact CG-CG1 4.45Å; Q574-I576 PolarHBondContact O-N 2.79Å; I576-S578 PolarHBondContact O-N 3Å; I576-S578 VanDerWaalsContact O-N 3.09Å
577	D	46	Very low	52.2	Low	137 Å²	137	70.5 Å²	70.5	73%	0.733	40%	0.404	S	S	*	.			trans	-62.9	112.1	179.6	-84.2	-25.1	0	0	0	110.6	Q575 T579	Q575-D577 PolarHBondContact O-N 2.85Å; D577-T579 VanDerWaalsContact C-N 3.27Å; D577-T579 PolarHBondContact O-N 3.18Å
578	S	46.7	Very low	51.7	Low	101 Å²	101	70.4 Å²	70.4	71%	0.706	40%	0.404	S	S	*	.			trans	-86.3	49.4	-170.6	63.9	0	0	0	0	112.8	I576	I576-S578 PolarHBondContact O-N 3Å; I576-S578 VanDerWaalsContact O-N 3.09Å
579	T	44.6	Very low	51.4	Low	141 Å²	141	70.8 Å²	70.8	87%	0.865	41%	0.406	S	S	*	.			trans	-87.6	-8.8	178.2	56.1	0	0	0	0	113.5	D577	D577-T579 VanDerWaalsContact C-N 3.27Å; D577-T579 PolarHBondContact O-N 3.18Å
580	A	40.7	Very low	51.5	Low	67 Å²	67	74.1 Å²	74.1	55%	0.554	42%	0.422	S	S	*	.	S	Bend	trans	-103.4	125.5	175.8	0	0	0	0	0	111.8	M582	A580-M582 PolarHBondContact O-N 3.26Å
581	S	40.3	Very low	51.7	Low	116 Å²	116	75.2 Å²	75.2	81%	0.811	43%	0.427	S	S	*	.	S	Bend	trans	-70.4	14.7	-171.8	59	0	0	0	0	116.7
582	M	41.7	Very low	52.2	Low	171 Å²	171	75.5 Å²	75.5	84%	0.842	42%	0.424	S	S	*	.			trans	-151.4	82	172.8	-79.1	-75.2	97.9	0	0	108.2	A580 D584	A580-M582 PolarHBondContact O-N 3.26Å; M582-D584 PolarHBondContact O-N 3.02Å; M582-D584 VanDerWaalsContact O-N 3.14Å
583	T	48.2	Very low	52.7	Low	55 Å²	55	79.8 Å²	79.8	34%	0.337	45%	0.447	S	S	.	.			trans	-73.6	101.9	172.2	46.6	0	0	0	0	109	Y585	T583-Y585 WeakPolarHBondContact O-CD2 3.13Å; T583-Y585 WeakPolarHBondContact O-CE2 3.39Å; T583-Y585 PolarHBondContact O-N 2.97Å; T583-Y585 VanDerWaalsContact OG1-CE2 3.23Å; T583-Y585 WeakPolarHBondContact OG1-CE2 3.12Å; T583-Y585 PolarHBondContact OG1-OH 3.14Å
584	D	50.8	Low	52.9	Low	122 Å²	122	79 Å²	79	65%	0.652	44%	0.442	S	S	*	.			trans	-70.1	106.1	169.5	-178	13.5	0	0	0	109.3	M582 S586	M582-D584 PolarHBondContact O-N 3.02Å; M582-D584 VanDerWaalsContact O-N 3.14Å; D584-S586 PolarHBondContact O-N 3.23Å; D584-S586 WeakPolarHBondContact OD1-CB 3.25Å; D584-S586 PolarHBondContact OD1-N 3.48Å; D584-S586 PolarHBondContact OD1-OG 2.98Å; D584-S586 PolarHBondContact OD2-OG 2.86Å
585	Y	55.6	Low	53.2	Low	69 Å²	69	77 Å²	77	27%	0.271	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-84.4	6.6	179.4	-58.4	-78	0	0	0	113.2	L11 M16 T583 C587 L588	L11-Y585 WeakPolarHBondContact CD2-O 3.46Å; M16-Y585 HydrophobicContact CB-CE1 3.7Å; M16-Y585 HydrophobicContact CB-CE2 4.46Å; M16-Y585 HydrophobicContact CE-CD1 4.41Å; M16-Y585 HydrophobicContact CE-CE1 4.11Å; M16-Y585 HydrophobicContact CG-CD1 4.16Å; M16-Y585 HydrophobicContact CG-CE1 3.81Å; T583-Y585 WeakPolarHBondContact O-CD2 3.13Å; T583-Y585 WeakPolarHBondContact O-CE2 3.39Å; T583-Y585 PolarHBondContact O-N 2.97Å; T583-Y585 VanDerWaalsContact OG1-CE2 3.23Å; T583-Y585 WeakPolarHBondContact OG1-CE2 3.12Å; T583-Y585 PolarHBondContact OG1-OH 3.14Å; Y585-C587 PolarHBondContact O-N 3.08Å; Y585-L588 HydrophobicContact CD1-CD1 3.98Å; Y585-L588 WeakPolarHBondContact O-CB 3.34Å; Y585-L588 PolarHBondContact O-N 3.05Å
586	S	53.2	Low	53	Low	53 Å²	53	78.4 Å²	78.4	37%	0.371	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-53.9	-28.5	178.6	66.8	0	0	0	0	113.3	D584 L588 V589	D584-S586 PolarHBondContact O-N 3.23Å; D584-S586 WeakPolarHBondContact OD1-CB 3.25Å; D584-S586 PolarHBondContact OD1-N 3.48Å; D584-S586 PolarHBondContact OD1-OG 2.98Å; D584-S586 PolarHBondContact OD2-OG 2.86Å; S586-L588 PolarHBondContact O-N 3.39Å; S586-V589 PolarHBondContact O-N 3.28Å
587	C	55.5	Low	52.2	Low	47 Å²	47	83 Å²	83	32%	0.318	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-64.1	-20.4	177.1	67.3	0	0	0	0	114.5	I515 R570 Y585 V589	I515-C587 HydrophobicContact CD1-CB 4.48Å; R570-C587 PolarHBondContact NH1-O 3.14Å; Y585-C587 PolarHBondContact O-N 3.08Å; C587-V589 VanDerWaalsContact C-N 3.26Å; C587-V589 PolarHBondContact O-N 2.98Å
588	L	57.2	Low	51.7	Low	1 Å²	1	81.2 Å²	81.2	1%	0.005	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-77.6	-10	179.9	-60.1	-177.2	0	0	0	112.9	L11 L14 M16 F529 I569 R570 P572 Y585 S586	L11-L588 HydrophobicContact CD2-CB 3.96Å; L11-L588 HydrophobicContact CD2-CD1 4.02Å; L11-L588 HydrophobicContact CD2-CG 4.44Å; L14-L588 HydrophobicContact CD1-CD1 4.3Å; M16-L588 HydrophobicContact CE-CD1 4.08Å; M16-L588 HydrophobicContact SD-CD1 4.44Å; F529-L588 HydrophobicContact CD1-CD2 3.92Å; F529-L588 HydrophobicContact CE1-CD2 3.57Å; I569-L588 CarbonylContact C-O 3.47Å; R570-L588 WeakPolarHBondContact CB-O 3.2Å; R570-L588 PolarHBondContact N-O 2.91Å; P572-L588 HydrophobicContact CG-CD2 4.01Å; Y585-L588 HydrophobicContact CD1-CD1 3.98Å; Y585-L588 WeakPolarHBondContact O-CB 3.34Å; Y585-L588 PolarHBondContact O-N 3.05Å; S586-L588 PolarHBondContact O-N 3.39Å
589	V	59.1	Low	50.8	Low	13 Å²	13	84.6 Å²	84.6	8%	0.079	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	132.5	-175.2	-172.5	0	0	0	0	110	L7 L11 L567 F568 S586 C587 F591	L7-V589 HydrophobicContact CD2-CB 3.28Å; L7-V589 HydrophobicContact CD2-CG1 3.32Å; L7-V589 HydrophobicContact CD2-CG2 3.56Å; L11-V589 HydrophobicContact CD2-CG2 4.05Å; L11-V589 HydrophobicContact CG-CG2 4.41Å; L567-V589 HydrophobicContact CD1-CG1 3.15Å; L567-V589 HydrophobicContact CG-CG1 4.45Å; F568-V589 WeakPolarHBondContact O-CA 3.47Å; S586-V589 PolarHBondContact O-N 3.28Å; C587-V589 VanDerWaalsContact C-N 3.26Å; C587-V589 PolarHBondContact O-N 2.98Å; V589-F591 HydrophobicContact CG1-CE2 4.21Å; V589-F591 HydrophobicContact CG1-CZ 4.33Å
590	H	64.8	Low	50.1	Low	78 Å²	78	84.7 Å²	84.7	36%	0.361	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151.5	-176.8	-165.2	87.8	0	0	0	112	F568 R570	F568-H590 HydrophobicContact CD1-CB 4.42Å; F568-H590 WeakPolarHBondContact CD1-O 3.49Å; F568-H590 HydrophobicContact CD2-CB 4.1Å; F568-H590 HydrophobicContact CE1-CB 3.87Å; F568-H590 AromaticContact CE1-CD2 3.52Å; F568-H590 HydrophobicContact CE2-CB 3.56Å; F568-H590 HydrophobicContact CZ-CB 3.45Å; F568-H590 VanDerWaalsContact CZ-CB 3.45Å; F568-H590 AromaticContact CZ-CD2 3.15Å; F568-H590 WeakPolarHBondContact CZ-CD2 3.5Å; F568-H590 AromaticContact CZ-CG 3.57Å; F568-H590 PolarHBondContact N-O 3.28Å; F568-H590 PolarHBondContact O-N 2.84Å; R570-H590 VanDerWaalsContact NH2-CG 3.27Å; R570-H590 PolarHBondContact NH2-ND1 3.04Å
591	F	64.1	Low	49.4	Very low	46 Å²	46	91.6 Å²	91.6	20%	0.202	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.5	-177.4	-63.3	-91.8	0	0	0	110.1	L3 L7 L537 T565 L566 L567 V589	L3-F591 HydrophobicContact CD1-CD1 4.2Å; L3-F591 HydrophobicContact CD1-CD2 4.37Å; L3-F591 HydrophobicContact CD1-CE1 3.39Å; L3-F591 HydrophobicContact CD1-CE2 3.63Å; L3-F591 HydrophobicContact CD1-CZ 3.09Å; L3-F591 HydrophobicContact CD2-CE2 4.16Å; L3-F591 HydrophobicContact CD2-CZ 4.46Å; L3-F591 HydrophobicContact CG-CE2 4.05Å; L3-F591 HydrophobicContact CG-CZ 3.92Å; L7-F591 HydrophobicContact CD1-CE2 4.4Å; L7-F591 HydrophobicContact CD2-CE2 4.47Å; L537-F591 HydrophobicContact CD1-CE1 4.34Å; T565-F591 HydrophobicContact CG2-CB 4.42Å; T565-F591 HydrophobicContact CG2-CD1 3.88Å; L566-F591 CarbonylContact O-C 3.54Å; L566-F591 VanDerWaalsContact O-CA 3.22Å; L566-F591 WeakPolarHBondContact O-CA 3.39Å; L567-F591 HydrophobicContact CB-CD1 4.31Å; L567-F591 HydrophobicContact CB-CE1 4.07Å; L567-F591 HydrophobicContact CD1-CD1 4.04Å; L567-F591 HydrophobicContact CD1-CE1 3.43Å; L567-F591 VanDerWaalsContact CD1-CE1 3.43Å; L567-F591 HydrophobicContact CD1-CE2 4.08Å; L567-F591 HydrophobicContact CD1-CZ 3.41Å; L567-F591 VanDerWaalsContact CD1-CZ 3.41Å; L567-F591 HydrophobicContact CD2-CE1 4.37Å; L567-F591 HydrophobicContact CG-CE1 4.16Å; L567-F591 HydrophobicContact CG-CZ 4.49Å; V589-F591 HydrophobicContact CG1-CE2 4.21Å; V589-F591 HydrophobicContact CG1-CZ 4.33Å
592	I	66	Low	48.7	Very low	34 Å²	34	90 Å²	90	17%	0.174	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.9	169.7	-73.1	162.4	0	0	0	108.3	L508 V509 T565 L566 F568 L594	L508-I592 HydrophobicContact CB-CD1 4.34Å; L508-I592 WeakPolarHBondContact O-CD1 3.32Å; V509-I592 HydrophobicContact CG2-CD1 3.91Å; T565-I592 CarbonylContact C-O 3.6Å; L566-I592 HydrophobicContact CB-CB 4.31Å; L566-I592 PolarHBondContact N-O 3.1Å; L566-I592 PolarHBondContact O-N 3.18Å; F568-I592 HydrophobicContact CD1-CD1 4.37Å; F568-I592 HydrophobicContact CE1-CB 4.38Å; F568-I592 HydrophobicContact CE1-CD1 3.36Å; F568-I592 HydrophobicContact CE1-CG1 3.65Å; F568-I592 HydrophobicContact CZ-CD1 3.72Å; F568-I592 HydrophobicContact CZ-CG1 4.18Å; I592-L594 HydrophobicContact CG2-CD2 3.87Å; I592-L594 HydrophobicContact CG2-CG 4.26Å
593	N	65.2	Low	48.1	Very low	101 Å²	101	89.5 Å²	89.5	54%	0.54	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116.7	171.2	-74.1	-37	0	0	0	109.8	T565	T565-N593 WeakPolarHBondContact CB-OD1 3.15Å; T565-N593 WeakPolarHBondContact CG2-OD1 3.41Å; T565-N593 PolarHBondContact OG1-OD1 2.63Å
594	L	59.7	Low	47	Very low	13 Å²	13	96.6 Å²	96.6	7%	0.068	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	104.5	172.3	-61.9	179.9	0	0	0	109.1	L466 L508 G563 V564 L566 I592	L466-L594 HydrophobicContact CD2-CD1 4.17Å; L508-L594 HydrophobicContact CD2-CD2 3.71Å; G563-L594 CarbonylContact C-O 3.55Å; G563-L594 WeakPolarHBondContact CA-O 3.27Å; V564-L594 HydrophobicContact CB-CB 4.38Å; V564-L594 PolarHBondContact N-O 3.03Å; V564-L594 PolarHBondContact O-N 2.82Å; L566-L594 HydrophobicContact CD1-CD1 3.5Å; L566-L594 HydrophobicContact CD1-CG 4.06Å; L566-L594 HydrophobicContact CD2-CD1 4.48Å; L566-L594 HydrophobicContact CG-CD1 3.92Å; L566-L594 HydrophobicContact CG-CG 4.32Å; I592-L594 HydrophobicContact CG2-CD2 3.87Å; I592-L594 HydrophobicContact CG2-CG 4.26Å
595	T	56.7	Low	46	Very low	87 Å²	87	99 Å²	99	53%	0.534	49%	0.49	S	S	.	.			trans	-90.7	139.6	172.7	51.8	0	0	0	0	110.5	K597	T595-K597 PolarHBondContact O-N 3.44Å
596	R	45.3	Very low	44.6	Very low	127 Å²	127	103.9 Å²	103.9	48%	0.479	52%	0.515	S	S	.	.	S	Bend	trans	-69.3	10.8	-174.1	-146.8	-176.5	-169.3	-175.9	4.1	114.7	N424 D427 P598	N424-R596 PolarHBondContact OD1-NH2 3.4Å; D427-R596 IonicContact OD1-NH1 3.93Å; D427-R596 IonicContact OD2-CZ 3.63Å; D427-R596 IonicContact OD2-NH1 2.78Å; D427-R596 PolarHBondContact OD2-NH1 3.23Å; D427-R596 IonicContact OD2-NH2 3.56Å; D427-R596 PolarHBondContact OD2-NH2 3.44Å; R596-P598 WeakPolarHBondContact O-CD 3.36Å
597	K	35.3	Very low	43.3	Very low	163 Å²	163	108.6 Å²	108.6	71%	0.709	53%	0.525	S	S	*	.			trans	-98.9	103	177	-82.6	-169.5	175.8	-176.5	0	110.2	T595 E599	T595-K597 PolarHBondContact O-N 3.44Å; K597-E599 PolarHBondContact O-N 2.81Å
598	P	35.7	Very low	42.1	Very low	100 Å²	100	115.2 Å²	115.2	65%	0.649	55%	0.545	S	S	*	.			trans	-68.6	121.3	155.6	29.7	-28.4	0	0	0	106.9	R596 I600	R596-P598 WeakPolarHBondContact O-CD 3.36Å; P598-I600 VanDerWaalsContact C-N 3.29Å; P598-I600 HydrophobicContact CG-CG1 4.5Å; P598-I600 PolarHBondContact O-N 3.42Å
599	E	27.8	Very low	40.7	Very low	172 Å²	172	122 Å²	122	80%	0.804	59%	0.587	S	S	*	*			trans	-63.6	103.6	152.2	-79.9	-175.8	161.8	0	0	105.8	K597 Y601	K597-E599 PolarHBondContact O-N 2.81Å; E599-Y601 HydrophobicContact CB-CD2 4.25Å; E599-Y601 PolarHBondContact O-N 3.33Å
600	I	28.5	Very low	39.1	Very low	143 Å²	143	124.6 Å²	124.6	73%	0.733	62%	0.615	S	S	*	*			trans	-67.1	83.6	168.7	-58.3	171.8	0	0	0	106.4	P598	P598-I600 VanDerWaalsContact C-N 3.29Å; P598-I600 HydrophobicContact CG-CG1 4.5Å; P598-I600 PolarHBondContact O-N 3.42Å
601	Y	26	Very low	37.4	Very low	212 Å²	212	128.5 Å²	128.5	83%	0.831	64%	0.638	S	S	*	*			trans	-113.9	65	152.8	-78	-75.7	0	0	0	106.9	E599	E599-Y601 HydrophobicContact CB-CD2 4.25Å; E599-Y601 PolarHBondContact O-N 3.33Å
602	A	26.9	Very low	35.6	Very low	82 Å²	82	132.8 Å²	132.8	68%	0.678	66%	0.663	S	S	*	*			trans	-129.5	106.6	169	0	0	0	0	0	108.4	K604	A602-K604 PolarHBondContact O-N 3.47Å
603	M	27.5	Very low	33.7	Very low	162 Å²	162	136.3 Å²	136.3	80%	0.798	69%	0.691	S	S	*	*			trans	-1	104.9	165.2	-70.4	-179	168.8	0	0	117.3	Q605	M603-Q605 VanDerWaalsContact C-N 3.26Å; M603-Q605 HydrophobicContact CB-CG 4.39Å; M603-Q605 PolarHBondContact O-N 2.99Å; M603-Q605 VanDerWaalsContact O-N 3.09Å; M603-Q605 HydrophobicContact SD-CG 4.48Å
604	K	25.4	Very low	32	Very low	204 Å²	204	142.5 Å²	142.5	89%	0.887	71%	0.707	S	S	*	*			trans	-67.9	92	139.7	-82.2	-176.2	175.1	-179	0	107.5	A602 Q606	A602-K604 PolarHBondContact O-N 3.47Å; K604-Q606 VanDerWaalsContact C-N 3.27Å; K604-Q606 PolarHBondContact O-N 3.2Å
605	Q	30.4	Very low	30.8	Very low	173 Å²	173	147.7 Å²	147.7	81%	0.808	74%	0.739	S	S	*	*			trans	-70.4	94.8	157.1	-81.7	-171.8	2.7	0	0	107.6	M603	M603-Q605 VanDerWaalsContact C-N 3.26Å; M603-Q605 HydrophobicContact CB-CG 4.39Å; M603-Q605 PolarHBondContact O-N 2.99Å; M603-Q605 VanDerWaalsContact O-N 3.09Å; M603-Q605 HydrophobicContact SD-CG 4.48Å
606	Q	25.4	Very low	29.5	Very low	170 Å²	170	148.2 Å²	148.2	79%	0.794	74%	0.742	S	S	*	*			trans	-62.6	134.8	159.4	-73.8	176.9	-48.8	0	0	109.1	K604	K604-Q606 VanDerWaalsContact C-N 3.27Å; K604-Q606 PolarHBondContact O-N 3.2Å
607	R	27.5	Very low	28.9	Very low	152 Å²	152	148.7 Å²	148.7	57%	0.574	75%	0.754	S	S	*	*				155.8	139.8	129.9	-80.7	164.6	-173.3	-168.4	13.7	107.9
608	Y	29.6	Very low	28.8	Very low	186 Å²	186	149.4 Å²	149.4	73%	0.729	76%	0.76	S	S	*	*			cis	-155.5	124.6	34.1	-95.3	-80.4	0	0	0	111.5
609	T	28.4	Very low	28.5	Very low	145 Å²	145	154.8 Å²	154.8	89%	0.89	77%	0.769	S	S	*	*	S	Bend	trans	-134	113.9	137.2	51.7	0	0	0	0	108.3
610	G	25.7	Very low	28.7	Very low	66 Å²	66	152 Å²	152	68%	0.68	76%	0.76	S	S	*	*			trans	52.1	112.2	144.9	0	0	0	0	0	120.8
611	L	27.6	Very low	28.8	Very low	161 Å²	161	151.1 Å²	151.1	84%	0.843	77%	0.766	S	S	*	*			trans	88.4	116.7	146.2	-118.5	72.4	0	0	0	119.5
612	D	26.3	Very low	29.1	Very low	135 Å²	135	146.5 Å²	146.5	72%	0.722	76%	0.764	S	S	*	*			trans	76.3	100.5	151.9	-60.7	-20.5	0	0	0	121.4
613	S	26.5	Very low	29.6	Very low	109 Å²	109	148.5 Å²	148.5	76%	0.762	76%	0.763	S	S	*	*			trans	94.2	116	133.6	80.2	0	0	0	0	119.5
614	R	29	Very low	30.2	Very low	231 Å²	231	144.1 Å²	144.1	87%	0.872	75%	0.748	S	S	*	*			trans	93	114.2	151.7	-63.2	180	176.4	-174.2	-0.4	119.4
615	T	34.5	Very low	31.1	Very low	121 Å²	121	139.5 Å²	139.5	74%	0.742	74%	0.737	S	S	*	*			trans	79.8	91.6	150	54.8	0	0	0	0	120.8
616	T	30.6	Very low	31.8	Very low	98 Å²	98	138 Å²	138	60%	0.601	73%	0.734	S	S	*	*				-41.4	152.9	124.3	31.9	0	0	0	0	112.5
617	D	31.6	Very low	32.9	Very low	137 Å²	137	139.5 Å²	139.5	73%	0.733	73%	0.733	S	S	*	*			cis	-162.7	153.6	-0.7	-79.1	-38.7	0	0	0	106.1
618	Q	34.1	Very low	34.4	Very low	178 Å²	178	135.3 Å²	135.3	83%	0.832	73%	0.727	S	S	*	*			trans	-148.6	78.8	155.3	-131.3	170.8	40	0	0	111.4
619	Y	29.6	Very low	36.3	Very low	213 Å²	213	131.9 Å²	131.9	84%	0.835	72%	0.717	S	S	*	*			trans	-64.8	156	142.6	-99.6	-103.3	0	0	0	109.2
620	D	31.3	Very low	38.7	Very low	115 Å²	115	126.9 Å²	126.9	62%	0.615	68%	0.683	S	S	*	*			trans	81.2	80.7	169.5	-58.1	-19.3	0	0	0	118.7	C622	D620-C622 PolarHBondContact O-N 2.95Å
621	S	31.7	Very low	41.1	Very low	123 Å²	123	126.9 Å²	126.9	86%	0.86	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	75.4	151	174	0	0	0	0	110.1
622	C	31.3	Very low	43.5	Very low	116 Å²	116	122.4 Å²	122.4	78%	0.784	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-168.4	-2.1	154	-103.3	0	0	0	0	114.5	D620	D620-C622 PolarHBondContact O-N 2.95Å
623	N	37.6	Very low	45.9	Very low	123 Å²	123	119.7 Å²	119.7	66%	0.658	64%	0.635	S	S	*	*	S	Bend	trans	-123.9	10.3	-176.9	-77.1	-33.2	0	0	0	115.3	T625	N623-T625 VanDerWaalsContact C-N 3.31Å; N623-T625 PolarHBondContact O-N 3.24Å
624	S	39.5	Very low	48.5	Very low	71 Å²	71	115.9 Å²	115.9	50%	0.497	61%	0.606	S	S	.	*	H	α-helix	trans	-75.5	-13.4	-174.1	64.6	0	0	0	0	114.9	S628	S624-S628 PolarHBondContact O-N 3.28Å; S624-S628 PolarHBondContact O-OG 3.38Å
625	T	44.6	Very low	50.8	Low	107 Å²	107	111.2 Å²	111.2	66%	0.656	59%	0.592	S	S	*	*	H	α-helix	trans	-75.5	-36.1	-177.8	35.2	0	0	0	0	113.9	N623 S628	N623-T625 VanDerWaalsContact C-N 3.31Å; N623-T625 PolarHBondContact O-N 3.24Å; T625-S628 PolarHBondContact O-OG 3.3Å
626	L	45.9	Very low	52.9	Low	141 Å²	141	112.8 Å²	112.8	74%	0.738	59%	0.591	S	S	*	*	H	α-helix	trans	-79.1	-38	177.9	-101.5	103.6	0	0	0	113.1	S628 H629 F630	L626-S628 VanDerWaalsContact C-N 3.28Å; L626-S628 PolarHBondContact O-N 3.38Å; L626-H629 PolarHBondContact O-N 3.39Å; L626-F630 PolarHBondContact O-N 3.01Å
627	R	48.6	Very low	55.3	Low	202 Å²	202	109.7 Å²	109.7	76%	0.762	57%	0.572	S	S	*	*	H	α-helix	trans	-68.9	-30.5	-177.4	-144.6	176.5	-176.8	179.5	0.7	111.5	T631	R627-T631 VanDerWaalsContact O-CB 3.23Å; R627-T631 WeakPolarHBondContact O-CB 3.37Å; R627-T631 PolarHBondContact O-N 2.83Å; R627-T631 PolarHBondContact O-OG1 2.81Å
628	S	59.1	Low	57.2	Low	64 Å²	64	107 Å²	107	45%	0.448	56%	0.557	S	S	.	*	H	α-helix	trans	-69.1	-36.3	173.1	70.8	0	0	0	0	111.8	S624 T625 L626 S632	S624-S628 PolarHBondContact O-N 3.28Å; S624-S628 PolarHBondContact O-OG 3.38Å; T625-S628 PolarHBondContact O-OG 3.3Å; L626-S628 VanDerWaalsContact C-N 3.28Å; L626-S628 PolarHBondContact O-N 3.38Å; S628-S632 WeakPolarHBondContact O-CB 3.13Å; S628-S632 PolarHBondContact O-N 3.41Å; S628-S632 PolarHBondContact O-OG 2.84Å
629	H	69.1	Low	58.8	Low	113 Å²	113	103 Å²	103	52%	0.523	55%	0.548	S	S	.	.	H	α-helix	trans	-69.9	-51.3	-177.4	-169.8	-97.3	0	0	0	112.9	L626 T631 S632 Q633	L626-H629 PolarHBondContact O-N 3.39Å; H629-T631 PolarHBondContact O-N 2.82Å; H629-S632 PolarHBondContact O-N 2.81Å; H629-Q633 PolarHBondContact CE1-NE2 3.28Å; H629-Q633 WeakPolarHBondContact O-CG 3.33Å; H629-Q633 PolarHBondContact O-N 3.1Å
630	F	77.7	Confident	60.3	Low	41 Å²	41	94.2 Å²	94.2	18%	0.18	52%	0.522	C	S	.	.	H	α-helix	trans	-63.9	-41.2	178	-179.1	-109.1	0	0	0	112.1	L626 S632 Q633 I634 I688 H691	L626-F630 PolarHBondContact O-N 3.01Å; F630-S632 VanDerWaalsContact C-N 3.31Å; F630-S632 PolarHBondContact O-N 3.42Å; F630-Q633 PolarHBondContact O-N 2.9Å; F630-I634 HydrophobicContact CD1-CD1 4.05Å; F630-I634 HydrophobicContact CE1-CD1 3.34Å; F630-I634 HydrophobicContact CE1-CG1 4.27Å; F630-I634 HydrophobicContact CE2-CD1 4.09Å; F630-I634 HydrophobicContact CE2-CG1 4.34Å; F630-I634 HydrophobicContact CZ-CD1 3.38Å; F630-I634 HydrophobicContact CZ-CG1 4.11Å; F630-I634 PolarHBondContact O-N 3.09Å; F630-I688 HydrophobicContact CZ-CG1 4.2Å; F630-H691 AromaticContact CD1-CD2 3.71Å; F630-H691 HydrophobicContact CD2-CB 4.3Å; F630-H691 HydrophobicContact CE1-CB 4.28Å; F630-H691 AromaticContact CE1-CD2 3.61Å; F630-H691 HydrophobicContact CE2-CB 3.6Å; F630-H691 AromaticContact CE2-CG 3.83Å; F630-H691 AromaticContact CG-CD2 3.97Å; F630-H691 HydrophobicContact CZ-CB 3.57Å; F630-H691 AromaticContact CZ-CD2 3.81Å; F630-H691 AromaticContact CZ-CG 3.86Å
631	T	78.1	Confident	61.4	Low	65 Å²	65	98.1 Å²	98.1	40%	0.399	54%	0.537	S	S	.	.	H	α-helix	trans	-63.2	-39.4	175.6	-54.7	0	0	0	0	111.3	R627 H629 K635	R627-T631 VanDerWaalsContact O-CB 3.23Å; R627-T631 WeakPolarHBondContact O-CB 3.37Å; R627-T631 PolarHBondContact O-N 2.83Å; R627-T631 PolarHBondContact O-OG1 2.81Å; H629-T631 PolarHBondContact O-N 2.82Å; T631-K635 HydrophobicContact CG2-CD 4.43Å; T631-K635 WeakPolarHBondContact O-CB 3.37Å; T631-K635 VanDerWaalsContact O-CG 3.32Å; T631-K635 WeakPolarHBondContact O-CG 3.42Å; T631-K635 PolarHBondContact O-N 3.33Å
632	S	76.2	Confident	62.3	Low	68 Å²	68	98.8 Å²	98.8	48%	0.476	53%	0.531	S	S	.	.	H	α-helix	trans	-68	-39.7	176.2	-62	0	0	0	0	111.9	S628 H629 F630 K635 Q636	S628-S632 WeakPolarHBondContact O-CB 3.13Å; S628-S632 PolarHBondContact O-N 3.41Å; S628-S632 PolarHBondContact O-OG 2.84Å; H629-S632 PolarHBondContact O-N 2.81Å; F630-S632 VanDerWaalsContact C-N 3.31Å; F630-S632 PolarHBondContact O-N 3.42Å; S632-K635 PolarHBondContact O-N 2.72Å; S632-Q636 WeakPolarHBondContact O-CB 3.2Å; S632-Q636 PolarHBondContact O-N 2.88Å
633	Q	77.8	Confident	63.3	Low	78 Å²	78	97 Å²	97	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-62.4	-44.5	174.6	-76.4	-177.5	-26.3	0	0	112.2	H629 F630 Q636 V637	H629-Q633 PolarHBondContact CE1-NE2 3.28Å; H629-Q633 WeakPolarHBondContact O-CG 3.33Å; H629-Q633 PolarHBondContact O-N 3.1Å; F630-Q633 PolarHBondContact O-N 2.9Å; Q633-Q636 PolarHBondContact O-N 3.24Å; Q633-V637 WeakPolarHBondContact O-CG2 2.99Å; Q633-V637 PolarHBondContact O-N 2.89Å
634	I	79.9	Confident	64	Low	28 Å²	28	98.4 Å²	98.4	14%	0.144	52%	0.522	C	S	.	.	H	α-helix	trans	-63.8	-45.1	174.8	-70.9	-176.5	0	0	0	110.8	F630 Q636 V637 L638 I688	F630-I634 HydrophobicContact CD1-CD1 4.05Å; F630-I634 HydrophobicContact CE1-CD1 3.34Å; F630-I634 HydrophobicContact CE1-CG1 4.27Å; F630-I634 HydrophobicContact CE2-CD1 4.09Å; F630-I634 HydrophobicContact CE2-CG1 4.34Å; F630-I634 HydrophobicContact CZ-CD1 3.38Å; F630-I634 HydrophobicContact CZ-CG1 4.11Å; F630-I634 PolarHBondContact O-N 3.09Å; I634-Q636 VanDerWaalsContact C-N 3.29Å; I634-Q636 PolarHBondContact O-N 3.35Å; I634-V637 PolarHBondContact O-N 3.25Å; I634-L638 HydrophobicContact CG2-CD1 3.71Å; I634-L638 HydrophobicContact CG2-CG 4.32Å; I634-L638 VanDerWaalsContact O-CG 3.31Å; I634-L638 WeakPolarHBondContact O-CG 3.04Å; I634-L638 PolarHBondContact O-N 2.86Å; I634-I688 HydrophobicContact CD1-CD1 3.94Å; I634-I688 HydrophobicContact CD1-CG1 3.46Å; I634-I688 VanDerWaalsContact CD1-CG1 3.46Å
635	K	78.6	Confident	64.7	Low	134 Å²	134	101.8 Å²	101.8	58%	0.583	53%	0.528	S	S	*	.	H	α-helix	trans	-58.3	-42	176.4	-79.2	179.8	178	-177.8	0	111.5	T631 S632 V637 L638 S639	T631-K635 HydrophobicContact CG2-CD 4.43Å; T631-K635 WeakPolarHBondContact O-CB 3.37Å; T631-K635 VanDerWaalsContact O-CG 3.32Å; T631-K635 WeakPolarHBondContact O-CG 3.42Å; T631-K635 PolarHBondContact O-N 3.33Å; S632-K635 PolarHBondContact O-N 2.72Å; K635-V637 PolarHBondContact O-N 2.83Å; K635-L638 PolarHBondContact O-N 2.89Å; K635-S639 VanDerWaalsContact O-CB 3.22Å; K635-S639 WeakPolarHBondContact O-CB 2.76Å; K635-S639 PolarHBondContact O-N 3.38Å; K635-S639 PolarHBondContact O-OG 2.65Å
636	Q	79	Confident	65.1	Low	153 Å²	153	98.6 Å²	98.6	72%	0.715	51%	0.509	S	S	*	.	H	α-helix	trans	-63.6	-40.6	177.8	-171.5	178.6	14.2	0	0	112.2	S632 Q633 I634 L638 S639	S632-Q636 WeakPolarHBondContact O-CB 3.2Å; S632-Q636 PolarHBondContact O-N 2.88Å; Q633-Q636 PolarHBondContact O-N 3.24Å; I634-Q636 VanDerWaalsContact C-N 3.29Å; I634-Q636 PolarHBondContact O-N 3.35Å; Q636-L638 VanDerWaalsContact C-N 3.28Å; Q636-L638 PolarHBondContact O-N 3.36Å; Q636-S639 PolarHBondContact O-N 2.79Å
637	V	79.5	Confident	65.3	Low	34 Å²	34	96.9 Å²	96.9	21%	0.206	51%	0.505	C	S	.	.	H	α-helix	trans	-67.1	-31.5	178.5	174	0	0	0	0	111.7	Q633 I634 K635 R683 A684 M687	Q633-V637 WeakPolarHBondContact O-CG2 2.99Å; Q633-V637 PolarHBondContact O-N 2.89Å; I634-V637 PolarHBondContact O-N 3.25Å; K635-V637 PolarHBondContact O-N 2.83Å; V637-R683 HydrophobicContact CG1-CB 4.32Å; V637-A684 HydrophobicContact CG1-CB 4.18Å; V637-M687 HydrophobicContact CB-CE 4.26Å; V637-M687 HydrophobicContact CG1-CE 3.99Å; V637-M687 HydrophobicContact CG2-CE 3.48Å; V637-M687 VanDerWaalsContact CG2-CE 3.48Å; V637-M687 HydrophobicContact CG2-SD 4.33Å
638	L	72.3	Confident	65.4	Low	80 Å²	80	92.2 Å²	92.2	42%	0.419	49%	0.494	S	S	.	.	H	α-helix	trans	-84.9	-29.5	179.2	-64.2	174.6	0	0	0	113.3	I634 K635 Q636 G640 L681 A684	I634-L638 HydrophobicContact CG2-CD1 3.71Å; I634-L638 HydrophobicContact CG2-CG 4.32Å; I634-L638 VanDerWaalsContact O-CG 3.31Å; I634-L638 WeakPolarHBondContact O-CG 3.04Å; I634-L638 PolarHBondContact O-N 2.86Å; K635-L638 PolarHBondContact O-N 2.89Å; Q636-L638 VanDerWaalsContact C-N 3.28Å; Q636-L638 PolarHBondContact O-N 3.36Å; L638-G640 PolarHBondContact O-N 3.15Å; L638-L681 HydrophobicContact CD2-CD2 4.04Å; L638-A684 HydrophobicContact CD2-CB 4.13Å
639	S	68	Low	65	Low	94 Å²	94	94.1 Å²	94.1	66%	0.657	50%	0.503	S	S	*	.			trans	-90.8	34.7	-170.6	-61.6	0	0	0	0	116.2	K635 Q636	K635-S639 VanDerWaalsContact O-CB 3.22Å; K635-S639 WeakPolarHBondContact O-CB 2.76Å; K635-S639 PolarHBondContact O-N 3.38Å; K635-S639 PolarHBondContact O-OG 2.65Å; Q636-S639 PolarHBondContact O-N 2.79Å
640	G	60.8	Low	64	Low	28 Å²	28	92.1 Å²	92.1	29%	0.289	51%	0.513	S	S	.	.			trans	-75.3	141	177.1	0	0	0	0	0	113.8	L638 N642 S643 R680	L638-G640 PolarHBondContact O-N 3.15Å; G640-N642 CarbonylContact O-C 3.54Å; G640-N642 PolarHBondContact O-N 2.98Å; G640-S643 PolarHBondContact O-N 3.22Å; G640-R680 PolarHBondContact O-NH1 3.43Å; G640-R680 VanDerWaalsContact O-NH1 3.11Å
641	E	53.2	Low	62.7	Low	197 Å²	197	92.2 Å²	92.2	92%	0.921	52%	0.515	S	S	*	.	S	Bend	trans	-52.1	-7.2	-169.8	-71.7	179.2	155.1	0	0	117.9
642	N	51.1	Low	61.2	Low	137 Å²	137	96.3 Å²	96.3	73%	0.733	53%	0.534	S	S	*	.			trans	-113.4	63.6	171.7	-67.1	-37.4	0	0	0	110.3	G640 H644 R680	G640-N642 CarbonylContact O-C 3.54Å; G640-N642 PolarHBondContact O-N 2.98Å; N642-H644 VanDerWaalsContact C-N 3.31Å; N642-R680 PolarHBondContact O-NH2 3.09Å
643	S	52.6	Low	60.1	Low	78 Å²	78	100.6 Å²	100.6	55%	0.545	55%	0.551	S	S	.	*			trans	-83	-3.2	-177	56.8	0	0	0	0	114.1	G640	G640-S643 PolarHBondContact O-N 3.22Å
644	H	53.1	Low	59	Low	153 Å²	153	103.5 Å²	103.5	71%	0.708	57%	0.565	S	S	*	*	S	Bend	trans	-85.8	123.1	175.3	-58.3	-62.8	0	0	0	109.8	N642	N642-H644 VanDerWaalsContact C-N 3.31Å
645	F	53.4	Low	57.9	Low	142 Å²	142	108 Å²	108	62%	0.623	60%	0.596	S	S	*	*			trans	-49.8	138.2	156.4	-75.2	-87.1	0	0	0	107.4	V647 L673 P677	F645-V647 PolarHBondContact O-N 3.1Å; F645-L673 HydrophobicContact CD1-CD2 3.69Å; F645-L673 HydrophobicContact CE1-CD2 4.17Å; F645-P677 HydrophobicContact CE1-CB 4.42Å
646	P	52.9	Low	56.9	Low	41 Å²	41	108.4 Å²	108.4	27%	0.266	60%	0.604	S	S	.	*			trans	-54.3	106.8	178.5	21.3	-31	0	0	0	108.1	I648 V669 I672 L673	P646-I648 PolarHBondContact O-N 2.95Å; P646-I648 VanDerWaalsContact O-N 3.13Å; P646-V669 HydrophobicContact CG-CG1 4.02Å; P646-I672 HydrophobicContact CG-CG2 4.38Å; P646-L673 HydrophobicContact CG-CD2 4.14Å; P646-L673 HydrophobicContact CG-CG 4.3Å
647	V	49.7	Very low	56.2	Low	105 Å²	105	103.7 Å²	103.7	64%	0.636	58%	0.583	S	S	*	*			trans	-65.9	117.9	178	-176.7	0	0	0	0	105.1	F645 T649	F645-V647 PolarHBondContact O-N 3.1Å; V647-T649 HydrophobicContact CG1-CG2 3.69Å; V647-T649 VanDerWaalsContact CG1-OG1 3.31Å; V647-T649 WeakPolarHBondContact CG1-OG1 3.28Å; V647-T649 PolarHBondContact O-N 3.11Å; V647-T649 PolarHBondContact O-OG1 2.92Å
648	I	52.4	Low	55.9	Low	104 Å²	104	105.7 Å²	105.7	53%	0.533	60%	0.596	S	S	.	*			trans	-73.6	68.1	176.4	-53.1	173.5	0	0	0	107.1	P646 F665	P646-I648 PolarHBondContact O-N 2.95Å; P646-I648 VanDerWaalsContact O-N 3.13Å; I648-F665 HydrophobicContact CG1-CZ 4.42Å; I648-F665 HydrophobicContact CG2-CE1 4.19Å; I648-F665 HydrophobicContact CG2-CZ 3.94Å
649	T	49.3	Very low	55.9	Low	104 Å²	104	110 Å²	110	64%	0.638	61%	0.614	S	S	*	*			trans	-105	-4.2	176.8	23.4	0	0	0	0	112.4	V647	V647-T649 HydrophobicContact CG1-CG2 3.69Å; V647-T649 VanDerWaalsContact CG1-OG1 3.31Å; V647-T649 WeakPolarHBondContact CG1-OG1 3.28Å; V647-T649 PolarHBondContact O-N 3.11Å; V647-T649 PolarHBondContact O-OG1 2.92Å
650	G	47.9	Very low	56.3	Low	71 Å²	71	113 Å²	113	73%	0.732	62%	0.618	S	S	*	*	S	Bend	trans	-89.8	-4.3	-176.9	0	0	0	0	0	117
651	L	50.2	Low	56.6	Low	42 Å²	42	116.1 Å²	116.1	22%	0.22	62%	0.624	C	S	.	*	S	Bend	trans	-109.3	-4.9	-176.4	-71.2	175.3	0	0	0	114.8	L653 L657 L662 F665	L651-L653 VanDerWaalsContact C-N 3.29Å; L651-L653 PolarHBondContact O-N 3.06Å; L651-L657 HydrophobicContact CD2-CD1 3.63Å; L651-L657 HydrophobicContact CD2-CD2 3.64Å; L651-L657 HydrophobicContact CD2-CG 4.3Å; L651-L662 HydrophobicContact CD1-CD2 4.28Å; L651-F665 HydrophobicContact CD1-CD1 3.47Å; L651-F665 VanDerWaalsContact CD1-CD1 3.47Å; L651-F665 HydrophobicContact CD1-CD2 4.13Å; L651-F665 HydrophobicContact CD1-CE1 3.44Å; L651-F665 VanDerWaalsContact CD1-CE1 3.44Å; L651-F665 HydrophobicContact CD1-CE2 4.12Å; L651-F665 HydrophobicContact CD1-CG 3.82Å; L651-F665 HydrophobicContact CD1-CZ 3.79Å; L651-F665 HydrophobicContact CG-CD2 4.38Å; L651-F665 HydrophobicContact CG-CE1 4.42Å; L651-F665 HydrophobicContact CG-CE2 4.29Å; L651-F665 HydrophobicContact CG-CG 4.5Å; L651-F665 HydrophobicContact CG-CZ 4.31Å
652	N	48.5	Very low	57.4	Low	152 Å²	152	109.8 Å²	109.8	81%	0.813	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	10.7	-176.8	-94.5	-1	0	0	0	115
653	L	51.1	Low	58.6	Low	158 Å²	158	107.3 Å²	107.3	83%	0.827	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	6.3	-172.4	-81.3	159.7	0	0	0	115.7	L651	L651-L653 VanDerWaalsContact C-N 3.29Å; L651-L653 PolarHBondContact O-N 3.06Å
654	Q	56.4	Low	59.7	Low	139 Å²	139	110.4 Å²	110.4	65%	0.65	59%	0.592	S	S	*	*			trans	-123.5	118	173.5	-67	-141.5	-22	0	0	111.5	D656 L657	Q654-D656 VanDerWaalsContact C-N 3.27Å; Q654-D656 PolarHBondContact O-N 3.49Å; Q654-L657 HydrophobicContact CB-CD1 4.1Å
655	P	56.2	Low	60.7	Low	122 Å²	122	105.5 Å²	105.5	79%	0.792	57%	0.569	S	S	*	*	S	Bend	trans	-74.7	-9.4	-178.3	27.3	-31	0	0	0	114.5
656	D	57.9	Low	61.8	Low	142 Å²	142	104.4 Å²	104.4	76%	0.759	56%	0.564	S	S	*	*			trans	-129.4	60.2	-174.6	-62.9	-43.9	0	0	0	113.5	Q654	Q654-D656 VanDerWaalsContact C-N 3.27Å; Q654-D656 PolarHBondContact O-N 3.49Å
657	L	64.2	Low	63	Low	54 Å²	54	107 Å²	107	28%	0.283	57%	0.574	S	S	.	*			trans	-80.5	121.2	172.3	-89.4	132	0	0	0	111.3	L651 Q654 Q661	L651-L657 HydrophobicContact CD2-CD1 3.63Å; L651-L657 HydrophobicContact CD2-CD2 3.64Å; L651-L657 HydrophobicContact CD2-CG 4.3Å; Q654-L657 HydrophobicContact CB-CD1 4.1Å; L657-Q661 HydrophobicContact CD2-CB 3.92Å
658	T	72.9	Confident	64.2	Low	76 Å²	76	108.8 Å²	108.8	47%	0.466	57%	0.574	S	S	.	*			trans	-69.2	148.5	174.6	57.8	0	0	0	0	111.3	Q660 Q661 L662	T658-Q660 PolarHBondContact O-N 2.84Å; T658-Q660 VanDerWaalsContact O-N 3.1Å; T658-Q661 VanDerWaalsContact N-OE1 3.17Å; T658-Q661 PolarHBondContact O-N 2.82Å; T658-Q661 VanDerWaalsContact OG1-CG 3.31Å; T658-Q661 WeakPolarHBondContact OG1-CG 3.39Å; T658-Q661 PolarHBondContact OG1-OE1 3.46Å; T658-L662 PolarHBondContact O-N 2.94Å
659	Q	71.4	Confident	65.1	Low	171 Å²	171	104.8 Å²	104.8	80%	0.799	55%	0.554	S	S	*	*	H	α-helix	trans	-52.9	-35.2	179.3	-77.2	-177.3	-18.1	0	0	113	L662 V663	Q659-L662 PolarHBondContact O-N 3.48Å; Q659-V663 WeakPolarHBondContact O-CG2 3.34Å; Q659-V663 PolarHBondContact O-N 3.02Å
660	Q	76.5	Confident	66.3	Low	158 Å²	158	102.1 Å²	102.1	74%	0.738	54%	0.54	S	S	*	.	H	α-helix	trans	-65.2	-37.4	176.9	-74.7	-177.9	-16.2	0	0	113	T658 V663 Q664	T658-Q660 PolarHBondContact O-N 2.84Å; T658-Q660 VanDerWaalsContact O-N 3.1Å; Q660-V663 PolarHBondContact O-N 3.36Å; Q660-Q664 PolarHBondContact O-N 2.82Å
661	Q	68.5	Low	67.6	Low	92 Å²	92	101.8 Å²	101.8	43%	0.43	52%	0.521	S	S	.	.	H	α-helix	trans	-71.2	-36.5	178.4	-71.7	167.1	-31.5	0	0	111.8	L657 T658 F665	L657-Q661 HydrophobicContact CD2-CB 3.92Å; T658-Q661 VanDerWaalsContact N-OE1 3.17Å; T658-Q661 PolarHBondContact O-N 2.82Å; T658-Q661 VanDerWaalsContact OG1-CG 3.31Å; T658-Q661 WeakPolarHBondContact OG1-CG 3.39Å; T658-Q661 PolarHBondContact OG1-OE1 3.46Å; Q661-F665 WeakPolarHBondContact O-CB 3.42Å; Q661-F665 PolarHBondContact O-N 3.39Å
662	L	70.2	Confident	68.6	Low	65 Å²	65	103.7 Å²	103.7	34%	0.34	53%	0.531	S	S	.	.	H	α-helix	trans	-62.8	-45.8	171.7	-92	163	0	0	0	111.7	L651 T658 Q659 F665 F666	L651-L662 HydrophobicContact CD1-CD2 4.28Å; T658-L662 PolarHBondContact O-N 2.94Å; Q659-L662 PolarHBondContact O-N 3.48Å; L662-F665 WeakPolarHBondContact O-CB 3.16Å; L662-F665 PolarHBondContact O-N 3.42Å; L662-F666 HydrophobicContact CD2-CE2 3.99Å; L662-F666 WeakPolarHBondContact O-CD2 3.25Å; L662-F666 PolarHBondContact O-N 3.48Å
663	V	75.7	Confident	69.6	Low	85 Å²	85	98.7 Å²	98.7	52%	0.515	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-45.2	177.9	172.5	0	0	0	0	111.1	Q659 Q660 F665 F666 I667	Q659-V663 WeakPolarHBondContact O-CG2 3.34Å; Q659-V663 PolarHBondContact O-N 3.02Å; Q660-V663 PolarHBondContact O-N 3.36Å; V663-F665 VanDerWaalsContact C-N 3.3Å; V663-F665 PolarHBondContact O-N 3.11Å; V663-F666 PolarHBondContact O-N 3.33Å; V663-I667 HydrophobicContact CG1-CD1 3.79Å; V663-I667 HydrophobicContact CG1-CG1 4.41Å; V663-I667 VanDerWaalsContact O-CG1 3.29Å; V663-I667 WeakPolarHBondContact O-CG1 3.41Å; V663-I667 PolarHBondContact O-N 2.93Å
664	Q	76.3	Confident	70.6	Confident	142 Å²	142	99.2 Å²	99.2	66%	0.664	50%	0.495	S	S	*	.	H	α-helix	trans	-61.7	-37.9	175.3	-83.6	-171.2	-8.3	0	0	112.6	Q660 I667 K668	Q660-Q664 PolarHBondContact O-N 2.82Å; Q664-I667 PolarHBondContact O-N 2.9Å; Q664-K668 VanDerWaalsContact O-CB 3.31Å; Q664-K668 WeakPolarHBondContact O-CB 3.02Å; Q664-K668 PolarHBondContact O-N 2.94Å
665	F	74	Confident	71.3	Confident	51 Å²	51	100.3 Å²	100.3	22%	0.224	50%	0.497	C	S	.	.	H	α-helix	trans	-61.3	-49.7	174.3	175.5	-94.4	0	0	0	111.5	I648 L651 Q661 L662 V663 I667 K668 V669	I648-F665 HydrophobicContact CG1-CZ 4.42Å; I648-F665 HydrophobicContact CG2-CE1 4.19Å; I648-F665 HydrophobicContact CG2-CZ 3.94Å; L651-F665 HydrophobicContact CD1-CD1 3.47Å; L651-F665 VanDerWaalsContact CD1-CD1 3.47Å; L651-F665 HydrophobicContact CD1-CD2 4.13Å; L651-F665 HydrophobicContact CD1-CE1 3.44Å; L651-F665 VanDerWaalsContact CD1-CE1 3.44Å; L651-F665 HydrophobicContact CD1-CE2 4.12Å; L651-F665 HydrophobicContact CD1-CG 3.82Å; L651-F665 HydrophobicContact CD1-CZ 3.79Å; L651-F665 HydrophobicContact CG-CD2 4.38Å; L651-F665 HydrophobicContact CG-CE1 4.42Å; L651-F665 HydrophobicContact CG-CE2 4.29Å; L651-F665 HydrophobicContact CG-CG 4.5Å; L651-F665 HydrophobicContact CG-CZ 4.31Å; Q661-F665 WeakPolarHBondContact O-CB 3.42Å; Q661-F665 PolarHBondContact O-N 3.39Å; L662-F665 WeakPolarHBondContact O-CB 3.16Å; L662-F665 PolarHBondContact O-N 3.42Å; V663-F665 VanDerWaalsContact C-N 3.3Å; V663-F665 PolarHBondContact O-N 3.11Å; F665-I667 VanDerWaalsContact C-N 3.33Å; F665-I667 PolarHBondContact O-N 2.93Å; F665-K668 PolarHBondContact O-N 2.82Å; F665-V669 HydrophobicContact CD1-CG2 4.15Å; F665-V669 HydrophobicContact CD2-CG2 4.27Å; F665-V669 HydrophobicContact CE1-CG2 3.7Å; F665-V669 HydrophobicContact CE2-CG2 3.83Å; F665-V669 HydrophobicContact CG-CG2 4.42Å; F665-V669 HydrophobicContact CZ-CG2 3.52Å; F665-V669 WeakPolarHBondContact O-CG2 3.47Å; F665-V669 PolarHBondContact O-N 3.11Å
666	F	74.8	Confident	72	Confident	119 Å²	119	95.5 Å²	95.5	52%	0.522	47%	0.47	S	S	.	.	H	α-helix	trans	-63.8	-36.7	178.6	-78.3	-64.1	0	0	0	112.8	L662 V663 S670	L662-F666 HydrophobicContact CD2-CE2 3.99Å; L662-F666 WeakPolarHBondContact O-CD2 3.25Å; L662-F666 PolarHBondContact O-N 3.48Å; V663-F666 PolarHBondContact O-N 3.33Å; F666-S670 WeakPolarHBondContact O-CB 3.41Å; F666-S670 PolarHBondContact O-N 3.05Å; F666-S670 PolarHBondContact O-OG 2.84Å
667	I	79.3	Confident	72.6	Confident	94 Å²	94	89.7 Å²	89.7	48%	0.482	44%	0.44	S	S	.	.	H	α-helix	trans	-62.6	-48.5	173.3	-68.9	168.2	0	0	0	109.8	V663 Q664 F665 V669 S670 D671	V663-I667 HydrophobicContact CG1-CD1 3.79Å; V663-I667 HydrophobicContact CG1-CG1 4.41Å; V663-I667 VanDerWaalsContact O-CG1 3.29Å; V663-I667 WeakPolarHBondContact O-CG1 3.41Å; V663-I667 PolarHBondContact O-N 2.93Å; Q664-I667 PolarHBondContact O-N 2.9Å; F665-I667 VanDerWaalsContact C-N 3.33Å; F665-I667 PolarHBondContact O-N 2.93Å; I667-V669 PolarHBondContact O-N 2.81Å; I667-S670 PolarHBondContact O-N 2.98Å; I667-D671 WeakPolarHBondContact O-CB 3.22Å; I667-D671 PolarHBondContact O-N 2.72Å
668	K	73.9	Confident	73.1	Confident	144 Å²	144	91.7 Å²	91.7	63%	0.626	45%	0.451	S	S	*	.	H	α-helix	trans	-64.4	-42.1	-178.8	-166.1	175.6	-177.8	180	0	112.2	Q664 F665 D671 I672	Q664-K668 VanDerWaalsContact O-CB 3.31Å; Q664-K668 WeakPolarHBondContact O-CB 3.02Å; Q664-K668 PolarHBondContact O-N 2.94Å; F665-K668 PolarHBondContact O-N 2.82Å; K668-D671 PolarHBondContact O-N 2.91Å; K668-I672 HydrophobicContact CG-CD1 4.13Å; K668-I672 WeakPolarHBondContact O-CB 3.38Å; K668-I672 WeakPolarHBondContact O-CD1 3.44Å; K668-I672 WeakPolarHBondContact O-CG1 3.4Å; K668-I672 PolarHBondContact O-N 2.81Å
669	V	71.7	Confident	73.5	Confident	19 Å²	19	91.2 Å²	91.2	12%	0.115	45%	0.445	C	S	.	.	H	α-helix	trans	-65.2	-43.5	174.7	171.5	0	0	0	0	111	P646 F665 I667 D671 I672 L673	P646-V669 HydrophobicContact CG-CG1 4.02Å; F665-V669 HydrophobicContact CD1-CG2 4.15Å; F665-V669 HydrophobicContact CD2-CG2 4.27Å; F665-V669 HydrophobicContact CE1-CG2 3.7Å; F665-V669 HydrophobicContact CE2-CG2 3.83Å; F665-V669 HydrophobicContact CG-CG2 4.42Å; F665-V669 HydrophobicContact CZ-CG2 3.52Å; F665-V669 WeakPolarHBondContact O-CG2 3.47Å; F665-V669 PolarHBondContact O-N 3.11Å; I667-V669 PolarHBondContact O-N 2.81Å; V669-D671 VanDerWaalsContact C-N 3.33Å; V669-D671 PolarHBondContact O-N 2.92Å; V669-I672 PolarHBondContact O-N 2.75Å; V669-L673 HydrophobicContact CG1-CD1 3.89Å; V669-L673 HydrophobicContact CG1-CG 4.31Å; V669-L673 WeakPolarHBondContact O-CB 3.4Å; V669-L673 VanDerWaalsContact O-CG 3.28Å; V669-L673 WeakPolarHBondContact O-CG 3.23Å; V669-L673 PolarHBondContact O-N 2.8Å
670	S	74	Confident	73.8	Confident	49 Å²	49	85 Å²	85	34%	0.343	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-40.7	177.1	-62.5	0	0	0	0	111.9	F666 I667 L673 R674	F666-S670 WeakPolarHBondContact O-CB 3.41Å; F666-S670 PolarHBondContact O-N 3.05Å; F666-S670 PolarHBondContact O-OG 2.84Å; I667-S670 PolarHBondContact O-N 2.98Å; S670-L673 PolarHBondContact O-N 2.75Å; S670-R674 WeakPolarHBondContact O-CB 3.4Å; S670-R674 WeakPolarHBondContact O-CG 3.22Å; S670-R674 PolarHBondContact O-N 3.45Å
671	D	75.2	Confident	74	Confident	63 Å²	63	82.4 Å²	82.4	34%	0.337	41%	0.405	S	S	.	.	H	α-helix	trans	-67.5	-39.7	176.5	-80.7	-12.5	0	0	0	112.2	I667 K668 V669 R674 K675	I667-D671 WeakPolarHBondContact O-CB 3.22Å; I667-D671 PolarHBondContact O-N 2.72Å; K668-D671 PolarHBondContact O-N 2.91Å; V669-D671 VanDerWaalsContact C-N 3.33Å; V669-D671 PolarHBondContact O-N 2.92Å; D671-R674 PolarHBondContact O-N 3.44Å; D671-K675 VanDerWaalsContact O-CB 3.28Å; D671-K675 WeakPolarHBondContact O-CB 3.03Å; D671-K675 WeakPolarHBondContact O-CG 3.1Å; D671-K675 PolarHBondContact O-N 3.42Å
672	I	71.1	Confident	74.7	Confident	83 Å²	83	82.8 Å²	82.8	43%	0.426	41%	0.408	S	S	.	.	H	α-helix	trans	-64.7	-42.6	174.7	-69.4	164.2	0	0	0	110.7	P646 K668 V669 G676 P677	P646-I672 HydrophobicContact CG-CG2 4.38Å; K668-I672 HydrophobicContact CG-CD1 4.13Å; K668-I672 WeakPolarHBondContact O-CB 3.38Å; K668-I672 WeakPolarHBondContact O-CD1 3.44Å; K668-I672 WeakPolarHBondContact O-CG1 3.4Å; K668-I672 PolarHBondContact O-N 2.81Å; V669-I672 PolarHBondContact O-N 2.75Å; I672-G676 PolarHBondContact O-N 2.96Å; I672-P677 WeakPolarHBondContact O-CD 3.09Å
673	L	69.4	Low	75.3	Confident	47 Å²	47	85.1 Å²	85.1	25%	0.246	41%	0.413	C	S	.	.	H	α-helix	trans	-64.6	-43.1	177.2	-73.7	173.1	0	0	0	112	F645 P646 V669 S670 P677 L678	F645-L673 HydrophobicContact CD1-CD2 3.69Å; F645-L673 HydrophobicContact CE1-CD2 4.17Å; P646-L673 HydrophobicContact CG-CD2 4.14Å; P646-L673 HydrophobicContact CG-CG 4.3Å; V669-L673 HydrophobicContact CG1-CD1 3.89Å; V669-L673 HydrophobicContact CG1-CG 4.31Å; V669-L673 WeakPolarHBondContact O-CB 3.4Å; V669-L673 VanDerWaalsContact O-CG 3.28Å; V669-L673 WeakPolarHBondContact O-CG 3.23Å; V669-L673 PolarHBondContact O-N 2.8Å; S670-L673 PolarHBondContact O-N 2.75Å; L673-P677 HydrophobicContact CD2-CG 4.36Å; L673-P677 WeakPolarHBondContact O-CD 3.34Å; L673-L678 HydrophobicContact CB-CD1 4.35Å; L673-L678 WeakPolarHBondContact O-CB 3.13Å; L673-L678 PolarHBondContact O-N 3.09Å; L673-L678 VanDerWaalsContact O-N 3.17Å
674	R	73.2	Confident	75.7	Confident	169 Å²	169	81.4 Å²	81.4	64%	0.638	39%	0.39	S	S	*	.	I	π-helix	trans	-66.7	-45	177.4	-76.7	177.9	-175.1	158	-0.1	112.2	S670 D671 D679	S670-R674 WeakPolarHBondContact O-CB 3.4Å; S670-R674 WeakPolarHBondContact O-CG 3.22Å; S670-R674 PolarHBondContact O-N 3.45Å; D671-R674 PolarHBondContact O-N 3.44Å; R674-D679 WeakPolarHBondContact O-CB 2.83Å
675	K	70.1	Confident	76.3	Confident	161 Å²	161	81.4 Å²	81.4	70%	0.7	38%	0.384	S	S	*	.	I	π-helix	trans	-79.8	-17.8	-175	-69.2	178.9	179.5	176.4	0	114.3	D671	D671-K675 VanDerWaalsContact O-CB 3.28Å; D671-K675 WeakPolarHBondContact O-CB 3.03Å; D671-K675 WeakPolarHBondContact O-CG 3.1Å; D671-K675 PolarHBondContact O-N 3.42Å
676	G	71.3	Confident	76.9	Confident	22 Å²	22	82 Å²	82	23%	0.227	40%	0.395	C	S	.	.	I	π-helix	trans	-113.3	-85.3	-177.3	0	0	0	0	0	113.7	I672 R680	I672-G676 PolarHBondContact O-N 2.96Å; G676-R680 WeakPolarHBondContact O-CG 3.25Å; G676-R680 PolarHBondContact O-N 3.29Å; G676-R680 PolarHBondContact O-NE 2.84Å
677	P	70.8	Confident	77.3	Confident	20 Å²	20	79.3 Å²	79.3	13%	0.13	39%	0.385	C	S	.	.	I	π-helix	trans	-62.4	-47.4	-173.5	-22.9	32	0	0	0	115	F645 I672 L673 R680 L681	F645-P677 HydrophobicContact CE1-CB 4.42Å; I672-P677 WeakPolarHBondContact O-CD 3.09Å; L673-P677 HydrophobicContact CD2-CG 4.36Å; L673-P677 WeakPolarHBondContact O-CD 3.34Å; P677-R680 PolarHBondContact O-N 2.7Å; P677-L681 WeakPolarHBondContact O-CG 3.22Å; P677-L681 PolarHBondContact O-N 3.06Å; P677-L681 VanDerWaalsContact O-N 3.12Å
678	L	75.4	Confident	77.7	Confident	96 Å²	96	78.8 Å²	78.8	50%	0.503	38%	0.382	S	S	.	.	I	π-helix	trans	-66.9	-44.8	-175.5	-90.9	139.5	0	0	0	112.3	L673 R680 L681 M682	L673-L678 HydrophobicContact CB-CD1 4.35Å; L673-L678 WeakPolarHBondContact O-CB 3.13Å; L673-L678 PolarHBondContact O-N 3.09Å; L673-L678 VanDerWaalsContact O-N 3.17Å; L678-R680 VanDerWaalsContact C-N 3.33Å; L678-R680 PolarHBondContact O-N 3.23Å; L678-L681 PolarHBondContact O-N 2.99Å; L678-M682 WeakPolarHBondContact O-CG 3.19Å; L678-M682 PolarHBondContact O-N 2.88Å
679	D	80.2	Confident	78.5	Confident	65 Å²	65	75.6 Å²	75.6	35%	0.348	37%	0.369	S	S	.	.	H	α-helix	trans	-62.5	-37.5	178.2	178.4	50.6	0	0	0	112.5	R674 M682 R683	R674-D679 WeakPolarHBondContact O-CB 2.83Å; D679-M682 PolarHBondContact O-N 3.34Å; D679-R683 PolarHBondContact O-N 3.25Å; D679-R683 IonicContact OD1-CZ 3.66Å; D679-R683 IonicContact OD1-NH1 3.38Å; D679-R683 PolarHBondContact OD1-NH1 3.48Å; D679-R683 IonicContact OD2-CZ 3.63Å; D679-R683 IonicContact OD2-NH1 2.61Å; D679-R683 PolarHBondContact OD2-NH1 3.43Å; D679-R683 IonicContact OD2-NH2 3.27Å; D679-R683 PolarHBondContact OD2-NH2 3.3Å
680	R	78.1	Confident	79.2	Confident	42 Å²	42	79.3 Å²	79.3	16%	0.158	39%	0.385	C	S	.	.	H	α-helix	trans	-63	-46.1	171.6	-75.1	-174.2	-68.1	-171	-1.3	112.7	G640 N642 G676 P677 L678 M682 R683 A684	G640-R680 PolarHBondContact O-NH1 3.43Å; G640-R680 VanDerWaalsContact O-NH1 3.11Å; N642-R680 PolarHBondContact O-NH2 3.09Å; G676-R680 WeakPolarHBondContact O-CG 3.25Å; G676-R680 PolarHBondContact O-N 3.29Å; G676-R680 PolarHBondContact O-NE 2.84Å; P677-R680 PolarHBondContact O-N 2.7Å; L678-R680 VanDerWaalsContact C-N 3.33Å; L678-R680 PolarHBondContact O-N 3.23Å; R680-M682 VanDerWaalsContact C-N 3.31Å; R680-M682 PolarHBondContact O-N 3.23Å; R680-R683 PolarHBondContact O-N 3.07Å; R680-A684 PolarHBondContact O-N 3.14Å
681	L	81	Confident	79.8	Confident	103 Å²	103	79.4 Å²	79.4	54%	0.539	38%	0.38	S	S	.	.	H	α-helix	trans	-63.8	-38.2	177.4	-71.2	173.5	0	0	0	111.6	L638 P677 L678 A684 R685	L638-L681 HydrophobicContact CD2-CD2 4.04Å; P677-L681 WeakPolarHBondContact O-CG 3.22Å; P677-L681 PolarHBondContact O-N 3.06Å; P677-L681 VanDerWaalsContact O-N 3.12Å; L678-L681 PolarHBondContact O-N 2.99Å; L681-A684 PolarHBondContact O-N 2.89Å; L681-R685 WeakPolarHBondContact O-CB 3.19Å; L681-R685 PolarHBondContact O-N 3.44Å
682	M	83.2	Confident	80.4	Confident	100 Å²	100	79.9 Å²	79.9	49%	0.493	39%	0.388	S	S	.	.	H	α-helix	trans	-63.6	-43.7	174.6	-74	-61.3	-63.7	0	0	111.9	L678 D679 R680 R685 S686	L678-M682 WeakPolarHBondContact O-CG 3.19Å; L678-M682 PolarHBondContact O-N 2.88Å; D679-M682 PolarHBondContact O-N 3.34Å; R680-M682 VanDerWaalsContact C-N 3.31Å; R680-M682 PolarHBondContact O-N 3.23Å; M682-R685 PolarHBondContact O-N 2.93Å; M682-S686 PolarHBondContact O-N 3.13Å; M682-S686 PolarHBondContact O-OG 3.3Å; M682-S686 VanDerWaalsContact O-OG 3.14Å
683	R	82.6	Confident	81.3	Confident	114 Å²	114	82.8 Å²	82.8	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-60.9	-45.9	173.3	-81.6	-167.6	-73.4	-83.9	-6.6	112.8	V637 D679 R680 R685 S686 M687	V637-R683 HydrophobicContact CG1-CB 4.32Å; D679-R683 PolarHBondContact O-N 3.25Å; D679-R683 IonicContact OD1-CZ 3.66Å; D679-R683 IonicContact OD1-NH1 3.38Å; D679-R683 PolarHBondContact OD1-NH1 3.48Å; D679-R683 IonicContact OD2-CZ 3.63Å; D679-R683 IonicContact OD2-NH1 2.61Å; D679-R683 PolarHBondContact OD2-NH1 3.43Å; D679-R683 IonicContact OD2-NH2 3.27Å; D679-R683 PolarHBondContact OD2-NH2 3.3Å; R680-R683 PolarHBondContact O-N 3.07Å; R683-R685 VanDerWaalsContact C-N 3.33Å; R683-R685 PolarHBondContact O-N 3.48Å; R683-S686 PolarHBondContact O-N 3.36Å; R683-M687 HydrophobicContact CB-CE 4.22Å; R683-M687 WeakPolarHBondContact O-CE 3.36Å; R683-M687 PolarHBondContact O-N 2.87Å
684	A	84.9	Confident	82.1	Confident	6 Å²	6	84.7 Å²	84.7	5%	0.05	40%	0.402	C	S	.	.	H	α-helix	trans	-60.9	-43.7	178	0	0	0	0	0	111.3	V637 L638 R680 L681 M687 I688	V637-A684 HydrophobicContact CG1-CB 4.18Å; L638-A684 HydrophobicContact CD2-CB 4.13Å; R680-A684 PolarHBondContact O-N 3.14Å; L681-A684 PolarHBondContact O-N 2.89Å; A684-M687 PolarHBondContact O-N 3.33Å; A684-I688 WeakPolarHBondContact O-CG1 3.3Å; A684-I688 PolarHBondContact O-N 2.78Å
685	R	87.2	Confident	82.7	Confident	142 Å²	142	80.4 Å²	80.4	54%	0.536	39%	0.391	S	S	.	.	H	α-helix	trans	-58.1	-49.9	174.2	179.1	-177.2	170.3	-169.9	-4.5	111.9	L681 M682 R683 M687 I688 E689	L681-R685 WeakPolarHBondContact O-CB 3.19Å; L681-R685 PolarHBondContact O-N 3.44Å; M682-R685 PolarHBondContact O-N 2.93Å; R683-R685 VanDerWaalsContact C-N 3.33Å; R683-R685 PolarHBondContact O-N 3.48Å; R685-M687 VanDerWaalsContact C-N 3.28Å; R685-M687 PolarHBondContact O-N 3.35Å; R685-I688 PolarHBondContact O-N 3Å; R685-I688 VanDerWaalsContact O-N 3.14Å; R685-E689 HydrophobicContact CG-CG 4.39Å; R685-E689 IonicContact CZ-OE1 2.89Å; R685-E689 VanDerWaalsContact CZ-OE1 3.27Å; R685-E689 IonicContact NE-OE1 3.99Å; R685-E689 PolarHBondContact NE-OE1 3.18Å; R685-E689 IonicContact NH2-OE1 3.7Å; R685-E689 PolarHBondContact NH2-OE1 3.41Å; R685-E689 PolarHBondContact O-N 3.31Å
686	S	87	Confident	83.7	Confident	64 Å²	64	78.1 Å²	78.1	45%	0.448	38%	0.383	S	S	.	.	H	α-helix	trans	-59.5	-38.9	179.6	-63.3	0	0	0	0	112.4	M682 R683 H690	M682-S686 PolarHBondContact O-N 3.13Å; M682-S686 PolarHBondContact O-OG 3.3Å; M682-S686 VanDerWaalsContact O-OG 3.14Å; R683-S686 PolarHBondContact O-N 3.36Å; S686-H690 WeakPolarHBondContact O-CB 3.49Å; S686-H690 PolarHBondContact O-N 2.87Å
687	M	84.7	Confident	84.5	Confident	62 Å²	62	82.4 Å²	82.4	31%	0.305	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-42.1	174.6	-85.8	179.5	-85.2	0	0	112.6	V637 R683 A684 R685 H690 H691	V637-M687 HydrophobicContact CB-CE 4.26Å; V637-M687 HydrophobicContact CG1-CE 3.99Å; V637-M687 HydrophobicContact CG2-CE 3.48Å; V637-M687 VanDerWaalsContact CG2-CE 3.48Å; V637-M687 HydrophobicContact CG2-SD 4.33Å; R683-M687 HydrophobicContact CB-CE 4.22Å; R683-M687 WeakPolarHBondContact O-CE 3.36Å; R683-M687 PolarHBondContact O-N 2.87Å; A684-M687 PolarHBondContact O-N 3.33Å; R685-M687 VanDerWaalsContact C-N 3.28Å; R685-M687 PolarHBondContact O-N 3.35Å; M687-H690 PolarHBondContact O-N 2.91Å; M687-H691 WeakPolarHBondContact O-CB 3.38Å; M687-H691 PolarHBondContact O-N 2.89Å
688	I	87.1	Confident	85.3	Confident	84 Å²	84	85.8 Å²	85.8	43%	0.431	42%	0.417	S	S	.	.	H	α-helix	trans	-63.5	-46.1	175.5	-66.1	165.3	0	0	0	111.2	F630 I634 A684 R685 H690 H691 S692	F630-I688 HydrophobicContact CZ-CG1 4.2Å; I634-I688 HydrophobicContact CD1-CD1 3.94Å; I634-I688 HydrophobicContact CD1-CG1 3.46Å; I634-I688 VanDerWaalsContact CD1-CG1 3.46Å; A684-I688 WeakPolarHBondContact O-CG1 3.3Å; A684-I688 PolarHBondContact O-N 2.78Å; R685-I688 PolarHBondContact O-N 3Å; R685-I688 VanDerWaalsContact O-N 3.14Å; I688-H690 VanDerWaalsContact C-N 3.29Å; I688-H690 PolarHBondContact O-N 2.83Å; I688-H691 PolarHBondContact O-N 3.13Å; I688-S692 VanDerWaalsContact O-CB 3.29Å; I688-S692 WeakPolarHBondContact O-CB 3.35Å; I688-S692 PolarHBondContact O-N 3.13Å
689	E	89.9	Confident	86.1	Confident	76 Å²	76	85.7 Å²	85.7	36%	0.355	42%	0.416	S	S	.	.	H	α-helix	trans	-64.4	-34.1	178.3	-74.3	179.5	177.4	0	0	112.4	R685 R693	R685-E689 HydrophobicContact CG-CG 4.39Å; R685-E689 IonicContact CZ-OE1 2.89Å; R685-E689 VanDerWaalsContact CZ-OE1 3.27Å; R685-E689 IonicContact NE-OE1 3.99Å; R685-E689 PolarHBondContact NE-OE1 3.18Å; R685-E689 IonicContact NH2-OE1 3.7Å; R685-E689 PolarHBondContact NH2-OE1 3.41Å; R685-E689 PolarHBondContact O-N 3.31Å; E689-R693 WeakPolarHBondContact O-CG 3.46Å; E689-R693 PolarHBondContact O-N 3.2Å; E689-R693 PolarHBondContact O-NE 3Å; E689-R693 VanDerWaalsContact O-NE 3.09Å
690	H	87.5	Confident	86.6	Confident	97 Å²	97	85.4 Å²	85.4	45%	0.449	42%	0.419	S	S	.	.	H	α-helix	trans	-69.3	-46.9	174.8	-175.4	64.7	0	0	0	111.7	S686 M687 I688 S692 R693 Q694	S686-H690 WeakPolarHBondContact O-CB 3.49Å; S686-H690 PolarHBondContact O-N 2.87Å; M687-H690 PolarHBondContact O-N 2.91Å; I688-H690 VanDerWaalsContact C-N 3.29Å; I688-H690 PolarHBondContact O-N 2.83Å; H690-S692 VanDerWaalsContact C-N 3.34Å; H690-S692 PolarHBondContact O-N 3.09Å; H690-R693 PolarHBondContact O-N 3.29Å; H690-Q694 PolarHBondContact NE2-NE2 2.86Å; H690-Q694 VanDerWaalsContact NE2-NE2 3.12Å; H690-Q694 PolarHBondContact O-N 3.5Å; H690-Q694 VanDerWaalsContact O-N 3.09Å
691	H	86	Confident	87.1	Confident	51 Å²	51	86.3 Å²	86.3	24%	0.236	44%	0.435	C	S	.	.	H	α-helix	trans	-65.5	-38.2	179.3	-167.8	56.1	0	0	0	112.2	F630 M687 I688 R693 Q694 L695	F630-H691 AromaticContact CD1-CD2 3.71Å; F630-H691 HydrophobicContact CD2-CB 4.3Å; F630-H691 HydrophobicContact CE1-CB 4.28Å; F630-H691 AromaticContact CE1-CD2 3.61Å; F630-H691 HydrophobicContact CE2-CB 3.6Å; F630-H691 AromaticContact CE2-CG 3.83Å; F630-H691 AromaticContact CG-CD2 3.97Å; F630-H691 HydrophobicContact CZ-CB 3.57Å; F630-H691 AromaticContact CZ-CD2 3.81Å; F630-H691 AromaticContact CZ-CG 3.86Å; M687-H691 WeakPolarHBondContact O-CB 3.38Å; M687-H691 PolarHBondContact O-N 2.89Å; I688-H691 PolarHBondContact O-N 3.13Å; H691-R693 VanDerWaalsContact C-N 3.34Å; H691-R693 PolarHBondContact O-N 3.07Å; H691-Q694 PolarHBondContact O-N 2.82Å; H691-L695 WeakPolarHBondContact O-CG 3.16Å; H691-L695 PolarHBondContact O-N 3.05Å
692	S	88.2	Confident	87.6	Confident	73 Å²	73	87.1 Å²	87.1	51%	0.51	44%	0.436	S	S	.	.	H	α-helix	trans	-59.2	-43.5	173.8	-177.8	0	0	0	0	112.1	I688 H690 L695 Q696	I688-S692 VanDerWaalsContact O-CB 3.29Å; I688-S692 WeakPolarHBondContact O-CB 3.35Å; I688-S692 PolarHBondContact O-N 3.13Å; H690-S692 VanDerWaalsContact C-N 3.34Å; H690-S692 PolarHBondContact O-N 3.09Å; S692-L695 PolarHBondContact O-N 3.48Å; S692-Q696 PolarHBondContact O-N 2.75Å
693	R	88.6	Confident	88	Confident	144 Å²	144	88.3 Å²	88.3	54%	0.543	44%	0.44	S	S	.	.	H	α-helix	trans	-62.5	-45.6	175.3	-80	179.1	-81.9	155	-12.7	112.4	E689 H690 H691 L695 Q696 D697	E689-R693 WeakPolarHBondContact O-CG 3.46Å; E689-R693 PolarHBondContact O-N 3.2Å; E689-R693 PolarHBondContact O-NE 3Å; E689-R693 VanDerWaalsContact O-NE 3.09Å; H690-R693 PolarHBondContact O-N 3.29Å; H691-R693 VanDerWaalsContact C-N 3.34Å; H691-R693 PolarHBondContact O-N 3.07Å; R693-L695 VanDerWaalsContact C-N 3.32Å; R693-L695 PolarHBondContact O-N 2.86Å; R693-Q696 WeakPolarHBondContact O-CB 3.01Å; R693-Q696 PolarHBondContact O-N 3.07Å; R693-D697 PolarHBondContact O-N 2.94Å
694	Q	87.1	Confident	88.5	Confident	87 Å²	87	86.7 Å²	86.7	41%	0.407	45%	0.447	S	S	.	.	H	α-helix	trans	-59.6	-42.5	176.3	-71.6	-179.5	-25.9	0	0	112.4	H690 H691 Q696 D697 I698	H690-Q694 PolarHBondContact NE2-NE2 2.86Å; H690-Q694 VanDerWaalsContact NE2-NE2 3.12Å; H690-Q694 PolarHBondContact O-N 3.5Å; H690-Q694 VanDerWaalsContact O-N 3.09Å; H691-Q694 PolarHBondContact O-N 2.82Å; Q694-Q696 VanDerWaalsContact C-N 3.34Å; Q694-D697 PolarHBondContact O-N 2.66Å; Q694-I698 VanDerWaalsContact O-CG1 3.31Å; Q694-I698 WeakPolarHBondContact O-CG1 3.49Å; Q694-I698 PolarHBondContact O-N 2.85Å
695	L	86.1	Confident	88.8	Confident	80 Å²	80	92.3 Å²	92.3	42%	0.419	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-40.4	176.3	-72.9	171.9	0	0	0	111.7	H691 S692 R693 D697 I698 I699	H691-L695 WeakPolarHBondContact O-CG 3.16Å; H691-L695 PolarHBondContact O-N 3.05Å; S692-L695 PolarHBondContact O-N 3.48Å; R693-L695 VanDerWaalsContact C-N 3.32Å; R693-L695 PolarHBondContact O-N 2.86Å; L695-D697 VanDerWaalsContact C-N 3.32Å; L695-D697 PolarHBondContact O-N 2.86Å; L695-I698 PolarHBondContact O-N 3.32Å; L695-I699 WeakPolarHBondContact O-CB 3.32Å; L695-I699 WeakPolarHBondContact O-CD1 3.29Å; L695-I699 WeakPolarHBondContact O-CG1 3.4Å; L695-I699 PolarHBondContact O-N 2.89Å
696	Q	90.3	Very high	88.8	Confident	112 Å²	112	87.9 Å²	87.9	52%	0.523	47%	0.466	S	S	.	.	H	α-helix	trans	-60.8	-41.6	175.8	-172.3	62.3	36.4	0	0	111.9	S692 R693 Q694 S700	S692-Q696 PolarHBondContact O-N 2.75Å; R693-Q696 WeakPolarHBondContact O-CB 3.01Å; R693-Q696 PolarHBondContact O-N 3.07Å; Q694-Q696 VanDerWaalsContact C-N 3.34Å; Q696-S700 WeakPolarHBondContact O-CB 3.28Å; Q696-S700 PolarHBondContact O-N 3.04Å; Q696-S700 PolarHBondContact O-OG 3.34Å
697	D	88.4	Confident	89.1	Confident	112 Å²	112	90.3 Å²	90.3	60%	0.599	47%	0.471	S	S	*	.	H	α-helix	trans	-65.3	-44.1	177.5	-66.9	-24.7	0	0	0	111.4	R693 Q694 L695 S700 A701	R693-D697 PolarHBondContact O-N 2.94Å; Q694-D697 PolarHBondContact O-N 2.66Å; L695-D697 VanDerWaalsContact C-N 3.32Å; L695-D697 PolarHBondContact O-N 2.86Å; D697-S700 PolarHBondContact O-N 3.06Å; D697-A701 PolarHBondContact O-N 2.93Å
698	I	88.8	Confident	89.5	Confident	91 Å²	91	94.4 Å²	94.4	47%	0.467	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-46.5	177.4	-67.3	165.3	0	0	0	111	Q694 L695 S700 A701 Q702	Q694-I698 VanDerWaalsContact O-CG1 3.31Å; Q694-I698 WeakPolarHBondContact O-CG1 3.49Å; Q694-I698 PolarHBondContact O-N 2.85Å; L695-I698 PolarHBondContact O-N 3.32Å; I698-S700 VanDerWaalsContact C-N 3.29Å; I698-S700 PolarHBondContact O-N 2.93Å; I698-A701 PolarHBondContact O-N 3.45Å; I698-Q702 HydrophobicContact CG2-CG 4.45Å; I698-Q702 WeakPolarHBondContact O-CG 3.45Å; I698-Q702 PolarHBondContact O-N 3.42Å
699	I	90.4	Very high	89.6	Confident	95 Å²	95	95.2 Å²	95.2	49%	0.487	49%	0.492	S	S	.	.	H	α-helix	trans	-61.3	-41	178	-69.8	166.2	0	0	0	110.4	L695 Q702 H703	L695-I699 WeakPolarHBondContact O-CB 3.32Å; L695-I699 WeakPolarHBondContact O-CD1 3.29Å; L695-I699 WeakPolarHBondContact O-CG1 3.4Å; L695-I699 PolarHBondContact O-N 2.89Å; I699-Q702 PolarHBondContact O-N 3.38Å; I699-H703 WeakPolarHBondContact O-CB 3.4Å; I699-H703 PolarHBondContact O-N 2.83Å
700	S	91	Very high	89.7	Confident	59 Å²	59	94.2 Å²	94.2	41%	0.413	49%	0.491	S	S	.	.	H	α-helix	trans	-66	-40.2	178.9	-56.7	0	0	0	0	111.9	Q696 D697 I698 H703 S704	Q696-S700 WeakPolarHBondContact O-CB 3.28Å; Q696-S700 PolarHBondContact O-N 3.04Å; Q696-S700 PolarHBondContact O-OG 3.34Å; D697-S700 PolarHBondContact O-N 3.06Å; I698-S700 VanDerWaalsContact C-N 3.29Å; I698-S700 PolarHBondContact O-N 2.93Å; S700-H703 PolarHBondContact O-N 3.44Å; S700-S704 PolarHBondContact O-N 2.85Å; S700-S704 VanDerWaalsContact O-N 3.1Å
701	A	89.6	Confident	89.9	Confident	61 Å²	61	92.5 Å²	92.5	50%	0.504	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-47	174.8	0	0	0	0	0	111.9	D697 I698 H703 S704 E705	D697-A701 PolarHBondContact O-N 2.93Å; I698-A701 PolarHBondContact O-N 3.45Å; A701-H703 VanDerWaalsContact C-N 3.31Å; A701-H703 PolarHBondContact O-N 3.07Å; A701-S704 WeakPolarHBondContact O-CB 3.29Å; A701-S704 PolarHBondContact O-N 3.22Å; A701-E705 PolarHBondContact O-N 2.81Å
702	Q	90.6	Very high	90.2	Very high	119 Å²	119	95 Å²	95	56%	0.556	50%	0.502	S	S	*	.	H	α-helix	trans	-62.1	-37.8	177.1	-72.9	179.1	-16.4	0	0	112.2	I698 I699 E705 A706	I698-Q702 HydrophobicContact CG2-CG 4.45Å; I698-Q702 WeakPolarHBondContact O-CG 3.45Å; I698-Q702 PolarHBondContact O-N 3.42Å; I699-Q702 PolarHBondContact O-N 3.38Å; Q702-E705 PolarHBondContact O-N 3.18Å; Q702-A706 WeakPolarHBondContact O-CB 3.47Å; Q702-A706 PolarHBondContact O-N 3.41Å
703	H	92.4	Very high	90.4	Very high	125 Å²	125	99.2 Å²	99.2	58%	0.579	51%	0.507	S	S	*	.	H	α-helix	trans	-65	-42.8	176.1	-174.2	65.7	0	0	0	112.2	I699 S700 A701 E705 A706 M707	I699-H703 WeakPolarHBondContact O-CB 3.4Å; I699-H703 PolarHBondContact O-N 2.83Å; S700-H703 PolarHBondContact O-N 3.44Å; A701-H703 VanDerWaalsContact C-N 3.31Å; A701-H703 PolarHBondContact O-N 3.07Å; H703-E705 VanDerWaalsContact C-N 3.34Å; H703-E705 PolarHBondContact O-N 3.09Å; H703-A706 PolarHBondContact O-N 2.73Å; H703-M707 WeakPolarHBondContact O-CG 3.47Å; H703-M707 PolarHBondContact O-N 3.48Å
704	S	92.1	Very high	90.5	Very high	81 Å²	81	98 Å²	98	57%	0.566	51%	0.507	S	S	*	.	H	α-helix	trans	-60.9	-42.6	175.4	-174.4	0	0	0	0	111.9	S700 A701 M707 K708	S700-S704 PolarHBondContact O-N 2.85Å; S700-S704 VanDerWaalsContact O-N 3.1Å; A701-S704 WeakPolarHBondContact O-CB 3.29Å; A701-S704 PolarHBondContact O-N 3.22Å; S704-M707 PolarHBondContact O-N 3.28Å; S704-K708 PolarHBondContact O-N 3.01Å
705	E	91.8	Very high	90.9	Very high	124 Å²	124	98.6 Å²	98.6	58%	0.579	52%	0.517	S	S	*	.	H	α-helix	trans	-64.3	-44	176.3	-172.2	173.1	-170	0	0	112.2	A701 Q702 H703 M707 K708 L709	A701-E705 PolarHBondContact O-N 2.81Å; Q702-E705 PolarHBondContact O-N 3.18Å; H703-E705 VanDerWaalsContact C-N 3.34Å; H703-E705 PolarHBondContact O-N 3.09Å; E705-M707 VanDerWaalsContact C-N 3.3Å; E705-M707 PolarHBondContact O-N 2.81Å; E705-K708 WeakPolarHBondContact O-CB 3.43Å; E705-K708 PolarHBondContact O-N 2.83Å; E705-L709 HydrophobicContact CG-CD1 4.45Å; E705-L709 PolarHBondContact O-N 2.77Å
706	A	88.1	Confident	91.2	Very high	49 Å²	49	100 Å²	100	41%	0.405	52%	0.524	S	S	.	.	H	α-helix	trans	-60.8	-38.3	176.1	0	0	0	0	0	112.6	Q702 H703 T710	Q702-A706 WeakPolarHBondContact O-CB 3.47Å; Q702-A706 PolarHBondContact O-N 3.41Å; H703-A706 PolarHBondContact O-N 2.73Å; A706-T710 WeakPolarHBondContact O-CB 3.4Å; A706-T710 PolarHBondContact O-N 2.7Å; A706-T710 PolarHBondContact O-OG1 2.9Å
707	M	92.2	Very high	91.2	Very high	115 Å²	115	100 Å²	100	57%	0.567	53%	0.525	S	S	*	.	H	α-helix	trans	-65.9	-42	175.2	-73.5	-66.6	-76.2	0	0	111.8	H703 S704 E705 T710 S711	H703-M707 WeakPolarHBondContact O-CG 3.47Å; H703-M707 PolarHBondContact O-N 3.48Å; S704-M707 PolarHBondContact O-N 3.28Å; E705-M707 VanDerWaalsContact C-N 3.3Å; E705-M707 PolarHBondContact O-N 2.81Å; M707-T710 PolarHBondContact O-N 2.92Å; M707-S711 PolarHBondContact O-N 3.01Å; M707-S711 VanDerWaalsContact O-N 3.11Å
708	K	92.7	Very high	91.4	Very high	147 Å²	147	98.3 Å²	98.3	64%	0.639	52%	0.521	S	S	*	.	H	α-helix	trans	-60	-49.3	174.9	-173.5	-175.8	175.1	-170.6	0	111.3	S704 E705 T710 S711 E712	S704-K708 PolarHBondContact O-N 3.01Å; E705-K708 WeakPolarHBondContact O-CB 3.43Å; E705-K708 PolarHBondContact O-N 2.83Å; K708-T710 VanDerWaalsContact C-N 3.27Å; K708-T710 PolarHBondContact O-N 2.88Å; K708-S711 PolarHBondContact O-N 2.97Å; K708-S711 VanDerWaalsContact O-N 3.15Å; K708-S711 PolarHBondContact O-OG 3.28Å; K708-E712 PolarHBondContact O-N 3.07Å; K708-E712 VanDerWaalsContact O-N 3.09Å
709	L	89.9	Confident	91.7	Very high	101 Å²	101	100.8 Å²	100.8	53%	0.529	53%	0.529	S	S	.	.	H	α-helix	trans	-61	-36	177.9	-70.6	171.9	0	0	0	112.4	E705 E712 R713	E705-L709 HydrophobicContact CG-CD1 4.45Å; E705-L709 PolarHBondContact O-N 2.77Å; L709-E712 PolarHBondContact O-N 3.01Å; L709-R713 WeakPolarHBondContact O-CB 3.39Å; L709-R713 PolarHBondContact O-N 3.5Å
710	T	91.1	Very high	91.7	Very high	56 Å²	56	99.1 Å²	99.1	34%	0.344	53%	0.529	S	S	.	.	H	α-helix	trans	-64.5	-40.4	176.3	-59.4	0	0	0	0	111.9	A706 M707 K708 R713 Q714	A706-T710 WeakPolarHBondContact O-CB 3.4Å; A706-T710 PolarHBondContact O-N 2.7Å; A706-T710 PolarHBondContact O-OG1 2.9Å; M707-T710 PolarHBondContact O-N 2.92Å; K708-T710 VanDerWaalsContact C-N 3.27Å; K708-T710 PolarHBondContact O-N 2.88Å; T710-R713 PolarHBondContact O-N 2.76Å; T710-Q714 PolarHBondContact O-N 3.2Å
711	S	92	Very high	91.7	Very high	61 Å²	61	101.3 Å²	101.3	43%	0.427	53%	0.532	S	S	.	.	H	α-helix	trans	-67	-38.3	176.4	74.7	0	0	0	0	112.7	M707 K708 Q714 T715	M707-S711 PolarHBondContact O-N 3.01Å; M707-S711 VanDerWaalsContact O-N 3.11Å; K708-S711 PolarHBondContact O-N 2.97Å; K708-S711 VanDerWaalsContact O-N 3.15Å; K708-S711 PolarHBondContact O-OG 3.28Å; S711-Q714 PolarHBondContact O-N 3.02Å; S711-T715 PolarHBondContact O-N 3.14Å; S711-T715 PolarHBondContact O-OG1 3.23Å
712	E	93.6	Very high	91.9	Very high	103 Å²	103	102.8 Å²	102.8	48%	0.481	53%	0.529	S	S	.	.	H	α-helix	trans	-66.3	-41.9	176.8	-169.9	171.4	-176.2	0	0	111.2	K708 L709 Q714 T715 L716	K708-E712 PolarHBondContact O-N 3.07Å; K708-E712 VanDerWaalsContact O-N 3.09Å; L709-E712 PolarHBondContact O-N 3.01Å; E712-Q714 PolarHBondContact O-N 2.79Å; E712-T715 WeakPolarHBondContact O-CB 3.47Å; E712-T715 PolarHBondContact O-N 2.94Å; E712-L716 HydrophobicContact CG-CD1 4.46Å; E712-L716 WeakPolarHBondContact O-CG 3.27Å; E712-L716 PolarHBondContact O-N 2.85Å
713	R	92.6	Very high	92	Very high	161 Å²	161	102.5 Å²	102.5	61%	0.608	53%	0.531	S	S	*	.	H	α-helix	trans	-56.9	-45	174.1	-174.8	-177.9	68.4	175.8	0.2	112.5	L709 T710 T715 L716 Q717	L709-R713 WeakPolarHBondContact O-CB 3.39Å; L709-R713 PolarHBondContact O-N 3.5Å; T710-R713 PolarHBondContact O-N 2.76Å; R713-T715 VanDerWaalsContact C-N 3.31Å; R713-T715 PolarHBondContact O-N 3.36Å; R713-L716 PolarHBondContact O-N 3.01Å; R713-Q717 WeakPolarHBondContact O-CB 3.04Å; R713-Q717 PolarHBondContact O-N 2.68Å
714	Q	90.7	Very high	92	Very high	119 Å²	119	99.5 Å²	99.5	56%	0.556	53%	0.528	S	S	*	.	H	α-helix	trans	-63.1	-39.1	178.1	-74.1	178.8	-11	0	0	112.2	T710 S711 E712 Q717 S718	T710-Q714 PolarHBondContact O-N 3.2Å; S711-Q714 PolarHBondContact O-N 3.02Å; E712-Q714 PolarHBondContact O-N 2.79Å; Q714-Q717 PolarHBondContact O-N 3.37Å; Q714-S718 PolarHBondContact O-N 2.58Å; Q714-S718 PolarHBondContact O-OG 3.45Å
715	T	94.2	Very high	91.9	Very high	99 Å²	99	102.8 Å²	102.8	61%	0.607	53%	0.532	S	S	*	.	H	α-helix	trans	-65	-44.5	176.9	-53.3	0	0	0	0	111	S711 E712 R713 S718 K719	S711-T715 PolarHBondContact O-N 3.14Å; S711-T715 PolarHBondContact O-OG1 3.23Å; E712-T715 WeakPolarHBondContact O-CB 3.47Å; E712-T715 PolarHBondContact O-N 2.94Å; R713-T715 VanDerWaalsContact C-N 3.31Å; R713-T715 PolarHBondContact O-N 3.36Å; T715-S718 PolarHBondContact O-N 2.99Å; T715-K719 PolarHBondContact O-N 3.06Å; T715-K719 VanDerWaalsContact O-N 3.13Å
716	L	92.4	Very high	92	Very high	110 Å²	110	103.5 Å²	103.5	58%	0.576	53%	0.529	S	S	*	.	H	α-helix	trans	-63.5	-41	176.4	-72.3	173.8	0	0	0	112.3	E712 R713 K719 A720	E712-L716 HydrophobicContact CG-CD1 4.46Å; E712-L716 WeakPolarHBondContact O-CG 3.27Å; E712-L716 PolarHBondContact O-N 2.85Å; R713-L716 PolarHBondContact O-N 3.01Å; L716-K719 PolarHBondContact O-N 2.86Å; L716-A720 PolarHBondContact O-N 3.43Å
717	Q	91.6	Very high	92.2	Very high	113 Å²	113	107 Å²	107	53%	0.528	54%	0.537	S	S	.	.	H	α-helix	trans	-62	-46.3	177.3	-176.2	173.9	-7	0	0	111.7	R713 Q714 K719 A720 E721	R713-Q717 WeakPolarHBondContact O-CB 3.04Å; R713-Q717 PolarHBondContact O-N 2.68Å; Q714-Q717 PolarHBondContact O-N 3.37Å; Q717-K719 VanDerWaalsContact C-N 3.29Å; Q717-K719 PolarHBondContact O-N 2.8Å; Q717-A720 WeakPolarHBondContact O-CB 3.5Å; Q717-A720 PolarHBondContact O-N 3.11Å; Q717-A720 VanDerWaalsContact O-N 3.14Å; Q717-E721 PolarHBondContact O-N 3.29Å
718	S	91.6	Very high	92.1	Very high	76 Å²	76	105.3 Å²	105.3	53%	0.531	54%	0.536	S	S	.	.	H	α-helix	trans	-60.2	-40.8	177.7	-56.7	0	0	0	0	111.8	Q714 T715 E721 E722	Q714-S718 PolarHBondContact O-N 2.58Å; Q714-S718 PolarHBondContact O-OG 3.45Å; T715-S718 PolarHBondContact O-N 2.99Å; S718-E721 PolarHBondContact O-N 2.77Å; S718-E722 PolarHBondContact O-N 2.88Å; S718-E722 VanDerWaalsContact O-N 3.15Å
719	K	95.1	Very high	92.1	Very high	143 Å²	143	102.3 Å²	102.3	62%	0.622	53%	0.526	S	S	*	.	H	α-helix	trans	-67.5	-36.2	176.7	-168.2	174.7	-177.2	178.8	0	112.5	T715 L716 Q717 E722 L723	T715-K719 PolarHBondContact O-N 3.06Å; T715-K719 VanDerWaalsContact O-N 3.13Å; L716-K719 PolarHBondContact O-N 2.86Å; Q717-K719 VanDerWaalsContact C-N 3.29Å; Q717-K719 PolarHBondContact O-N 2.8Å; K719-E722 PolarHBondContact O-N 2.97Å; K719-L723 WeakPolarHBondContact O-CB 3.33Å; K719-L723 PolarHBondContact O-N 3.01Å
720	A	91.6	Very high	92.2	Very high	59 Å²	59	101.7 Å²	101.7	49%	0.488	52%	0.522	S	S	.	.	H	α-helix	trans	-64.9	-41	175.7	0	0	0	0	0	111.7	L716 Q717 L723 A724	L716-A720 PolarHBondContact O-N 3.43Å; Q717-A720 WeakPolarHBondContact O-CB 3.5Å; Q717-A720 PolarHBondContact O-N 3.11Å; Q717-A720 VanDerWaalsContact O-N 3.14Å; A720-L723 PolarHBondContact O-N 3.22Å; A720-A724 WeakPolarHBondContact O-CB 3.42Å; A720-A724 PolarHBondContact O-N 2.86Å
721	E	90.2	Very high	92.3	Very high	105 Å²	105	102 Å²	102	49%	0.491	53%	0.525	S	S	.	.	H	α-helix	trans	-62.7	-41.8	174.9	-70.2	177.6	-165.6	0	0	112.3	Q717 S718 A724 K725	Q717-E721 PolarHBondContact O-N 3.29Å; S718-E721 PolarHBondContact O-N 2.77Å; E721-A724 PolarHBondContact O-N 2.94Å; E721-K725 WeakPolarHBondContact O-CG 3.25Å; E721-K725 PolarHBondContact O-N 2.62Å
722	E	93.2	Very high	92.2	Very high	93 Å²	93	105.5 Å²	105.5	44%	0.435	53%	0.534	S	S	.	.	H	α-helix	trans	-62.1	-43.9	174.7	-170.7	-172	169.3	0	0	111.7	S718 K719 K725 R726	S718-E722 PolarHBondContact O-N 2.88Å; S718-E722 VanDerWaalsContact O-N 3.15Å; K719-E722 PolarHBondContact O-N 2.97Å; E722-K725 PolarHBondContact O-N 2.85Å; E722-R726 PolarHBondContact O-N 3.45Å; E722-R726 VanDerWaalsContact O-N 3.17Å; E722-R726 IonicContact OE1-CZ 2.83Å; E722-R726 IonicContact OE1-NE 3.78Å; E722-R726 IonicContact OE1-NH1 2.93Å; E722-R726 IonicContact OE1-NH2 2.66Å; E722-R726 PolarHBondContact OE1-NH2 3.34Å
723	L	94.1	Very high	92.2	Very high	113 Å²	113	108.6 Å²	108.6	59%	0.592	54%	0.541	S	S	*	.	H	α-helix	trans	-65	-41.9	179	-158.7	87.7	0	0	0	111.8	K719 A720 K725 R726 H727	K719-L723 WeakPolarHBondContact O-CB 3.33Å; K719-L723 PolarHBondContact O-N 3.01Å; A720-L723 PolarHBondContact O-N 3.22Å; L723-K725 VanDerWaalsContact C-N 3.34Å; L723-K725 PolarHBondContact O-N 3.47Å; L723-R726 PolarHBondContact O-N 2.86Å; L723-H727 PolarHBondContact O-N 2.83Å
724	A	90.5	Very high	92.2	Very high	62 Å²	62	106 Å²	106	51%	0.512	54%	0.536	S	S	.	.	H	α-helix	trans	-60.9	-41.9	178.2	0	0	0	0	0	111.9	A720 E721 H727 S728	A720-A724 WeakPolarHBondContact O-CB 3.42Å; A720-A724 PolarHBondContact O-N 2.86Å; E721-A724 PolarHBondContact O-N 2.94Å; A724-H727 PolarHBondContact O-N 2.84Å; A724-S728 PolarHBondContact O-N 3.36Å; A724-S728 VanDerWaalsContact O-N 3.08Å
725	K	90.2	Very high	92.1	Very high	149 Å²	149	103 Å²	103	65%	0.648	53%	0.528	S	S	*	.	H	α-helix	trans	-60.9	-45.2	174	-71.8	175.1	-175.7	172.6	0	111.7	E721 E722 L723 S728 I729	E721-K725 WeakPolarHBondContact O-CG 3.25Å; E721-K725 PolarHBondContact O-N 2.62Å; E722-K725 PolarHBondContact O-N 2.85Å; L723-K725 VanDerWaalsContact C-N 3.34Å; L723-K725 PolarHBondContact O-N 3.47Å; K725-S728 PolarHBondContact O-N 3.11Å; K725-I729 WeakPolarHBondContact O-CG1 3.34Å; K725-I729 PolarHBondContact O-N 3.48Å
726	R	93.9	Very high	91.8	Very high	139 Å²	139	103.6 Å²	103.6	53%	0.525	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-42.5	176.4	-73	-175.7	-176.8	149.9	4.6	112.2	E722 L723 S728 I729 I730	E722-R726 PolarHBondContact O-N 3.45Å; E722-R726 VanDerWaalsContact O-N 3.17Å; E722-R726 IonicContact OE1-CZ 2.83Å; E722-R726 IonicContact OE1-NE 3.78Å; E722-R726 IonicContact OE1-NH1 2.93Å; E722-R726 IonicContact OE1-NH2 2.66Å; E722-R726 PolarHBondContact OE1-NH2 3.34Å; L723-R726 PolarHBondContact O-N 2.86Å; R726-S728 PolarHBondContact O-N 3.4Å; R726-I729 PolarHBondContact O-N 2.66Å; R726-I730 WeakPolarHBondContact O-CG1 3.39Å; R726-I730 PolarHBondContact O-N 2.79Å
727	H	93.5	Very high	91.8	Very high	124 Å²	124	102.7 Å²	102.7	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-59.6	-45.8	178.9	-175.5	-85.6	0	0	0	111.4	L723 A724 I729 I730 T731	L723-H727 PolarHBondContact O-N 2.83Å; A724-H727 PolarHBondContact O-N 2.84Å; H727-I729 VanDerWaalsContact C-N 3.32Å; H727-I729 PolarHBondContact O-N 2.76Å; H727-I730 PolarHBondContact O-N 3.09Å; H727-I730 VanDerWaalsContact O-N 3.09Å; H727-T731 PolarHBondContact CE1-OG1 3.23Å; H727-T731 PolarHBondContact ND1-OG1 3.47Å; H727-T731 PolarHBondContact O-N 3.14Å; H727-T731 PolarHBondContact O-OG1 2.69Å
728	S	89.4	Confident	91.6	Very high	79 Å²	79	101.8 Å²	101.8	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-56.2	-43.7	176.8	176.4	0	0	0	0	112.8	A724 K725 R726 I730 T731 E732	A724-S728 PolarHBondContact O-N 3.36Å; A724-S728 VanDerWaalsContact O-N 3.08Å; K725-S728 PolarHBondContact O-N 3.11Å; R726-S728 PolarHBondContact O-N 3.4Å; S728-I730 VanDerWaalsContact C-N 3.34Å; S728-I730 PolarHBondContact O-N 3.38Å; S728-T731 PolarHBondContact O-N 2.96Å; S728-E732 PolarHBondContact O-N 3.1Å; S728-E732 VanDerWaalsContact O-N 3.15Å
729	I	92.2	Very high	91.5	Very high	84 Å²	84	104.8 Å²	104.8	43%	0.431	52%	0.523	S	S	.	.	H	α-helix	trans	-64.4	-39.6	177.2	-63.6	167.1	0	0	0	111.2	K725 R726 H727 R733	K725-I729 WeakPolarHBondContact O-CG1 3.34Å; K725-I729 PolarHBondContact O-N 3.48Å; R726-I729 PolarHBondContact O-N 2.66Å; H727-I729 VanDerWaalsContact C-N 3.32Å; H727-I729 PolarHBondContact O-N 2.76Å; I729-R733 WeakPolarHBondContact O-CG 3.19Å; I729-R733 PolarHBondContact O-N 3.41Å; I729-R733 VanDerWaalsContact O-N 3.14Å
730	I	93.4	Very high	91.2	Very high	87 Å²	87	105.5 Å²	105.5	45%	0.446	52%	0.522	S	S	.	.	H	α-helix	trans	-67.5	-44.8	179.3	-67.9	167.4	0	0	0	110.8	R726 H727 S728 E732 R733 Q734	R726-I730 WeakPolarHBondContact O-CG1 3.39Å; R726-I730 PolarHBondContact O-N 2.79Å; H727-I730 PolarHBondContact O-N 3.09Å; H727-I730 VanDerWaalsContact O-N 3.09Å; S728-I730 VanDerWaalsContact C-N 3.34Å; S728-I730 PolarHBondContact O-N 3.38Å; I730-E732 VanDerWaalsContact C-N 3.31Å; I730-E732 PolarHBondContact O-N 3.37Å; I730-R733 PolarHBondContact O-N 3.19Å; I730-R733 VanDerWaalsContact O-N 3.15Å; I730-Q734 HydrophobicContact CG2-CG 4.37Å; I730-Q734 WeakPolarHBondContact O-CG 3.41Å; I730-Q734 PolarHBondContact O-N 2.81Å
731	T	92.6	Very high	91.1	Very high	63 Å²	63	107.8 Å²	107.8	39%	0.387	52%	0.524	S	S	.	.	H	α-helix	trans	-61.9	-38.9	179	-46.3	0	0	0	0	111.7	H727 S728 Q734 S735	H727-T731 PolarHBondContact CE1-OG1 3.23Å; H727-T731 PolarHBondContact ND1-OG1 3.47Å; H727-T731 PolarHBondContact O-N 3.14Å; H727-T731 PolarHBondContact O-OG1 2.69Å; S728-T731 PolarHBondContact O-N 2.96Å; T731-Q734 PolarHBondContact O-N 3.42Å; T731-S735 PolarHBondContact O-N 3.4Å
732	E	90.9	Very high	90.7	Very high	135 Å²	135	105.3 Å²	105.3	63%	0.631	52%	0.521	S	S	*	.	H	α-helix	trans	-62.4	-44.2	173.9	-172.9	-178.2	-175.9	0	0	111.8	S728 I730 S735 M736	S728-E732 PolarHBondContact O-N 3.1Å; S728-E732 VanDerWaalsContact O-N 3.15Å; I730-E732 VanDerWaalsContact C-N 3.31Å; I730-E732 PolarHBondContact O-N 3.37Å; E732-S735 PolarHBondContact O-N 3.1Å; E732-M736 PolarHBondContact O-N 3.38Å; E732-M736 VanDerWaalsContact O-N 3.09Å
733	R	93	Very high	90.3	Very high	167 Å²	167	105.8 Å²	105.8	63%	0.63	53%	0.527	S	S	*	.	H	α-helix	trans	-64.3	-40.6	176.2	-74.1	179.3	177.4	178.5	0.1	112.6	I729 I730 M736 L737	I729-R733 WeakPolarHBondContact O-CG 3.19Å; I729-R733 PolarHBondContact O-N 3.41Å; I729-R733 VanDerWaalsContact O-N 3.14Å; I730-R733 PolarHBondContact O-N 3.19Å; I730-R733 VanDerWaalsContact O-N 3.15Å; R733-M736 WeakPolarHBondContact O-CB 3.24Å; R733-M736 PolarHBondContact O-N 2.92Å; R733-L737 WeakPolarHBondContact O-CG 3.29Å; R733-L737 PolarHBondContact O-N 3.06Å
734	Q	91.3	Very high	89.9	Confident	107 Å²	107	104.8 Å²	104.8	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-60.9	-47.9	175.5	-76.8	176.6	-26.1	0	0	111.1	I730 T731 M736 L737 D738	I730-Q734 HydrophobicContact CG2-CG 4.37Å; I730-Q734 WeakPolarHBondContact O-CG 3.41Å; I730-Q734 PolarHBondContact O-N 2.81Å; T731-Q734 PolarHBondContact O-N 3.42Å; Q734-M736 PolarHBondContact O-N 3.13Å; Q734-L737 PolarHBondContact O-N 2.87Å; Q734-D738 PolarHBondContact O-N 2.89Å
735	S	88.8	Confident	89.4	Confident	55 Å²	55	104.5 Å²	104.5	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-57.9	-37.4	175.7	-174.7	0	0	0	0	112.7	T731 E732 K739	T731-S735 PolarHBondContact O-N 3.4Å; E732-S735 PolarHBondContact O-N 3.1Å; S735-K739 WeakPolarHBondContact O-CG 3.2Å; S735-K739 PolarHBondContact O-N 2.99Å
736	M	89.3	Confident	88.8	Confident	113 Å²	113	101.8 Å²	101.8	56%	0.557	52%	0.515	S	S	*	.	H	α-helix	trans	-66.7	-41.2	175.1	-170.5	-171.3	-63.4	0	0	112.1	E732 R733 Q734 R740	E732-M736 PolarHBondContact O-N 3.38Å; E732-M736 VanDerWaalsContact O-N 3.09Å; R733-M736 WeakPolarHBondContact O-CB 3.24Å; R733-M736 PolarHBondContact O-N 2.92Å; Q734-M736 PolarHBondContact O-N 3.13Å; M736-R740 WeakPolarHBondContact O-CG 2.87Å; M736-R740 PolarHBondContact O-N 3.24Å
737	L	91.1	Very high	88.2	Confident	91 Å²	91	103.7 Å²	103.7	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-67.5	-42.9	177.2	-71.7	171.5	0	0	0	111.8	R733 Q734 K739 R740 M741	R733-L737 WeakPolarHBondContact O-CG 3.29Å; R733-L737 PolarHBondContact O-N 3.06Å; Q734-L737 PolarHBondContact O-N 2.87Å; L737-K739 VanDerWaalsContact C-N 3.31Å; L737-K739 PolarHBondContact O-N 3.08Å; L737-R740 CarbonylContact O-C 3.56Å; L737-R740 WeakPolarHBondContact O-CA 3.19Å; L737-R740 WeakPolarHBondContact O-CB 3.35Å; L737-R740 PolarHBondContact O-N 3.19Å; L737-M741 WeakPolarHBondContact O-CG 3.3Å; L737-M741 PolarHBondContact O-N 2.82Å
738	D	88.5	Confident	87.5	Confident	94 Å²	94	103.6 Å²	103.6	50%	0.503	53%	0.525	S	S	.	.	H	α-helix	trans	-59.3	-42.1	177.1	-69.3	-25.5	0	0	0	111.6	Q734 R740 M741 A742	Q734-D738 PolarHBondContact O-N 2.89Å; D738-R740 VanDerWaalsContact C-N 3.32Å; D738-R740 PolarHBondContact O-N 3.43Å; D738-M741 PolarHBondContact O-N 3.06Å; D738-M741 WeakPolarHBondContact OD1-CE 3.06Å; D738-A742 WeakPolarHBondContact O-CB 3.33Å; D738-A742 PolarHBondContact O-N 3.35Å
739	K	88.5	Confident	86.7	Confident	138 Å²	138	102.9 Å²	102.9	60%	0.6	52%	0.524	S	S	*	.	H	α-helix	trans	-60.4	-41.3	172.8	-73.4	172.4	-175.2	172.6	0	112.1	S735 L737 N743	S735-K739 WeakPolarHBondContact O-CG 3.2Å; S735-K739 PolarHBondContact O-N 2.99Å; L737-K739 VanDerWaalsContact C-N 3.31Å; L737-K739 PolarHBondContact O-N 3.08Å; K739-N743 WeakPolarHBondContact O-CB 3.11Å; K739-N743 VanDerWaalsContact O-CG 3.25Å; K739-N743 PolarHBondContact O-N 3.01Å; K739-N743 PolarHBondContact O-ND2 3.5Å
740	R	89.9	Confident	85.7	Confident	158 Å²	158	102.8 Å²	102.8	60%	0.596	54%	0.536	S	S	*	.	H	α-helix	trans	-66.6	-41.3	176.8	-72	176.6	65.1	-174.8	-0.5	111.6	M736 L737 D738 N743 L744	M736-R740 WeakPolarHBondContact O-CG 2.87Å; M736-R740 PolarHBondContact O-N 3.24Å; L737-R740 CarbonylContact O-C 3.56Å; L737-R740 WeakPolarHBondContact O-CA 3.19Å; L737-R740 WeakPolarHBondContact O-CB 3.35Å; L737-R740 PolarHBondContact O-N 3.19Å; D738-R740 VanDerWaalsContact C-N 3.32Å; D738-R740 PolarHBondContact O-N 3.43Å; R740-N743 PolarHBondContact O-N 3.32Å; R740-L744 WeakPolarHBondContact O-CG 3.34Å; R740-L744 PolarHBondContact O-N 2.9Å
741	M	88.4	Confident	84.7	Confident	107 Å²	107	105.7 Å²	105.7	53%	0.527	55%	0.552	S	S	.	*	H	α-helix	trans	-65.4	-43.9	177.1	-70.8	-170.6	-66.8	0	0	111.6	L737 D738 N743 L744 A745	L737-M741 WeakPolarHBondContact O-CG 3.3Å; L737-M741 PolarHBondContact O-N 2.82Å; D738-M741 PolarHBondContact O-N 3.06Å; D738-M741 WeakPolarHBondContact OD1-CE 3.06Å; M741-N743 VanDerWaalsContact C-N 3.3Å; M741-N743 PolarHBondContact O-N 3.33Å; M741-L744 PolarHBondContact O-N 3.13Å; M741-A745 PolarHBondContact O-N 3.08Å
742	A	82.2	Confident	83.4	Confident	53 Å²	53	105.1 Å²	105.1	44%	0.438	56%	0.558	S	S	.	*	H	α-helix	trans	-59	-41.4	174	0	0	0	0	0	112	D738 L744 A745 T746	D738-A742 WeakPolarHBondContact O-CB 3.33Å; D738-A742 PolarHBondContact O-N 3.35Å; A742-L744 VanDerWaalsContact C-N 3.32Å; A742-L744 PolarHBondContact O-N 3.42Å; A742-A745 PolarHBondContact O-N 3.39Å; A742-T746 WeakPolarHBondContact O-CG2 3.48Å; A742-T746 PolarHBondContact O-N 3.41Å; A742-T746 PolarHBondContact O-OG1 3.44Å
743	N	84.3	Confident	81.9	Confident	103 Å²	103	108.6 Å²	108.6	55%	0.551	58%	0.575	S	S	*	*	H	α-helix	trans	-66.1	-30.9	174.7	-73.8	-16	0	0	0	113.2	K739 R740 M741 T746 R747	K739-N743 WeakPolarHBondContact O-CB 3.11Å; K739-N743 VanDerWaalsContact O-CG 3.25Å; K739-N743 PolarHBondContact O-N 3.01Å; K739-N743 PolarHBondContact O-ND2 3.5Å; R740-N743 PolarHBondContact O-N 3.32Å; M741-N743 VanDerWaalsContact C-N 3.3Å; M741-N743 PolarHBondContact O-N 3.33Å; N743-T746 WeakPolarHBondContact CA-OG1 3.5Å; N743-T746 PolarHBondContact O-OG1 2.79Å; N743-R747 WeakPolarHBondContact O-CD 3.47Å; N743-R747 VanDerWaalsContact O-CG 3.25Å; N743-R747 WeakPolarHBondContact O-CG 3.38Å; N743-R747 PolarHBondContact O-N 3.48Å
744	L	86.5	Confident	80.4	Confident	93 Å²	93	103 Å²	103	49%	0.487	57%	0.569	S	S	.	*	H	α-helix	trans	-75.5	-42.1	173.8	-72	171.4	0	0	0	111.7	R740 M741 A742 T746 R747 L748	R740-L744 WeakPolarHBondContact O-CG 3.34Å; R740-L744 PolarHBondContact O-N 2.9Å; M741-L744 PolarHBondContact O-N 3.13Å; A742-L744 VanDerWaalsContact C-N 3.32Å; A742-L744 PolarHBondContact O-N 3.42Å; L744-T746 VanDerWaalsContact C-N 3.34Å; L744-T746 PolarHBondContact O-N 3.25Å; L744-R747 WeakPolarHBondContact O-CB 3.37Å; L744-R747 PolarHBondContact O-N 2.88Å; L744-R747 VanDerWaalsContact O-N 3.14Å; L744-L748 PolarHBondContact O-N 3.36Å
745	A	80.5	Confident	79.3	Confident	56 Å²	56	102.1 Å²	102.1	46%	0.463	57%	0.573	S	S	.	*	H	α-helix	trans	-60.2	-43.7	177.7	0	0	0	0	0	111.7	M741 A742 R747 L748 A749	M741-A745 PolarHBondContact O-N 3.08Å; A742-A745 PolarHBondContact O-N 3.39Å; A745-R747 VanDerWaalsContact C-N 3.32Å; A745-R747 PolarHBondContact O-N 2.94Å; A745-L748 PolarHBondContact O-N 2.92Å; A745-A749 WeakPolarHBondContact O-CB 3.25Å; A745-A749 PolarHBondContact O-N 2.87Å
746	T	76.8	Confident	78.5	Confident	91 Å²	91	103.2 Å²	103.2	56%	0.558	58%	0.577	S	S	*	*	H	α-helix	trans	-61.2	-38.1	174.2	46.6	0	0	0	0	112.8	A742 N743 L744 A750	A742-T746 WeakPolarHBondContact O-CG2 3.48Å; A742-T746 PolarHBondContact O-N 3.41Å; A742-T746 PolarHBondContact O-OG1 3.44Å; N743-T746 WeakPolarHBondContact CA-OG1 3.5Å; N743-T746 PolarHBondContact O-OG1 2.79Å; L744-T746 VanDerWaalsContact C-N 3.34Å; L744-T746 PolarHBondContact O-N 3.25Å; T746-A750 PolarHBondContact O-N 3.08Å
747	R	81.7	Confident	77.8	Confident	179 Å²	179	107 Å²	107	68%	0.675	59%	0.591	S	S	*	*	H	α-helix	trans	-68	-37.1	174.6	-72.4	173.2	65	-169.6	0.2	112.9	N743 L744 A745 A750	N743-R747 WeakPolarHBondContact O-CD 3.47Å; N743-R747 VanDerWaalsContact O-CG 3.25Å; N743-R747 WeakPolarHBondContact O-CG 3.38Å; N743-R747 PolarHBondContact O-N 3.48Å; L744-R747 WeakPolarHBondContact O-CB 3.37Å; L744-R747 PolarHBondContact O-N 2.88Å; L744-R747 VanDerWaalsContact O-N 3.14Å; A745-R747 VanDerWaalsContact C-N 3.32Å; A745-R747 PolarHBondContact O-N 2.94Å; R747-A750 PolarHBondContact O-N 2.99Å
748	L	79.3	Confident	77	Confident	122 Å²	122	106.2 Å²	106.2	64%	0.639	60%	0.597	S	S	*	*	H	α-helix	trans	-68.9	-43.4	176.4	-75.1	168.9	0	0	0	111.5	L744 A745 A750 L751	L744-L748 PolarHBondContact O-N 3.36Å; A745-L748 PolarHBondContact O-N 2.92Å; L748-A750 PolarHBondContact O-N 3.49Å; L748-L751 HydrophobicContact CD2-CD1 4.45Å; L748-L751 WeakPolarHBondContact O-CB 3.43Å; L748-L751 PolarHBondContact O-N 3.29Å
749	A	70.8	Confident	76.3	Confident	64 Å²	64	106.1 Å²	106.1	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-60	-32.2	175.8	0	0	0	0	0	112.2	A745 L751 G752	A745-A749 WeakPolarHBondContact O-CB 3.25Å; A745-A749 PolarHBondContact O-N 2.87Å; A749-L751 PolarHBondContact O-N 2.97Å; A749-G752 PolarHBondContact O-N 3.04Å
750	A	71.5	Confident	75.8	Confident	83 Å²	83	103.2 Å²	103.2	69%	0.686	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-10.3	176.2	0	0	0	0	0	114.7	T746 R747 L748	T746-A750 PolarHBondContact O-N 3.08Å; R747-A750 PolarHBondContact O-N 2.99Å; L748-A750 PolarHBondContact O-N 3.49Å
751	L	73.5	Confident	75.2	Confident	147 Å²	147	98 Å²	98	77%	0.77	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-6.4	178.7	-64.3	170.5	0	0	0	113.6	L748 A749	L748-L751 HydrophobicContact CD2-CD1 4.45Å; L748-L751 WeakPolarHBondContact O-CB 3.43Å; L748-L751 PolarHBondContact O-N 3.29Å; A749-L751 PolarHBondContact O-N 2.97Å
752	G	64.4	Low	74.9	Confident	51 Å²	51	99 Å²	99	53%	0.526	58%	0.579	S	S	.	*	S	Bend	trans	-81	161.6	179	0	0	0	0	0	114.3	A749 G754	A749-G752 PolarHBondContact O-N 3.04Å; G752-G754 VanDerWaalsContact C-N 3.33Å; G752-G754 PolarHBondContact O-N 2.9Å
753	E	58.8	Low	74.9	Confident	209 Å²	209	104.8 Å²	104.8	98%	0.977	59%	0.59	S	S	*	*	S	Bend	trans	-69.6	81.8	178.6	-73.3	-171.6	165.2	0	0	112.4
754	G	62.2	Low	74.8	Confident	50 Å²	50	104.3 Å²	104.3	52%	0.515	59%	0.587	S	S	.	*	S	Bend	trans	65.4	162.2	171.7	0	0	0	0	0	114.4	G752 T756	G752-G754 VanDerWaalsContact C-N 3.33Å; G752-G754 PolarHBondContact O-N 2.9Å; G754-T756 PolarHBondContact O-N 3.39Å
755	P	68.7	Low	74.7	Confident	88 Å²	88	106.1 Å²	106.1	57%	0.571	59%	0.593	S	S	*	*			trans	-70.2	125	-179.7	29.1	-32.9	0	0	0	109.8	E759 I760	P755-E759 WeakPolarHBondContact CA-OE2 3.46Å; P755-E759 HydrophobicContact CB-CB 4.28Å; P755-I760 HydrophobicContact CB-CD1 4.43Å; P755-I760 HydrophobicContact CB-CG1 3.84Å; P755-I760 HydrophobicContact CG-CD1 4.14Å; P755-I760 HydrophobicContact CG-CG1 3.96Å
756	T	72	Confident	75	Confident	77 Å²	77	107.5 Å²	107.5	47%	0.472	60%	0.596	S	S	.	*			trans	-59.6	155.3	171.2	60.5	0	0	0	0	110.3	G754 A758 E759 I760	G754-T756 PolarHBondContact O-N 3.39Å; T756-A758 PolarHBondContact O-N 2.98Å; T756-A758 VanDerWaalsContact O-N 3.1Å; T756-E759 PolarHBondContact N-OE2 2.87Å; T756-E759 PolarHBondContact O-N 3.43Å; T756-E759 VanDerWaalsContact OG1-CD 3.31Å; T756-E759 VanDerWaalsContact OG1-CG 3.24Å; T756-E759 WeakPolarHBondContact OG1-CG 3.48Å; T756-E759 PolarHBondContact OG1-N 3.46Å; T756-E759 PolarHBondContact OG1-OE2 2.9Å; T756-I760 WeakPolarHBondContact O-CG1 3.04Å; T756-I760 PolarHBondContact O-N 2.89Å
757	K	73.4	Confident	75.4	Confident	194 Å²	194	105.7 Å²	105.7	84%	0.843	58%	0.582	S	S	*	*	H	α-helix	trans	-54.4	-32.9	176.7	-77.1	-176.7	177.2	178.2	0	112.7	A761	K757-A761 PolarHBondContact O-N 2.95Å; K757-A761 VanDerWaalsContact O-N 3.09Å
758	A	76.1	Confident	75.6	Confident	73 Å²	73	101.9 Å²	101.9	60%	0.603	58%	0.579	S	S	*	*	H	α-helix	trans	-67.6	-42.5	175	0	0	0	0	0	112.3	T756 I760 A761 M762	T756-A758 PolarHBondContact O-N 2.98Å; T756-A758 VanDerWaalsContact O-N 3.1Å; A758-I760 VanDerWaalsContact C-N 3.35Å; A758-I760 PolarHBondContact O-N 3.35Å; A758-A761 PolarHBondContact O-N 2.95Å; A758-M762 WeakPolarHBondContact O-CB 3.12Å; A758-M762 PolarHBondContact O-N 2.83Å
759	E	72.4	Confident	75.8	Confident	92 Å²	92	100.6 Å²	100.6	43%	0.43	57%	0.571	S	S	.	*	H	α-helix	trans	-66.5	-35.5	176	-73.3	166.4	143.3	0	0	112.4	P755 T756 R763	P755-E759 WeakPolarHBondContact CA-OE2 3.46Å; P755-E759 HydrophobicContact CB-CB 4.28Å; T756-E759 PolarHBondContact N-OE2 2.87Å; T756-E759 PolarHBondContact O-N 3.43Å; T756-E759 VanDerWaalsContact OG1-CD 3.31Å; T756-E759 VanDerWaalsContact OG1-CG 3.24Å; T756-E759 WeakPolarHBondContact OG1-CG 3.48Å; T756-E759 PolarHBondContact OG1-N 3.46Å; T756-E759 PolarHBondContact OG1-OE2 2.9Å; E759-R763 WeakPolarHBondContact O-CB 3.43Å; E759-R763 PolarHBondContact O-N 2.61Å
760	I	77.5	Confident	76.6	Confident	77 Å²	77	103.7 Å²	103.7	40%	0.395	57%	0.569	S	S	.	*	H	α-helix	trans	-65.9	-44.8	174.7	-61.4	172.9	0	0	0	110.4	P755 T756 A758 R763 N764	P755-I760 HydrophobicContact CB-CD1 4.43Å; P755-I760 HydrophobicContact CB-CG1 3.84Å; P755-I760 HydrophobicContact CG-CD1 4.14Å; P755-I760 HydrophobicContact CG-CG1 3.96Å; T756-I760 WeakPolarHBondContact O-CG1 3.04Å; T756-I760 PolarHBondContact O-N 2.89Å; A758-I760 VanDerWaalsContact C-N 3.35Å; A758-I760 PolarHBondContact O-N 3.35Å; I760-R763 PolarHBondContact O-N 2.97Å; I760-N764 VanDerWaalsContact O-CG 3.26Å; I760-N764 PolarHBondContact O-N 3.07Å; I760-N764 PolarHBondContact O-ND2 2.73Å
761	A	79.3	Confident	77.3	Confident	49 Å²	49	102.8 Å²	102.8	41%	0.405	55%	0.553	S	S	.	*	H	α-helix	trans	-63.3	-48.3	176.3	0	0	0	0	0	111.7	K757 A758 R763 N764 E765	K757-A761 PolarHBondContact O-N 2.95Å; K757-A761 VanDerWaalsContact O-N 3.09Å; A758-A761 PolarHBondContact O-N 2.95Å; A761-R763 VanDerWaalsContact C-N 3.31Å; A761-R763 PolarHBondContact O-N 3.01Å; A761-N764 PolarHBondContact O-N 2.94Å; A761-N764 VanDerWaalsContact O-N 3.12Å; A761-E765 PolarHBondContact O-N 3.24Å
762	M	81.4	Confident	77.6	Confident	127 Å²	127	105.5 Å²	105.5	63%	0.626	55%	0.553	S	S	*	*	H	α-helix	trans	-61.1	-39.7	177	-175.5	179.3	-85.5	0	0	111.5	A758 N764 E765 V766	A758-M762 WeakPolarHBondContact O-CB 3.12Å; A758-M762 PolarHBondContact O-N 2.83Å; M762-N764 VanDerWaalsContact C-N 3.34Å; M762-N764 PolarHBondContact O-N 3Å; M762-E765 PolarHBondContact O-N 3.36Å; M762-V766 HydrophobicContact CG-CG2 4.44Å; M762-V766 WeakPolarHBondContact O-CB 3.33Å; M762-V766 VanDerWaalsContact O-CG2 3.25Å; M762-V766 WeakPolarHBondContact O-CG2 3.4Å; M762-V766 PolarHBondContact O-N 3.35Å
763	R	81.3	Confident	78.3	Confident	175 Å²	175	107.2 Å²	107.2	66%	0.66	55%	0.549	S	S	*	.	H	α-helix	trans	-61.9	-41.1	175	-179.2	176.2	-179.4	151	-0.2	112	E759 I760 A761 V766 I767	E759-R763 WeakPolarHBondContact O-CB 3.43Å; E759-R763 PolarHBondContact O-N 2.61Å; I760-R763 PolarHBondContact O-N 2.97Å; A761-R763 VanDerWaalsContact C-N 3.31Å; A761-R763 PolarHBondContact O-N 3.01Å; R763-V766 PolarHBondContact O-N 3.1Å; R763-I767 HydrophobicContact CG-CD1 3.95Å; R763-I767 WeakPolarHBondContact O-CB 3.47Å; R763-I767 VanDerWaalsContact O-CG1 3.25Å; R763-I767 WeakPolarHBondContact O-CG1 3.33Å; R763-I767 PolarHBondContact O-N 3.21Å
764	N	82.4	Confident	79.4	Confident	93 Å²	93	101.9 Å²	101.9	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-65.8	-42.4	178	-70	-20	0	0	0	111.4	I760 A761 M762 I767 V768	I760-N764 VanDerWaalsContact O-CG 3.26Å; I760-N764 PolarHBondContact O-N 3.07Å; I760-N764 PolarHBondContact O-ND2 2.73Å; A761-N764 PolarHBondContact O-N 2.94Å; A761-N764 VanDerWaalsContact O-N 3.12Å; M762-N764 VanDerWaalsContact C-N 3.34Å; M762-N764 PolarHBondContact O-N 3Å; N764-I767 PolarHBondContact O-N 2.9Å; N764-V768 WeakPolarHBondContact O-CG2 3.46Å; N764-V768 PolarHBondContact O-N 3.21Å
765	E	85.1	Confident	80.2	Confident	131 Å²	131	107.6 Å²	107.6	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-61.9	-45.1	173.8	-70.3	-177.1	179.2	0	0	112.1	A761 M762 I767 V768 I769	A761-E765 PolarHBondContact O-N 3.24Å; M762-E765 PolarHBondContact O-N 3.36Å; E765-I767 VanDerWaalsContact C-N 3.31Å; E765-I767 PolarHBondContact O-N 2.87Å; E765-V768 PolarHBondContact O-N 2.9Å; E765-I769 WeakPolarHBondContact O-CG1 3.39Å; E765-I769 PolarHBondContact O-N 2.85Å
766	V	86.1	Confident	80.7	Confident	85 Å²	85	105.4 Å²	105.4	52%	0.515	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-38.4	176.9	170.7	0	0	0	0	111.4	M762 R763 R770	M762-V766 HydrophobicContact CG-CG2 4.44Å; M762-V766 WeakPolarHBondContact O-CB 3.33Å; M762-V766 VanDerWaalsContact O-CG2 3.25Å; M762-V766 WeakPolarHBondContact O-CG2 3.4Å; M762-V766 PolarHBondContact O-N 3.35Å; R763-V766 PolarHBondContact O-N 3.1Å; V766-R770 WeakPolarHBondContact O-CB 3.29Å; V766-R770 PolarHBondContact O-N 2.91Å
767	I	86.3	Confident	81	Confident	53 Å²	53	106.1 Å²	106.1	27%	0.272	53%	0.529	S	S	.	.	H	α-helix	trans	-64.6	-45.4	175.9	-73.9	166.7	0	0	0	110.8	R763 N764 E765 R770 D771	R763-I767 HydrophobicContact CG-CD1 3.95Å; R763-I767 WeakPolarHBondContact O-CB 3.47Å; R763-I767 VanDerWaalsContact O-CG1 3.25Å; R763-I767 WeakPolarHBondContact O-CG1 3.33Å; R763-I767 PolarHBondContact O-N 3.21Å; N764-I767 PolarHBondContact O-N 2.9Å; E765-I767 VanDerWaalsContact C-N 3.31Å; E765-I767 PolarHBondContact O-N 2.87Å; I767-R770 PolarHBondContact O-N 3.35Å; I767-D771 WeakPolarHBondContact O-CB 3.46Å; I767-D771 PolarHBondContact O-N 2.81Å
768	V	86.1	Confident	81.4	Confident	100 Å²	100	104.8 Å²	104.8	61%	0.606	52%	0.518	S	S	*	.	H	α-helix	trans	-62.4	-45.5	178.1	171.8	0	0	0	0	110.9	N764 E765 D771 R772	N764-V768 WeakPolarHBondContact O-CG2 3.46Å; N764-V768 PolarHBondContact O-N 3.21Å; E765-V768 PolarHBondContact O-N 2.9Å; V768-D771 PolarHBondContact O-N 2.99Å; V768-R772 VanDerWaalsContact O-CB 3.32Å; V768-R772 WeakPolarHBondContact O-CB 3.39Å; V768-R772 PolarHBondContact O-N 2.75Å
769	I	83.1	Confident	81.8	Confident	95 Å²	95	107 Å²	107	49%	0.487	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-47.4	176.5	-68	167.7	0	0	0	110.4	E765 D771 R772 L773	E765-I769 WeakPolarHBondContact O-CG1 3.39Å; E765-I769 PolarHBondContact O-N 2.85Å; I769-D771 VanDerWaalsContact C-N 3.34Å; I769-D771 PolarHBondContact O-N 3.19Å; I769-R772 PolarHBondContact O-N 2.86Å; I769-L773 HydrophobicContact CG2-CD1 3.59Å; I769-L773 HydrophobicContact CG2-CG 4.24Å; I769-L773 VanDerWaalsContact O-CB 3.28Å; I769-L773 WeakPolarHBondContact O-CB 3.38Å; I769-L773 VanDerWaalsContact O-CG 3.23Å; I769-L773 WeakPolarHBondContact O-CG 3.33Å; I769-L773 PolarHBondContact O-N 2.86Å
770	R	87.3	Confident	82.4	Confident	128 Å²	128	109.9 Å²	109.9	48%	0.483	52%	0.523	S	S	.	.	H	α-helix	trans	-57.2	-47.9	177.6	-179.8	-161.2	68.7	-168.3	-3.1	110.8	V766 I767 L773 H774	V766-R770 WeakPolarHBondContact O-CB 3.29Å; V766-R770 PolarHBondContact O-N 2.91Å; I767-R770 PolarHBondContact O-N 3.35Å; R770-L773 PolarHBondContact O-N 3.45Å; R770-H774 VanDerWaalsContact O-CB 3.31Å; R770-H774 WeakPolarHBondContact O-CB 3.28Å; R770-H774 PolarHBondContact O-N 3.31Å
771	D	84.9	Confident	82.8	Confident	64 Å²	64	110.5 Å²	110.5	34%	0.342	53%	0.527	S	S	.	.	H	α-helix	trans	-71.3	-37	-175.2	-68.9	-4.5	0	0	0	111.4	I767 V768 I769 H774 K775	I767-D771 WeakPolarHBondContact O-CB 3.46Å; I767-D771 PolarHBondContact O-N 2.81Å; V768-D771 PolarHBondContact O-N 2.99Å; I769-D771 VanDerWaalsContact C-N 3.34Å; I769-D771 PolarHBondContact O-N 3.19Å; D771-H774 PolarHBondContact O-N 2.93Å; D771-K775 WeakPolarHBondContact O-CG 3.31Å; D771-K775 PolarHBondContact O-N 2.83Å
772	R	80.8	Confident	83.2	Confident	205 Å²	205	110.8 Å²	110.8	77%	0.774	53%	0.526	S	S	*	.	H	α-helix	trans	-63	-45.7	171.6	-164.6	174.7	90.4	167.4	5.8	111.3	V768 I769 G776	V768-R772 VanDerWaalsContact O-CB 3.32Å; V768-R772 WeakPolarHBondContact O-CB 3.39Å; V768-R772 PolarHBondContact O-N 2.75Å; I769-R772 PolarHBondContact O-N 2.86Å; R772-G776 PolarHBondContact O-N 3.12Å
773	L	79.4	Confident	83.6	Confident	86 Å²	86	108.9 Å²	108.9	45%	0.45	52%	0.519	S	S	.	.	H	α-helix	trans	-65.2	-43.2	176	-74.1	170.6	0	0	0	111.4	I769 R770 K775 L777	I769-L773 HydrophobicContact CG2-CD1 3.59Å; I769-L773 HydrophobicContact CG2-CG 4.24Å; I769-L773 VanDerWaalsContact O-CB 3.28Å; I769-L773 WeakPolarHBondContact O-CB 3.38Å; I769-L773 VanDerWaalsContact O-CG 3.23Å; I769-L773 WeakPolarHBondContact O-CG 3.33Å; I769-L773 PolarHBondContact O-N 2.86Å; R770-L773 PolarHBondContact O-N 3.45Å; L773-K775 PolarHBondContact O-N 3.44Å; L773-L777 HydrophobicContact CB-CD1 4.07Å; L773-L777 HydrophobicContact CD2-CD1 3.78Å; L773-L777 HydrophobicContact CD2-CG 4.29Å; L773-L777 HydrophobicContact CG-CD1 4.49Å; L773-L777 WeakPolarHBondContact O-CA 3.34Å; L773-L777 WeakPolarHBondContact O-CB 3.13Å; L773-L777 WeakPolarHBondContact O-CG 3.37Å; L773-L777 PolarHBondContact O-N 2.84Å
774	H	82	Confident	83.9	Confident	97 Å²	97	104.3 Å²	104.3	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-43.2	-177.7	-123.7	67.4	0	0	0	112.1	R770 D771 R778	R770-H774 VanDerWaalsContact O-CB 3.31Å; R770-H774 WeakPolarHBondContact O-CB 3.28Å; R770-H774 PolarHBondContact O-N 3.31Å; D771-H774 PolarHBondContact O-N 2.93Å; H774-R778 PolarHBondContact CD2-NE 2.83Å; H774-R778 PolarHBondContact NE2-NE 2.92Å; H774-R778 VanDerWaalsContact NE2-NE 3.16Å; H774-R778 PolarHBondContact NE2-NH2 3.2Å; H774-R778 VanDerWaalsContact O-CB 3.28Å; H774-R778 WeakPolarHBondContact O-CB 3.4Å; H774-R778 WeakPolarHBondContact O-CD 2.92Å; H774-R778 WeakPolarHBondContact O-CG 3.41Å; H774-R778 PolarHBondContact O-N 3.36Å
775	K	78.7	Confident	84.3	Confident	170 Å²	170	105 Å²	105	74%	0.739	51%	0.505	S	S	*	.	H	α-helix	trans	-73.2	-46.5	178.6	-69.4	179.5	-178.9	178	0	111.4	D771 L773 Q779	D771-K775 WeakPolarHBondContact O-CG 3.31Å; D771-K775 PolarHBondContact O-N 2.83Å; L773-K775 PolarHBondContact O-N 3.44Å; K775-Q779 WeakPolarHBondContact O-CB 3.47Å; K775-Q779 PolarHBondContact O-N 3.36Å
776	G	79.2	Confident	84.6	Confident	42 Å²	42	103.3 Å²	103.3	43%	0.433	50%	0.5	S	S	.	.	H	α-helix	trans	-68.1	-50.4	-178.9	0	0	0	0	0	113.6	R772 Q779 W780	R772-G776 PolarHBondContact O-N 3.12Å; G776-Q779 PolarHBondContact O-N 3.22Å; G776-W780 VanDerWaalsContact O-CB 3.26Å; G776-W780 WeakPolarHBondContact O-CB 3Å; G776-W780 PolarHBondContact O-N 3.26Å
777	L	79.2	Confident	84.7	Confident	92 Å²	92	107.9 Å²	107.9	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-70.5	-36.1	-175.4	-70.6	169.7	0	0	0	112.9	L773 W780 L781	L773-L777 HydrophobicContact CB-CD1 4.07Å; L773-L777 HydrophobicContact CD2-CD1 3.78Å; L773-L777 HydrophobicContact CD2-CG 4.29Å; L773-L777 HydrophobicContact CG-CD1 4.49Å; L773-L777 WeakPolarHBondContact O-CA 3.34Å; L773-L777 WeakPolarHBondContact O-CB 3.13Å; L773-L777 WeakPolarHBondContact O-CG 3.37Å; L773-L777 PolarHBondContact O-N 2.84Å; L777-W780 PolarHBondContact O-N 3.09Å; L777-L781 WeakPolarHBondContact O-CB 3.17Å; L777-L781 PolarHBondContact O-N 3.02Å
778	R	81.6	Confident	84.8	Confident	166 Å²	166	112.2 Å²	112.2	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-44.3	177.6	-75.1	-178.3	179.9	-122.6	6.3	111	H774 S782	H774-R778 PolarHBondContact CD2-NE 2.83Å; H774-R778 PolarHBondContact NE2-NE 2.92Å; H774-R778 VanDerWaalsContact NE2-NE 3.16Å; H774-R778 PolarHBondContact NE2-NH2 3.2Å; H774-R778 VanDerWaalsContact O-CB 3.28Å; H774-R778 WeakPolarHBondContact O-CB 3.4Å; H774-R778 WeakPolarHBondContact O-CD 2.92Å; H774-R778 WeakPolarHBondContact O-CG 3.41Å; H774-R778 PolarHBondContact O-N 3.36Å; R778-S782 WeakPolarHBondContact O-CB 3.25Å; R778-S782 PolarHBondContact O-N 3.33Å
779	Q	83.5	Confident	85.1	Confident	119 Å²	119	109.9 Å²	109.9	56%	0.556	51%	0.506	S	S	*	.	H	α-helix	trans	-63.4	-45.7	176.7	-169	64.5	16.8	0	0	110.9	K775 G776 S782 N783	K775-Q779 WeakPolarHBondContact O-CB 3.47Å; K775-Q779 PolarHBondContact O-N 3.36Å; G776-Q779 PolarHBondContact O-N 3.22Å; Q779-S782 PolarHBondContact O-N 2.84Å; Q779-N783 VanDerWaalsContact O-CG 3.26Å; Q779-N783 PolarHBondContact O-N 3.28Å
780	W	84.4	Confident	85.4	Confident	154 Å²	154	111.5 Å²	111.5	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-62.9	-47.1	178.3	-176.9	81.6	0	0	0	112.6	G776 L777 S782 N783 L784	G776-W780 VanDerWaalsContact O-CB 3.26Å; G776-W780 WeakPolarHBondContact O-CB 3Å; G776-W780 PolarHBondContact O-N 3.26Å; L777-W780 PolarHBondContact O-N 3.09Å; W780-S782 VanDerWaalsContact C-N 3.3Å; W780-S782 PolarHBondContact O-N 2.57Å; W780-N783 WeakPolarHBondContact O-CB 3.25Å; W780-N783 PolarHBondContact O-N 3Å; W780-N783 VanDerWaalsContact O-N 3.15Å; W780-L784 HydrophobicContact CD2-CD1 3.97Å; W780-L784 HydrophobicContact CE3-CD1 4.02Å; W780-L784 HydrophobicContact CH2-CD1 3.26Å; W780-L784 HydrophobicContact CZ2-CD1 3.18Å; W780-L784 HydrophobicContact CZ3-CD1 3.68Å; W780-L784 WeakPolarHBondContact O-CB 3.33Å; W780-L784 PolarHBondContact O-N 3.3Å
781	L	86.4	Confident	85.5	Confident	89 Å²	89	109.4 Å²	109.4	47%	0.466	51%	0.507	S	S	.	.	H	α-helix	trans	-60.3	-40.5	177.1	-173.7	78.3	0	0	0	111.6	L777 L784 K785	L777-L781 WeakPolarHBondContact O-CB 3.17Å; L777-L781 PolarHBondContact O-N 3.02Å; L781-L784 PolarHBondContact O-N 3Å; L781-K785 WeakPolarHBondContact O-CB 3.31Å; L781-K785 WeakPolarHBondContact O-CG 3.06Å; L781-K785 PolarHBondContact O-N 3.33Å
782	S	88.6	Confident	85.7	Confident	56 Å²	56	112.3 Å²	112.3	39%	0.392	52%	0.518	S	S	.	.	H	α-helix	trans	-61.8	-46.3	175.2	-174.3	0	0	0	0	111.2	R778 Q779 W780 L784 K785 N786	R778-S782 WeakPolarHBondContact O-CB 3.25Å; R778-S782 PolarHBondContact O-N 3.33Å; Q779-S782 PolarHBondContact O-N 2.84Å; W780-S782 VanDerWaalsContact C-N 3.3Å; W780-S782 PolarHBondContact O-N 2.57Å; S782-L784 VanDerWaalsContact C-N 3.33Å; S782-L784 PolarHBondContact O-N 2.95Å; S782-K785 PolarHBondContact O-N 3.09Å; S782-N786 WeakPolarHBondContact O-CB 3.36Å; S782-N786 VanDerWaalsContact O-CG 3.27Å; S782-N786 PolarHBondContact O-N 3.5Å; S782-N786 PolarHBondContact O-ND2 3.09Å
783	N	89.1	Confident	86.1	Confident	87 Å²	87	110.3 Å²	110.3	47%	0.465	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-40.2	176.6	-69.7	-11.6	0	0	0	112.2	Q779 W780 N786 R787	Q779-N783 VanDerWaalsContact O-CG 3.26Å; Q779-N783 PolarHBondContact O-N 3.28Å; W780-N783 WeakPolarHBondContact O-CB 3.25Å; W780-N783 PolarHBondContact O-N 3Å; W780-N783 VanDerWaalsContact O-N 3.15Å; N783-N786 PolarHBondContact O-N 3.39Å; N783-R787 WeakPolarHBondContact O-CB 3.04Å; N783-R787 PolarHBondContact O-N 2.76Å
784	L	87.5	Confident	86.4	Confident	78 Å²	78	110.8 Å²	110.8	41%	0.408	51%	0.511	S	S	.	.	H	α-helix	trans	-69.5	-41.8	-178.9	-137.1	155.2	0	0	0	112	W780 L781 S782 R787 R788	W780-L784 HydrophobicContact CD2-CD1 3.97Å; W780-L784 HydrophobicContact CE3-CD1 4.02Å; W780-L784 HydrophobicContact CH2-CD1 3.26Å; W780-L784 HydrophobicContact CZ2-CD1 3.18Å; W780-L784 HydrophobicContact CZ3-CD1 3.68Å; W780-L784 WeakPolarHBondContact O-CB 3.33Å; W780-L784 PolarHBondContact O-N 3.3Å; L781-L784 PolarHBondContact O-N 3Å; S782-L784 VanDerWaalsContact C-N 3.33Å; S782-L784 PolarHBondContact O-N 2.95Å; L784-R787 PolarHBondContact O-N 3.4Å; L784-R788 WeakPolarHBondContact O-CB 3.43Å; L784-R788 PolarHBondContact O-N 2.78Å
785	K	90.8	Very high	86.6	Confident	107 Å²	107	110.7 Å²	110.7	47%	0.465	51%	0.513	S	S	.	.	H	α-helix	trans	-59.5	-48.6	171.1	-76.2	-180	177.5	-178.4	0	111	L781 S782 R787 R788 D789	L781-K785 WeakPolarHBondContact O-CB 3.31Å; L781-K785 WeakPolarHBondContact O-CG 3.06Å; L781-K785 PolarHBondContact O-N 3.33Å; S782-K785 PolarHBondContact O-N 3.09Å; K785-R787 VanDerWaalsContact C-N 3.3Å; K785-R787 PolarHBondContact O-N 2.9Å; K785-R788 PolarHBondContact O-N 3.12Å; K785-D789 WeakPolarHBondContact O-CB 2.94Å; K785-D789 PolarHBondContact O-N 3.29Å
786	N	91.2	Very high	86.9	Confident	96 Å²	96	107.5 Å²	107.5	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-59.7	-39.4	177.5	-72.5	-18.8	0	0	0	112.5	S782 N783 K790	S782-N786 WeakPolarHBondContact O-CB 3.36Å; S782-N786 VanDerWaalsContact O-CG 3.27Å; S782-N786 PolarHBondContact O-N 3.5Å; S782-N786 PolarHBondContact O-ND2 3.09Å; N783-N786 PolarHBondContact O-N 3.39Å; N786-K790 WeakPolarHBondContact O-CB 3.3Å; N786-K790 PolarHBondContact O-N 2.8Å
787	R	88.7	Confident	87	Confident	181 Å²	181	110.8 Å²	110.8	68%	0.683	51%	0.51	S	S	*	.	H	α-helix	trans	-67.4	-45.6	176.5	-174.2	172.6	-179.3	146.2	-1.5	111.9	N783 L784 K785 D789 K790 L791	N783-R787 WeakPolarHBondContact O-CB 3.04Å; N783-R787 PolarHBondContact O-N 2.76Å; L784-R787 PolarHBondContact O-N 3.4Å; K785-R787 VanDerWaalsContact C-N 3.3Å; K785-R787 PolarHBondContact O-N 2.9Å; R787-D789 VanDerWaalsContact C-N 3.34Å; R787-D789 PolarHBondContact O-N 2.94Å; R787-K790 WeakPolarHBondContact O-CB 3.25Å; R787-K790 PolarHBondContact O-N 2.82Å; R787-L791 HydrophobicContact CG-CD1 4.34Å; R787-L791 WeakPolarHBondContact O-CG 3.26Å; R787-L791 PolarHBondContact O-N 3.46Å
788	R	89.4	Confident	86.8	Confident	145 Å²	145	115.3 Å²	115.3	55%	0.547	52%	0.521	S	S	.	.	H	α-helix	trans	-57	-49.7	174.5	-178.2	-164.8	66.5	168.2	3	110.5	L784 K785 K790 L791 E792	L784-R788 WeakPolarHBondContact O-CB 3.43Å; L784-R788 PolarHBondContact O-N 2.78Å; K785-R788 PolarHBondContact O-N 3.12Å; R788-K790 PolarHBondContact O-N 2.87Å; R788-L791 PolarHBondContact O-N 3.03Å; R788-L791 VanDerWaalsContact O-N 3.14Å; R788-E792 WeakPolarHBondContact O-CB 3.5Å; R788-E792 PolarHBondContact O-N 3.24Å
789	D	91.8	Very high	86.4	Confident	51 Å²	51	114 Å²	114	27%	0.273	52%	0.52	S	S	.	.	H	α-helix	trans	-67.2	-26	-177.5	-60.4	-7.3	0	0	0	111.9	K785 R787 R793	K785-D789 WeakPolarHBondContact O-CB 2.94Å; K785-D789 PolarHBondContact O-N 3.29Å; R787-D789 VanDerWaalsContact C-N 3.34Å; R787-D789 PolarHBondContact O-N 2.94Å; D789-R793 WeakPolarHBondContact O-CB 3.49Å; D789-R793 WeakPolarHBondContact O-CG 3.45Å; D789-R793 PolarHBondContact O-N 2.84Å; D789-R793 PolarHBondContact O-NE 3.24Å
790	K	90.3	Very high	85.9	Confident	129 Å²	129	114.8 Å²	114.8	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-72.4	-46.2	171	-174.1	-179.5	179.7	-178	0	111.6	N786 R787 R788 R793 Q794	N786-K790 WeakPolarHBondContact O-CB 3.3Å; N786-K790 PolarHBondContact O-N 2.8Å; R787-K790 WeakPolarHBondContact O-CB 3.25Å; R787-K790 PolarHBondContact O-N 2.82Å; R788-K790 PolarHBondContact O-N 2.87Å; K790-R793 PolarHBondContact O-N 2.84Å; K790-Q794 WeakPolarHBondContact O-CG 3.46Å; K790-Q794 PolarHBondContact O-N 3.12Å
791	L	88.2	Confident	84.7	Confident	84 Å²	84	111.1 Å²	111.1	44%	0.44	52%	0.516	S	S	.	.	H	α-helix	trans	-64.7	-42.2	178	-74.4	170.4	0	0	0	111.7	R787 R788 R793 Q794 I795	R787-L791 HydrophobicContact CG-CD1 4.34Å; R787-L791 WeakPolarHBondContact O-CG 3.26Å; R787-L791 PolarHBondContact O-N 3.46Å; R788-L791 PolarHBondContact O-N 3.03Å; R788-L791 VanDerWaalsContact O-N 3.14Å; L791-R793 VanDerWaalsContact C-N 3.31Å; L791-R793 PolarHBondContact O-N 3.24Å; L791-Q794 PolarHBondContact O-N 3.06Å; L791-Q794 VanDerWaalsContact O-N 3.09Å; L791-I795 WeakPolarHBondContact O-CG1 3.49Å; L791-I795 PolarHBondContact O-N 2.92Å
792	E	89.3	Confident	83.2	Confident	124 Å²	124	112.1 Å²	112.1	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-62.1	-40.9	177.5	-166.8	169.8	-157.9	0	0	111.2	R788 I795 L796	R788-E792 WeakPolarHBondContact O-CB 3.5Å; R788-E792 PolarHBondContact O-N 3.24Å; E792-I795 PolarHBondContact O-N 3.34Å; E792-L796 VanDerWaalsContact O-CB 3.32Å; E792-L796 WeakPolarHBondContact O-CB 3.48Å; E792-L796 PolarHBondContact O-N 2.95Å
793	R	89.4	Confident	81.6	Confident	163 Å²	163	117.8 Å²	117.8	62%	0.615	54%	0.54	S	S	*	.	H	α-helix	trans	-61.3	-42.4	170.9	-82.8	-177.4	-84	171.6	-11.9	112.7	D789 K790 L791 L796 L797	D789-R793 WeakPolarHBondContact O-CB 3.49Å; D789-R793 WeakPolarHBondContact O-CG 3.45Å; D789-R793 PolarHBondContact O-N 2.84Å; D789-R793 PolarHBondContact O-NE 3.24Å; K790-R793 PolarHBondContact O-N 2.84Å; L791-R793 VanDerWaalsContact C-N 3.31Å; L791-R793 PolarHBondContact O-N 3.24Å; R793-L796 PolarHBondContact O-N 3.35Å; R793-L797 WeakPolarHBondContact O-CB 3.41Å; R793-L797 VanDerWaalsContact O-CG 3.28Å; R793-L797 WeakPolarHBondContact O-CG 3.47Å; R793-L797 PolarHBondContact O-N 3.19Å
794	Q	85	Confident	79.7	Confident	96 Å²	96	117.6 Å²	117.6	45%	0.449	55%	0.545	S	S	.	.	H	α-helix	trans	-67	-42.5	177.8	-75	-178	-8.8	0	0	112.8	K790 L791 L796 L797 R798	K790-Q794 WeakPolarHBondContact O-CG 3.46Å; K790-Q794 PolarHBondContact O-N 3.12Å; L791-Q794 PolarHBondContact O-N 3.06Å; L791-Q794 VanDerWaalsContact O-N 3.09Å; Q794-L796 VanDerWaalsContact C-N 3.31Å; Q794-L796 PolarHBondContact O-N 2.83Å; Q794-L797 PolarHBondContact O-N 3.46Å; Q794-R798 PolarHBondContact O-N 2.78Å
795	I	86	Confident	77.7	Confident	96 Å²	96	118.8 Å²	118.8	49%	0.492	56%	0.56	S	S	.	*	H	α-helix	trans	-62.2	-42.3	175.5	-67.8	166.9	0	0	0	109.9	L791 E792 R798 K799	L791-I795 WeakPolarHBondContact O-CG1 3.49Å; L791-I795 PolarHBondContact O-N 2.92Å; E792-I795 PolarHBondContact O-N 3.34Å; I795-R798 PolarHBondContact O-N 3.46Å; I795-K799 HydrophobicContact CG2-CD 4.21Å; I795-K799 WeakPolarHBondContact O-CB 3.37Å; I795-K799 WeakPolarHBondContact O-CG 3.45Å; I795-K799 PolarHBondContact O-N 2.81Å
796	L	86.4	Confident	75.7	Confident	103 Å²	103	120.3 Å²	120.3	54%	0.539	57%	0.572	S	S	.	*	H	α-helix	trans	-64.8	-39	177.2	-170.3	68.9	0	0	0	112.1	E792 R793 Q794 K800	E792-L796 VanDerWaalsContact O-CB 3.32Å; E792-L796 WeakPolarHBondContact O-CB 3.48Å; E792-L796 PolarHBondContact O-N 2.95Å; R793-L796 PolarHBondContact O-N 3.35Å; Q794-L796 VanDerWaalsContact C-N 3.31Å; Q794-L796 PolarHBondContact O-N 2.83Å; L796-K800 WeakPolarHBondContact O-CG 3.26Å; L796-K800 PolarHBondContact O-N 2.88Å; L796-K800 VanDerWaalsContact O-N 3.12Å
797	L	81.3	Confident	73.3	Confident	111 Å²	111	127 Å²	127	58%	0.581	59%	0.59	S	S	*	*	H	α-helix	trans	-66.2	-45.3	175.1	-74.8	167	0	0	0	111.7	R793 Q794 K800 T801	R793-L797 WeakPolarHBondContact O-CB 3.41Å; R793-L797 VanDerWaalsContact O-CG 3.28Å; R793-L797 WeakPolarHBondContact O-CG 3.47Å; R793-L797 PolarHBondContact O-N 3.19Å; Q794-L797 PolarHBondContact O-N 3.46Å; L797-K800 WeakPolarHBondContact O-CA 3.46Å; L797-K800 WeakPolarHBondContact O-CB 3.23Å; L797-K800 PolarHBondContact O-N 3.4Å; L797-K800 VanDerWaalsContact O-N 3.08Å; L797-T801 PolarHBondContact O-N 3.32Å; L797-T801 PolarHBondContact O-OG1 3.35Å
798	R	74	Confident	70.9	Confident	187 Å²	187	123.7 Å²	123.7	71%	0.706	59%	0.594	S	S	*	*	H	α-helix	trans	-61.9	-44.5	176.2	-77.2	-169.2	179.3	-165.4	1.4	112.4	Q794 I795 K800 T801 D802	Q794-R798 PolarHBondContact O-N 2.78Å; I795-R798 PolarHBondContact O-N 3.46Å; R798-K800 PolarHBondContact O-N 2.95Å; R798-T801 WeakPolarHBondContact CA-OG1 3.37Å; R798-T801 PolarHBondContact O-N 2.85Å; R798-T801 VanDerWaalsContact O-N 3.15Å; R798-T801 PolarHBondContact O-OG1 3.32Å; R798-D802 PolarHBondContact O-N 2.92Å
799	K	74.4	Confident	68.3	Low	138 Å²	138	122.5 Å²	122.5	60%	0.6	61%	0.608	S	S	*	*	H	α-helix	trans	-61.6	-25.9	173.7	-75.8	-176.5	177.3	-178.3	0	113.2	I795 K803	I795-K799 HydrophobicContact CG2-CD 4.21Å; I795-K799 WeakPolarHBondContact O-CB 3.37Å; I795-K799 WeakPolarHBondContact O-CG 3.45Å; I795-K799 PolarHBondContact O-N 2.81Å; K799-K803 WeakPolarHBondContact O-CG 2.98Å
800	K	72.8	Confident	65.9	Low	135 Å²	135	127.7 Å²	127.7	59%	0.587	64%	0.635	S	S	*	*	H	α-helix	trans	-80.1	-40.5	173.3	-80.4	-178.2	177.2	-177.7	0	112.2	L796 L797 R798 K803 S804	L796-K800 WeakPolarHBondContact O-CG 3.26Å; L796-K800 PolarHBondContact O-N 2.88Å; L796-K800 VanDerWaalsContact O-N 3.12Å; L797-K800 WeakPolarHBondContact O-CA 3.46Å; L797-K800 WeakPolarHBondContact O-CB 3.23Å; L797-K800 PolarHBondContact O-N 3.4Å; L797-K800 VanDerWaalsContact O-N 3.08Å; R798-K800 PolarHBondContact O-N 2.95Å; K800-K803 PolarHBondContact O-N 3.22Å; K800-S804 PolarHBondContact O-N 2.99Å; K800-S804 VanDerWaalsContact O-N 3.11Å; K800-S804 PolarHBondContact O-OG 2.98Å
801	T	59.2	Low	63.2	Low	78 Å²	78	128.1 Å²	128.1	48%	0.479	65%	0.651	S	S	.	*	H	α-helix	trans	-67.5	-36.2	178.3	49.8	0	0	0	0	112.5	L797 R798 K803 S804 S805	L797-T801 PolarHBondContact O-N 3.32Å; L797-T801 PolarHBondContact O-OG1 3.35Å; R798-T801 WeakPolarHBondContact CA-OG1 3.37Å; R798-T801 PolarHBondContact O-N 2.85Å; R798-T801 VanDerWaalsContact O-N 3.15Å; R798-T801 PolarHBondContact O-OG1 3.32Å; T801-K803 VanDerWaalsContact C-N 3.26Å; T801-K803 PolarHBondContact O-N 3.31Å; T801-S804 WeakPolarHBondContact CA-OG 3.5Å; T801-S804 PolarHBondContact O-N 3.31Å; T801-S804 PolarHBondContact O-OG 2.82Å; T801-S804 VanDerWaalsContact O-OG 3.11Å; T801-S805 PolarHBondContact O-N 2.9Å; T801-S805 VanDerWaalsContact O-N 3.15Å
802	D	55.1	Low	60.7	Low	109 Å²	109	127.6 Å²	127.6	58%	0.583	67%	0.666	S	S	*	*	H	α-helix	trans	-67.8	-28	175.7	-66.4	-20.4	0	0	0	112	R798	R798-D802 PolarHBondContact O-N 2.92Å
803	K	54.5	Low	58.1	Low	176 Å²	176	126.5 Å²	126.5	77%	0.765	67%	0.672	S	S	*	*	H	α-helix	trans	-80.8	-24.7	173.9	-75.8	-176.2	176.9	-173.2	0	113.7	K799 K800 T801	K799-K803 WeakPolarHBondContact O-CG 2.98Å; K800-K803 PolarHBondContact O-N 3.22Å; T801-K803 VanDerWaalsContact C-N 3.26Å; T801-K803 PolarHBondContact O-N 3.31Å
804	S	49.4	Very low	55.5	Low	83 Å²	83	127.2 Å²	127.2	58%	0.58	69%	0.687	S	S	*	*	H	α-helix	trans	-89.9	-16	179.2	55.9	0	0	0	0	114.3	K800 T801 I806	K800-S804 PolarHBondContact O-N 2.99Å; K800-S804 VanDerWaalsContact O-N 3.11Å; K800-S804 PolarHBondContact O-OG 2.98Å; T801-S804 WeakPolarHBondContact CA-OG 3.5Å; T801-S804 PolarHBondContact O-N 3.31Å; T801-S804 PolarHBondContact O-OG 2.82Å; T801-S804 VanDerWaalsContact O-OG 3.11Å; S804-I806 VanDerWaalsContact C-N 3.33Å
805	S	45.3	Very low	53.2	Low	103 Å²	103	129.5 Å²	129.5	72%	0.72	70%	0.702	S	S	*	*	S	Bend	trans	-79.1	-12.5	177.8	-160.6	0	0	0	0	113.7	T801 R807	T801-S805 PolarHBondContact O-N 2.9Å; T801-S805 VanDerWaalsContact O-N 3.15Å; S805-R807 PolarHBondContact O-N 2.86Å
806	I	49.1	Very low	50.8	Low	139 Å²	139	136 Å²	136	71%	0.713	72%	0.72	S	S	*	*			trans	-97.4	64.5	177.2	-48.9	174.6	0	0	0	109.8	S804	S804-I806 VanDerWaalsContact C-N 3.33Å
807	R	40.8	Very low	48.6	Very low	236 Å²	236	137.9 Å²	137.9	89%	0.891	74%	0.736	S	S	*	*			trans	-140.5	43.4	172.6	-105	-170.5	-175.2	-170.2	1.5	112.8	S805	S805-R807 PolarHBondContact O-N 2.86Å
808	S	38.4	Very low	46.8	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	74%	0.738	S	S	*	*	S	Bend	trans	-167.7	71.9	161.1	59.7	0	0	0	0	112.7
809	S	33.8	Very low	45.7	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	75%	0.746	S	S	*	*	S	Bend	trans	-178.2	155.3	147.9	48.1	0	0	0	0	110.4
810	L	41.2	Very low	44.5	Very low	160 Å²	160	137.3 Å²	137.3	84%	0.838	75%	0.752	S	S	*	*			trans	-44.1	151.4	-159.9	-84.7	68.6	0	0	0	118.3	G812	L810-G812 PolarHBondContact O-N 2.89Å
811	P	34.7	Very low	43.8	Very low	138 Å²	138	134.4 Å²	134.4	90%	0.896	74%	0.742	S	S	*	*	S	Bend	trans	-74.4	94.1	171	31.9	-30.1	0	0	0	109.5
812	G	35.3	Very low	44.3	Very low	74 Å²	74	137 Å²	137	76%	0.763	75%	0.749	S	S	*	*	S	Bend	trans	176.6	35.9	-179.8	0	0	0	0	0	115.9	L810	L810-G812 PolarHBondContact O-N 2.89Å
813	S	34.1	Very low	44.9	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	75%	0.749	S	S	*	*			trans	-175.6	81.9	161.5	-173.2	0	0	0	0	109.1
814	L	35.5	Very low	45.7	Very low	177 Å²	177	131.8 Å²	131.8	93%	0.927	74%	0.743	S	S	*	*			trans	-109	67.6	175.7	-146.2	105.3	0	0	0	108.9
815	L	36.1	Very low	46.9	Very low	144 Å²	144	132.9 Å²	132.9	75%	0.754	74%	0.739	S	S	*	*			trans	-156.2	64	178.9	-115.6	151.8	0	0	0	109.2
816	R	36	Very low	48.5	Very low	233 Å²	233	135.1 Å²	135.1	88%	0.879	73%	0.731	S	S	*	*			trans	-163.2	53	176.5	-111.6	171.1	-157.2	-142.7	6.1	113.9
817	T	40.2	Very low	49.9	Very low	142 Å²	142	134 Å²	134	87%	0.871	72%	0.723	S	S	*	*	S	Bend	trans	-156.5	17.5	160.4	45.3	0	0	0	0	114.1
818	T	43.6	Very low	51.8	Low	102 Å²	102	127 Å²	127	63%	0.626	71%	0.707	S	S	*	*	S	Bend	trans	-106.6	101.6	153	45.5	0	0	0	0	104.4	N820	T818-N820 PolarHBondContact O-N 2.8Å
819	E	49.8	Very low	54	Low	189 Å²	189	125 Å²	125	88%	0.883	69%	0.69	S	S	*	*			trans	-58.3	87.9	158.1	-73.1	177.6	163.4	0	0	105.7	I821	E819-I821 PolarHBondContact O-N 3.25Å
820	N	48.9	Very low	56.4	Low	134 Å²	134	122.7 Å²	122.7	72%	0.717	67%	0.674	S	S	*	*			trans	-68.3	87.5	167.6	-96.6	-10.5	0	0	0	104.6	T818 E822	T818-N820 PolarHBondContact O-N 2.8Å; N820-E822 PolarHBondContact O-N 3.1Å
821	I	59.3	Low	58.5	Low	74 Å²	74	120.2 Å²	120.2	38%	0.379	66%	0.658	S	S	.	*			trans	-43.9	113	157.1	-63.6	171.8	0	0	0	105	E819 Q825 W826	E819-I821 PolarHBondContact O-N 3.25Å; I821-Q825 HydrophobicContact CG2-CB 3.44Å; I821-Q825 VanDerWaalsContact CG2-CB 3.44Å; I821-W826 HydrophobicContact CD1-CZ2 4.39Å; I821-W826 HydrophobicContact CG2-CD2 4.46Å; I821-W826 HydrophobicContact CG2-CG 3.97Å
822	E	68.5	Low	61	Low	132 Å²	132	117 Å²	117	62%	0.617	63%	0.631	S	S	*	*			trans	-57.4	148.2	-176.6	-78.8	-177	152.7	0	0	109.4	N820 N824 Q825 W826	N820-E822 PolarHBondContact O-N 3.1Å; E822-N824 PolarHBondContact O-N 2.72Å; E822-Q825 WeakPolarHBondContact O-CA 3.45Å; E822-Q825 WeakPolarHBondContact O-CB 3.07Å; E822-Q825 PolarHBondContact O-N 3.08Å; E822-W826 PolarHBondContact O-N 3.31Å; E822-W826 VanDerWaalsContact O-N 3.15Å
823	G	67.6	Low	63.6	Low	57 Å²	57	117.8 Å²	117.8	59%	0.588	62%	0.617	S	S	*	*	H	α-helix	trans	-52.2	-30.4	-175.6	0	0	0	0	0	113.9	W826 Q827	G823-W826 PolarHBondContact O-N 3.05Å; G823-Q827 PolarHBondContact O-N 3.01Å; G823-Q827 VanDerWaalsContact O-N 3.11Å
824	N	72.9	Confident	66.1	Low	119 Å²	119	120.9 Å²	120.9	64%	0.636	61%	0.613	S	S	*	*	H	α-helix	trans	-69.4	-39.2	175.2	-64.5	-8.8	0	0	0	112.6	E822 W826 Q827 T828	E822-N824 PolarHBondContact O-N 2.72Å; N824-W826 VanDerWaalsContact C-N 3.35Å; N824-Q827 PolarHBondContact O-N 3.03Å; N824-T828 PolarHBondContact O-N 3.36Å; N824-T828 PolarHBondContact O-OG1 3.44Å; N824-T828 VanDerWaalsContact O-OG1 3.07Å
825	Q	73.3	Confident	68.6	Low	105 Å²	105	118.3 Å²	118.3	49%	0.491	59%	0.591	S	S	.	*	H	α-helix	trans	-66.6	-38.3	175.7	-67.9	-179	-10.7	0	0	111.1	I821 E822 Q827 T828 V829	I821-Q825 HydrophobicContact CG2-CB 3.44Å; I821-Q825 VanDerWaalsContact CG2-CB 3.44Å; E822-Q825 WeakPolarHBondContact O-CA 3.45Å; E822-Q825 WeakPolarHBondContact O-CB 3.07Å; E822-Q825 PolarHBondContact O-N 3.08Å; Q825-Q827 VanDerWaalsContact C-N 3.29Å; Q825-Q827 PolarHBondContact O-N 3.24Å; Q825-T828 PolarHBondContact O-N 3.44Å; Q825-V829 WeakPolarHBondContact O-CB 3.44Å; Q825-V829 VanDerWaalsContact O-CG2 3.28Å; Q825-V829 WeakPolarHBondContact O-CG2 3.48Å; Q825-V829 PolarHBondContact O-N 2.94Å
826	W	79.2	Confident	71.2	Confident	150 Å²	150	115.8 Å²	115.8	57%	0.568	58%	0.576	S	S	*	*	H	α-helix	trans	-61.3	-38.2	171.9	-93.1	109.7	0	0	0	112.6	I821 E822 G823 N824 S830	I821-W826 HydrophobicContact CD1-CZ2 4.39Å; I821-W826 HydrophobicContact CG2-CD2 4.46Å; I821-W826 HydrophobicContact CG2-CG 3.97Å; E822-W826 PolarHBondContact O-N 3.31Å; E822-W826 VanDerWaalsContact O-N 3.15Å; G823-W826 PolarHBondContact O-N 3.05Å; N824-W826 VanDerWaalsContact C-N 3.35Å; W826-S830 VanDerWaalsContact O-CB 3.23Å; W826-S830 WeakPolarHBondContact O-CB 3.5Å; W826-S830 PolarHBondContact O-N 2.84Å
827	Q	78.6	Confident	73.8	Confident	117 Å²	117	108.9 Å²	108.9	55%	0.547	56%	0.559	S	S	.	*	H	α-helix	trans	-68.5	-42.1	178.1	-161.4	165.8	-6.3	0	0	111.3	G823 N824 Q825 S830 E831	G823-Q827 PolarHBondContact O-N 3.01Å; G823-Q827 VanDerWaalsContact O-N 3.11Å; N824-Q827 PolarHBondContact O-N 3.03Å; Q825-Q827 VanDerWaalsContact C-N 3.29Å; Q825-Q827 PolarHBondContact O-N 3.24Å; Q827-S830 PolarHBondContact O-N 2.84Å; Q827-E831 WeakPolarHBondContact O-CB 3.46Å; Q827-E831 WeakPolarHBondContact O-CG 3.25Å; Q827-E831 PolarHBondContact O-N 3.4Å
828	T	81.6	Confident	76	Confident	88 Å²	88	106.4 Å²	106.4	54%	0.54	54%	0.54	S	S	.	.	H	α-helix	trans	-61.2	-47.8	173	-51.3	0	0	0	0	111.8	N824 Q825 S830 E831 E832	N824-T828 PolarHBondContact O-N 3.36Å; N824-T828 PolarHBondContact O-OG1 3.44Å; N824-T828 VanDerWaalsContact O-OG1 3.07Å; Q825-T828 PolarHBondContact O-N 3.44Å; T828-S830 VanDerWaalsContact C-N 3.32Å; T828-S830 PolarHBondContact O-N 2.92Å; T828-E831 PolarHBondContact O-N 3.5Å; T828-E832 WeakPolarHBondContact O-CB 3.39Å; T828-E832 PolarHBondContact O-N 3.18Å
829	V	84.2	Confident	78.1	Confident	69 Å²	69	106 Å²	106	42%	0.418	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-39.1	177.4	172	0	0	0	0	111.2	Q825 E832 L833	Q825-V829 WeakPolarHBondContact O-CB 3.44Å; Q825-V829 VanDerWaalsContact O-CG2 3.28Å; Q825-V829 WeakPolarHBondContact O-CG2 3.48Å; Q825-V829 PolarHBondContact O-N 2.94Å; V829-E832 PolarHBondContact O-N 2.81Å; V829-L833 HydrophobicContact CG1-CD1 3.86Å; V829-L833 HydrophobicContact CG1-CG 4.35Å; V829-L833 WeakPolarHBondContact O-CB 3.46Å; V829-L833 VanDerWaalsContact O-CG 3.26Å; V829-L833 WeakPolarHBondContact O-CG 3.01Å; V829-L833 PolarHBondContact O-N 3.38Å
830	S	84.6	Confident	80	Confident	72 Å²	72	101.5 Å²	101.5	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-67.7	-36.2	177	-176.6	0	0	0	0	112.8	W826 Q827 T828 R834	W826-S830 VanDerWaalsContact O-CB 3.23Å; W826-S830 WeakPolarHBondContact O-CB 3.5Å; W826-S830 PolarHBondContact O-N 2.84Å; Q827-S830 PolarHBondContact O-N 2.84Å; T828-S830 VanDerWaalsContact C-N 3.32Å; T828-S830 PolarHBondContact O-N 2.92Å; S830-R834 WeakPolarHBondContact O-CB 3.36Å; S830-R834 PolarHBondContact O-N 2.98Å; S830-R834 VanDerWaalsContact O-N 3.1Å
831	E	85	Confident	81.9	Confident	108 Å²	108	101.7 Å²	101.7	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-70.1	-41.1	175.9	-76.7	176.6	-177.9	0	0	111.2	Q827 T828 R834 R835	Q827-E831 WeakPolarHBondContact O-CB 3.46Å; Q827-E831 WeakPolarHBondContact O-CG 3.25Å; Q827-E831 PolarHBondContact O-N 3.4Å; T828-E831 PolarHBondContact O-N 3.5Å; E831-R834 WeakPolarHBondContact O-CB 3.09Å; E831-R834 PolarHBondContact O-N 3.15Å; E831-R835 PolarHBondContact O-N 3.42Å
832	E	87.9	Confident	83.1	Confident	70 Å²	70	103.3 Å²	103.3	33%	0.327	51%	0.514	S	S	.	.	H	α-helix	trans	-62.3	-50.8	175.4	-158.4	60.7	-118.2	0	0	111.3	T828 V829 R834 R835 E836	T828-E832 WeakPolarHBondContact O-CB 3.39Å; T828-E832 PolarHBondContact O-N 3.18Å; V829-E832 PolarHBondContact O-N 2.81Å; E832-R834 PolarHBondContact O-N 2.78Å; E832-R835 WeakPolarHBondContact O-CA 3.47Å; E832-R835 VanDerWaalsContact O-CB 3.28Å; E832-R835 WeakPolarHBondContact O-CB 3.06Å; E832-R835 PolarHBondContact O-N 3.4Å; E832-R835 IonicContact OE1-CZ 2.76Å; E832-R835 IonicContact OE1-NE 3.96Å; E832-R835 PolarHBondContact OE1-NE 3.24Å; E832-R835 IonicContact OE1-NH2 3.66Å; E832-R835 PolarHBondContact OE1-NH2 2.93Å; E832-R835 IonicContact OE2-CZ 2.89Å; E832-R835 IonicContact OE2-NE 2.61Å; E832-R835 IonicContact OE2-NH2 3.21Å; E832-R835 PolarHBondContact OE2-NH2 2.8Å; E832-E836 PolarHBondContact O-N 3.37Å
833	L	88.3	Confident	84	Confident	90 Å²	90	102.3 Å²	102.3	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-58.5	-35.1	175.8	-75.4	170.2	0	0	0	112.2	V829 T837	V829-L833 HydrophobicContact CG1-CD1 3.86Å; V829-L833 HydrophobicContact CG1-CG 4.35Å; V829-L833 WeakPolarHBondContact O-CB 3.46Å; V829-L833 VanDerWaalsContact O-CG 3.26Å; V829-L833 WeakPolarHBondContact O-CG 3.01Å; V829-L833 PolarHBondContact O-N 3.38Å; L833-T837 VanDerWaalsContact O-CB 3.22Å; L833-T837 WeakPolarHBondContact O-CB 3.48Å; L833-T837 PolarHBondContact O-N 3.42Å; L833-T837 PolarHBondContact O-OG1 3.37Å
834	R	87.7	Confident	85	Confident	166 Å²	166	103.5 Å²	103.5	63%	0.626	50%	0.504	S	S	*	.	H	α-helix	trans	-67.8	-38.4	175.8	-168.8	-172.3	71.3	82	0	111.4	S830 E831 E832 L838	S830-R834 WeakPolarHBondContact O-CB 3.36Å; S830-R834 PolarHBondContact O-N 2.98Å; S830-R834 VanDerWaalsContact O-N 3.1Å; E831-R834 WeakPolarHBondContact O-CB 3.09Å; E831-R834 PolarHBondContact O-N 3.15Å; E832-R834 PolarHBondContact O-N 2.78Å; R834-L838 PolarHBondContact O-N 3.01Å
835	R	88.3	Confident	85.6	Confident	124 Å²	124	101.8 Å²	101.8	47%	0.468	50%	0.495	S	S	.	.	H	α-helix	trans	-64.4	-54.4	176.4	-162.2	-157.6	-36	-100	-2.4	110.2	E831 E832 T837 L838 E839	E831-R835 PolarHBondContact O-N 3.42Å; E832-R835 WeakPolarHBondContact O-CA 3.47Å; E832-R835 VanDerWaalsContact O-CB 3.28Å; E832-R835 WeakPolarHBondContact O-CB 3.06Å; E832-R835 PolarHBondContact O-N 3.4Å; E832-R835 IonicContact OE1-CZ 2.76Å; E832-R835 IonicContact OE1-NE 3.96Å; E832-R835 PolarHBondContact OE1-NE 3.24Å; E832-R835 IonicContact OE1-NH2 3.66Å; E832-R835 PolarHBondContact OE1-NH2 2.93Å; E832-R835 IonicContact OE2-CZ 2.89Å; E832-R835 IonicContact OE2-NE 2.61Å; E832-R835 IonicContact OE2-NH2 3.21Å; E832-R835 PolarHBondContact OE2-NH2 2.8Å; R835-T837 VanDerWaalsContact C-N 3.33Å; R835-T837 PolarHBondContact O-N 3.33Å; R835-L838 WeakPolarHBondContact O-CA 3.35Å; R835-L838 VanDerWaalsContact O-CB 3.28Å; R835-L838 WeakPolarHBondContact O-CB 3.37Å; R835-L838 PolarHBondContact O-N 3.27Å; R835-E839 PolarHBondContact O-N 3.06Å
836	E	89.5	Confident	86	Confident	91 Å²	91	99.1 Å²	99.1	43%	0.425	49%	0.491	S	S	.	.	H	α-helix	trans	-59.8	-41.6	178.8	-69.4	-177	176.6	0	0	111.8	E832 L838 E839 I840	E832-E836 PolarHBondContact O-N 3.37Å; E836-L838 PolarHBondContact O-N 3.43Å; E836-E839 PolarHBondContact O-N 3.4Å; E836-I840 WeakPolarHBondContact O-CB 3.46Å; E836-I840 VanDerWaalsContact O-CG1 3.29Å; E836-I840 WeakPolarHBondContact O-CG1 3.48Å; E836-I840 PolarHBondContact O-N 3.08Å
837	T	89.9	Confident	86.3	Confident	87 Å²	87	95.6 Å²	95.6	53%	0.534	49%	0.486	S	S	.	.	H	α-helix	trans	-60.5	-34.7	176	-61.1	0	0	0	0	111.8	L833 R835 K841	L833-T837 VanDerWaalsContact O-CB 3.22Å; L833-T837 WeakPolarHBondContact O-CB 3.48Å; L833-T837 PolarHBondContact O-N 3.42Å; L833-T837 PolarHBondContact O-OG1 3.37Å; R835-T837 VanDerWaalsContact C-N 3.33Å; R835-T837 PolarHBondContact O-N 3.33Å; T837-K841 WeakPolarHBondContact O-CB 3.22Å; T837-K841 PolarHBondContact O-N 3.11Å
838	L	86.9	Confident	86.5	Confident	90 Å²	90	96 Å²	96	47%	0.471	49%	0.486	S	S	.	.	H	α-helix	trans	-71.2	-42.7	178.3	-136.8	145.2	0	0	0	110.4	R834 R835 E836 K841 M842	R834-L838 PolarHBondContact O-N 3.01Å; R835-L838 WeakPolarHBondContact O-CA 3.35Å; R835-L838 VanDerWaalsContact O-CB 3.28Å; R835-L838 WeakPolarHBondContact O-CB 3.37Å; R835-L838 PolarHBondContact O-N 3.27Å; E836-L838 PolarHBondContact O-N 3.43Å; L838-K841 PolarHBondContact O-N 3Å; L838-M842 WeakPolarHBondContact O-CG 3.46Å; L838-M842 PolarHBondContact O-N 2.85Å
839	E	88.3	Confident	86.4	Confident	93 Å²	93	95.4 Å²	95.4	44%	0.435	48%	0.482	S	S	.	.	H	α-helix	trans	-61.6	-49	174.5	-69.9	172.8	-165	0	0	111.9	R835 E836 K841 M842 L843	R835-E839 PolarHBondContact O-N 3.06Å; E836-E839 PolarHBondContact O-N 3.4Å; E839-K841 PolarHBondContact O-N 2.83Å; E839-M842 WeakPolarHBondContact O-CB 3.24Å; E839-M842 PolarHBondContact O-N 2.6Å; E839-L843 PolarHBondContact O-N 2.92Å
840	I	89.7	Confident	86.1	Confident	95 Å²	95	96.9 Å²	96.9	49%	0.487	49%	0.487	S	S	.	.	H	α-helix	trans	-56.8	-40.5	174.7	-68.3	165.8	0	0	0	110.6	E836 L843 I844	E836-I840 WeakPolarHBondContact O-CB 3.46Å; E836-I840 VanDerWaalsContact O-CG1 3.29Å; E836-I840 WeakPolarHBondContact O-CG1 3.48Å; E836-I840 PolarHBondContact O-N 3.08Å; I840-L843 PolarHBondContact O-N 2.95Å; I840-I844 HydrophobicContact CG2-CD1 3.8Å; I840-I844 HydrophobicContact CG2-CG1 4.35Å; I840-I844 VanDerWaalsContact O-CG1 3.28Å; I840-I844 WeakPolarHBondContact O-CG1 3.26Å; I840-I844 PolarHBondContact O-N 3.35Å
841	K	88.1	Confident	85.6	Confident	139 Å²	139	97.9 Å²	97.9	60%	0.604	49%	0.487	S	S	*	.	H	α-helix	trans	-67.8	-36.8	178.1	-168.5	177.2	179.9	-177.5	0	112.2	T837 L838 E839 N845	T837-K841 WeakPolarHBondContact O-CB 3.22Å; T837-K841 PolarHBondContact O-N 3.11Å; L838-K841 PolarHBondContact O-N 3Å; E839-K841 PolarHBondContact O-N 2.83Å; K841-N845 WeakPolarHBondContact O-CB 3.2Å; K841-N845 VanDerWaalsContact O-CG 3.3Å; K841-N845 PolarHBondContact O-N 3.17Å; K841-N845 VanDerWaalsContact O-N 3.1Å; K841-N845 PolarHBondContact O-ND2 3.18Å
842	M	86	Confident	84.9	Confident	108 Å²	108	97.4 Å²	97.4	53%	0.532	49%	0.492	S	S	.	.	H	α-helix	trans	-64.2	-45.4	172.8	-66.2	-164.4	-47.7	0	0	111	L838 E839 N845 A846	L838-M842 WeakPolarHBondContact O-CG 3.46Å; L838-M842 PolarHBondContact O-N 2.85Å; E839-M842 WeakPolarHBondContact O-CB 3.24Å; E839-M842 PolarHBondContact O-N 2.6Å; M842-N845 PolarHBondContact O-N 2.76Å; M842-A846 PolarHBondContact O-N 2.83Å
843	L	86.7	Confident	83.5	Confident	110 Å²	110	101.8 Å²	101.8	58%	0.576	51%	0.51	S	S	*	.	H	α-helix	trans	-58.3	-49.1	174.9	-88.6	144.9	0	0	0	112.2	E839 I840 N845 A846 V847	E839-L843 PolarHBondContact O-N 2.92Å; I840-L843 PolarHBondContact O-N 2.95Å; L843-N845 VanDerWaalsContact C-N 3.26Å; L843-N845 PolarHBondContact O-N 2.92Å; L843-A846 WeakPolarHBondContact O-CB 3.2Å; L843-A846 PolarHBondContact O-N 2.83Å; L843-A846 VanDerWaalsContact O-N 3.1Å; L843-V847 WeakPolarHBondContact O-CG2 3.44Å; L843-V847 PolarHBondContact O-N 2.82Å
844	I	87.4	Confident	81.8	Confident	83 Å²	83	102.5 Å²	102.5	43%	0.426	52%	0.518	S	S	.	.	H	α-helix	trans	-58.4	-40.5	176.8	-71	168.3	0	0	0	111.1	I840 K848	I840-I844 HydrophobicContact CG2-CD1 3.8Å; I840-I844 HydrophobicContact CG2-CG1 4.35Å; I840-I844 VanDerWaalsContact O-CG1 3.28Å; I840-I844 WeakPolarHBondContact O-CG1 3.26Å; I840-I844 PolarHBondContact O-N 3.35Å; I844-K848 HydrophobicContact CG2-CD 4.2Å; I844-K848 WeakPolarHBondContact O-CB 3.47Å; I844-K848 VanDerWaalsContact O-CG 3.3Å; I844-K848 WeakPolarHBondContact O-CG 3.31Å; I844-K848 PolarHBondContact O-N 2.91Å
845	N	85.8	Confident	80.1	Confident	82 Å²	82	100.7 Å²	100.7	44%	0.439	52%	0.519	S	S	.	.	H	α-helix	trans	-68.7	-38.8	177.1	-74.1	-18.1	0	0	0	111.8	K841 M842 L843 K848 T849	K841-N845 WeakPolarHBondContact O-CB 3.2Å; K841-N845 VanDerWaalsContact O-CG 3.3Å; K841-N845 PolarHBondContact O-N 3.17Å; K841-N845 VanDerWaalsContact O-N 3.1Å; K841-N845 PolarHBondContact O-ND2 3.18Å; M842-N845 PolarHBondContact O-N 2.76Å; L843-N845 VanDerWaalsContact C-N 3.26Å; L843-N845 PolarHBondContact O-N 2.92Å; N845-K848 PolarHBondContact O-N 2.74Å; N845-T849 WeakPolarHBondContact O-CB 3.35Å; N845-T849 PolarHBondContact O-N 2.88Å; N845-T849 PolarHBondContact O-OG1 3.31Å
846	A	82.9	Confident	77.8	Confident	50 Å²	50	100.2 Å²	100.2	41%	0.413	53%	0.526	S	S	.	.	H	α-helix	trans	-61.3	-48.8	174.3	0	0	0	0	0	111.2	M842 L843 K848 T849 L850	M842-A846 PolarHBondContact O-N 2.83Å; L843-A846 WeakPolarHBondContact O-CB 3.2Å; L843-A846 PolarHBondContact O-N 2.83Å; L843-A846 VanDerWaalsContact O-N 3.1Å; A846-K848 PolarHBondContact O-N 2.76Å; A846-T849 WeakPolarHBondContact O-CB 3.38Å; A846-T849 PolarHBondContact O-N 2.65Å; A846-T849 VanDerWaalsContact O-N 3.09Å; A846-L850 WeakPolarHBondContact O-CG 3.47Å; A846-L850 PolarHBondContact O-N 2.78Å
847	V	84	Confident	75.4	Confident	76 Å²	76	101.7 Å²	101.7	46%	0.461	54%	0.543	S	S	.	.	H	α-helix	trans	-61.6	-42.2	177.1	174	0	0	0	0	111.9	L843 T849 L850 N851	L843-V847 WeakPolarHBondContact O-CG2 3.44Å; L843-V847 PolarHBondContact O-N 2.82Å; V847-T849 VanDerWaalsContact C-N 3.28Å; V847-T849 PolarHBondContact O-N 3.37Å; V847-L850 PolarHBondContact O-N 3.47Å; V847-N851 WeakPolarHBondContact O-CB 3.2Å; V847-N851 PolarHBondContact O-N 3.06Å
848	K	83.4	Confident	72.8	Confident	126 Å²	126	104.7 Å²	104.7	55%	0.548	56%	0.562	S	S	.	*	H	α-helix	trans	-59.5	-41.5	173.9	-78.8	176.3	-179.2	177.3	0	111.6	I844 N845 A846 N851 T852	I844-K848 HydrophobicContact CG2-CD 4.2Å; I844-K848 WeakPolarHBondContact O-CB 3.47Å; I844-K848 VanDerWaalsContact O-CG 3.3Å; I844-K848 WeakPolarHBondContact O-CG 3.31Å; I844-K848 PolarHBondContact O-N 2.91Å; N845-K848 PolarHBondContact O-N 2.74Å; A846-K848 PolarHBondContact O-N 2.76Å; K848-N851 PolarHBondContact O-N 3.13Å; K848-T852 WeakPolarHBondContact O-CG2 3.34Å; K848-T852 PolarHBondContact O-N 2.98Å; K848-T852 PolarHBondContact O-OG1 3.47Å; K848-T852 VanDerWaalsContact O-OG1 3.13Å
849	T	80.5	Confident	72.1	Confident	75 Å²	75	105.5 Å²	105.5	46%	0.46	57%	0.566	S	S	.	*	H	α-helix	trans	-66.5	-40.2	179.2	-49.5	0	0	0	0	111.3	N845 A846 V847 T852 K853	N845-T849 WeakPolarHBondContact O-CB 3.35Å; N845-T849 PolarHBondContact O-N 2.88Å; N845-T849 PolarHBondContact O-OG1 3.31Å; A846-T849 WeakPolarHBondContact O-CB 3.38Å; A846-T849 PolarHBondContact O-N 2.65Å; A846-T849 VanDerWaalsContact O-N 3.09Å; V847-T849 VanDerWaalsContact C-N 3.28Å; V847-T849 PolarHBondContact O-N 3.37Å; T849-T852 WeakPolarHBondContact CA-OG1 3.49Å; T849-T852 PolarHBondContact O-OG1 3.39Å; T849-K853 PolarHBondContact O-N 2.86Å
850	L	76.5	Confident	71.3	Confident	99 Å²	99	106.1 Å²	106.1	52%	0.518	57%	0.573	S	S	.	*	H	α-helix	trans	-63.1	-47.4	174	-73.6	163.1	0	0	0	111.6	A846 V847 T852 K853 T854	A846-L850 WeakPolarHBondContact O-CG 3.47Å; A846-L850 PolarHBondContact O-N 2.78Å; V847-L850 PolarHBondContact O-N 3.47Å; L850-T852 VanDerWaalsContact C-N 3.34Å; L850-T852 PolarHBondContact O-N 3.18Å; L850-K853 WeakPolarHBondContact O-CB 3.45Å; L850-K853 PolarHBondContact O-N 2.87Å; L850-T854 PolarHBondContact O-N 3.13Å; L850-T854 PolarHBondContact O-OG1 3.36Å
851	N	74.2	Confident	70.2	Confident	93 Å²	93	106.7 Å²	106.7	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-66.5	-30.7	179.2	-82.3	-24	0	0	0	113.9	V847 K848 K853 T854	V847-N851 WeakPolarHBondContact O-CB 3.2Å; V847-N851 PolarHBondContact O-N 3.06Å; K848-N851 PolarHBondContact O-N 3.13Å; N851-K853 VanDerWaalsContact C-N 3.27Å; N851-K853 PolarHBondContact O-N 3.12Å; N851-T854 WeakPolarHBondContact CA-OG1 3.21Å; N851-T854 PolarHBondContact O-OG1 3.48Å; N851-T854 VanDerWaalsContact O-OG1 3.13Å
852	T	69.9	Low	69.2	Low	99 Å²	99	104.8 Å²	104.8	61%	0.607	58%	0.577	S	S	*	*	H	α-helix	trans	-71.8	-21.8	172.9	50.1	0	0	0	0	113.2	K848 T849 L850	K848-T852 WeakPolarHBondContact O-CG2 3.34Å; K848-T852 PolarHBondContact O-N 2.98Å; K848-T852 PolarHBondContact O-OG1 3.47Å; K848-T852 VanDerWaalsContact O-OG1 3.13Å; T849-T852 WeakPolarHBondContact CA-OG1 3.49Å; T849-T852 PolarHBondContact O-OG1 3.39Å; L850-T852 VanDerWaalsContact C-N 3.34Å; L850-T852 PolarHBondContact O-N 3.18Å
853	K	58.9	Low	68.1	Low	162 Å²	162	104.6 Å²	104.6	70%	0.704	58%	0.579	S	S	*	*	H	α-helix	trans	-83.4	-24.3	176	-74.2	-179.9	177.6	-178.8	0	113	T849 L850 N851	T849-K853 PolarHBondContact O-N 2.86Å; L850-K853 WeakPolarHBondContact O-CB 3.45Å; L850-K853 PolarHBondContact O-N 2.87Å; N851-K853 VanDerWaalsContact C-N 3.27Å; N851-K853 PolarHBondContact O-N 3.12Å
854	T	53.6	Low	66.9	Low	105 Å²	105	104.3 Å²	104.3	64%	0.644	58%	0.58	S	S	*	*	H	α-helix	trans	-85.5	-10.6	-178.6	41.3	0	0	0	0	115	L850 N851	L850-T854 PolarHBondContact O-N 3.13Å; L850-T854 PolarHBondContact O-OG1 3.36Å; N851-T854 WeakPolarHBondContact CA-OG1 3.21Å; N851-T854 PolarHBondContact O-OG1 3.48Å; N851-T854 VanDerWaalsContact O-OG1 3.13Å
855	I	50.9	Low	65.4	Low	128 Å²	128	105.8 Å²	105.8	66%	0.656	59%	0.591	S	S	*	*	S	Bend	trans	-96.2	-3.1	-174.1	-65	173.3	0	0	0	114.3	P857	I855-P857 WeakPolarHBondContact O-CD 3.38Å
856	N	40.5	Very low	63.9	Low	114 Å²	114	107.6 Å²	107.6	61%	0.61	60%	0.602	S	S	*	*			trans	-105.3	94.9	170.9	-78.2	-12.7	0	0	0	110.9	T858	N856-T858 PolarHBondContact O-N 3.41Å
857	P	39.4	Very low	62.3	Low	121 Å²	121	112.4 Å²	112.4	79%	0.786	62%	0.618	S	S	*	*			trans	-79.6	99.7	161.4	32.7	-27.6	0	0	0	107.9	I855	I855-P857 WeakPolarHBondContact O-CD 3.38Å
858	T	35.7	Very low	60.3	Low	151 Å²	151	115.7 Å²	115.7	93%	0.926	63%	0.633	S	S	*	*			trans	-143.2	0	151.8	48.9	0	0	0	0	109.3	N856	N856-T858 PolarHBondContact O-N 3.41Å

Retrieved 858 of 858 residues in 1116 ms (Link to these results)

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